A0A061IGA4_CRIGR Loading...

Oxidative stress induced growth inhibitor family member 2

AlphaFold DB , UniProt , Accession A0A061IGA4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Osgin2, Length 550 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	20.2	Very low	22.6	Very low	239 Å²	239	140.7 Å²	140.7	100%	1.177	77%	0.771	S	S	*	*				0	143.7	0	-96.1	-174.7	177.2	0	0	108.2
2	P	27.8	Very low	22.6	Very low	108 Å²	108	135.2 Å²	135.2	70%	0.701	77%	0.77	S	S	*	*				-120.7	-164.5	-105.7	21.1	0.7	0	0	0	112
3	V	20.5	Very low	22.7	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.685	78%	0.779	S	S	*	*			trans	83.9	120.9	151.8	-168.4	0	0	0	0	111.4
4	W	21.5	Very low	22.7	Very low	232 Å²	232	142.9 Å²	142.9	88%	0.879	78%	0.782	S	S	*	*			cis	174.3	175	27.9	-118.2	18.5	0	0	0	105.2
5	C	21.2	Very low	22.7	Very low	74 Å²	74	149.1 Å²	149.1	50%	0.5	79%	0.789	S	S	.	*			cis	-167.1	132	1.2	-131.6	0	0	0	0	103.3
6	C	21.8	Very low	22.8	Very low	109 Å²	109	148.5 Å²	148.5	74%	0.736	79%	0.787	S	S	*	*				73.7	147	94	-74.6	0	0	0	0	117.7
7	R	23.1	Very low	22.9	Very low	228 Å²	228	151.9 Å²	151.9	86%	0.86	79%	0.788	S	S	*	*			trans	96.3	131	155	-61.4	-159	174.5	-168.6	-2.2	114.4
8	C	22.7	Very low	23	Very low	96 Å²	96	149.1 Å²	149.1	65%	0.649	78%	0.783	S	S	*	*			cis	-174	134.8	7.3	-116.9	0	0	0	0	106.6
9	S	22.9	Very low	23.2	Very low	93 Å²	93	148.1 Å²	148.1	65%	0.65	78%	0.779	S	S	*	*				65.6	125.2	103.5	80.4	0	0	0	0	113.7
10	L	24.3	Very low	23.5	Very low	157 Å²	157	147 Å²	147	82%	0.822	78%	0.778	S	S	*	*			cis	-171.6	133.5	49.5	-93.6	129	0	0	0	108.2
11	A	22.6	Very low	23.8	Very low	99 Å²	99	147.4 Å²	147.4	82%	0.818	78%	0.776	S	S	*	*				76.1	120.1	105.2	0	0	0	0	0	117
12	G	22.2	Very low	24.6	Very low	74 Å²	74	141 Å²	141	76%	0.763	75%	0.75	S	S	*	*			trans	-178.1	77.8	170.3	0	0	0	0	0	112.9
13	H	23.7	Very low	24.9	Very low	192 Å²	192	143.6 Å²	143.6	89%	0.889	75%	0.753	S	S	*	*			trans	48	112.2	159	-74.1	-57	0	0	0	122.1
14	F	22.7	Very low	25.4	Very low	187 Å²	187	139.8 Å²	139.8	82%	0.82	74%	0.737	S	S	*	*			trans	-49.7	132.2	151.8	-89.4	-104.8	0	0	0	112.4
15	R	22.8	Very low	26	Very low	236 Å²	236	135.4 Å²	135.4	89%	0.891	73%	0.726	S	S	*	*			trans	-128.1	114.7	142.9	-95.7	-175.8	170.9	176.5	-3.1	106.9	Y17	R15-Y17 PolarHBondContact O-N 3.38Å
16	D	25.4	Very low	27	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	72%	0.715	S	S	*	*			trans	-58.5	123.3	168.3	-74.6	-42.3	0	0	0	109.5
17	Y	23	Very low	27.7	Very low	207 Å²	207	136.2 Å²	136.2	81%	0.812	71%	0.711	S	S	*	*			trans	-132.4	103.3	150.8	-102.4	-89.2	0	0	0	106.4	R15 D19	R15-Y17 PolarHBondContact O-N 3.38Å; Y17-D19 PolarHBondContact O-N 3.12Å
18	S	26.3	Very low	28.3	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	70%	0.695	S	S	*	*			trans	-74.8	99.8	171.2	50.9	0	0	0	0	108.9
19	D	26.6	Very low	29.2	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	68%	0.682	S	S	*	*			trans	-95.2	89.7	169.5	-78.8	-17.1	0	0	0	109.4	Y17 E21	Y17-D19 PolarHBondContact O-N 3.12Å; D19-E21 VanDerWaalsContact C-N 3.3Å
20	T	28.8	Very low	30	Very low	126 Å²	126	127.2 Å²	127.2	77%	0.773	67%	0.67	S	S	*	*			trans	-89.6	20.3	172.2	41.3	0	0	0	0	113.2
21	E	29.8	Very low	30.8	Very low	156 Å²	156	123.4 Å²	123.4	73%	0.729	65%	0.653	S	S	*	*			trans	-93	-3.8	-170.9	-73.8	-169.3	154.4	0	0	116.1	D19	D19-E21 VanDerWaalsContact C-N 3.3Å
22	T	37	Very low	31.5	Very low	104 Å²	104	124.5 Å²	124.5	64%	0.638	64%	0.641	S	S	*	*	H	α-helix	trans	-99.8	-18.3	-172.3	37.7	0	0	0	0	116.5
23	E	34.8	Very low	32.4	Very low	164 Å²	164	122.2 Å²	122.2	77%	0.766	61%	0.61	S	S	*	*	H	α-helix	trans	-78.8	-30.7	170.5	-73.2	-173.5	157.8	0	0	111.9	E25 I26 F27	E23-E25 PolarHBondContact O-N 3.14Å; E23-I26 PolarHBondContact O-N 3.08Å; E23-F27 PolarHBondContact O-N 3.3Å
24	G	29.2	Very low	33.3	Very low	33 Å²	33	116.8 Å²	116.8	34%	0.34	58%	0.584	S	S	.	*	H	α-helix	trans	-66.9	-33.8	-179.8	0	0	0	0	0	113.8	I26 N28	G24-I26 PolarHBondContact O-N 3.25Å; G24-N28 WeakPolarHBondContact O-CB 3.47Å; G24-N28 PolarHBondContact O-N 2.84Å; G24-N28 PolarHBondContact O-ND2 3.29Å
25	E	35.3	Very low	33.7	Very low	140 Å²	140	110 Å²	110	65%	0.654	57%	0.566	S	S	*	*	H	α-helix	trans	-71.3	-29.7	-179.2	-69.5	-171.8	154.6	0	0	113.2	E23 S29	E23-E25 PolarHBondContact O-N 3.14Å; E25-S29 VanDerWaalsContact O-CB 3.31Å; E25-S29 WeakPolarHBondContact O-CB 3.33Å; E25-S29 PolarHBondContact O-N 3.07Å
26	I	41.8	Very low	34.4	Very low	50 Å²	50	105.1 Å²	105.1	26%	0.256	56%	0.558	S	S	.	*	H	α-helix	trans	-76.6	-44.8	178.6	-62.2	164.3	0	0	0	110.3	E23 G24 S29 L30 I287 V293	E23-I26 PolarHBondContact O-N 3.08Å; G24-I26 PolarHBondContact O-N 3.25Å; I26-S29 PolarHBondContact O-N 3.43Å; I26-L30 HydrophobicContact CG2-CD1 4.44Å; I26-L30 PolarHBondContact O-N 3.34Å; I26-I287 HydrophobicContact CD1-CD1 3.96Å; I26-V293 HydrophobicContact CD1-CG1 4.15Å; I26-V293 HydrophobicContact CD1-CG2 4.01Å
27	F	36.5	Very low	34.9	Very low	150 Å²	150	102.9 Å²	102.9	66%	0.658	55%	0.546	S	S	*	.	H	α-helix	trans	-62.1	-44.4	171	-102	-87	0	0	0	110.6	E23 S29 L30 V31	E23-F27 PolarHBondContact O-N 3.3Å; F27-S29 VanDerWaalsContact C-N 3.29Å; F27-S29 PolarHBondContact O-N 3.26Å; F27-L30 PolarHBondContact O-N 2.85Å; F27-V31 HydrophobicContact CD1-CG2 4.33Å; F27-V31 WeakPolarHBondContact O-CA 3.29Å; F27-V31 WeakPolarHBondContact O-CB 3.26Å; F27-V31 WeakPolarHBondContact O-CG2 3.37Å; F27-V31 PolarHBondContact O-N 2.69Å
28	N	36.6	Very low	35.4	Very low	100 Å²	100	99.8 Å²	99.8	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-64.8	-30.2	177	-75	-30.4	0	0	0	112.8	G24 Q32	G24-N28 WeakPolarHBondContact O-CB 3.47Å; G24-N28 PolarHBondContact O-N 2.84Å; G24-N28 PolarHBondContact O-ND2 3.29Å; N28-Q32 WeakPolarHBondContact O-CA 3.14Å; N28-Q32 WeakPolarHBondContact O-CB 3.22Å; N28-Q32 WeakPolarHBondContact O-CG 3.4Å; N28-Q32 PolarHBondContact O-N 3.38Å
29	S	41.1	Very low	35.4	Very low	54 Å²	54	98.3 Å²	98.3	38%	0.378	54%	0.543	S	S	.	.	H	α-helix	trans	-74.2	-37.8	175.3	-174.5	0	0	0	0	113.4	E25 I26 F27 Y33	E25-S29 VanDerWaalsContact O-CB 3.31Å; E25-S29 WeakPolarHBondContact O-CB 3.33Å; E25-S29 PolarHBondContact O-N 3.07Å; I26-S29 PolarHBondContact O-N 3.43Å; F27-S29 VanDerWaalsContact C-N 3.29Å; F27-S29 PolarHBondContact O-N 3.26Å; S29-Y33 PolarHBondContact O-N 2.7Å
30	L	39.2	Very low	35.5	Very low	73 Å²	73	98.6 Å²	98.6	38%	0.382	55%	0.552	S	S	.	*	H	α-helix	trans	-75.1	-38.2	173.4	-79.8	162.2	0	0	0	111.6	I26 F27 Y33 F34	I26-L30 HydrophobicContact CG2-CD1 4.44Å; I26-L30 PolarHBondContact O-N 3.34Å; F27-L30 PolarHBondContact O-N 2.85Å; L30-Y33 WeakPolarHBondContact O-CB 3.19Å; L30-Y33 PolarHBondContact O-N 3.23Å; L30-F34 WeakPolarHBondContact O-CD2 3.4Å; L30-F34 WeakPolarHBondContact O-CE2 3.07Å; L30-F34 PolarHBondContact O-N 3.43Å
31	V	40.7	Very low	35.6	Very low	77 Å²	77	102 Å²	102	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-72.6	-35.3	175.5	173.6	0	0	0	0	111.3	F27 Y33 F34 G35	F27-V31 HydrophobicContact CD1-CG2 4.33Å; F27-V31 WeakPolarHBondContact O-CA 3.29Å; F27-V31 WeakPolarHBondContact O-CB 3.26Å; F27-V31 WeakPolarHBondContact O-CG2 3.37Å; F27-V31 PolarHBondContact O-N 2.69Å; V31-Y33 VanDerWaalsContact C-N 3.3Å; V31-Y33 PolarHBondContact O-N 2.91Å; V31-F34 CarbonylContact O-C 3.59Å; V31-F34 WeakPolarHBondContact O-CA 3.18Å; V31-F34 PolarHBondContact O-N 3.33Å; V31-G35 PolarHBondContact O-N 3.08Å
32	Q	38	Very low	35.4	Very low	123 Å²	123	101.6 Å²	101.6	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-59.6	-40.4	171.3	-101.1	179.4	-49.4	0	0	111.6	N28 F34 G35 D36	N28-Q32 WeakPolarHBondContact O-CA 3.14Å; N28-Q32 WeakPolarHBondContact O-CB 3.22Å; N28-Q32 WeakPolarHBondContact O-CG 3.4Å; N28-Q32 PolarHBondContact O-N 3.38Å; Q32-F34 PolarHBondContact O-N 3.02Å; Q32-G35 PolarHBondContact O-N 3.07Å; Q32-D36 PolarHBondContact O-N 3.16Å
33	Y	41.2	Very low	35.1	Very low	26 Å²	26	106.3 Å²	106.3	10%	0.102	58%	0.575	C	S	.	*	H	α-helix	trans	-59.6	-31	173.6	179.9	-92.6	0	0	0	112.4	S29 L30 V31 N37 L61 Y160	S29-Y33 PolarHBondContact O-N 2.7Å; L30-Y33 WeakPolarHBondContact O-CB 3.19Å; L30-Y33 PolarHBondContact O-N 3.23Å; V31-Y33 VanDerWaalsContact C-N 3.3Å; V31-Y33 PolarHBondContact O-N 2.91Å; Y33-N37 PolarHBondContact O-ND2 2.83Å; Y33-L61 HydrophobicContact CE1-CD2 4.33Å; Y33-Y160 PolarHBondContact OH-OH 3.34Å
34	F	42.6	Very low	34.6	Very low	78 Å²	78	102.1 Å²	102.1	34%	0.342	58%	0.576	S	S	.	*	H	α-helix	trans	-85.6	-34.2	174.7	-67	-60.9	0	0	0	113.7	L30 V31 Q32 V59	L30-F34 WeakPolarHBondContact O-CD2 3.4Å; L30-F34 WeakPolarHBondContact O-CE2 3.07Å; L30-F34 PolarHBondContact O-N 3.43Å; V31-F34 CarbonylContact O-C 3.59Å; V31-F34 WeakPolarHBondContact O-CA 3.18Å; V31-F34 PolarHBondContact O-N 3.33Å; Q32-F34 PolarHBondContact O-N 3.02Å; F34-V59 HydrophobicContact CE1-CB 4.12Å; F34-V59 HydrophobicContact CE1-CG1 3.5Å; F34-V59 VanDerWaalsContact CE1-CG1 3.5Å; F34-V59 HydrophobicContact CE1-CG2 4.02Å; F34-V59 HydrophobicContact CE2-CG2 4.24Å; F34-V59 HydrophobicContact CZ-CB 3.75Å; F34-V59 HydrophobicContact CZ-CG1 3.57Å; F34-V59 HydrophobicContact CZ-CG2 3.77Å
35	G	30.8	Very low	34.4	Very low	43 Å²	43	108 Å²	108	44%	0.443	60%	0.597	S	S	.	*	H	α-helix	trans	-71	-37.4	-178	0	0	0	0	0	113.6	V31 Q32 N37 L38	V31-G35 PolarHBondContact O-N 3.08Å; Q32-G35 PolarHBondContact O-N 3.07Å; G35-N37 PolarHBondContact O-N 3Å; G35-L38 PolarHBondContact O-N 2.94Å
36	D	36.8	Very low	34.2	Very low	135 Å²	135	107.5 Å²	107.5	72%	0.722	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-11.2	-179.5	-69.6	-18.5	0	0	0	113.5	Q32	Q32-D36 PolarHBondContact O-N 3.16Å
37	N	36.9	Very low	33.7	Very low	92 Å²	92	112.1 Å²	112.1	49%	0.492	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	-0.2	-179.6	-80	-47.8	0	0	0	114.1	Y33 G35	Y33-N37 PolarHBondContact O-ND2 2.83Å; G35-N37 PolarHBondContact O-N 3Å
38	L	32.3	Very low	33.3	Very low	142 Å²	142	111 Å²	111	74%	0.743	64%	0.635	S	S	*	*	S	Bend	trans	-116.6	111.1	175.4	-70.5	165.6	0	0	0	108.7	G35	G35-L38 PolarHBondContact O-N 2.94Å
39	G	27.3	Very low	32.7	Very low	70 Å²	70	115 Å²	115	72%	0.722	65%	0.651	S	S	*	*			trans	-56.7	156.9	-177.3	0	0	0	0	0	113.9	K41	G39-K41 PolarHBondContact O-N 3.32Å
40	P	29.4	Very low	32.4	Very low	134 Å²	134	121.1 Å²	121.1	87%	0.87	67%	0.673	S	S	*	*			trans	-82.7	111.9	-162.7	31.6	-32.7	0	0	0	111.9
41	K	30.5	Very low	31.9	Very low	199 Å²	199	124.6 Å²	124.6	87%	0.865	70%	0.698	S	S	*	*			trans	-146.1	116	148.8	-78.2	-169.2	178.5	174.4	0	108.9	G39	G39-K41 PolarHBondContact O-N 3.32Å
42	V	26.1	Very low	31.1	Very low	146 Å²	146	125.8 Å²	125.8	89%	0.885	71%	0.71	S	S	*	*				166.6	133.1	117.5	162.2	0	0	0	0	110.2
43	K	29.1	Very low	30.8	Very low	204 Å²	204	128.2 Å²	128.2	89%	0.887	73%	0.726	S	S	*	*			trans	-66.7	144	169.6	-91.7	173.5	165.2	177.6	0	111.7
44	G	25.8	Very low	30.3	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	76%	0.761	S	S	*	*			trans	97.6	109.7	142.4	0	0	0	0	0	116.7
45	M	23.7	Very low	29.9	Very low	157 Å²	157	139.3 Å²	139.3	77%	0.773	78%	0.784	S	S	*	*			trans	-71	159.6	157.9	-65.7	173	64.8	0	0	110.3	L47	M45-L47 HydrophobicContact CE-CD2 4.44Å; M45-L47 HydrophobicContact CE-CG 4.07Å
46	P	32.7	Very low	30.2	Very low	129 Å²	129	144.4 Å²	144.4	84%	0.838	80%	0.801	S	S	*	*				-135.3	159.5	86.8	23.8	-3.2	0	0	0	115.2
47	L	30.3	Very low	30.4	Very low	146 Å²	146	142.9 Å²	142.9	76%	0.764	80%	0.8	S	S	*	*			trans	-50	141.7	176.7	-66	134.8	0	0	0	114.9	M45	M45-L47 HydrophobicContact CE-CD2 4.44Å; M45-L47 HydrophobicContact CE-CG 4.07Å
48	V	27.7	Very low	31.1	Very low	127 Å²	127	142.5 Å²	142.5	77%	0.77	81%	0.805	S	S	*	*			trans	-164.3	123.1	137.3	167	0	0	0	0	110.3
49	E	25.3	Very low	33	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.864	79%	0.788	S	S	*	*			trans	53.4	128.4	146.6	-64.9	167.9	167.7	0	0	124.3
50	E	33.3	Very low	35.9	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	77%	0.765	S	S	*	*			trans	-54.9	162.7	164.9	-73.8	171.7	131	0	0	113.9
51	T	30.1	Very low	38.9	Very low	146 Å²	146	131.8 Å²	131.8	90%	0.896	73%	0.728	S	S	*	*			trans	89	68.1	173.4	65.4	0	0	0	0	117
52	S	24	Very low	42	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	70%	0.697	S	S	*	*			trans	-139	120	140.2	57.2	0	0	0	0	109.7	L54	S52-L54 PolarHBondContact O-N 2.84Å
53	L	31.5	Very low	45.4	Very low	174 Å²	174	116.9 Å²	116.9	91%	0.911	66%	0.655	S	S	*	*			trans	-58.9	104.3	166	-72.1	160.5	0	0	0	107.4	E55	L53-E55 PolarHBondContact O-N 2.7Å
54	L	29.6	Very low	48.7	Very low	163 Å²	163	107.1 Å²	107.1	85%	0.853	61%	0.613	S	S	*	*			trans	-77	84	166.8	-83.7	161.5	0	0	0	108.3	S52	S52-L54 PolarHBondContact O-N 2.84Å
55	E	35	Very low	52.2	Low	174 Å²	174	103.5 Å²	103.5	81%	0.813	58%	0.575	S	S	*	*			trans	-53.6	146.8	143.1	-73.4	179.9	146.2	0	0	109.2	L53	L53-E55 PolarHBondContact O-N 2.7Å
56	D	36.3	Very low	55.7	Low	150 Å²	150	96.4 Å²	96.4	80%	0.802	54%	0.54	S	S	*	.			trans	76.1	93	176.5	-75.7	-21.8	0	0	0	119.7
57	S	40.8	Very low	58.8	Low	102 Å²	102	90.8 Å²	90.8	71%	0.713	51%	0.506	S	S	*	.				-140.9	81.3	128.4	70.4	0	0	0	0	110.7	V59	S57-V59 PolarHBondContact O-N 3.08Å
58	S	53	Low	62	Low	84 Å²	84	84.2 Å²	84.2	59%	0.587	47%	0.471	S	S	*	.			trans	-67.2	58.6	170.2	63.9	0	0	0	0	111.8	T60	S58-T60 PolarHBondContact O-N 2.83Å
59	V	71	Confident	65.3	Low	64 Å²	64	78.6 Å²	78.6	39%	0.388	44%	0.439	S	S	.	.			trans	-69.5	111.1	179.6	-171.6	0	0	0	0	108.5	F34 S57	F34-V59 HydrophobicContact CE1-CB 4.12Å; F34-V59 HydrophobicContact CE1-CG1 3.5Å; F34-V59 VanDerWaalsContact CE1-CG1 3.5Å; F34-V59 HydrophobicContact CE1-CG2 4.02Å; F34-V59 HydrophobicContact CE2-CG2 4.24Å; F34-V59 HydrophobicContact CZ-CB 3.75Å; F34-V59 HydrophobicContact CZ-CG1 3.57Å; F34-V59 HydrophobicContact CZ-CG2 3.77Å; S57-V59 PolarHBondContact O-N 3.08Å
60	T	88	Confident	68.7	Low	40 Å²	40	70.4 Å²	70.4	25%	0.245	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.5	170.2	-57.5	0	0	0	0	108.7	S58 N278 F298 E300	S58-T60 PolarHBondContact O-N 2.83Å; T60-N278 HydrophobicContact CG2-CB 4.1Å; T60-N278 VanDerWaalsContact CG2-CG 3.41Å; T60-N278 VanDerWaalsContact CG2-ND2 3.29Å; T60-N278 WeakPolarHBondContact CG2-ND2 3.16Å; T60-N278 PolarHBondContact OG1-ND2 3.33Å; T60-F298 CarbonylContact C-O 3.59Å; T60-F298 WeakPolarHBondContact CA-O 3.32Å; T60-F298 HydrophobicContact CG2-CB 4.36Å; T60-E300 HydrophobicContact CG2-CG 3.9Å
61	L	93.2	Very high	71.8	Confident	17 Å²	17	62.1 Å²	62.1	9%	0.089	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.7	174.3	-70	168.7	0	0	0	110.4	Y33 V63 V64 L164 F298 A299 E300	Y33-L61 HydrophobicContact CE1-CD2 4.33Å; L61-V63 VanDerWaalsContact C-N 3.3Å; L61-V63 PolarHBondContact O-N 3.25Å; L61-V64 HydrophobicContact CB-CG2 4.26Å; L61-V64 HydrophobicContact CD1-CG2 3.78Å; L61-L164 HydrophobicContact CD1-CB 3.91Å; L61-L164 HydrophobicContact CD1-CD2 4.13Å; L61-F298 PolarHBondContact N-O 3.49Å; L61-A299 CarbonylContact O-C 3.6Å; L61-A299 WeakPolarHBondContact O-CA 3.46Å; L61-E300 PolarHBondContact O-N 2.9Å
62	P	95.2	Very high	75	Confident	31 Å²	31	55.1 Å²	55.1	20%	0.201	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	-41	172.5	-25.9	34.6	0	0	0	112.7	I161 P162 N301	P62-I161 HydrophobicContact CB-CG2 4.03Å; P62-P162 WeakPolarHBondContact CB-O 3.37Å; P62-P162 WeakPolarHBondContact CD-O 3.22Å; P62-P162 HydrophobicContact CG-CB 3.93Å; P62-P162 HydrophobicContact CG-CG 4.12Å; P62-P162 WeakPolarHBondContact CG-O 3.34Å; P62-N301 WeakPolarHBondContact O-CB 3.27Å; P62-N301 PolarHBondContact O-N 3.06Å; P62-N301 PolarHBondContact O-ND2 2.73Å
63	V	98.1	Very high	78.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	134.9	-178.9	-170.8	0	0	0	0	111.6	L61 I65 L79 I161 P162 H163 L164 N301 L529	L61-V63 VanDerWaalsContact C-N 3.3Å; L61-V63 PolarHBondContact O-N 3.25Å; V63-I65 HydrophobicContact CG1-CG1 4.07Å; V63-L79 HydrophobicContact CB-CD1 4.28Å; V63-L79 HydrophobicContact CG1-CD1 4.1Å; V63-L79 HydrophobicContact CG2-CD1 4.25Å; V63-I161 HydrophobicContact CG2-CG2 3.94Å; V63-P162 PolarHBondContact N-O 2.92Å; V63-H163 HydrophobicContact CB-CB 3.88Å; V63-H163 WeakPolarHBondContact O-CA 3.34Å; V63-L164 PolarHBondContact O-N 3.23Å; V63-L164 VanDerWaalsContact O-N 3.13Å; V63-N301 WeakPolarHBondContact CA-O 3.49Å; V63-N301 HydrophobicContact CG2-CB 4.36Å; V63-L529 HydrophobicContact CG2-CD1 3.59Å
64	V	98.5	Very high	81.7	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128	163	170.7	0	0	0	0	109.2	L61 I66 L164 L166 I281 A299 N301 V302 A303	L61-V64 HydrophobicContact CB-CG2 4.26Å; L61-V64 HydrophobicContact CD1-CG2 3.78Å; V64-I66 HydrophobicContact CG1-CG1 4.32Å; V64-L164 CarbonylContact C-O 3.48Å; V64-L164 WeakPolarHBondContact CA-O 3.31Å; V64-L166 HydrophobicContact CG1-CD1 3.8Å; V64-L166 HydrophobicContact CG1-CG 4.25Å; V64-I281 HydrophobicContact CB-CD1 4.4Å; V64-I281 HydrophobicContact CG1-CG1 4.48Å; V64-I281 HydrophobicContact CG2-CD1 4.36Å; V64-A299 HydrophobicContact CB-CB 4.07Å; V64-A299 HydrophobicContact CG2-CB 3.68Å; V64-N301 PolarHBondContact N-O 3.48Å; V64-V302 CarbonylContact O-C 3.37Å; V64-V302 VanDerWaalsContact O-CA 3.31Å; V64-V302 WeakPolarHBondContact O-CA 3.46Å; V64-A303 PolarHBondContact O-N 3.43Å
65	I	98.8	Very high	85	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.1	178.2	-54.7	171.1	0	0	0	107.9	V63 L75 L79 L164 V165 L166 A303 A305	V63-I65 HydrophobicContact CG1-CG1 4.07Å; I65-L75 HydrophobicContact CD1-CB 4.1Å; I65-L75 HydrophobicContact CD1-CD2 3.66Å; I65-L75 HydrophobicContact CD1-CG 3.68Å; I65-L75 HydrophobicContact CG1-CD2 3.85Å; I65-L75 HydrophobicContact CG1-CG 4.42Å; I65-L79 HydrophobicContact CD1-CD1 4.06Å; I65-L164 PolarHBondContact N-O 3.15Å; I65-V165 HydrophobicContact CB-CG1 4.42Å; I65-V165 HydrophobicContact CB-CG2 4.2Å; I65-V165 HydrophobicContact CD1-CG2 3.95Å; I65-V165 HydrophobicContact CG2-CG1 4.38Å; I65-V165 WeakPolarHBondContact O-CA 3.19Å; I65-L166 PolarHBondContact O-N 2.85Å; I65-A303 WeakPolarHBondContact CA-O 3.41Å; I65-A303 HydrophobicContact CG1-CB 4.24Å; I65-A305 HydrophobicContact CG2-CB 4.1Å
66	I	98.3	Very high	88.1	Confident	7 Å²	7	26 Å²	26	4%	0.036	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.1	178.3	-57.4	176.9	0	0	0	108.1	V64 I242 V245 V302 A303 L304 A305 T306 F465	V64-I66 HydrophobicContact CG1-CG1 4.32Å; I66-I242 HydrophobicContact CD1-CG1 4.35Å; I66-I242 HydrophobicContact CD1-CG2 4.39Å; I66-I242 HydrophobicContact CG1-CG1 4.39Å; I66-I242 HydrophobicContact CG2-CG1 3.82Å; I66-V245 HydrophobicContact CD1-CG2 3.51Å; I66-V302 HydrophobicContact CD1-CG1 3.86Å; I66-V302 HydrophobicContact CG1-CG1 4.3Å; I66-A303 PolarHBondContact N-O 3Å; I66-L304 HydrophobicContact CD1-CD2 4.16Å; I66-A305 CarbonylContact O-C 3.06Å; I66-A305 VanDerWaalsContact O-CA 3.29Å; I66-A305 WeakPolarHBondContact O-CA 3.25Å; I66-A305 PolarHBondContact O-N 2.87Å; I66-T306 HydrophobicContact CB-CG2 4.5Å; I66-T306 HydrophobicContact CG2-CG2 3.79Å; I66-T306 PolarHBondContact O-N 3.45Å; I66-F465 HydrophobicContact CD1-CE2 4.15Å; I66-F465 HydrophobicContact CG2-CZ 4.14Å
67	G	97.4	Very high	91	Very high	11 Å²	11	19 Å²	19	11%	0.113	13%	0.127	C	C	.	.			trans	113.3	123.4	-175.8	0	0	0	0	0	112	L166 A305	G67-L166 WeakPolarHBondContact CA-O 3.47Å; G67-L166 PolarHBondContact N-O 2.88Å; G67-A305 WeakPolarHBondContact CA-O 3.19Å
68	N	96.8	Very high	93.8	Very high	8 Å²	8	14.1 Å²	14.1	4%	0.043	9%	0.093	C	C	.	.			trans	-106.4	25.6	-178.8	70.1	-20.4	0	0	0	113.2	V165 G169 P170 G172 F236	N68-V165 HydrophobicContact CB-CG1 3.79Å; N68-G169 PolarHBondContact ND2-O 3.35Å; N68-P170 VanDerWaalsContact ND2-C 3.29Å; N68-P170 PolarHBondContact ND2-O 3.15Å; N68-P170 VanDerWaalsContact ND2-O 3.15Å; N68-G172 PolarHBondContact O-N 3.28Å; N68-F236 HydrophobicContact CB-CD1 4.04Å; N68-F236 HydrophobicContact CB-CE1 3.99Å
69	G	96.9	Very high	95.9	Very high	10 Å²	10	10.1 Å²	10.1	10%	0.103	7%	0.065	C	C	.	.	S	Bend	trans	-73.8	-175.8	168.3	0	0	0	0	0	112.6	S71 G72 I73	G69-S71 VanDerWaalsContact C-N 3.25Å; G69-S71 PolarHBondContact O-N 2.91Å; G69-S71 VanDerWaalsContact O-N 3.17Å; G69-G72 PolarHBondContact O-N 3.02Å; G69-I73 WeakPolarHBondContact O-CG1 3.14Å; G69-I73 PolarHBondContact O-N 3.33Å
70	P	97.1	Very high	97.2	Very high	13 Å²	13	7.5 Å²	7.5	8%	0.084	5%	0.05	C	C	.	.	H	α-helix	trans	-56.6	-33.7	-176.9	20.4	-32.5	0	0	0	114.1	I73 C74 L193 Y223 V515 L518	P70-I73 PolarHBondContact O-N 3.43Å; P70-C74 VanDerWaalsContact O-CB 3.29Å; P70-C74 WeakPolarHBondContact O-CB 3.33Å; P70-C74 PolarHBondContact O-N 3.12Å; P70-L193 HydrophobicContact CB-CD2 4.02Å; P70-Y223 HydrophobicContact CB-CE1 4.4Å; P70-Y223 HydrophobicContact CB-CE2 4.27Å; P70-Y223 HydrophobicContact CG-CE2 4.3Å; P70-V515 HydrophobicContact CB-CG1 4.18Å; P70-V515 HydrophobicContact CG-CG2 4.14Å; P70-L518 HydrophobicContact CB-CD1 4.07Å; P70-L518 HydrophobicContact CB-CD2 3.77Å; P70-L518 HydrophobicContact CG-CD2 3.62Å
71	S	97.3	Very high	97.7	Very high	7 Å²	7	5.6 Å²	5.6	5%	0.049	4%	0.038	C	C	.	.	H	α-helix	trans	-60.4	-49.8	173	-57.4	0	0	0	0	112.2	G69 C74 L75 L518	G69-S71 VanDerWaalsContact C-N 3.25Å; G69-S71 PolarHBondContact O-N 2.91Å; G69-S71 VanDerWaalsContact O-N 3.17Å; S71-C74 PolarHBondContact O-N 3.33Å; S71-L75 PolarHBondContact O-N 2.7Å; S71-L518 WeakPolarHBondContact OG-CB 3.27Å
72	G	98.2	Very high	97.9	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-68.6	-36	179.5	0	0	0	0	0	112.7	G69 S76	G69-G72 PolarHBondContact O-N 3.02Å; G72-S76 VanDerWaalsContact O-CB 3.31Å; G72-S76 WeakPolarHBondContact O-CB 3.46Å; G72-S76 PolarHBondContact O-N 2.92Å
73	I	98.6	Very high	98.1	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-65.7	-46.4	175.2	-60.9	165.4	0	0	0	111	G69 P70 L75 S76 Y77 P171 L193 Y223 Y226 V227 L232 F236	G69-I73 WeakPolarHBondContact O-CG1 3.14Å; G69-I73 PolarHBondContact O-N 3.33Å; P70-I73 PolarHBondContact O-N 3.43Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 3.14Å; I73-S76 PolarHBondContact O-N 2.89Å; I73-Y77 WeakPolarHBondContact O-CB 3.48Å; I73-Y77 PolarHBondContact O-N 3.39Å; I73-P171 HydrophobicContact CD1-CB 4.11Å; I73-L193 HydrophobicContact CB-CD1 4.05Å; I73-L193 HydrophobicContact CD1-CD1 4.33Å; I73-L193 HydrophobicContact CG2-CD1 3.49Å; I73-L193 VanDerWaalsContact CG2-CD1 3.49Å; I73-Y223 HydrophobicContact CD1-CG 4.34Å; I73-Y226 HydrophobicContact CG2-CD1 3.6Å; I73-Y226 HydrophobicContact CG2-CE1 3.7Å; I73-V227 HydrophobicContact CD1-CG2 4.14Å; I73-V227 HydrophobicContact CG1-CG2 4.02Å; I73-V227 HydrophobicContact CG2-CG2 3.9Å; I73-L232 HydrophobicContact CG2-CD1 4.37Å; I73-F236 HydrophobicContact CB-CZ 4.39Å; I73-F236 HydrophobicContact CG1-CE1 3.89Å; I73-F236 HydrophobicContact CG1-CZ 3.87Å
74	C	98.3	Very high	98	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.8	-40.9	179.3	-169.6	0	0	0	0	111.7	P70 S71 Y77 M78 L518 A522	P70-C74 VanDerWaalsContact O-CB 3.29Å; P70-C74 WeakPolarHBondContact O-CB 3.33Å; P70-C74 PolarHBondContact O-N 3.12Å; S71-C74 PolarHBondContact O-N 3.33Å; C74-Y77 PolarHBondContact O-N 3.41Å; C74-M78 PolarHBondContact O-N 3.4Å; C74-L518 HydrophobicContact CB-CD1 4.46Å; C74-A522 HydrophobicContact CB-CB 3.94Å
75	L	98.8	Very high	98	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-64.2	-48	174.7	-179.1	58.1	0	0	0	111.2	I65 S71 I73 Y77 M78 L79 A303 L506 A522 V525	I65-L75 HydrophobicContact CD1-CB 4.1Å; I65-L75 HydrophobicContact CD1-CD2 3.66Å; I65-L75 HydrophobicContact CD1-CG 3.68Å; I65-L75 HydrophobicContact CG1-CD2 3.85Å; I65-L75 HydrophobicContact CG1-CG 4.42Å; S71-L75 PolarHBondContact O-N 2.7Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 3.14Å; L75-Y77 VanDerWaalsContact C-N 3.26Å; L75-Y77 PolarHBondContact O-N 3.43Å; L75-M78 PolarHBondContact O-N 3.47Å; L75-L79 HydrophobicContact CD1-CD1 4Å; L75-L79 HydrophobicContact CD1-CD2 4.22Å; L75-L79 HydrophobicContact CD1-CG 3.85Å; L75-L79 HydrophobicContact CG-CD1 3.9Å; L75-L79 HydrophobicContact CG-CG 4.16Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.17Å; L75-L79 PolarHBondContact O-N 3.2Å; L75-A303 HydrophobicContact CD2-CB 3.69Å; L75-L506 HydrophobicContact CD2-CD1 4.12Å; L75-L506 HydrophobicContact CD2-CD2 4.46Å; L75-A522 HydrophobicContact CB-CB 4.07Å; L75-A522 HydrophobicContact CD1-CB 4.47Å; L75-V525 HydrophobicContact CD1-CB 3.86Å; L75-V525 HydrophobicContact CD1-CG1 3.75Å; L75-V525 HydrophobicContact CD2-CG1 4.17Å
76	S	98.7	Very high	97.9	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-58.1	-38.2	177	179.2	0	0	0	0	112.7	G72 I73 S80 H163 F236	G72-S76 VanDerWaalsContact O-CB 3.31Å; G72-S76 WeakPolarHBondContact O-CB 3.46Å; G72-S76 PolarHBondContact O-N 2.92Å; I73-S76 PolarHBondContact O-N 2.89Å; S76-S80 VanDerWaalsContact O-CB 3.26Å; S76-S80 WeakPolarHBondContact O-CB 3.48Å; S76-S80 PolarHBondContact O-N 2.82Å; S76-S80 PolarHBondContact O-OG 2.86Å; S76-H163 WeakPolarHBondContact CA-NE2 3.44Å; S76-H163 WeakPolarHBondContact CB-NE2 3.13Å; S76-H163 PolarHBondContact O-CE1 2.81Å; S76-H163 PolarHBondContact O-NE2 2.92Å; S76-H163 PolarHBondContact OG-NE2 3.22Å; S76-F236 WeakPolarHBondContact OG-CE2 3.46Å
77	Y	98.6	Very high	97.6	Very high	3 Å²	3	7.4 Å²	7.4	1%	0.012	4%	0.044	C	C	.	.	H	α-helix	trans	-59.9	-51.1	175.3	178.2	-108.7	0	0	0	111.9	I73 C74 L75 S80 Y82 W153 P194 Y226 M230 L232	I73-Y77 WeakPolarHBondContact O-CB 3.48Å; I73-Y77 PolarHBondContact O-N 3.39Å; C74-Y77 PolarHBondContact O-N 3.41Å; L75-Y77 VanDerWaalsContact C-N 3.26Å; L75-Y77 PolarHBondContact O-N 3.43Å; Y77-S80 WeakPolarHBondContact O-CB 3.41Å; Y77-S80 PolarHBondContact O-N 2.86Å; Y77-S80 VanDerWaalsContact O-N 3.17Å; Y77-Y82 HydrophobicContact CD1-CG 4.4Å; Y77-Y82 HydrophobicContact CD2-CD1 4.39Å; Y77-Y82 AromaticContact CD2-CD2 3.44Å; Y77-Y82 HydrophobicContact CD2-CD2 3.44Å; Y77-Y82 VanDerWaalsContact CD2-CD2 3.44Å; Y77-Y82 AromaticContact CD2-CE2 3.8Å; Y77-Y82 HydrophobicContact CD2-CE2 3.8Å; Y77-Y82 AromaticContact CD2-CG 3.76Å; Y77-Y82 HydrophobicContact CD2-CG 3.76Å; Y77-Y82 HydrophobicContact CE1-CD1 4.37Å; Y77-Y82 AromaticContact CE1-CG 3.96Å; Y77-Y82 HydrophobicContact CE1-CG 3.96Å; Y77-Y82 AromaticContact CE2-CD1 3.46Å; Y77-Y82 HydrophobicContact CE2-CD1 3.46Å; Y77-Y82 VanDerWaalsContact CE2-CD1 3.46Å; Y77-Y82 AromaticContact CE2-CD2 3.33Å; Y77-Y82 HydrophobicContact CE2-CD2 3.33Å; Y77-Y82 AromaticContact CE2-CE1 3.71Å; Y77-Y82 HydrophobicContact CE2-CE1 3.71Å; Y77-Y82 AromaticContact CE2-CE2 3.59Å; Y77-Y82 HydrophobicContact CE2-CE2 3.59Å; Y77-Y82 AromaticContact CE2-CG 3.24Å; Y77-Y82 HydrophobicContact CE2-CG 3.24Å; Y77-Y82 AromaticContact CE2-CZ 3.77Å; Y77-Y82 HydrophobicContact CG-CD2 4.15Å; Y77-Y82 HydrophobicContact CG-CG 4.31Å; Y77-Y82 AromaticContact CZ-CD1 3.44Å; Y77-Y82 VanDerWaalsContact CZ-CD1 3.44Å; Y77-Y82 AromaticContact CZ-CD2 3.95Å; Y77-Y82 AromaticContact CZ-CG 3.36Å; Y77-Y82 WeakPolarHBondContact O-CD2 3.35Å; Y77-Y82 WeakPolarHBondContact OH-CD1 3.19Å; Y77-W153 HydrophobicContact CD1-CE3 4.4Å; Y77-W153 HydrophobicContact CD1-CZ3 4.1Å; Y77-W153 AromaticContact CE1-CD2 3.83Å; Y77-W153 HydrophobicContact CE1-CD2 3.83Å; Y77-W153 AromaticContact CE1-CE3 3.42Å; Y77-W153 HydrophobicContact CE1-CE3 3.42Å; Y77-W153 VanDerWaalsContact CE1-CE3 3.42Å; Y77-W153 HydrophobicContact CE1-CH2 4.07Å; Y77-W153 AromaticContact CE1-CZ3 3.52Å; Y77-W153 HydrophobicContact CE1-CZ3 3.52Å; Y77-P194 HydrophobicContact CD1-CB 4.28Å; Y77-P194 HydrophobicContact CE1-CB 3.91Å; Y77-Y226 WeakPolarHBondContact CD1-OH 3.33Å; Y77-Y226 HydrophobicContact CD2-CE1 4.21Å; Y77-Y226 WeakPolarHBondContact CD2-OH 3.27Å; Y77-Y226 WeakPolarHBondContact CE2-OH 3.36Å; Y77-Y226 HydrophobicContact CG-CE1 4.45Å; Y77-M230 HydrophobicContact CD2-CB 4.13Å; Y77-M230 HydrophobicContact CD2-CG 4.14Å; Y77-M230 HydrophobicContact CE2-CB 4.25Å; Y77-M230 HydrophobicContact CE2-CE 4.23Å; Y77-M230 HydrophobicContact CE2-CG 3.97Å; Y77-M230 HydrophobicContact CE2-SD 3.88Å; Y77-L232 HydrophobicContact CD2-CD1 4.29Å; Y77-L232 HydrophobicContact CD2-CD2 4.46Å
78	M	98.5	Very high	97.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-69.4	-37.4	179.4	-67	178.9	-177	0	0	113.2	C74 L75 S80 G81 R83 F133 W153 A522 L523 T526	C74-M78 PolarHBondContact O-N 3.4Å; L75-M78 PolarHBondContact O-N 3.47Å; M78-S80 PolarHBondContact O-N 2.91Å; M78-G81 PolarHBondContact O-N 2.98Å; M78-R83 PolarHBondContact O-NH1 2.81Å; M78-F133 HydrophobicContact CE-CD1 4.41Å; M78-F133 HydrophobicContact CE-CE1 3.41Å; M78-F133 VanDerWaalsContact CE-CE1 3.41Å; M78-F133 HydrophobicContact CE-CZ 3.52Å; M78-W153 HydrophobicContact CE-CH2 3.78Å; M78-W153 HydrophobicContact CG-CH2 4.4Å; M78-W153 HydrophobicContact CG-CZ3 4.25Å; M78-A522 HydrophobicContact CE-CB 4.21Å; M78-A522 HydrophobicContact SD-CB 3.86Å; M78-L523 HydrophobicContact CE-CB 4.04Å; M78-L523 HydrophobicContact CE-CD1 4.45Å; M78-L523 VanDerWaalsContact SD-CA 3.58Å; M78-L523 HydrophobicContact SD-CB 4.23Å; M78-L523 PolarHBondContact SD-N 3.25Å; M78-L523 VanDerWaalsContact SD-N 3.43Å; M78-T526 HydrophobicContact CB-CG2 3.99Å; M78-T526 VanDerWaalsContact CB-OG1 3.27Å; M78-T526 WeakPolarHBondContact CB-OG1 3.45Å
79	L	98.6	Very high	96.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.9	-21.4	173.3	-64.3	-175.8	0	0	0	112.2	V63 I65 L75 G81 Y160 I161 H163 T526 L529	V63-L79 HydrophobicContact CB-CD1 4.28Å; V63-L79 HydrophobicContact CG1-CD1 4.1Å; V63-L79 HydrophobicContact CG2-CD1 4.25Å; I65-L79 HydrophobicContact CD1-CD1 4.06Å; L75-L79 HydrophobicContact CD1-CD1 4Å; L75-L79 HydrophobicContact CD1-CD2 4.22Å; L75-L79 HydrophobicContact CD1-CG 3.85Å; L75-L79 HydrophobicContact CG-CD1 3.9Å; L75-L79 HydrophobicContact CG-CG 4.16Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.17Å; L75-L79 PolarHBondContact O-N 3.2Å; L79-G81 PolarHBondContact O-N 2.8Å; L79-Y160 WeakPolarHBondContact O-CA 3.46Å; L79-I161 HydrophobicContact CB-CB 4.4Å; L79-I161 HydrophobicContact CD2-CB 4.12Å; L79-I161 HydrophobicContact CD2-CD1 3.95Å; L79-I161 HydrophobicContact CD2-CG1 4.37Å; L79-I161 PolarHBondContact O-N 3.5Å; L79-H163 WeakPolarHBondContact CB-ND1 3.49Å; L79-H163 HydrophobicContact CD1-CB 4.01Å; L79-T526 HydrophobicContact CD2-CG2 4.45Å; L79-L529 HydrophobicContact CD2-CD1 3.91Å
80	S	98.3	Very high	96	Very high	9 Å²	9	20.3 Å²	20.3	6%	0.063	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	2.7	174.6	-62.9	0	0	0	0	113.8	S76 Y77 M78 H163 L232 N235	S76-S80 VanDerWaalsContact O-CB 3.26Å; S76-S80 WeakPolarHBondContact O-CB 3.48Å; S76-S80 PolarHBondContact O-N 2.82Å; S76-S80 PolarHBondContact O-OG 2.86Å; Y77-S80 WeakPolarHBondContact O-CB 3.41Å; Y77-S80 PolarHBondContact O-N 2.86Å; Y77-S80 VanDerWaalsContact O-N 3.17Å; M78-S80 PolarHBondContact O-N 2.91Å; S80-H163 PolarHBondContact OG-CE1 2.89Å; S80-L232 VanDerWaalsContact OG-CD2 3.29Å; S80-L232 WeakPolarHBondContact OG-CD2 3.34Å; S80-N235 PolarHBondContact OG-ND2 3.03Å; S80-N235 VanDerWaalsContact OG-ND2 3.16Å
81	G	97.5	Very high	95.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	99	2.4	177.7	0	0	0	0	0	114.2	M78 L79 R83 E156	M78-G81 PolarHBondContact O-N 2.98Å; L79-G81 PolarHBondContact O-N 2.8Å; G81-R83 PolarHBondContact O-N 2.82Å; G81-E156 PolarHBondContact O-N 3.05Å
82	Y	98.3	Very high	95.7	Very high	37 Å²	37	25.7 Å²	25.7	15%	0.145	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.2	173.4	-71.3	-88.6	0	0	0	110.8	Y77 K154 L155 M230 L232	Y77-Y82 HydrophobicContact CD1-CG 4.4Å; Y77-Y82 HydrophobicContact CD2-CD1 4.39Å; Y77-Y82 AromaticContact CD2-CD2 3.44Å; Y77-Y82 HydrophobicContact CD2-CD2 3.44Å; Y77-Y82 VanDerWaalsContact CD2-CD2 3.44Å; Y77-Y82 AromaticContact CD2-CE2 3.8Å; Y77-Y82 HydrophobicContact CD2-CE2 3.8Å; Y77-Y82 AromaticContact CD2-CG 3.76Å; Y77-Y82 HydrophobicContact CD2-CG 3.76Å; Y77-Y82 HydrophobicContact CE1-CD1 4.37Å; Y77-Y82 AromaticContact CE1-CG 3.96Å; Y77-Y82 HydrophobicContact CE1-CG 3.96Å; Y77-Y82 AromaticContact CE2-CD1 3.46Å; Y77-Y82 HydrophobicContact CE2-CD1 3.46Å; Y77-Y82 VanDerWaalsContact CE2-CD1 3.46Å; Y77-Y82 AromaticContact CE2-CD2 3.33Å; Y77-Y82 HydrophobicContact CE2-CD2 3.33Å; Y77-Y82 AromaticContact CE2-CE1 3.71Å; Y77-Y82 HydrophobicContact CE2-CE1 3.71Å; Y77-Y82 AromaticContact CE2-CE2 3.59Å; Y77-Y82 HydrophobicContact CE2-CE2 3.59Å; Y77-Y82 AromaticContact CE2-CG 3.24Å; Y77-Y82 HydrophobicContact CE2-CG 3.24Å; Y77-Y82 AromaticContact CE2-CZ 3.77Å; Y77-Y82 HydrophobicContact CG-CD2 4.15Å; Y77-Y82 HydrophobicContact CG-CG 4.31Å; Y77-Y82 AromaticContact CZ-CD1 3.44Å; Y77-Y82 VanDerWaalsContact CZ-CD1 3.44Å; Y77-Y82 AromaticContact CZ-CD2 3.95Å; Y77-Y82 AromaticContact CZ-CG 3.36Å; Y77-Y82 WeakPolarHBondContact O-CD2 3.35Å; Y77-Y82 WeakPolarHBondContact OH-CD1 3.19Å; Y82-K154 CarbonylContact C-O 3.6Å; Y82-K154 WeakPolarHBondContact CA-O 3.45Å; Y82-L155 HydrophobicContact CD1-CB 4.04Å; Y82-L155 HydrophobicContact CD1-CD1 4.29Å; Y82-L155 HydrophobicContact CD2-CD1 3.86Å; Y82-L155 HydrophobicContact CE1-CB 3.84Å; Y82-L155 HydrophobicContact CE1-CD1 4.24Å; Y82-L155 HydrophobicContact CE1-CD2 4.39Å; Y82-L155 HydrophobicContact CE1-CG 4.38Å; Y82-L155 HydrophobicContact CE2-CD1 3.8Å; Y82-L155 HydrophobicContact CG-CD1 4.13Å; Y82-M230 PolarHBondContact OH-O 3.05Å; Y82-L232 HydrophobicContact CE2-CD2 4.49Å
83	R	97.8	Very high	95.5	Very high	1 Å²	1	28.4 Å²	28.4	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.8	-175.9	-70.3	-69.6	176.7	-98.8	5.9	111.1	M78 G81 Y85 W153 K154 E156	M78-R83 PolarHBondContact O-NH1 2.81Å; G81-R83 PolarHBondContact O-N 2.82Å; R83-Y85 HydrophobicContact CB-CD2 4.31Å; R83-Y85 HydrophobicContact CB-CE2 3.64Å; R83-W153 WeakPolarHBondContact O-CA 3.49Å; R83-K154 PolarHBondContact N-O 3.26Å; R83-K154 PolarHBondContact O-N 3.27Å; R83-E156 WeakPolarHBondContact CG-OE2 3.46Å
84	P	97.6	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.1	174.5	30.3	-30.2	0	0	0	110.8	S108 I109 V110 F133 L151 W153 L523	P84-S108 CarbonylContact O-C 3.53Å; P84-S108 VanDerWaalsContact O-CA 3.31Å; P84-S108 WeakPolarHBondContact O-CA 3.25Å; P84-S108 WeakPolarHBondContact O-CB 3.4Å; P84-I109 HydrophobicContact CB-CG1 4.23Å; P84-I109 HydrophobicContact CG-CB 3.97Å; P84-I109 HydrophobicContact CG-CG1 4.24Å; P84-I109 PolarHBondContact O-N 3.46Å; P84-V110 HydrophobicContact CG-CG2 4.38Å; P84-F133 HydrophobicContact CB-CE2 4.41Å; P84-F133 HydrophobicContact CG-CE2 4.29Å; P84-L151 HydrophobicContact CB-CD1 4.07Å; P84-W153 HydrophobicContact CB-CD2 4.3Å; P84-W153 HydrophobicContact CB-CE3 4.12Å; P84-W153 HydrophobicContact CB-CH2 3.78Å; P84-W153 HydrophobicContact CB-CZ2 3.85Å; P84-W153 HydrophobicContact CB-CZ3 3.91Å; P84-W153 HydrophobicContact CG-CH2 3.91Å; P84-W153 HydrophobicContact CG-CZ2 4.44Å; P84-W153 HydrophobicContact CG-CZ3 3.96Å; P84-L523 HydrophobicContact CG-CD1 4.34Å
85	Y	97.5	Very high	95.3	Very high	26 Å²	26	35.8 Å²	35.8	10%	0.102	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.4	174.9	-73.2	-92.7	0	0	0	110.1	R83 S87 L151 H152 K154 E156	R83-Y85 HydrophobicContact CB-CD2 4.31Å; R83-Y85 HydrophobicContact CB-CE2 3.64Å; Y85-S87 PolarHBondContact O-N 2.67Å; Y85-L151 CarbonylContact O-C 3.39Å; Y85-L151 VanDerWaalsContact O-CA 3.3Å; Y85-L151 WeakPolarHBondContact O-CA 3.38Å; Y85-H152 WeakPolarHBondContact CB-CE1 3.16Å; Y85-H152 PolarHBondContact N-O 3.01Å; Y85-H152 PolarHBondContact O-N 2.96Å; Y85-H152 PolarHBondContact O-ND1 2.8Å; Y85-K154 HydrophobicContact CD2-CB 4.24Å; Y85-K154 HydrophobicContact CD2-CD 3.91Å; Y85-K154 HydrophobicContact CD2-CG 4.05Å; Y85-K154 HydrophobicContact CE2-CB 4.15Å; Y85-K154 HydrophobicContact CE2-CD 3.99Å; Y85-K154 HydrophobicContact CE2-CG 4.32Å; Y85-E156 PolarHBondContact OH-OE1 3.32Å; Y85-E156 PolarHBondContact OH-OE2 3.2Å; Y85-E156 VanDerWaalsContact OH-OE2 3.08Å
86	L	96.4	Very high	95.2	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	120.2	172.8	-174.9	66	0	0	0	110.5	S88 L101 E102 R105 I150 H152	L86-S88 PolarHBondContact O-N 3.25Å; L86-L101 HydrophobicContact CD1-CD1 4.39Å; L86-L101 HydrophobicContact CD2-CB 4.07Å; L86-E102 WeakPolarHBondContact CD2-OE1 2.93Å; L86-R105 HydrophobicContact CD2-CG 4.26Å; L86-R105 PolarHBondContact O-NH2 2.75Å; L86-R105 VanDerWaalsContact O-NH2 3.15Å; L86-I150 HydrophobicContact CD1-CB 4.29Å; L86-I150 HydrophobicContact CD1-CD1 3.61Å; L86-I150 HydrophobicContact CD1-CG1 4.32Å; L86-H152 PolarHBondContact O-CE1 3.28Å; L86-H152 PolarHBondContact O-ND1 3.39Å
87	S	92.9	Very high	95.1	Very high	27 Å²	27	41.3 Å²	41.3	19%	0.189	23%	0.228	C	C	.	.			trans	-60	132.8	177.7	-65.6	0	0	0	0	111.5	Y85 E89 A90 R105 I150 L151 H152	Y85-S87 PolarHBondContact O-N 2.67Å; S87-E89 PolarHBondContact O-N 2.89Å; S87-A90 PolarHBondContact O-N 3.21Å; S87-R105 PolarHBondContact O-NH2 2.98Å; S87-I150 WeakPolarHBondContact CB-O 3.41Å; S87-I150 PolarHBondContact N-O 3.4Å; S87-I150 PolarHBondContact OG-O 3.32Å; S87-L151 VanDerWaalsContact OG-C 3.24Å; S87-H152 VanDerWaalsContact CA-ND1 3.31Å; S87-H152 WeakPolarHBondContact CA-ND1 3.25Å; S87-H152 PolarHBondContact N-ND1 2.96Å; S87-H152 PolarHBondContact OG-N 2.85Å
88	S	85.9	Confident	95	Very high	99 Å²	99	43 Å²	43	69%	0.692	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-38.6	-174	46	0	0	0	0	114.1	L86	L86-S88 PolarHBondContact O-N 3.25Å
89	E	85.6	Confident	94.9	Very high	180 Å²	180	46.4 Å²	46.4	84%	0.841	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.9	-173.8	-62.1	173.3	-172.7	0	0	113.2	S87	S87-E89 PolarHBondContact O-N 2.89Å
90	A	85.7	Confident	94.9	Very high	20 Å²	20	47.3 Å²	47.3	17%	0.165	26%	0.264	C	S	.	.			trans	-83.5	127.8	-174.1	0	0	0	0	0	111.7	S87 I150	S87-A90 PolarHBondContact O-N 3.21Å; A90-I150 HydrophobicContact CB-CB 3.69Å; A90-I150 HydrophobicContact CB-CG2 3.92Å
91	I	92.4	Very high	94.8	Very high	131 Å²	131	46.9 Å²	46.9	67%	0.672	26%	0.261	S	S	*	.			trans	-110.5	126.4	172.5	-59.6	174.1	0	0	0	107.4
92	H	95.3	Very high	94.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.009	28%	0.277	C	S	.	.			trans	-81.1	135.2	177.4	-169.8	-83.5	0	0	0	110.1	N94 H98 T135 I150	H92-N94 VanDerWaalsContact C-N 3.32Å; H92-N94 VanDerWaalsContact CE1-CB 3.48Å; H92-N94 WeakPolarHBondContact CE1-CB 3.43Å; H92-N94 WeakPolarHBondContact ND1-CB 3.15Å; H92-N94 PolarHBondContact ND1-N 3.12Å; H92-N94 PolarHBondContact ND1-O 2.99Å; H92-N94 PolarHBondContact O-N 3.44Å; H92-H98 HydrophobicContact CB-CB 4.03Å; H92-T135 WeakPolarHBondContact CE1-CG2 3.46Å; H92-T135 WeakPolarHBondContact NE2-CG2 3.24Å; H92-T135 PolarHBondContact NE2-O 3.41Å; H92-I150 HydrophobicContact CB-CD1 3.95Å
93	P	94.7	Very high	94.6	Very high	57 Å²	57	54.5 Å²	54.5	37%	0.37	30%	0.298	S	S	.	.	S	Bend	trans	-63.2	-33.2	-177.5	22.8	-33.6	0	0	0	113.7	T95 P139 D140	P93-T95 PolarHBondContact O-N 2.94Å; P93-P139 HydrophobicContact CG-CB 3.71Å; P93-D140 WeakPolarHBondContact CB-OD2 3.37Å; P93-D140 WeakPolarHBondContact CG-OD2 3.47Å
94	N	95.5	Very high	94.5	Very high	54 Å²	54	55.5 Å²	55.5	29%	0.289	31%	0.306	S	S	.	.	S	Bend	trans	-74.2	108.3	167.4	-177.7	-30.2	0	0	0	109.8	H92 I96 L97 H98	H92-N94 VanDerWaalsContact C-N 3.32Å; H92-N94 VanDerWaalsContact CE1-CB 3.48Å; H92-N94 WeakPolarHBondContact CE1-CB 3.43Å; H92-N94 WeakPolarHBondContact ND1-CB 3.15Å; H92-N94 PolarHBondContact ND1-N 3.12Å; H92-N94 PolarHBondContact ND1-O 2.99Å; H92-N94 PolarHBondContact O-N 3.44Å; N94-I96 PolarHBondContact O-N 2.93Å; N94-I96 PolarHBondContact OD1-N 3.47Å; N94-L97 HydrophobicContact CB-CB 4.1Å; N94-L97 PolarHBondContact O-N 2.84Å; N94-L97 PolarHBondContact OD1-N 3.16Å; N94-H98 WeakPolarHBondContact O-CB 3.48Å; N94-H98 PolarHBondContact O-N 2.88Å
95	T	96.2	Very high	94.3	Very high	102 Å²	102	58.5 Å²	58.5	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-66.9	-32.4	-175.8	54.3	0	0	0	0	113.5	P93 S99	P93-T95 PolarHBondContact O-N 2.94Å; T95-S99 PolarHBondContact O-N 3.06Å; T95-S99 PolarHBondContact O-OG 3.32Å
96	I	97.3	Very high	94.1	Very high	112 Å²	112	64.2 Å²	64.2	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-67.5	-53.1	176.5	-61.5	174.4	0	0	0	108.7	N94 H98 S99 K100	N94-I96 PolarHBondContact O-N 2.93Å; N94-I96 PolarHBondContact OD1-N 3.47Å; I96-H98 VanDerWaalsContact C-N 3.28Å; I96-H98 PolarHBondContact O-N 3.21Å; I96-S99 PolarHBondContact O-N 2.81Å; I96-S99 VanDerWaalsContact O-N 3.16Å; I96-K100 WeakPolarHBondContact O-CG 3.44Å; I96-K100 PolarHBondContact O-N 3.26Å; I96-K100 VanDerWaalsContact O-N 3.09Å
97	L	97.1	Very high	94.1	Very high	3 Å²	3	67 Å²	67	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-41	177	179.1	58.4	0	0	0	111.5	N94 S99 K100 L101 L117 L121 L132 T135 L136	N94-L97 HydrophobicContact CB-CB 4.1Å; N94-L97 PolarHBondContact O-N 2.84Å; N94-L97 PolarHBondContact OD1-N 3.16Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-S99 PolarHBondContact O-N 3.1Å; L97-K100 PolarHBondContact O-N 2.91Å; L97-L101 HydrophobicContact CD1-CD1 4.22Å; L97-L101 HydrophobicContact CD1-CG 4.17Å; L97-L101 HydrophobicContact CG-CD1 3.92Å; L97-L101 HydrophobicContact CG-CG 4.37Å; L97-L101 VanDerWaalsContact O-CG 3.25Å; L97-L101 WeakPolarHBondContact O-CG 3.2Å; L97-L101 PolarHBondContact O-N 3.02Å; L97-L117 HydrophobicContact CD1-CB 4.48Å; L97-L117 HydrophobicContact CD1-CD2 4.25Å; L97-L117 WeakPolarHBondContact CD1-O 3.4Å; L97-L121 HydrophobicContact CD2-CD1 4.14Å; L97-L121 HydrophobicContact CD2-CD2 4.17Å; L97-L132 HydrophobicContact CD1-CD1 3.88Å; L97-L132 HydrophobicContact CD2-CD1 4.26Å; L97-T135 HydrophobicContact CD2-CG2 3.83Å; L97-L136 HydrophobicContact CD2-CD2 4.07Å
98	H	96.8	Very high	94.3	Very high	39 Å²	39	65.7 Å²	65.7	18%	0.181	35%	0.35	C	S	.	.	H	α-helix	trans	-57.4	-47.6	175.9	-174.3	48.2	0	0	0	111.8	H92 N94 I96 K100 L101 E102	H92-H98 HydrophobicContact CB-CB 4.03Å; N94-H98 WeakPolarHBondContact O-CB 3.48Å; N94-H98 PolarHBondContact O-N 2.88Å; I96-H98 VanDerWaalsContact C-N 3.28Å; I96-H98 PolarHBondContact O-N 3.21Å; H98-K100 VanDerWaalsContact C-N 3.34Å; H98-K100 PolarHBondContact O-N 3.11Å; H98-L101 PolarHBondContact O-N 3.36Å; H98-E102 IonicContact CE1-OE1 2.67Å; H98-E102 PolarHBondContact CE1-OE1 2.87Å; H98-E102 IonicContact ND1-OE1 2.73Å; H98-E102 IonicContact NE2-OE1 3.9Å; H98-E102 WeakPolarHBondContact O-CG 3.37Å; H98-E102 PolarHBondContact O-N 3.23Å
99	S	96.8	Very high	94.9	Very high	71 Å²	71	61 Å²	61	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-44.3	179.4	-55.7	0	0	0	0	111.5	T95 I96 L97 L101 E102 E103	T95-S99 PolarHBondContact O-N 3.06Å; T95-S99 PolarHBondContact O-OG 3.32Å; I96-S99 PolarHBondContact O-N 2.81Å; I96-S99 VanDerWaalsContact O-N 3.16Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-S99 PolarHBondContact O-N 3.1Å; S99-L101 VanDerWaalsContact C-N 3.34Å; S99-L101 PolarHBondContact O-N 3.1Å; S99-E102 PolarHBondContact O-N 2.81Å; S99-E103 PolarHBondContact O-N 3.34Å
100	K	97.3	Very high	95.5	Very high	20 Å²	20	52.5 Å²	52.5	9%	0.087	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-40.6	176	-63.7	-172.3	167	-172.8	0	112.8	I96 L97 H98 E102 E103 Y116 L117 E119	I96-K100 WeakPolarHBondContact O-CG 3.44Å; I96-K100 PolarHBondContact O-N 3.26Å; I96-K100 VanDerWaalsContact O-N 3.09Å; L97-K100 PolarHBondContact O-N 2.91Å; H98-K100 VanDerWaalsContact C-N 3.34Å; H98-K100 PolarHBondContact O-N 3.11Å; K100-E102 VanDerWaalsContact C-N 3.34Å; K100-E103 PolarHBondContact O-N 3.22Å; K100-Y116 HydrophobicContact CB-CD1 4.39Å; K100-Y116 HydrophobicContact CB-CE1 3.75Å; K100-Y116 HydrophobicContact CD-CD1 4.26Å; K100-Y116 HydrophobicContact CD-CD2 4.27Å; K100-Y116 HydrophobicContact CD-CE1 3.93Å; K100-Y116 HydrophobicContact CD-CE2 3.9Å; K100-Y116 HydrophobicContact CD-CG 4.45Å; K100-Y116 WeakPolarHBondContact CD-O 3.32Å; K100-Y116 VanDerWaalsContact CE-CE2 3.45Å; K100-Y116 HydrophobicContact CG-CD1 4.5Å; K100-Y116 HydrophobicContact CG-CE1 3.74Å; K100-Y116 HydrophobicContact CG-CE2 4.25Å; K100-Y116 PolarHBondContact NZ-O 2.79Å; K100-L117 HydrophobicContact CB-CD2 3.82Å; K100-E119 IonicContact NZ-OE2 2.64Å; K100-E119 PolarHBondContact NZ-OE2 3.17Å
101	L	96.7	Very high	96	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.9	-32.6	178.3	-69.3	164.1	0	0	0	112.5	L86 L97 H98 S99 R105 I109 L117 L136 I150	L86-L101 HydrophobicContact CD1-CD1 4.39Å; L86-L101 HydrophobicContact CD2-CB 4.07Å; L97-L101 HydrophobicContact CD1-CD1 4.22Å; L97-L101 HydrophobicContact CD1-CG 4.17Å; L97-L101 HydrophobicContact CG-CD1 3.92Å; L97-L101 HydrophobicContact CG-CG 4.37Å; L97-L101 VanDerWaalsContact O-CG 3.25Å; L97-L101 WeakPolarHBondContact O-CG 3.2Å; L97-L101 PolarHBondContact O-N 3.02Å; H98-L101 PolarHBondContact O-N 3.36Å; S99-L101 VanDerWaalsContact C-N 3.34Å; S99-L101 PolarHBondContact O-N 3.1Å; L101-R105 WeakPolarHBondContact O-CA 3.4Å; L101-R105 PolarHBondContact O-N 3.44Å; L101-I109 HydrophobicContact CD2-CD1 3.91Å; L101-L117 HydrophobicContact CD2-CD1 4.14Å; L101-L117 HydrophobicContact CD2-CD2 3.81Å; L101-L117 HydrophobicContact CG-CD2 4.11Å; L101-L136 HydrophobicContact CD1-CD2 3.66Å; L101-L136 HydrophobicContact CD2-CD2 4.21Å; L101-I150 HydrophobicContact CD1-CD1 3.83Å
102	E	95.6	Very high	96.2	Very high	72 Å²	72	47.1 Å²	47.1	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-35.6	177.7	-71.6	-57.2	136.7	0	0	112.5	L86 H98 S99 K100 A104 R105	L86-E102 WeakPolarHBondContact CD2-OE1 2.93Å; H98-E102 IonicContact CE1-OE1 2.67Å; H98-E102 PolarHBondContact CE1-OE1 2.87Å; H98-E102 IonicContact ND1-OE1 2.73Å; H98-E102 IonicContact NE2-OE1 3.9Å; H98-E102 WeakPolarHBondContact O-CG 3.37Å; H98-E102 PolarHBondContact O-N 3.23Å; S99-E102 PolarHBondContact O-N 2.81Å; K100-E102 VanDerWaalsContact C-N 3.34Å; E102-A104 PolarHBondContact O-N 3.3Å; E102-A104 VanDerWaalsContact O-N 3.15Å; E102-R105 WeakPolarHBondContact O-CB 3.3Å; E102-R105 PolarHBondContact O-N 3.43Å; E102-R105 IonicContact OE1-CZ 3.41Å; E102-R105 IonicContact OE1-NH1 3.24Å; E102-R105 PolarHBondContact OE1-NH1 2.96Å; E102-R105 WeakPolarHBondContact OE2-CD 3.43Å; E102-R105 IonicContact OE2-NH1 3.52Å; E102-R105 PolarHBondContact OE2-NH1 2.78Å
103	E	96.1	Very high	96.3	Very high	124 Å²	124	51 Å²	51	58%	0.579	27%	0.269	S	S	*	.	H	α-helix	trans	-54	-37	179.3	-68.1	171.9	-143.9	0	0	112.8	S99 K100 Y116	S99-E103 PolarHBondContact O-N 3.34Å; K100-E103 PolarHBondContact O-N 3.22Å; E103-Y116 PolarHBondContact OE1-OH 3.23Å; E103-Y116 PolarHBondContact OE2-OH 2.82Å
104	A	94.4	Very high	96.5	Very high	22 Å²	22	48.4 Å²	48.4	18%	0.182	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	28	-176.7	0	0	0	0	0	113.2	E102 H106 L107 Q112	E102-A104 PolarHBondContact O-N 3.3Å; E102-A104 VanDerWaalsContact O-N 3.15Å; A104-H106 PolarHBondContact O-N 2.8Å; A104-L107 HydrophobicContact CB-CD1 4.3Å; A104-L107 WeakPolarHBondContact O-CB 3.5Å; A104-L107 PolarHBondContact O-N 3.02Å; A104-Q112 HydrophobicContact CB-CG 3.89Å; A104-Q112 PolarHBondContact O-NE2 2.83Å; A104-Q112 VanDerWaalsContact O-NE2 3.12Å
105	R	93.9	Very high	96.6	Very high	64 Å²	64	50.5 Å²	50.5	24%	0.242	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-32.2	-174.5	-177.7	174.8	-170.5	97	28	115.4	L86 S87 L101 E102 L107	L86-R105 HydrophobicContact CD2-CG 4.26Å; L86-R105 PolarHBondContact O-NH2 2.75Å; L86-R105 VanDerWaalsContact O-NH2 3.15Å; S87-R105 PolarHBondContact O-NH2 2.98Å; L101-R105 WeakPolarHBondContact O-CA 3.4Å; L101-R105 PolarHBondContact O-N 3.44Å; E102-R105 WeakPolarHBondContact O-CB 3.3Å; E102-R105 PolarHBondContact O-N 3.43Å; E102-R105 IonicContact OE1-CZ 3.41Å; E102-R105 IonicContact OE1-NH1 3.24Å; E102-R105 PolarHBondContact OE1-NH1 2.96Å; E102-R105 WeakPolarHBondContact OE2-CD 3.43Å; E102-R105 IonicContact OE2-NH1 3.52Å; E102-R105 PolarHBondContact OE2-NH1 2.78Å; R105-L107 PolarHBondContact O-N 3.19Å
106	H	93.8	Very high	96.6	Very high	146 Å²	146	49.1 Å²	49.1	68%	0.676	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-15.4	-179.3	63.1	-80.2	0	0	0	113.2	A104	A104-H106 PolarHBondContact O-N 2.8Å
107	L	96.4	Very high	96.7	Very high	62 Å²	62	44 Å²	44	33%	0.325	22%	0.217	S	C	.	.	S	Bend	trans	-95.9	150	178.8	-58.8	-178.5	0	0	0	111.5	A104 R105 D111 Q112	A104-L107 HydrophobicContact CB-CD1 4.3Å; A104-L107 WeakPolarHBondContact O-CB 3.5Å; A104-L107 PolarHBondContact O-N 3.02Å; R105-L107 PolarHBondContact O-N 3.19Å; L107-D111 HydrophobicContact CB-CB 4.3Å; L107-Q112 HydrophobicContact CB-CG 3.85Å; L107-Q112 PolarHBondContact O-NE2 2.88Å
108	S	97.7	Very high	96.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-65.8	152.4	167.5	84.1	0	0	0	0	109.9	P84 V110 D111 Q112	P84-S108 CarbonylContact O-C 3.53Å; P84-S108 VanDerWaalsContact O-CA 3.31Å; P84-S108 WeakPolarHBondContact O-CA 3.25Å; P84-S108 WeakPolarHBondContact O-CB 3.4Å; S108-V110 PolarHBondContact O-N 3.25Å; S108-V110 VanDerWaalsContact O-N 3.13Å; S108-V110 PolarHBondContact OG-N 3.22Å; S108-D111 PolarHBondContact O-N 3.4Å; S108-D111 PolarHBondContact OG-N 3.41Å; S108-D111 PolarHBondContact OG-OD2 3.06Å; S108-Q112 WeakPolarHBondContact O-CG 3.35Å; S108-Q112 PolarHBondContact O-N 3.32Å
109	I	98.1	Very high	96.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.8	177.1	-49.9	-59.2	0	0	0	111.1	P84 L101 D111 Q112 L114 L136 L151 L523	P84-I109 HydrophobicContact CB-CG1 4.23Å; P84-I109 HydrophobicContact CG-CB 3.97Å; P84-I109 HydrophobicContact CG-CG1 4.24Å; P84-I109 PolarHBondContact O-N 3.46Å; L101-I109 HydrophobicContact CD2-CD1 3.91Å; I109-D111 PolarHBondContact O-N 3.14Å; I109-Q112 PolarHBondContact O-N 2.84Å; I109-L114 HydrophobicContact CG2-CD2 4.11Å; I109-L114 WeakPolarHBondContact O-CD2 3.46Å; I109-L136 HydrophobicContact CD1-CD1 4.42Å; I109-L136 HydrophobicContact CG1-CD1 4.38Å; I109-L136 HydrophobicContact CG2-CD1 4.06Å; I109-L151 HydrophobicContact CD1-CD2 4.13Å; I109-L151 HydrophobicContact CG1-CD2 3.8Å; I109-L523 HydrophobicContact CG2-CD2 4.05Å
110	V	97.6	Very high	96.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-36	174.6	174	0	0	0	0	111.4	P84 S108 L523 T526 R527 A530	P84-V110 HydrophobicContact CG-CG2 4.38Å; S108-V110 PolarHBondContact O-N 3.25Å; S108-V110 VanDerWaalsContact O-N 3.13Å; S108-V110 PolarHBondContact OG-N 3.22Å; V110-L523 HydrophobicContact CB-CD1 4.45Å; V110-L523 HydrophobicContact CG2-CD1 3.59Å; V110-T526 HydrophobicContact CG1-CG2 4.04Å; V110-T526 HydrophobicContact CG2-CG2 4.24Å; V110-R527 HydrophobicContact CG1-CB 4.19Å; V110-R527 WeakPolarHBondContact O-CB 3.45Å; V110-R527 WeakPolarHBondContact O-CD 3Å; V110-R527 VanDerWaalsContact O-CG 3.27Å; V110-R527 WeakPolarHBondContact O-CG 3.44Å; V110-R527 PolarHBondContact O-NH1 2.9Å; V110-A530 HydrophobicContact CG1-CB 4.38Å
111	D	96.6	Very high	96.5	Very high	33 Å²	33	48.4 Å²	48.4	18%	0.176	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-16.1	-176.6	-62.2	-61.5	0	0	0	113.4	L107 S108 I109 R527 K534	L107-D111 HydrophobicContact CB-CB 4.3Å; S108-D111 PolarHBondContact O-N 3.4Å; S108-D111 PolarHBondContact OG-N 3.41Å; S108-D111 PolarHBondContact OG-OD2 3.06Å; I109-D111 PolarHBondContact O-N 3.14Å; D111-R527 PolarHBondContact O-NH1 2.87Å; D111-R527 VanDerWaalsContact O-NH1 3.12Å; D111-K534 IonicContact OD1-NZ 3.25Å; D111-K534 PolarHBondContact OD1-NZ 3.48Å
112	Q	97	Very high	96.3	Very high	5 Å²	5	57 Å²	57	2%	0.023	29%	0.293	C	S	.	.	S	Bend	trans	-78.9	160.2	177.8	-65.9	-176.4	31.5	0	0	113.2	A104 L107 S108 I109 L114 L117 R527	A104-Q112 HydrophobicContact CB-CG 3.89Å; A104-Q112 PolarHBondContact O-NE2 2.83Å; A104-Q112 VanDerWaalsContact O-NE2 3.12Å; L107-Q112 HydrophobicContact CB-CG 3.85Å; L107-Q112 PolarHBondContact O-NE2 2.88Å; S108-Q112 WeakPolarHBondContact O-CG 3.35Å; S108-Q112 PolarHBondContact O-N 3.32Å; I109-Q112 PolarHBondContact O-N 2.84Å; Q112-L114 PolarHBondContact O-N 2.82Å; Q112-L114 VanDerWaalsContact O-N 3.08Å; Q112-L117 HydrophobicContact CB-CD1 3.89Å; Q112-R527 PolarHBondContact O-NH1 2.84Å; Q112-R527 PolarHBondContact O-NH2 2.91Å
113	D	97	Very high	96.1	Very high	85 Å²	85	55.4 Å²	55.4	46%	0.455	30%	0.296	S	S	.	.			trans	-71.4	101.8	178.6	-167.8	-24	0	0	0	111.9	E115 Y116 L117	D113-E115 VanDerWaalsContact C-N 3.28Å; D113-E115 PolarHBondContact O-N 2.66Å; D113-E115 WeakPolarHBondContact OD1-CB 3.49Å; D113-E115 PolarHBondContact OD1-N 2.93Å; D113-Y116 PolarHBondContact O-N 3.47Å; D113-Y116 PolarHBondContact OD1-N 3.43Å; D113-L117 WeakPolarHBondContact O-CB 3.42Å; D113-L117 VanDerWaalsContact O-CG 3.24Å; D113-L117 WeakPolarHBondContact O-CG 3.24Å; D113-L117 PolarHBondContact O-N 2.69Å
114	L	97.8	Very high	95.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-67.7	-27.3	-179.1	-58	-175.2	0	0	0	113	I109 Q112 S118 V129 L132 L523 R527	I109-L114 HydrophobicContact CG2-CD2 4.11Å; I109-L114 WeakPolarHBondContact O-CD2 3.46Å; Q112-L114 PolarHBondContact O-N 2.82Å; Q112-L114 VanDerWaalsContact O-N 3.08Å; L114-S118 VanDerWaalsContact O-CB 3.24Å; L114-S118 WeakPolarHBondContact O-CB 3.41Å; L114-S118 PolarHBondContact O-N 3.46Å; L114-S118 VanDerWaalsContact O-N 3.11Å; L114-S118 PolarHBondContact O-OG 3.03Å; L114-V129 HydrophobicContact CB-CG2 4.17Å; L114-V129 HydrophobicContact CD1-CG1 3.93Å; L114-V129 HydrophobicContact CD1-CG2 4.09Å; L114-L132 HydrophobicContact CD2-CD2 4.11Å; L114-L523 HydrophobicContact CD1-CD2 4.23Å; L114-L523 HydrophobicContact CD1-CG 4.18Å; L114-L523 HydrophobicContact CD2-CD2 3.89Å; L114-L523 HydrophobicContact CD2-CG 4.45Å; L114-R527 HydrophobicContact CD1-CB 4.3Å; L114-R527 HydrophobicContact CD1-CG 4.48Å; L114-R527 VanDerWaalsContact CG-CD 3.48Å
115	E	97.6	Very high	95.7	Very high	99 Å²	99	56.5 Å²	56.5	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-69.3	-53.9	176.2	173.8	157.4	-141	0	0	108.9	D113 L117 S118 E119 Y493	D113-E115 VanDerWaalsContact C-N 3.28Å; D113-E115 PolarHBondContact O-N 2.66Å; D113-E115 WeakPolarHBondContact OD1-CB 3.49Å; D113-E115 PolarHBondContact OD1-N 2.93Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 3.33Å; E115-S118 PolarHBondContact O-N 3.44Å; E115-E119 WeakPolarHBondContact O-CG 3.36Å; E115-E119 PolarHBondContact O-N 3.2Å; E115-Y493 VanDerWaalsContact CA-CE1 3.48Å; E115-Y493 HydrophobicContact CB-CD1 4.08Å; E115-Y493 HydrophobicContact CB-CD2 4.31Å; E115-Y493 HydrophobicContact CB-CE1 3.79Å; E115-Y493 HydrophobicContact CB-CE2 3.98Å; E115-Y493 HydrophobicContact CB-CG 4.34Å; E115-Y493 HydrophobicContact CG-CE1 4.15Å; E115-Y493 HydrophobicContact CG-CE2 3.88Å; E115-Y493 WeakPolarHBondContact CG-OH 3.46Å; E115-Y493 WeakPolarHBondContact OE1-CE2 3.08Å; E115-Y493 PolarHBondContact OE1-OH 3.01Å
116	Y	98.1	Very high	95.7	Very high	73 Å²	73	58.3 Å²	58.3	29%	0.286	32%	0.315	S	S	.	.	H	α-helix	trans	-54.4	-44.7	176	177.2	-123.4	0	0	0	113.2	K100 E103 D113 S118	K100-Y116 HydrophobicContact CB-CD1 4.39Å; K100-Y116 HydrophobicContact CB-CE1 3.75Å; K100-Y116 HydrophobicContact CD-CD1 4.26Å; K100-Y116 HydrophobicContact CD-CD2 4.27Å; K100-Y116 HydrophobicContact CD-CE1 3.93Å; K100-Y116 HydrophobicContact CD-CE2 3.9Å; K100-Y116 HydrophobicContact CD-CG 4.45Å; K100-Y116 WeakPolarHBondContact CD-O 3.32Å; K100-Y116 VanDerWaalsContact CE-CE2 3.45Å; K100-Y116 HydrophobicContact CG-CD1 4.5Å; K100-Y116 HydrophobicContact CG-CE1 3.74Å; K100-Y116 HydrophobicContact CG-CE2 4.25Å; K100-Y116 PolarHBondContact NZ-O 2.79Å; E103-Y116 PolarHBondContact OE1-OH 3.23Å; E103-Y116 PolarHBondContact OE2-OH 2.82Å; D113-Y116 PolarHBondContact O-N 3.47Å; D113-Y116 PolarHBondContact OD1-N 3.43Å; Y116-S118 VanDerWaalsContact C-N 3.3Å; Y116-S118 PolarHBondContact O-N 3.21Å
117	L	98.1	Very high	95.8	Very high	3 Å²	3	52 Å²	52	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-68.2	-28	179.1	-70.3	176.5	0	0	0	113.2	L97 K100 L101 Q112 D113 E115 L132	L97-L117 HydrophobicContact CD1-CB 4.48Å; L97-L117 HydrophobicContact CD1-CD2 4.25Å; L97-L117 WeakPolarHBondContact CD1-O 3.4Å; K100-L117 HydrophobicContact CB-CD2 3.82Å; L101-L117 HydrophobicContact CD2-CD1 4.14Å; L101-L117 HydrophobicContact CD2-CD2 3.81Å; L101-L117 HydrophobicContact CG-CD2 4.11Å; Q112-L117 HydrophobicContact CB-CD1 3.89Å; D113-L117 WeakPolarHBondContact O-CB 3.42Å; D113-L117 VanDerWaalsContact O-CG 3.24Å; D113-L117 WeakPolarHBondContact O-CG 3.24Å; D113-L117 PolarHBondContact O-N 2.69Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 3.33Å; L117-L132 HydrophobicContact CB-CD1 3.93Å; L117-L132 HydrophobicContact CB-CD2 3.54Å; L117-L132 HydrophobicContact CB-CG 4.4Å; L117-L132 HydrophobicContact CD1-CD2 4.26Å
118	S	97.6	Very high	95.8	Very high	8 Å²	8	50.7 Å²	50.7	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-85.5	-14.9	-177	-56.8	0	0	0	0	113.7	L114 E115 Y116 G120 L121 L132	L114-S118 VanDerWaalsContact O-CB 3.24Å; L114-S118 WeakPolarHBondContact O-CB 3.41Å; L114-S118 PolarHBondContact O-N 3.46Å; L114-S118 VanDerWaalsContact O-N 3.11Å; L114-S118 PolarHBondContact O-OG 3.03Å; E115-S118 PolarHBondContact O-N 3.44Å; Y116-S118 VanDerWaalsContact C-N 3.3Å; Y116-S118 PolarHBondContact O-N 3.21Å; S118-G120 PolarHBondContact O-N 2.98Å; S118-L121 WeakPolarHBondContact O-CB 3.32Å; S118-L121 PolarHBondContact O-N 3.25Å; S118-L132 WeakPolarHBondContact OG-CB 3.49Å; S118-L132 WeakPolarHBondContact OG-CD2 3.41Å
119	E	96.4	Very high	95.8	Very high	108 Å²	108	50.7 Å²	50.7	51%	0.505	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	129	-177.1	-65.3	170.9	170.3	0	0	112.4	K100 E115 L121	K100-E119 IonicContact NZ-OE2 2.64Å; K100-E119 PolarHBondContact NZ-OE2 3.17Å; E115-E119 WeakPolarHBondContact O-CG 3.36Å; E115-E119 PolarHBondContact O-N 3.2Å; E119-L121 PolarHBondContact O-N 3.5Å
120	G	94.5	Very high	95.8	Very high	79 Å²	79	50.7 Å²	50.7	81%	0.814	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	5.7	176.2	0	0	0	0	0	114.6	S118	S118-G120 PolarHBondContact O-N 2.98Å
121	L	95.9	Very high	95.8	Very high	31 Å²	31	50.9 Å²	50.9	16%	0.162	28%	0.283	C	S	.	.			trans	-82	134.7	171.9	-58.8	-175.7	0	0	0	110.8	L97 S118 E119 V131 L132	L97-L121 HydrophobicContact CD2-CD1 4.14Å; L97-L121 HydrophobicContact CD2-CD2 4.17Å; S118-L121 WeakPolarHBondContact O-CB 3.32Å; S118-L121 PolarHBondContact O-N 3.25Å; E119-L121 PolarHBondContact O-N 3.5Å; L121-V131 HydrophobicContact CB-CG1 3.84Å; L121-L132 HydrophobicContact CD1-CB 3.96Å; L121-L132 HydrophobicContact CD1-CD1 3.78Å
122	E	92.6	Very high	95.9	Very high	182 Å²	182	49.3 Å²	49.3	85%	0.85	27%	0.274	S	S	*	.			trans	-115	144.7	175.1	-64.2	-175.5	176	0	0	109.8
123	G	90.2	Very high	95.9	Very high	38 Å²	38	49.1 Å²	49.1	39%	0.392	27%	0.273	S	S	.	.			trans	-169.9	-175.8	-179.3	0	0	0	0	0	112.9	S125	G123-S125 VanDerWaalsContact C-N 3.32Å; G123-S125 PolarHBondContact O-N 2.82Å
124	R	90.4	Very high	95.9	Very high	152 Å²	152	45.3 Å²	45.3	57%	0.574	25%	0.253	S	S	*	.	S	Bend	trans	-88.2	8.2	-176.8	-57.4	176.7	-179.8	-176.9	4.9	114.7	D142 F517	R124-D142 IonicContact CZ-OD1 2.88Å; R124-D142 IonicContact NE-OD1 3.79Å; R124-D142 PolarHBondContact NE-OD1 3.36Å; R124-D142 IonicContact NE-OD2 3.96Å; R124-D142 IonicContact NH2-OD1 3.05Å; R124-F517 HydrophobicContact CB-CE2 3.89Å; R124-F517 HydrophobicContact CB-CZ 3.74Å
125	S	93.3	Very high	95.8	Very high	16 Å²	16	46.3 Å²	46.3	11%	0.112	26%	0.259	C	S	.	.			trans	-111.3	146.9	170.9	172.9	0	0	0	0	109.4	G123 N127 D512	G123-S125 VanDerWaalsContact C-N 3.32Å; G123-S125 PolarHBondContact O-N 2.82Å; S125-N127 VanDerWaalsContact C-N 3.25Å; S125-N127 PolarHBondContact OG-N 3.07Å; S125-D512 WeakPolarHBondContact CB-OD1 3.48Å; S125-D512 PolarHBondContact OG-OD1 3.12Å
126	S	92.1	Very high	95.7	Very high	103 Å²	103	41.6 Å²	41.6	72%	0.72	24%	0.237	S	C	*	.	S	Bend	trans	-78.5	-10	169.8	53.4	0	0	0	0	113.1
127	N	96.1	Very high	95.6	Very high	14 Å²	14	38.6 Å²	38.6	8%	0.075	23%	0.226	C	C	.	.			trans	-95.7	119.2	-178.1	-62.5	-64.6	0	0	0	110.3	S125 V129 A130 V131 Y495 V510 D512	S125-N127 VanDerWaalsContact C-N 3.25Å; S125-N127 PolarHBondContact OG-N 3.07Å; N127-V129 PolarHBondContact O-N 3.1Å; N127-A130 HydrophobicContact CB-CB 3.99Å; N127-A130 WeakPolarHBondContact O-CB 3.29Å; N127-A130 PolarHBondContact O-N 2.8Å; N127-A130 VanDerWaalsContact O-N 3.1Å; N127-V131 PolarHBondContact O-N 2.87Å; N127-V131 VanDerWaalsContact O-N 3.14Å; N127-Y495 HydrophobicContact CB-CE2 4.42Å; N127-Y495 WeakPolarHBondContact CB-OH 3.48Å; N127-V510 PolarHBondContact ND2-O 3.37Å; N127-D512 VanDerWaalsContact ND2-CG 3.33Å; N127-D512 PolarHBondContact ND2-OD1 2.85Å; N127-D512 PolarHBondContact ND2-OD2 2.6Å
128	P	97.6	Very high	95.4	Very high	33 Å²	33	38.9 Å²	38.9	21%	0.214	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-39.6	-173.7	22.2	-32.2	0	0	0	112.8	A130 V131 L132 A492 Y493	P128-A130 VanDerWaalsContact C-N 3.3Å; P128-A130 PolarHBondContact O-N 2.78Å; P128-V131 PolarHBondContact O-N 2.74Å; P128-L132 PolarHBondContact O-N 2.91Å; P128-A492 HydrophobicContact CG-CB 3.84Å; P128-Y493 HydrophobicContact CB-CE1 3.95Å; P128-Y493 HydrophobicContact CG-CD1 4.08Å; P128-Y493 HydrophobicContact CG-CE1 3.53Å
129	V	98.1	Very high	95.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-32.3	177.7	-176.9	0	0	0	0	112	L114 N127 F133 A492 Y493 Y495 G520 L523	L114-V129 HydrophobicContact CB-CG2 4.17Å; L114-V129 HydrophobicContact CD1-CG1 3.93Å; L114-V129 HydrophobicContact CD1-CG2 4.09Å; N127-V129 PolarHBondContact O-N 3.1Å; V129-F133 VanDerWaalsContact O-CB 3.27Å; V129-F133 WeakPolarHBondContact O-CB 3.49Å; V129-F133 PolarHBondContact O-N 3.34Å; V129-A492 WeakPolarHBondContact CG2-O 3.48Å; V129-Y493 HydrophobicContact CG2-CD1 3.78Å; V129-Y495 HydrophobicContact CB-CE2 4.14Å; V129-G520 VanDerWaalsContact CG1-O 3.29Å; V129-G520 WeakPolarHBondContact CG1-O 3.49Å; V129-L523 HydrophobicContact CG1-CB 4.26Å; V129-L523 HydrophobicContact CG1-CD2 3.93Å; V129-L523 HydrophobicContact CG1-CG 4.36Å
130	A	97.4	Very high	95.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.7	-43.4	172.4	0	0	0	0	0	111.7	N127 P128 D134 Y495 F517	N127-A130 HydrophobicContact CB-CB 3.99Å; N127-A130 WeakPolarHBondContact O-CB 3.29Å; N127-A130 PolarHBondContact O-N 2.8Å; N127-A130 VanDerWaalsContact O-N 3.1Å; P128-A130 VanDerWaalsContact C-N 3.3Å; P128-A130 PolarHBondContact O-N 2.78Å; A130-D134 WeakPolarHBondContact O-CB 3.39Å; A130-D134 PolarHBondContact O-N 2.94Å; A130-Y495 WeakPolarHBondContact CB-OH 3.38Å; A130-F517 HydrophobicContact CB-CB 3.99Å; A130-F517 HydrophobicContact CB-CD1 4.3Å; A130-F517 WeakPolarHBondContact CB-O 3.43Å
131	V	97.5	Very high	94.9	Very high	6 Å²	6	32 Å²	32	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-50.7	176.2	178.7	0	0	0	0	110.6	L121 N127 P128 F133 D134 T135	L121-V131 HydrophobicContact CB-CG1 3.84Å; N127-V131 PolarHBondContact O-N 2.87Å; N127-V131 VanDerWaalsContact O-N 3.14Å; P128-V131 PolarHBondContact O-N 2.74Å; V131-F133 PolarHBondContact O-N 3.13Å; V131-D134 WeakPolarHBondContact O-CB 3.43Å; V131-D134 PolarHBondContact O-N 3.21Å; V131-T135 WeakPolarHBondContact O-CB 3.41Å; V131-T135 PolarHBondContact O-N 2.79Å; V131-T135 PolarHBondContact O-OG1 3.33Å; V131-T135 VanDerWaalsContact O-OG1 3.06Å
132	L	98.1	Very high	94.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-52.7	-56.2	176.5	170.4	62.1	0	0	0	111	L97 L114 L117 S118 L121 P128 D134 T135 L136	L97-L132 HydrophobicContact CD1-CD1 3.88Å; L97-L132 HydrophobicContact CD2-CD1 4.26Å; L114-L132 HydrophobicContact CD2-CD2 4.11Å; L117-L132 HydrophobicContact CB-CD1 3.93Å; L117-L132 HydrophobicContact CB-CD2 3.54Å; L117-L132 HydrophobicContact CB-CG 4.4Å; L117-L132 HydrophobicContact CD1-CD2 4.26Å; S118-L132 WeakPolarHBondContact OG-CB 3.49Å; S118-L132 WeakPolarHBondContact OG-CD2 3.41Å; L121-L132 HydrophobicContact CD1-CB 3.96Å; L121-L132 HydrophobicContact CD1-CD1 3.78Å; P128-L132 PolarHBondContact O-N 2.91Å; L132-D134 VanDerWaalsContact C-N 3.27Å; L132-D134 PolarHBondContact O-N 2.73Å; L132-T135 PolarHBondContact O-N 2.84Å; L132-T135 VanDerWaalsContact O-N 3.16Å; L132-L136 HydrophobicContact CD1-CD1 4.04Å; L132-L136 HydrophobicContact CD1-CD2 4.36Å; L132-L136 HydrophobicContact CD1-CG 4.13Å; L132-L136 HydrophobicContact CG-CD1 4.21Å; L132-L136 WeakPolarHBondContact O-CG 3.3Å; L132-L136 PolarHBondContact O-N 2.88Å
133	F	97.4	Very high	94.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.8	-31.7	-172.3	-160.5	-129.1	0	0	0	112.7	M78 P84 V129 V131 L136 L137 L151 W153 K519 L523	M78-F133 HydrophobicContact CE-CD1 4.41Å; M78-F133 HydrophobicContact CE-CE1 3.41Å; M78-F133 VanDerWaalsContact CE-CE1 3.41Å; M78-F133 HydrophobicContact CE-CZ 3.52Å; P84-F133 HydrophobicContact CB-CE2 4.41Å; P84-F133 HydrophobicContact CG-CE2 4.29Å; V129-F133 VanDerWaalsContact O-CB 3.27Å; V129-F133 WeakPolarHBondContact O-CB 3.49Å; V129-F133 PolarHBondContact O-N 3.34Å; V131-F133 PolarHBondContact O-N 3.13Å; F133-L136 HydrophobicContact CD2-CD1 4.34Å; F133-L136 PolarHBondContact O-N 2.77Å; F133-L137 HydrophobicContact CD1-CD1 3.74Å; F133-L137 HydrophobicContact CE1-CD1 3.63Å; F133-L137 HydrophobicContact CE1-CG 4.41Å; F133-L137 HydrophobicContact CG-CD1 4.32Å; F133-L137 HydrophobicContact CZ-CD1 4.11Å; F133-L137 HydrophobicContact CZ-CG 4.44Å; F133-L137 WeakPolarHBondContact O-CB 3.27Å; F133-L137 VanDerWaalsContact O-CG 3.31Å; F133-L137 WeakPolarHBondContact O-CG 3.37Å; F133-L137 PolarHBondContact O-N 3.38Å; F133-L137 VanDerWaalsContact O-N 3.09Å; F133-L151 HydrophobicContact CD2-CD1 4.18Å; F133-L151 HydrophobicContact CE2-CD1 3.56Å; F133-L151 HydrophobicContact CZ-CD1 4.3Å; F133-W153 AromaticContact CZ-CH2 3.72Å; F133-W153 HydrophobicContact CZ-CH2 3.72Å; F133-W153 AromaticContact CZ-CZ2 3.69Å; F133-W153 HydrophobicContact CZ-CZ2 3.69Å; F133-K519 VanDerWaalsContact CD1-C 3.47Å; F133-K519 HydrophobicContact CD1-CB 3.63Å; F133-K519 WeakPolarHBondContact CD1-O 3.44Å; F133-K519 HydrophobicContact CE1-CB 3.79Å; F133-L523 HydrophobicContact CB-CD2 4.16Å; F133-L523 HydrophobicContact CD2-CD2 3.64Å; F133-L523 HydrophobicContact CE2-CD1 4.44Å; F133-L523 HydrophobicContact CE2-CD2 4.15Å; F133-L523 HydrophobicContact CG-CD2 3.96Å
134	D	96.4	Very high	94.1	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.032	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-50.6	169.9	-179.6	49.9	0	0	0	112.1	A130 V131 L132 L136 L137 H138 R516 F517	A130-D134 WeakPolarHBondContact O-CB 3.39Å; A130-D134 PolarHBondContact O-N 2.94Å; V131-D134 WeakPolarHBondContact O-CB 3.43Å; V131-D134 PolarHBondContact O-N 3.21Å; L132-D134 VanDerWaalsContact C-N 3.27Å; L132-D134 PolarHBondContact O-N 2.73Å; D134-L136 VanDerWaalsContact C-N 3.25Å; D134-L136 PolarHBondContact O-N 2.71Å; D134-L137 PolarHBondContact O-N 2.9Å; D134-H138 PolarHBondContact O-N 3.31Å; D134-R516 WeakPolarHBondContact OD1-CD 3.47Å; D134-R516 WeakPolarHBondContact OD1-CG 3.45Å; D134-R516 IonicContact OD1-CZ 3.81Å; D134-R516 IonicContact OD1-NE 2.68Å; D134-R516 PolarHBondContact OD1-NE 3.19Å; D134-R516 IonicContact OD2-CZ 3.74Å; D134-R516 IonicContact OD2-NE 3.85Å; D134-R516 PolarHBondContact OD2-NE 2.99Å; D134-R516 IonicContact OD2-NH2 2.82Å; D134-R516 PolarHBondContact OD2-NH2 3.19Å; D134-F517 HydrophobicContact CB-CD1 3.95Å; D134-F517 HydrophobicContact CB-CE1 3.93Å; D134-F517 VanDerWaalsContact OD2-CE1 3.27Å; D134-F517 WeakPolarHBondContact OD2-CE1 3.5Å
135	T	95.9	Very high	94	Very high	22 Å²	22	31.9 Å²	31.9	14%	0.135	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-33.6	177.7	-63.9	0	0	0	0	112.6	H92 L97 V131 L132 P139	H92-T135 WeakPolarHBondContact CE1-CG2 3.46Å; H92-T135 WeakPolarHBondContact NE2-CG2 3.24Å; H92-T135 PolarHBondContact NE2-O 3.41Å; L97-T135 HydrophobicContact CD2-CG2 3.83Å; V131-T135 WeakPolarHBondContact O-CB 3.41Å; V131-T135 PolarHBondContact O-N 2.79Å; V131-T135 PolarHBondContact O-OG1 3.33Å; V131-T135 VanDerWaalsContact O-OG1 3.06Å; L132-T135 PolarHBondContact O-N 2.84Å; L132-T135 VanDerWaalsContact O-N 3.16Å; T135-P139 VanDerWaalsContact O-CA 3.31Å; T135-P139 WeakPolarHBondContact O-CA 2.87Å; T135-P139 WeakPolarHBondContact O-CG 3.25Å
136	L	96.5	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-74.5	-33	174.8	-58.3	176.7	0	0	0	113.5	L97 L101 I109 L132 F133 D134 S149 I150 L151	L97-L136 HydrophobicContact CD2-CD2 4.07Å; L101-L136 HydrophobicContact CD1-CD2 3.66Å; L101-L136 HydrophobicContact CD2-CD2 4.21Å; I109-L136 HydrophobicContact CD1-CD1 4.42Å; I109-L136 HydrophobicContact CG1-CD1 4.38Å; I109-L136 HydrophobicContact CG2-CD1 4.06Å; L132-L136 HydrophobicContact CD1-CD1 4.04Å; L132-L136 HydrophobicContact CD1-CD2 4.36Å; L132-L136 HydrophobicContact CD1-CG 4.13Å; L132-L136 HydrophobicContact CG-CD1 4.21Å; L132-L136 WeakPolarHBondContact O-CG 3.3Å; L132-L136 PolarHBondContact O-N 2.88Å; F133-L136 HydrophobicContact CD2-CD1 4.34Å; F133-L136 PolarHBondContact O-N 2.77Å; D134-L136 VanDerWaalsContact C-N 3.25Å; D134-L136 PolarHBondContact O-N 2.71Å; L136-S149 PolarHBondContact O-OG 3.16Å; L136-I150 HydrophobicContact CB-CD1 4.43Å; L136-I150 HydrophobicContact CB-CG1 4.2Å; L136-I150 HydrophobicContact CD2-CD1 3.47Å; L136-I150 VanDerWaalsContact CD2-CD1 3.47Å; L136-I150 HydrophobicContact CD2-CG1 4.17Å; L136-I150 VanDerWaalsContact O-CG1 3.25Å; L136-I150 WeakPolarHBondContact O-CG1 3.18Å; L136-I150 PolarHBondContact O-N 3.01Å; L136-I150 VanDerWaalsContact O-N 3.11Å; L136-L151 HydrophobicContact CB-CD1 3.76Å; L136-L151 HydrophobicContact CB-CD2 4.26Å; L136-L151 HydrophobicContact CB-CG 3.97Å; L136-L151 HydrophobicContact CD1-CD1 4.39Å; L136-L151 HydrophobicContact CD1-CD2 4.36Å
137	L	95	Very high	93.7	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-84	-38	-178.9	-73.4	172.3	0	0	0	112.5	F133 D134 S149 L151 K519	F133-L137 HydrophobicContact CD1-CD1 3.74Å; F133-L137 HydrophobicContact CE1-CD1 3.63Å; F133-L137 HydrophobicContact CE1-CG 4.41Å; F133-L137 HydrophobicContact CG-CD1 4.32Å; F133-L137 HydrophobicContact CZ-CD1 4.11Å; F133-L137 HydrophobicContact CZ-CG 4.44Å; F133-L137 WeakPolarHBondContact O-CB 3.27Å; F133-L137 VanDerWaalsContact O-CG 3.31Å; F133-L137 WeakPolarHBondContact O-CG 3.37Å; F133-L137 PolarHBondContact O-N 3.38Å; F133-L137 VanDerWaalsContact O-N 3.09Å; D134-L137 PolarHBondContact O-N 2.9Å; L137-S149 VanDerWaalsContact O-CA 3.24Å; L137-S149 WeakPolarHBondContact O-CA 3.42Å; L137-S149 VanDerWaalsContact O-CB 3.24Å; L137-S149 WeakPolarHBondContact O-CB 3.38Å; L137-L151 HydrophobicContact CD2-CD1 4.02Å; L137-L151 HydrophobicContact CG-CD1 4.29Å; L137-K519 HydrophobicContact CD1-CB 4.28Å; L137-K519 HydrophobicContact CD1-CD 3.77Å
138	H	94	Very high	93.4	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.046	21%	0.209	C	C	.	.	S	Bend	trans	-137.5	70.4	-173.7	-61.2	-81.9	0	0	0	109.9	D134 D140 A141 N189 E192	D134-H138 PolarHBondContact O-N 3.31Å; H138-D140 PolarHBondContact O-N 2.79Å; H138-A141 HydrophobicContact CB-CB 3.78Å; H138-A141 VanDerWaalsContact O-CB 3.31Å; H138-A141 WeakPolarHBondContact O-CB 3.47Å; H138-A141 PolarHBondContact O-N 3.23Å; H138-N189 PolarHBondContact CE1-O 3.18Å; H138-N189 VanDerWaalsContact CE1-O 3.25Å; H138-E192 IonicContact CE1-OE1 2.81Å; H138-E192 PolarHBondContact CE1-OE1 3.37Å; H138-E192 IonicContact NE2-OE1 3.17Å
139	P	94.7	Very high	93.2	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	134.2	-177.3	-21.3	30.7	0	0	0	111.8	P93 T135 A141 Y147 I150	P93-P139 HydrophobicContact CG-CB 3.71Å; T135-P139 VanDerWaalsContact O-CA 3.31Å; T135-P139 WeakPolarHBondContact O-CA 2.87Å; T135-P139 WeakPolarHBondContact O-CG 3.25Å; P139-A141 PolarHBondContact O-N 3.2Å; P139-Y147 HydrophobicContact CB-CD2 4.27Å; P139-Y147 WeakPolarHBondContact O-CD2 3.36Å; P139-I150 HydrophobicContact CG-CG2 4.13Å
140	D	92.8	Very high	93.1	Very high	45 Å²	45	39.1 Å²	39.1	24%	0.241	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	24.1	179.4	-60.8	-24.3	0	0	0	116	P93 H138 D142 F143 G144 Y145 Y147	P93-D140 WeakPolarHBondContact CB-OD2 3.37Å; P93-D140 WeakPolarHBondContact CG-OD2 3.47Å; H138-D140 PolarHBondContact O-N 2.79Å; D140-D142 PolarHBondContact O-N 3.17Å; D140-F143 HydrophobicContact CB-CD2 3.89Å; D140-F143 WeakPolarHBondContact O-CB 3.42Å; D140-F143 PolarHBondContact O-N 3.11Å; D140-G144 PolarHBondContact O-N 3.31Å; D140-Y145 HydrophobicContact CB-CD2 3.72Å; D140-Y145 HydrophobicContact CB-CG 4.36Å; D140-Y145 PolarHBondContact O-N 2.82Å; D140-Y147 HydrophobicContact CB-CD2 4.24Å; D140-Y147 HydrophobicContact CB-CE2 4.21Å
141	A	90.8	Very high	93	Very high	5 Å²	5	39.8 Å²	39.8	4%	0.041	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-60.7	-29.1	-179.4	0	0	0	0	0	113.7	H138 P139 F143 G144	H138-A141 HydrophobicContact CB-CB 3.78Å; H138-A141 VanDerWaalsContact O-CB 3.31Å; H138-A141 WeakPolarHBondContact O-CB 3.47Å; H138-A141 PolarHBondContact O-N 3.23Å; P139-A141 PolarHBondContact O-N 3.2Å; A141-F143 PolarHBondContact O-N 3.37Å; A141-G144 PolarHBondContact O-N 2.9Å; A141-G144 VanDerWaalsContact O-N 3.09Å
142	D	87.6	Confident	92.9	Very high	47 Å²	47	42.4 Å²	42.4	25%	0.251	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-70	-20.7	175.6	-77.7	-19.1	0	0	0	113.6	R124 D140 G144 R516	R124-D142 IonicContact CZ-OD1 2.88Å; R124-D142 IonicContact NE-OD1 3.79Å; R124-D142 PolarHBondContact NE-OD1 3.36Å; R124-D142 IonicContact NE-OD2 3.96Å; R124-D142 IonicContact NH2-OD1 3.05Å; D140-D142 PolarHBondContact O-N 3.17Å; D142-G144 VanDerWaalsContact C-N 3.33Å; D142-R516 IonicContact OD1-CZ 2.83Å; D142-R516 VanDerWaalsContact OD1-CZ 3.25Å; D142-R516 IonicContact OD1-NH1 3.77Å; D142-R516 PolarHBondContact OD1-NH1 3.32Å; D142-R516 IonicContact OD1-NH2 2.68Å; D142-R516 PolarHBondContact OD1-NH2 3.43Å; D142-R516 IonicContact OD2-NH2 2.86Å; D142-R516 PolarHBondContact OD2-NH2 3.35Å
143	F	88.2	Confident	92.8	Very high	162 Å²	162	44.7 Å²	44.7	71%	0.711	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-89.6	0	171.9	-57.6	-74	0	0	0	112.7	D140 A141 Y145	D140-F143 HydrophobicContact CB-CD2 3.89Å; D140-F143 WeakPolarHBondContact O-CB 3.42Å; D140-F143 PolarHBondContact O-N 3.11Å; A141-F143 PolarHBondContact O-N 3.37Å; F143-Y145 HydrophobicContact CB-CD2 3.74Å; F143-Y145 HydrophobicContact CB-CE2 3.8Å
144	G	86.2	Confident	92.8	Very high	65 Å²	65	49 Å²	49	67%	0.67	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	11.3	177.2	0	0	0	0	0	114.9	D140 A141 D142	D140-G144 PolarHBondContact O-N 3.31Å; A141-G144 PolarHBondContact O-N 2.9Å; A141-G144 VanDerWaalsContact O-N 3.09Å; D142-G144 VanDerWaalsContact C-N 3.33Å
145	Y	89.1	Confident	92.9	Very high	126 Å²	126	52.5 Å²	52.5	49%	0.494	27%	0.271	S	S	.	.			trans	-78.1	151.3	171.7	-63.1	-79.4	0	0	0	111.3	D140 F143 Y147	D140-Y145 HydrophobicContact CB-CD2 3.72Å; D140-Y145 HydrophobicContact CB-CG 4.36Å; D140-Y145 PolarHBondContact O-N 2.82Å; F143-Y145 HydrophobicContact CB-CD2 3.74Å; F143-Y145 HydrophobicContact CB-CE2 3.8Å; Y145-Y147 AromaticContact CD1-CE2 3.99Å; Y145-Y147 HydrophobicContact CD1-CE2 3.99Å; Y145-Y147 AromaticContact CD1-CZ 3.97Å; Y145-Y147 HydrophobicContact CD2-CE2 4.21Å; Y145-Y147 HydrophobicContact CG-CD2 4.29Å; Y145-Y147 AromaticContact CG-CE2 3.67Å; Y145-Y147 HydrophobicContact CG-CE2 3.67Å
146	D	87.5	Confident	92.9	Very high	96 Å²	96	53.2 Å²	53.2	51%	0.513	27%	0.272	S	S	.	.			trans	-117.5	56.5	176.4	-167.5	32.2	0	0	0	109.1	N189 K199	D146-N189 PolarHBondContact OD1-ND2 3.36Å; D146-K199 IonicContact OD2-NZ 2.71Å; D146-K199 PolarHBondContact OD2-NZ 3.33Å
147	Y	90.8	Very high	92.8	Very high	104 Å²	104	59 Å²	59	41%	0.408	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-71.1	145.9	175.8	-69.4	-56.4	0	0	0	110.8	P139 D140 Y145	P139-Y147 HydrophobicContact CB-CD2 4.27Å; P139-Y147 WeakPolarHBondContact O-CD2 3.36Å; D140-Y147 HydrophobicContact CB-CD2 4.24Å; D140-Y147 HydrophobicContact CB-CE2 4.21Å; Y145-Y147 AromaticContact CD1-CE2 3.99Å; Y145-Y147 HydrophobicContact CD1-CE2 3.99Å; Y145-Y147 AromaticContact CD1-CZ 3.97Å; Y145-Y147 HydrophobicContact CD2-CE2 4.21Å; Y145-Y147 HydrophobicContact CG-CD2 4.29Å; Y145-Y147 AromaticContact CG-CE2 3.67Å; Y145-Y147 HydrophobicContact CG-CE2 3.67Å
148	P	90.3	Very high	92.8	Very high	85 Å²	85	65.3 Å²	65.3	55%	0.552	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-65.7	151.2	174	29.5	-34.8	0	0	0	110.7	I150	P148-I150 PolarHBondContact O-N 3.47Å
149	S	93.1	Very high	92.9	Very high	28 Å²	28	66.3 Å²	66.3	20%	0.196	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-55	137.9	169.3	-179.6	0	0	0	0	111	L136 L137 L151	L136-S149 PolarHBondContact O-OG 3.16Å; L137-S149 VanDerWaalsContact O-CA 3.24Å; L137-S149 WeakPolarHBondContact O-CA 3.42Å; L137-S149 VanDerWaalsContact O-CB 3.24Å; L137-S149 WeakPolarHBondContact O-CB 3.38Å; S149-L151 PolarHBondContact O-N 3.31Å; S149-L151 PolarHBondContact OG-N 3.49Å; S149-L151 VanDerWaalsContact OG-N 3.1Å
150	I	95.4	Very high	93	Very high	5 Å²	5	68 Å²	68	3%	0.026	34%	0.339	C	S	.	.	S	Bend	trans	-83.6	3.7	173.4	63.5	151.7	0	0	0	112.8	L86 S87 A90 H92 L101 L136 P139 P148	L86-I150 HydrophobicContact CD1-CB 4.29Å; L86-I150 HydrophobicContact CD1-CD1 3.61Å; L86-I150 HydrophobicContact CD1-CG1 4.32Å; S87-I150 WeakPolarHBondContact CB-O 3.41Å; S87-I150 PolarHBondContact N-O 3.4Å; S87-I150 PolarHBondContact OG-O 3.32Å; A90-I150 HydrophobicContact CB-CB 3.69Å; A90-I150 HydrophobicContact CB-CG2 3.92Å; H92-I150 HydrophobicContact CB-CD1 3.95Å; L101-I150 HydrophobicContact CD1-CD1 3.83Å; L136-I150 HydrophobicContact CB-CD1 4.43Å; L136-I150 HydrophobicContact CB-CG1 4.2Å; L136-I150 HydrophobicContact CD2-CD1 3.47Å; L136-I150 VanDerWaalsContact CD2-CD1 3.47Å; L136-I150 HydrophobicContact CD2-CG1 4.17Å; L136-I150 VanDerWaalsContact O-CG1 3.25Å; L136-I150 WeakPolarHBondContact O-CG1 3.18Å; L136-I150 PolarHBondContact O-N 3.01Å; L136-I150 VanDerWaalsContact O-N 3.11Å; P139-I150 HydrophobicContact CG-CG2 4.13Å; P148-I150 PolarHBondContact O-N 3.47Å
151	L	96.1	Very high	93.2	Very high	13 Å²	13	65.9 Å²	65.9	7%	0.068	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.8	-177	-57.9	178.7	0	0	0	111.4	P84 Y85 S87 I109 F133 L136 L137 S149	P84-L151 HydrophobicContact CB-CD1 4.07Å; Y85-L151 CarbonylContact O-C 3.39Å; Y85-L151 VanDerWaalsContact O-CA 3.3Å; Y85-L151 WeakPolarHBondContact O-CA 3.38Å; S87-L151 VanDerWaalsContact OG-C 3.24Å; I109-L151 HydrophobicContact CD1-CD2 4.13Å; I109-L151 HydrophobicContact CG1-CD2 3.8Å; F133-L151 HydrophobicContact CD2-CD1 4.18Å; F133-L151 HydrophobicContact CE2-CD1 3.56Å; F133-L151 HydrophobicContact CZ-CD1 4.3Å; L136-L151 HydrophobicContact CB-CD1 3.76Å; L136-L151 HydrophobicContact CB-CD2 4.26Å; L136-L151 HydrophobicContact CB-CG 3.97Å; L136-L151 HydrophobicContact CD1-CD1 4.39Å; L136-L151 HydrophobicContact CD1-CD2 4.36Å; L137-L151 HydrophobicContact CD2-CD1 4.02Å; L137-L151 HydrophobicContact CG-CD1 4.29Å; S149-L151 PolarHBondContact O-N 3.31Å; S149-L151 PolarHBondContact OG-N 3.49Å; S149-L151 VanDerWaalsContact OG-N 3.1Å
152	H	95.1	Very high	93.5	Very high	61 Å²	61	67.7 Å²	67.7	28%	0.282	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.1	163.8	68.7	-73.6	0	0	0	109.7	Y85 L86 S87 K154	Y85-H152 WeakPolarHBondContact CB-CE1 3.16Å; Y85-H152 PolarHBondContact N-O 3.01Å; Y85-H152 PolarHBondContact O-N 2.96Å; Y85-H152 PolarHBondContact O-ND1 2.8Å; L86-H152 PolarHBondContact O-CE1 3.28Å; L86-H152 PolarHBondContact O-ND1 3.39Å; S87-H152 VanDerWaalsContact CA-ND1 3.31Å; S87-H152 WeakPolarHBondContact CA-ND1 3.25Å; S87-H152 PolarHBondContact N-ND1 2.96Å; S87-H152 PolarHBondContact OG-N 2.85Å; H152-K154 WeakPolarHBondContact NE2-CE 3.43Å
153	W	96.4	Very high	94	Very high	48 Å²	48	65.4 Å²	65.4	18%	0.182	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.7	-173.8	-69.5	87.6	0	0	0	110.6	Y77 M78 R83 P84 F133 P194	Y77-W153 HydrophobicContact CD1-CE3 4.4Å; Y77-W153 HydrophobicContact CD1-CZ3 4.1Å; Y77-W153 AromaticContact CE1-CD2 3.83Å; Y77-W153 HydrophobicContact CE1-CD2 3.83Å; Y77-W153 AromaticContact CE1-CE3 3.42Å; Y77-W153 HydrophobicContact CE1-CE3 3.42Å; Y77-W153 VanDerWaalsContact CE1-CE3 3.42Å; Y77-W153 HydrophobicContact CE1-CH2 4.07Å; Y77-W153 AromaticContact CE1-CZ3 3.52Å; Y77-W153 HydrophobicContact CE1-CZ3 3.52Å; M78-W153 HydrophobicContact CE-CH2 3.78Å; M78-W153 HydrophobicContact CG-CH2 4.4Å; M78-W153 HydrophobicContact CG-CZ3 4.25Å; R83-W153 WeakPolarHBondContact O-CA 3.49Å; P84-W153 HydrophobicContact CB-CD2 4.3Å; P84-W153 HydrophobicContact CB-CE3 4.12Å; P84-W153 HydrophobicContact CB-CH2 3.78Å; P84-W153 HydrophobicContact CB-CZ2 3.85Å; P84-W153 HydrophobicContact CB-CZ3 3.91Å; P84-W153 HydrophobicContact CG-CH2 3.91Å; P84-W153 HydrophobicContact CG-CZ2 4.44Å; P84-W153 HydrophobicContact CG-CZ3 3.96Å; F133-W153 AromaticContact CZ-CH2 3.72Å; F133-W153 HydrophobicContact CZ-CH2 3.72Å; F133-W153 AromaticContact CZ-CZ2 3.69Å; F133-W153 HydrophobicContact CZ-CZ2 3.69Å; W153-P194 HydrophobicContact CD2-CB 4.29Å; W153-P194 VanDerWaalsContact CE2-CB 3.46Å; W153-P194 HydrophobicContact CH2-CB 3.73Å; W153-P194 HydrophobicContact CH2-CG 4.24Å; W153-P194 HydrophobicContact CZ2-CB 3.17Å; W153-P194 HydrophobicContact CZ2-CG 3.99Å
154	K	97.1	Very high	94.5	Very high	92 Å²	92	58.2 Å²	58.2	40%	0.4	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.5	173.6	-63.2	-175	-171.4	168.4	0	110	Y82 R83 Y85 H152 E156	Y82-K154 CarbonylContact C-O 3.6Å; Y82-K154 WeakPolarHBondContact CA-O 3.45Å; R83-K154 PolarHBondContact N-O 3.26Å; R83-K154 PolarHBondContact O-N 3.27Å; Y85-K154 HydrophobicContact CD2-CB 4.24Å; Y85-K154 HydrophobicContact CD2-CD 3.91Å; Y85-K154 HydrophobicContact CD2-CG 4.05Å; Y85-K154 HydrophobicContact CE2-CB 4.15Å; Y85-K154 HydrophobicContact CE2-CD 3.99Å; Y85-K154 HydrophobicContact CE2-CG 4.32Å; H152-K154 WeakPolarHBondContact NE2-CE 3.43Å; K154-E156 HydrophobicContact CB-CG 4.37Å
155	L	97.6	Very high	95.1	Very high	79 Å²	79	55.1 Å²	55.1	41%	0.414	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.4	172.3	178.2	55.7	0	0	0	109.4	Y82 Q157	Y82-L155 HydrophobicContact CD1-CB 4.04Å; Y82-L155 HydrophobicContact CD1-CD1 4.29Å; Y82-L155 HydrophobicContact CD2-CD1 3.86Å; Y82-L155 HydrophobicContact CE1-CB 3.84Å; Y82-L155 HydrophobicContact CE1-CD1 4.24Å; Y82-L155 HydrophobicContact CE1-CD2 4.39Å; Y82-L155 HydrophobicContact CE1-CG 4.38Å; Y82-L155 HydrophobicContact CE2-CD1 3.8Å; Y82-L155 HydrophobicContact CG-CD1 4.13Å; L155-Q157 VanDerWaalsContact CD2-NE2 3.27Å
156	E	97.3	Very high	95.5	Very high	36 Å²	36	49.4 Å²	49.4	17%	0.168	24%	0.242	C	C	.	.			trans	-118.9	93.8	-177.5	-67	-176.2	157.2	0	0	109.3	G81 R83 Y85 K154 H158 H159	G81-E156 PolarHBondContact O-N 3.05Å; R83-E156 WeakPolarHBondContact CG-OE2 3.46Å; Y85-E156 PolarHBondContact OH-OE1 3.32Å; Y85-E156 PolarHBondContact OH-OE2 3.2Å; Y85-E156 VanDerWaalsContact OH-OE2 3.08Å; K154-E156 HydrophobicContact CB-CG 4.37Å; E156-H158 PolarHBondContact O-N 3.04Å; E156-H158 VanDerWaalsContact O-N 3.11Å; E156-H159 HydrophobicContact CB-CB 4.46Å; E156-H159 WeakPolarHBondContact O-CB 3.49Å; E156-H159 PolarHBondContact O-N 2.81Å; E156-H159 IonicContact OE2-CD2 3.99Å; E156-H159 PolarHBondContact OE2-CD2 3.36Å; E156-H159 VanDerWaalsContact OE2-CD2 3.25Å; E156-H159 IonicContact OE2-NE2 3.57Å
157	Q	94.3	Very high	95.9	Very high	121 Å²	121	45 Å²	45	57%	0.565	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-58	-30.6	-170.8	-66.2	-65.2	-24.2	0	0	113.8	L155 H159 Y160	L155-Q157 VanDerWaalsContact CD2-NE2 3.27Å; Q157-H159 PolarHBondContact O-N 2.76Å; Q157-Y160 WeakPolarHBondContact O-CB 3.47Å; Q157-Y160 PolarHBondContact O-N 3.18Å; Q157-Y160 VanDerWaalsContact O-N 3.07Å
158	H	94.3	Very high	96.1	Very high	142 Å²	142	44.1 Å²	44.1	66%	0.657	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-68.7	-11.8	177.6	65.8	-87	0	0	0	113.4	E156	E156-H158 PolarHBondContact O-N 3.04Å; E156-H158 VanDerWaalsContact O-N 3.11Å
159	H	96	Very high	96.2	Very high	31 Å²	31	41 Å²	41	14%	0.144	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-96.8	5.9	173.5	-78.8	-39.9	0	0	0	113.8	E156 Q157 I161	E156-H159 HydrophobicContact CB-CB 4.46Å; E156-H159 WeakPolarHBondContact O-CB 3.49Å; E156-H159 PolarHBondContact O-N 2.81Å; E156-H159 IonicContact OE2-CD2 3.99Å; E156-H159 PolarHBondContact OE2-CD2 3.36Å; E156-H159 VanDerWaalsContact OE2-CD2 3.25Å; E156-H159 IonicContact OE2-NE2 3.57Å; Q157-H159 PolarHBondContact O-N 2.76Å; H159-I161 PolarHBondContact O-N 3.48Å
160	Y	97.3	Very high	96.4	Very high	36 Å²	36	41.5 Å²	41.5	14%	0.141	20%	0.204	C	C	.	.			trans	-61.2	125.5	174.2	-179.8	-107.6	0	0	0	111.2	Y33 L79 Q157 P162 N235	Y33-Y160 PolarHBondContact OH-OH 3.34Å; L79-Y160 WeakPolarHBondContact O-CA 3.46Å; Q157-Y160 WeakPolarHBondContact O-CB 3.47Å; Q157-Y160 PolarHBondContact O-N 3.18Å; Q157-Y160 VanDerWaalsContact O-N 3.07Å; Y160-P162 HydrophobicContact CD1-CG 4.16Å; Y160-P162 HydrophobicContact CE1-CB 4.03Å; Y160-P162 HydrophobicContact CE1-CG 3.81Å; Y160-N235 PolarHBondContact OH-OD1 3.38Å; Y160-N235 VanDerWaalsContact OH-OD1 3.06Å
161	I	97.2	Very high	96.4	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	20%	0.202	C	C	.	.			trans	-109.6	113	171.5	-55.9	-170.2	0	0	0	107	P62 V63 L79 H159 H163 L529	P62-I161 HydrophobicContact CB-CG2 4.03Å; V63-I161 HydrophobicContact CG2-CG2 3.94Å; L79-I161 HydrophobicContact CB-CB 4.4Å; L79-I161 HydrophobicContact CD2-CB 4.12Å; L79-I161 HydrophobicContact CD2-CD1 3.95Å; L79-I161 HydrophobicContact CD2-CG1 4.37Å; L79-I161 PolarHBondContact O-N 3.5Å; H159-I161 PolarHBondContact O-N 3.48Å; I161-H163 PolarHBondContact O-N 3.31Å; I161-H163 PolarHBondContact O-ND1 3.49Å; I161-L529 HydrophobicContact CD1-CB 3.78Å
162	P	97.1	Very high	96.4	Very high	42 Å²	42	40.7 Å²	40.7	27%	0.273	20%	0.199	S	C	.	.			trans	-55.7	128.3	179.2	-22.9	29.1	0	0	0	111.6	P62 V63 Y160	P62-P162 WeakPolarHBondContact CB-O 3.37Å; P62-P162 WeakPolarHBondContact CD-O 3.22Å; P62-P162 HydrophobicContact CG-CB 3.93Å; P62-P162 HydrophobicContact CG-CG 4.12Å; P62-P162 WeakPolarHBondContact CG-O 3.34Å; V63-P162 PolarHBondContact N-O 2.92Å; Y160-P162 HydrophobicContact CD1-CG 4.16Å; Y160-P162 HydrophobicContact CE1-CB 4.03Å; Y160-P162 HydrophobicContact CE1-CG 3.81Å
163	H	98.3	Very high	96.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	159.3	-174.2	64.5	-82.4	0	0	0	112.4	V63 S76 L79 S80 I161 N235	V63-H163 HydrophobicContact CB-CB 3.88Å; V63-H163 WeakPolarHBondContact O-CA 3.34Å; S76-H163 WeakPolarHBondContact CA-NE2 3.44Å; S76-H163 WeakPolarHBondContact CB-NE2 3.13Å; S76-H163 PolarHBondContact O-CE1 2.81Å; S76-H163 PolarHBondContact O-NE2 2.92Å; S76-H163 PolarHBondContact OG-NE2 3.22Å; L79-H163 WeakPolarHBondContact CB-ND1 3.49Å; L79-H163 HydrophobicContact CD1-CB 4.01Å; S80-H163 PolarHBondContact OG-CE1 2.89Å; I161-H163 PolarHBondContact O-N 3.31Å; I161-H163 PolarHBondContact O-ND1 3.49Å; H163-N235 PolarHBondContact CE1-ND2 3.17Å; H163-N235 PolarHBondContact NE2-ND2 3.09Å
164	L	98.4	Very high	96	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.8	176.6	-165.4	68.4	0	0	0	110.6	L61 V63 V64 I65 L166 N235 R237 L297	L61-L164 HydrophobicContact CD1-CB 3.91Å; L61-L164 HydrophobicContact CD1-CD2 4.13Å; V63-L164 PolarHBondContact O-N 3.23Å; V63-L164 VanDerWaalsContact O-N 3.13Å; V64-L164 CarbonylContact C-O 3.48Å; V64-L164 WeakPolarHBondContact CA-O 3.31Å; I65-L164 PolarHBondContact N-O 3.15Å; L164-L166 HydrophobicContact CD2-CD2 3.6Å; L164-L166 HydrophobicContact CD2-CG 4.48Å; L164-L166 HydrophobicContact CG-CD2 3.78Å; L164-N235 CarbonylContact C-O 3.58Å; L164-R237 HydrophobicContact CD1-CG 3.72Å; L164-R237 HydrophobicContact CD2-CG 4.34Å; L164-R237 HydrophobicContact CG-CG 4.22Å; L164-L297 HydrophobicContact CD2-CD1 3.69Å
165	V	98.8	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.9	176.5	-171.7	0	0	0	0	109	I65 N68 N235 F236 R237	I65-V165 HydrophobicContact CB-CG1 4.42Å; I65-V165 HydrophobicContact CB-CG2 4.2Å; I65-V165 HydrophobicContact CD1-CG2 3.95Å; I65-V165 HydrophobicContact CG2-CG1 4.38Å; I65-V165 WeakPolarHBondContact O-CA 3.19Å; N68-V165 HydrophobicContact CB-CG1 3.79Å; V165-N235 PolarHBondContact N-O 2.93Å; V165-F236 HydrophobicContact CB-CD1 3.89Å; V165-F236 HydrophobicContact CB-CD2 4.35Å; V165-F236 HydrophobicContact CB-CE1 3.98Å; V165-F236 HydrophobicContact CB-CE2 4.41Å; V165-F236 HydrophobicContact CB-CG 4.1Å; V165-F236 HydrophobicContact CB-CZ 4.24Å; V165-F236 HydrophobicContact CG1-CD1 3.86Å; V165-F236 HydrophobicContact CG1-CE1 3.67Å; V165-F236 HydrophobicContact CG1-CZ 4.22Å; V165-F236 HydrophobicContact CG2-CD1 4.45Å; V165-F236 HydrophobicContact CG2-CD2 4.27Å; V165-F236 HydrophobicContact CG2-CE1 4.2Å; V165-F236 HydrophobicContact CG2-CE2 3.97Å; V165-F236 HydrophobicContact CG2-CG 4.5Å; V165-F236 HydrophobicContact CG2-CZ 3.94Å; V165-R237 PolarHBondContact O-N 2.93Å
166	L	98.1	Very high	95.4	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.4	-178.2	-55.2	-178.4	0	0	0	109.7	V64 I65 G67 L164 R237 T240 I242 I281 F295 L297	V64-L166 HydrophobicContact CG1-CD1 3.8Å; V64-L166 HydrophobicContact CG1-CG 4.25Å; I65-L166 PolarHBondContact O-N 2.85Å; G67-L166 WeakPolarHBondContact CA-O 3.47Å; G67-L166 PolarHBondContact N-O 2.88Å; L164-L166 HydrophobicContact CD2-CD2 3.6Å; L164-L166 HydrophobicContact CD2-CG 4.48Å; L164-L166 HydrophobicContact CG-CD2 3.78Å; L166-R237 HydrophobicContact CD2-CB 3.83Å; L166-R237 HydrophobicContact CD2-CG 4.22Å; L166-T240 HydrophobicContact CB-CG2 4.1Å; L166-T240 HydrophobicContact CD1-CG2 4.4Å; L166-T240 HydrophobicContact CD2-CG2 4.1Å; L166-T240 HydrophobicContact CG-CG2 4.42Å; L166-I242 HydrophobicContact CB-CD1 4.09Å; L166-I242 HydrophobicContact CD1-CD1 3.55Å; L166-I242 HydrophobicContact CG-CD1 4.46Å; L166-I281 HydrophobicContact CD1-CG2 4.4Å; L166-F295 HydrophobicContact CD1-CE2 4.32Å; L166-F295 HydrophobicContact CD1-CZ 4.31Å; L166-L297 HydrophobicContact CD1-CD1 4.2Å
167	G	95.8	Very high	94.8	Very high	4 Å²	4	38.5 Å²	38.5	4%	0.041	21%	0.206	C	C	.	.			trans	-146.5	149.7	-179.2	0	0	0	0	0	114.2	G169 R237 E238 N239 T240	G167-G169 PolarHBondContact O-N 2.75Å; G167-R237 PolarHBondContact N-O 3.05Å; G167-R237 VanDerWaalsContact N-O 3.09Å; G167-E238 CarbonylContact O-C 3.24Å; G167-N239 PolarHBondContact O-N 2.85Å; G167-T240 CarbonylContact C-O 3.56Å; G167-T240 PolarHBondContact O-N 2.88Å
168	K	94	Very high	94.3	Very high	85 Å²	85	36 Å²	36	37%	0.37	20%	0.195	S	C	.	.	S	Bend	trans	-68.4	-17.6	-176.5	-62.5	172.8	-176.4	162.1	0	114.1	T240 Y241 D310	K168-T240 PolarHBondContact N-O 3.33Å; K168-Y241 HydrophobicContact CB-CD1 4.49Å; K168-Y241 HydrophobicContact CB-CE1 3.98Å; K168-Y241 HydrophobicContact CD-CD1 4.36Å; K168-Y241 HydrophobicContact CD-CE1 4.19Å; K168-Y241 HydrophobicContact CG-CD1 3.89Å; K168-Y241 HydrophobicContact CG-CE1 3.8Å; K168-D310 IonicContact NZ-OD1 4Å; K168-D310 PolarHBondContact NZ-OD1 2.95Å; K168-D310 IonicContact NZ-OD2 3.11Å; K168-D310 PolarHBondContact NZ-OD2 3.27Å
169	G	93.4	Very high	93.2	Very high	18 Å²	18	31.5 Å²	31.5	19%	0.186	18%	0.175	C	C	.	.	S	Bend	trans	-152.5	-158.9	-177.6	0	0	0	0	0	111.6	N68 G167	N68-G169 PolarHBondContact ND2-O 3.35Å; G167-G169 PolarHBondContact O-N 2.75Å
170	P	95.7	Very high	91.7	Very high	40 Å²	40	31.7 Å²	31.7	26%	0.26	19%	0.185	S	C	.	.	S	Bend	trans	-64.5	160.1	177.5	-21.4	33.8	0	0	0	113.2	N68 G172 N176	N68-P170 VanDerWaalsContact ND2-C 3.29Å; N68-P170 PolarHBondContact ND2-O 3.15Å; N68-P170 VanDerWaalsContact ND2-O 3.15Å; P170-G172 PolarHBondContact O-N 3.44Å; P170-N176 PolarHBondContact O-ND2 3.23Å
171	P	97.3	Very high	90.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	138.2	172.8	-26	32.1	0	0	0	112.5	I73 V227 F236 E238	I73-P171 HydrophobicContact CD1-CB 4.11Å; P171-V227 HydrophobicContact CB-CB 4.33Å; P171-V227 HydrophobicContact CB-CG2 3.65Å; P171-V227 HydrophobicContact CG-CB 4.23Å; P171-V227 HydrophobicContact CG-CG1 4.26Å; P171-V227 HydrophobicContact CG-CG2 4.01Å; P171-F236 HydrophobicContact CB-CE1 4.42Å; P171-F236 HydrophobicContact CG-CD1 4.06Å; P171-F236 HydrophobicContact CG-CE1 4.41Å; P171-E238 WeakPolarHBondContact CD-OE1 3.36Å
172	G	95.1	Very high	89.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.3	-13.5	-174.1	0	0	0	0	0	113.1	N68 P170 A174 W175	N68-G172 PolarHBondContact O-N 3.28Å; P170-G172 PolarHBondContact O-N 3.44Å; G172-A174 PolarHBondContact O-N 2.71Å; G172-W175 PolarHBondContact O-N 3.29Å
173	G	93.8	Very high	88.7	Confident	20 Å²	20	35.5 Å²	35.5	21%	0.206	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	57.4	-129	174	0	0	0	0	0	112.1	W175 N176	G173-W175 PolarHBondContact O-N 2.83Å; G173-W175 VanDerWaalsContact O-N 3.08Å; G173-N176 PolarHBondContact O-N 3Å; G173-N176 VanDerWaalsContact O-N 3.16Å; G173-N176 PolarHBondContact O-ND2 2.78Å
174	A	90.1	Very high	88.2	Confident	37 Å²	37	35.8 Å²	35.8	31%	0.306	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-58.8	-22.7	-175	0	0	0	0	0	114.8	G172 N176 N177 M178 L309	G172-A174 PolarHBondContact O-N 2.71Å; A174-N176 PolarHBondContact O-N 3.38Å; A174-N177 PolarHBondContact O-N 2.96Å; A174-M178 HydrophobicContact CB-CE 4.44Å; A174-M178 PolarHBondContact O-N 3.32Å; A174-L309 HydrophobicContact CB-CB 4.14Å; A174-L309 HydrophobicContact CB-CD1 3.66Å; A174-L309 HydrophobicContact CB-CG 4.45Å
175	W	91.6	Very high	87.6	Confident	36 Å²	36	37.5 Å²	37.5	14%	0.136	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-60.1	-25.2	177.7	-69	93.7	0	0	0	113.4	G172 G173 N177 M178 T184 M191 P216 I219 A220 Y223 V515	G172-W175 PolarHBondContact O-N 3.29Å; G173-W175 PolarHBondContact O-N 2.83Å; G173-W175 VanDerWaalsContact O-N 3.08Å; W175-N177 VanDerWaalsContact C-N 3.26Å; W175-N177 PolarHBondContact O-N 2.77Å; W175-M178 HydrophobicContact CD2-CE 4.32Å; W175-M178 HydrophobicContact CD2-SD 4Å; W175-M178 HydrophobicContact CE3-CE 4.37Å; W175-M178 HydrophobicContact CE3-SD 3.52Å; W175-M178 VanDerWaalsContact CE3-SD 3.52Å; W175-M178 HydrophobicContact CH2-SD 4.42Å; W175-M178 HydrophobicContact CZ3-SD 3.75Å; W175-T184 HydrophobicContact CH2-CG2 4Å; W175-T184 HydrophobicContact CZ3-CG2 3.61Å; W175-M191 HydrophobicContact CH2-SD 3.3Å; W175-M191 WeakPolarHBondContact CH2-SD 3.38Å; W175-M191 HydrophobicContact CZ2-SD 3.75Å; W175-M191 HydrophobicContact CZ3-SD 4.13Å; W175-P216 HydrophobicContact CE3-CB 3.97Å; W175-P216 HydrophobicContact CZ3-CB 4.19Å; W175-I219 HydrophobicContact CD2-CB 4.27Å; W175-I219 HydrophobicContact CD2-CG2 3.52Å; W175-I219 HydrophobicContact CE3-CB 3.85Å; W175-I219 HydrophobicContact CE3-CG1 4.44Å; W175-I219 HydrophobicContact CE3-CG2 3.6Å; W175-I219 HydrophobicContact CG-CG2 3.95Å; W175-I219 HydrophobicContact CH2-CG2 4.41Å; W175-I219 HydrophobicContact CZ2-CG2 4.32Å; W175-I219 HydrophobicContact CZ3-CB 4.2Å; W175-I219 HydrophobicContact CZ3-CG1 4.28Å; W175-I219 HydrophobicContact CZ3-CG2 4.07Å; W175-A220 HydrophobicContact CB-CB 4.13Å; W175-Y223 AromaticContact CD1-CE2 3.46Å; W175-Y223 VanDerWaalsContact CD1-CE2 3.46Å; W175-Y223 HydrophobicContact CD2-CE2 4.26Å; W175-Y223 HydrophobicContact CG-CD2 4.29Å; W175-Y223 AromaticContact CG-CE2 3.84Å; W175-Y223 HydrophobicContact CG-CE2 3.84Å; W175-Y223 AromaticContact NE1-CE2 3.61Å; W175-V515 HydrophobicContact CZ2-CG2 4.12Å
176	N	90.2	Very high	87.1	Confident	62 Å²	62	38.4 Å²	38.4	33%	0.332	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-72.4	-19.2	175.3	-64.8	-76.2	0	0	0	113.4	P170 G173 A174	P170-N176 PolarHBondContact O-ND2 3.23Å; G173-N176 PolarHBondContact O-N 3Å; G173-N176 VanDerWaalsContact O-N 3.16Å; G173-N176 PolarHBondContact O-ND2 2.78Å; A174-N176 PolarHBondContact O-N 3.38Å
177	N	84.3	Confident	86.7	Confident	116 Å²	116	39.8 Å²	39.8	62%	0.62	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-109.1	5.3	-175.6	-60.7	-25.5	0	0	0	112.3	A174 W175 P330	A174-N177 PolarHBondContact O-N 2.96Å; W175-N177 VanDerWaalsContact C-N 3.26Å; W175-N177 PolarHBondContact O-N 2.77Å; N177-P330 WeakPolarHBondContact O-CG 3.5Å
178	M	83.3	Confident	86.4	Confident	67 Å²	67	39.8 Å²	39.8	33%	0.33	23%	0.233	S	C	.	.	S	Bend	trans	-82.3	146.1	176.3	-70	179.3	-177.8	0	0	110.5	A174 W175 G180 P216 L309	A174-M178 HydrophobicContact CB-CE 4.44Å; A174-M178 PolarHBondContact O-N 3.32Å; W175-M178 HydrophobicContact CD2-CE 4.32Å; W175-M178 HydrophobicContact CD2-SD 4Å; W175-M178 HydrophobicContact CE3-CE 4.37Å; W175-M178 HydrophobicContact CE3-SD 3.52Å; W175-M178 VanDerWaalsContact CE3-SD 3.52Å; W175-M178 HydrophobicContact CH2-SD 4.42Å; W175-M178 HydrophobicContact CZ3-SD 3.75Å; M178-G180 PolarHBondContact O-N 3.07Å; M178-P216 HydrophobicContact CB-CB 3.62Å; M178-P216 HydrophobicContact CB-CG 4.09Å; M178-P216 HydrophobicContact SD-CB 4.2Å; M178-L309 HydrophobicContact CE-CD1 3.54Å
179	E	70.8	Confident	86.2	Confident	48 Å²	48	36.5 Å²	36.5	22%	0.224	22%	0.22	C	C	.	.			trans	-62.2	123.5	179.2	-178.1	60.8	-148.4	0	0	110.7	S181 M182 M329	E179-S181 VanDerWaalsContact C-N 3.3Å; E179-S181 WeakPolarHBondContact CG-OG 3.28Å; E179-S181 PolarHBondContact O-N 2.86Å; E179-S181 PolarHBondContact OE1-OG 3.37Å; E179-M182 HydrophobicContact CB-SD 4.37Å; E179-M182 HydrophobicContact CG-CE 4.49Å; E179-M182 HydrophobicContact CG-SD 4.26Å; E179-M329 HydrophobicContact CB-CB 4.33Å; E179-M329 HydrophobicContact CB-CE 4.28Å; E179-M329 HydrophobicContact CG-CE 4.17Å
180	G	65.3	Low	86.1	Confident	35 Å²	35	37.5 Å²	37.5	36%	0.361	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-11.6	-170	0	0	0	0	0	115.4	M178	M178-G180 PolarHBondContact O-N 3.07Å
181	S	66.4	Low	86	Confident	77 Å²	77	35.7 Å²	35.7	54%	0.538	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.2	-176	57.3	0	0	0	0	114.3	E179	E179-S181 VanDerWaalsContact C-N 3.3Å; E179-S181 WeakPolarHBondContact CG-OG 3.28Å; E179-S181 PolarHBondContact O-N 2.86Å; E179-S181 PolarHBondContact OE1-OG 3.37Å
182	M	77.9	Confident	85.8	Confident	24 Å²	24	36.9 Å²	36.9	12%	0.118	21%	0.212	C	C	.	.	S	Bend	trans	-112.6	145.8	-175.5	-68.8	162	-177.7	0	0	111.8	E179 M215 P216 M329 D359 C363	E179-M182 HydrophobicContact CB-SD 4.37Å; E179-M182 HydrophobicContact CG-CE 4.49Å; E179-M182 HydrophobicContact CG-SD 4.26Å; M182-M215 VanDerWaalsContact C-SD 3.52Å; M182-P216 WeakPolarHBondContact O-CD 3.43Å; M182-M329 HydrophobicContact CE-CE 3.66Å; M182-M329 HydrophobicContact SD-CE 4.12Å; M182-D359 HydrophobicContact CE-CB 3.65Å; M182-D359 WeakPolarHBondContact CE-O 3.18Å; M182-D359 HydrophobicContact SD-CB 3.3Å; M182-D359 WeakPolarHBondContact SD-CB 3.29Å; M182-C363 HydrophobicContact CE-CB 3.73Å
183	L	84.7	Confident	85.9	Confident	59 Å²	59	36.9 Å²	36.9	31%	0.309	21%	0.212	S	C	.	.			trans	-77.1	150.1	176.2	-70.1	170.6	0	0	0	111.1	R213 M215	L183-R213 HydrophobicContact CB-CB 4.32Å; L183-M215 HydrophobicContact CD2-CE 3.41Å; L183-M215 VanDerWaalsContact CD2-CE 3.41Å; L183-M215 HydrophobicContact CD2-CG 4.46Å; L183-M215 HydrophobicContact CD2-SD 3.74Å; L183-M215 HydrophobicContact CG-CE 3.84Å; L183-M215 HydrophobicContact CG-SD 4.21Å
184	T	86.9	Confident	85.9	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.043	20%	0.203	C	C	.	.			trans	-59.9	153.9	169.8	56.6	0	0	0	0	111.4	W175 S186 M191 R213 V214 P216 I219	W175-T184 HydrophobicContact CH2-CG2 4Å; W175-T184 HydrophobicContact CZ3-CG2 3.61Å; T184-S186 WeakPolarHBondContact CB-O 3.43Å; T184-S186 PolarHBondContact OG1-O 3.24Å; T184-M191 HydrophobicContact CG2-CE 3.66Å; T184-M191 HydrophobicContact CG2-SD 4.03Å; T184-M191 WeakPolarHBondContact OG1-CE 3.48Å; T184-R213 VanDerWaalsContact O-CD 3.26Å; T184-R213 WeakPolarHBondContact O-CD 3.42Å; T184-R213 PolarHBondContact O-NH1 3.01Å; T184-V214 HydrophobicContact CG2-CG2 4.11Å; T184-V214 VanDerWaalsContact CG2-O 3.25Å; T184-V214 WeakPolarHBondContact CG2-O 3.31Å; T184-V214 PolarHBondContact N-O 3.41Å; T184-V214 PolarHBondContact OG1-N 2.72Å; T184-V214 PolarHBondContact OG1-O 3.33Å; T184-P216 HydrophobicContact CG2-CG 4.32Å; T184-I219 HydrophobicContact CG2-CG1 4.3Å
185	I	86.1	Confident	86	Confident	46 Å²	46	36.6 Å²	36.6	24%	0.236	21%	0.212	C	C	.	.	S	Bend	trans	-72.3	-52.8	168.4	-56	-56.3	0	0	0	109.5	L355 L389 Y394 Y397	I185-L355 HydrophobicContact CD1-CD1 3.72Å; I185-L355 HydrophobicContact CG1-CD1 3.78Å; I185-L355 HydrophobicContact CG2-CD1 4.49Å; I185-L389 HydrophobicContact CG2-CD2 4.48Å; I185-Y394 HydrophobicContact CG2-CE1 4.16Å; I185-Y394 WeakPolarHBondContact O-CE1 3.38Å; I185-Y394 PolarHBondContact O-OH 3.04Å; I185-Y397 HydrophobicContact CD1-CD2 4.23Å; I185-Y397 HydrophobicContact CD1-CE2 3.24Å; I185-Y397 WeakPolarHBondContact CD1-OH 3.22Å
186	S	88.2	Confident	86	Confident	20 Å²	20	36.7 Å²	36.7	14%	0.14	22%	0.215	C	C	.	.	S	Bend	trans	-73.2	157.8	178.9	-57.8	0	0	0	0	112.1	T184 M191	T184-S186 WeakPolarHBondContact CB-O 3.43Å; T184-S186 PolarHBondContact OG1-O 3.24Å; S186-M191 WeakPolarHBondContact O-CE 3.32Å
187	F	89.9	Confident	86.1	Confident	35 Å²	35	38.1 Å²	38.1	15%	0.154	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-70.7	151.4	170.5	-55.2	-35.6	0	0	0	111.6	N189 W190 M191 D212 R213 L393	F187-N189 VanDerWaalsContact C-N 3.35Å; F187-N189 WeakPolarHBondContact CB-OD1 3.38Å; F187-N189 PolarHBondContact O-N 3.4Å; F187-W190 HydrophobicContact CB-CD2 4.32Å; F187-W190 HydrophobicContact CB-CG 4.31Å; F187-W190 AromaticContact CD2-CD2 3.99Å; F187-W190 HydrophobicContact CD2-CD2 3.99Å; F187-W190 AromaticContact CD2-CE2 3.68Å; F187-W190 HydrophobicContact CD2-CE3 4.27Å; F187-W190 AromaticContact CD2-CH2 4Å; F187-W190 HydrophobicContact CD2-CH2 4Å; F187-W190 AromaticContact CD2-CZ2 3.7Å; F187-W190 HydrophobicContact CD2-CZ2 3.7Å; F187-W190 HydrophobicContact CD2-CZ3 4.27Å; F187-W190 AromaticContact CE2-CH2 3.95Å; F187-W190 HydrophobicContact CE2-CH2 3.95Å; F187-W190 AromaticContact CE2-CZ2 3.87Å; F187-W190 HydrophobicContact CE2-CZ2 3.87Å; F187-W190 HydrophobicContact CE2-CZ3 4.48Å; F187-W190 HydrophobicContact CG-CD2 4.5Å; F187-W190 PolarHBondContact O-N 3.3Å; F187-W190 VanDerWaalsContact O-N 3.13Å; F187-M191 WeakPolarHBondContact O-CE 3.47Å; F187-M191 PolarHBondContact O-N 3.19Å; F187-D212 CarbonylContact C-O 3.54Å; F187-D212 WeakPolarHBondContact CA-O 3.35Å; F187-D212 HydrophobicContact CB-CB 4.33Å; F187-D212 HydrophobicContact CD1-CB 3.8Å; F187-D212 HydrophobicContact CE1-CB 4.34Å; F187-D212 HydrophobicContact CG-CB 4.12Å; F187-R213 HydrophobicContact CD1-CG 3.87Å; F187-R213 HydrophobicContact CE1-CG 4.23Å; F187-L393 HydrophobicContact CE1-CD1 4.39Å; F187-L393 HydrophobicContact CE1-CD2 4.3Å; F187-L393 HydrophobicContact CZ-CD1 3.9Å; F187-L393 HydrophobicContact CZ-CD2 4.28Å
188	G	89.3	Confident	86.5	Confident	3 Å²	3	32.9 Å²	32.9	3%	0.031	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-43.8	-178.8	0	0	0	0	0	113.3	W190 M191 E192 D212	G188-W190 VanDerWaalsContact C-N 3.29Å; G188-W190 PolarHBondContact O-N 2.76Å; G188-M191 PolarHBondContact O-N 2.91Å; G188-M191 VanDerWaalsContact O-N 3.08Å; G188-E192 PolarHBondContact O-N 3.5Å; G188-D212 PolarHBondContact N-O 3.48Å
189	N	88.9	Confident	86.7	Confident	16 Å²	16	33.8 Å²	33.8	9%	0.086	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-61.2	-34.2	176.9	60.8	-19	0	0	0	112.6	H138 D146 F187 M191 E192	H138-N189 PolarHBondContact CE1-O 3.18Å; H138-N189 VanDerWaalsContact CE1-O 3.25Å; D146-N189 PolarHBondContact OD1-ND2 3.36Å; F187-N189 VanDerWaalsContact C-N 3.35Å; F187-N189 WeakPolarHBondContact CB-OD1 3.38Å; F187-N189 PolarHBondContact O-N 3.4Å; N189-M191 PolarHBondContact O-N 3.48Å; N189-E192 WeakPolarHBondContact O-CG 3.5Å; N189-E192 PolarHBondContact O-N 3.02Å
190	W	92.1	Very high	87.6	Confident	39 Å²	39	36.2 Å²	36.2	15%	0.148	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-71.2	-17.7	177.3	-65.2	-2.6	0	0	0	113.5	F187 G188 R516	F187-W190 HydrophobicContact CB-CD2 4.32Å; F187-W190 HydrophobicContact CB-CG 4.31Å; F187-W190 AromaticContact CD2-CD2 3.99Å; F187-W190 HydrophobicContact CD2-CD2 3.99Å; F187-W190 AromaticContact CD2-CE2 3.68Å; F187-W190 HydrophobicContact CD2-CE3 4.27Å; F187-W190 AromaticContact CD2-CH2 4Å; F187-W190 HydrophobicContact CD2-CH2 4Å; F187-W190 AromaticContact CD2-CZ2 3.7Å; F187-W190 HydrophobicContact CD2-CZ2 3.7Å; F187-W190 HydrophobicContact CD2-CZ3 4.27Å; F187-W190 AromaticContact CE2-CH2 3.95Å; F187-W190 HydrophobicContact CE2-CH2 3.95Å; F187-W190 AromaticContact CE2-CZ2 3.87Å; F187-W190 HydrophobicContact CE2-CZ2 3.87Å; F187-W190 HydrophobicContact CE2-CZ3 4.48Å; F187-W190 HydrophobicContact CG-CD2 4.5Å; F187-W190 PolarHBondContact O-N 3.3Å; F187-W190 VanDerWaalsContact O-N 3.13Å; G188-W190 VanDerWaalsContact C-N 3.29Å; G188-W190 PolarHBondContact O-N 2.76Å; W190-R516 HydrophobicContact CB-CG 4.24Å; W190-R516 PolarHBondContact O-N 3.44Å
191	M	93.4	Very high	88.8	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-100.4	3.7	179.2	-62.2	-179.5	-72.7	0	0	113.2	W175 T184 S186 F187 G188 N189 V214 I219 Y223 V515	W175-M191 HydrophobicContact CH2-SD 3.3Å; W175-M191 WeakPolarHBondContact CH2-SD 3.38Å; W175-M191 HydrophobicContact CZ2-SD 3.75Å; W175-M191 HydrophobicContact CZ3-SD 4.13Å; T184-M191 HydrophobicContact CG2-CE 3.66Å; T184-M191 HydrophobicContact CG2-SD 4.03Å; T184-M191 WeakPolarHBondContact OG1-CE 3.48Å; S186-M191 WeakPolarHBondContact O-CE 3.32Å; F187-M191 WeakPolarHBondContact O-CE 3.47Å; F187-M191 PolarHBondContact O-N 3.19Å; G188-M191 PolarHBondContact O-N 2.91Å; G188-M191 VanDerWaalsContact O-N 3.08Å; N189-M191 PolarHBondContact O-N 3.48Å; M191-V214 HydrophobicContact CE-CG2 3.68Å; M191-I219 HydrophobicContact CB-CD1 3.94Å; M191-I219 HydrophobicContact CE-CD1 3.68Å; M191-I219 HydrophobicContact CE-CG1 3.9Å; M191-I219 HydrophobicContact SD-CD1 4.19Å; M191-I219 HydrophobicContact SD-CG1 4.21Å; M191-Y223 WeakPolarHBondContact O-CE1 3.45Å; M191-Y223 PolarHBondContact O-OH 3.44Å; M191-Y223 VanDerWaalsContact O-OH 3.05Å; M191-V515 HydrophobicContact CB-CB 4.33Å; M191-V515 HydrophobicContact CB-CG1 4.35Å; M191-V515 HydrophobicContact CG-CB 4.21Å; M191-V515 HydrophobicContact CG-CG2 4.26Å
192	E	94.2	Very high	89.7	Confident	25 Å²	25	32.4 Å²	32.4	12%	0.117	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-71.8	148.8	177.2	82.3	-168.1	-171.7	0	0	111.9	H138 G188 N189 K197 F198 K519	H138-E192 IonicContact CE1-OE1 2.81Å; H138-E192 PolarHBondContact CE1-OE1 3.37Å; H138-E192 IonicContact NE2-OE1 3.17Å; G188-E192 PolarHBondContact O-N 3.5Å; N189-E192 WeakPolarHBondContact O-CG 3.5Å; N189-E192 PolarHBondContact O-N 3.02Å; E192-K197 VanDerWaalsContact OE2-CA 3.25Å; E192-K197 WeakPolarHBondContact OE2-CA 3.46Å; E192-F198 HydrophobicContact CB-CB 3.72Å; E192-F198 PolarHBondContact OE2-N 3.08Å; E192-K519 PolarHBondContact O-NZ 3.42Å
193	L	95.8	Very high	89.9	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-93.9	156.3	175	-63.9	-179.2	0	0	0	110.5	P70 I73 L196 Y222 Y223 Y226	P70-L193 HydrophobicContact CB-CD2 4.02Å; I73-L193 HydrophobicContact CB-CD1 4.05Å; I73-L193 HydrophobicContact CD1-CD1 4.33Å; I73-L193 HydrophobicContact CG2-CD1 3.49Å; I73-L193 VanDerWaalsContact CG2-CD1 3.49Å; L193-L196 PolarHBondContact O-N 3.05Å; L193-Y222 HydrophobicContact CB-CE1 4.33Å; L193-Y222 HydrophobicContact CG-CE1 4.14Å; L193-Y222 PolarHBondContact N-OH 3.31Å; L193-Y222 PolarHBondContact O-OH 3.34Å; L193-Y223 HydrophobicContact CD1-CD1 3.45Å; L193-Y223 VanDerWaalsContact CD1-CD1 3.45Å; L193-Y223 HydrophobicContact CD1-CE1 3.85Å; L193-Y223 HydrophobicContact CD1-CG 4.41Å; L193-Y223 HydrophobicContact CD2-CD1 4.47Å; L193-Y223 HydrophobicContact CD2-CE1 4.02Å; L193-Y223 HydrophobicContact CG-CD1 3.77Å; L193-Y223 HydrophobicContact CG-CE1 3.63Å; L193-Y226 HydrophobicContact CB-CD1 4.41Å; L193-Y226 HydrophobicContact CB-CD2 3.64Å; L193-Y226 HydrophobicContact CB-CE1 4.17Å; L193-Y226 HydrophobicContact CB-CE2 3.32Å; L193-Y226 HydrophobicContact CB-CG 4.18Å; L193-Y226 HydrophobicContact CD1-CD1 3.7Å; L193-Y226 HydrophobicContact CD1-CD2 4.11Å; L193-Y226 HydrophobicContact CD1-CE1 3.98Å; L193-Y226 HydrophobicContact CD1-CE2 4.35Å; L193-Y226 HydrophobicContact CD1-CG 3.77Å; L193-Y226 HydrophobicContact CG-CD2 4.45Å; L193-Y226 HydrophobicContact CG-CE2 4.47Å
194	P	93.7	Very high	89.5	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	143.2	-170.1	-17.1	28.7	0	0	0	114.2	Y77 W153 L196 Y226 K519	Y77-P194 HydrophobicContact CD1-CB 4.28Å; Y77-P194 HydrophobicContact CE1-CB 3.91Å; W153-P194 HydrophobicContact CD2-CB 4.29Å; W153-P194 VanDerWaalsContact CE2-CB 3.46Å; W153-P194 HydrophobicContact CH2-CB 3.73Å; W153-P194 HydrophobicContact CH2-CG 4.24Å; W153-P194 HydrophobicContact CZ2-CB 3.17Å; W153-P194 HydrophobicContact CZ2-CG 3.99Å; P194-L196 VanDerWaalsContact C-N 3.26Å; P194-L196 PolarHBondContact O-N 3.47Å; P194-Y226 VanDerWaalsContact O-CE2 3.25Å; P194-Y226 WeakPolarHBondContact O-CE2 3.37Å; P194-Y226 PolarHBondContact O-OH 2.84Å; P194-K519 HydrophobicContact CG-CD 4.05Å; P194-K519 HydrophobicContact CG-CG 4.45Å
195	G	92.2	Very high	88.9	Confident	47 Å²	47	41.6 Å²	41.6	49%	0.485	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	-8	176.8	0	0	0	0	0	116.2	M230	G195-M230 VanDerWaalsContact C-CE 3.41Å; G195-M230 WeakPolarHBondContact O-CE 3.46Å
196	L	93.6	Very high	87.7	Confident	38 Å²	38	50.7 Å²	50.7	20%	0.199	26%	0.259	C	S	.	.	S	Bend	trans	-137.6	105.8	170	177.4	70	0	0	0	110.6	L193 P194 Y222 Y226 V229 M230	L193-L196 PolarHBondContact O-N 3.05Å; P194-L196 VanDerWaalsContact C-N 3.26Å; P194-L196 PolarHBondContact O-N 3.47Å; L196-Y222 HydrophobicContact CD2-CD2 4.48Å; L196-Y222 HydrophobicContact CD2-CE2 3.79Å; L196-Y222 HydrophobicContact CG-CE2 4.03Å; L196-Y222 PolarHBondContact O-OH 3.4Å; L196-Y226 HydrophobicContact CB-CD2 3.9Å; L196-Y226 HydrophobicContact CB-CE2 3.99Å; L196-Y226 HydrophobicContact CD2-CD2 3.98Å; L196-V229 HydrophobicContact CD2-CG2 3.89Å; L196-M230 HydrophobicContact CB-CE 3.48Å; L196-M230 VanDerWaalsContact CB-CE 3.48Å
197	K	92.3	Very high	86.4	Confident	91 Å²	91	55.4 Å²	55.4	40%	0.396	27%	0.274	S	S	.	.			trans	-66.5	139.8	179	-63.5	-177	178.3	179.6	0	111.5	E192 K199 D200 W201	E192-K197 VanDerWaalsContact OE2-CA 3.25Å; E192-K197 WeakPolarHBondContact OE2-CA 3.46Å; K197-K199 PolarHBondContact O-N 3.16Å; K197-D200 HydrophobicContact CB-CB 4.26Å; K197-D200 WeakPolarHBondContact CB-OD2 3.42Å; K197-D200 PolarHBondContact O-N 3.17Å; K197-W201 PolarHBondContact O-N 2.94Å
198	F	91.3	Very high	84.6	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-39.7	-179.6	-176.3	-90.5	0	0	0	111.6	E192 D200 W201 M202 V214 I219 Y222	E192-F198 HydrophobicContact CB-CB 3.72Å; E192-F198 PolarHBondContact OE2-N 3.08Å; F198-D200 VanDerWaalsContact C-N 3.34Å; F198-D200 PolarHBondContact O-N 3.36Å; F198-W201 HydrophobicContact CD2-CE3 4.26Å; F198-W201 AromaticContact CE2-CE3 3.88Å; F198-W201 HydrophobicContact CE2-CE3 3.88Å; F198-W201 AromaticContact CE2-CZ3 3.83Å; F198-W201 HydrophobicContact CE2-CZ3 3.83Å; F198-W201 HydrophobicContact CZ-CE3 4.3Å; F198-W201 HydrophobicContact CZ-CZ3 4.12Å; F198-W201 PolarHBondContact O-N 2.82Å; F198-M202 HydrophobicContact CD1-CG 3.8Å; F198-M202 HydrophobicContact CE1-CG 3.24Å; F198-M202 HydrophobicContact CE1-SD 4.04Å; F198-M202 HydrophobicContact CE2-CG 4.34Å; F198-M202 HydrophobicContact CZ-CG 3.57Å; F198-M202 HydrophobicContact CZ-SD 3.8Å; F198-M202 WeakPolarHBondContact O-CG 3.34Å; F198-M202 PolarHBondContact O-N 2.9Å; F198-V214 HydrophobicContact CE1-CB 4.41Å; F198-V214 HydrophobicContact CE1-CG1 3.67Å; F198-V214 HydrophobicContact CE1-CG2 4.43Å; F198-V214 HydrophobicContact CZ-CB 4.35Å; F198-V214 HydrophobicContact CZ-CG1 4.09Å; F198-V214 HydrophobicContact CZ-CG2 4.25Å; F198-I219 HydrophobicContact CD2-CD1 4.02Å; F198-I219 HydrophobicContact CE2-CD1 3.56Å; F198-I219 HydrophobicContact CZ-CD1 3.98Å; F198-Y222 HydrophobicContact CB-CE2 4.5Å; F198-Y222 AromaticContact CD2-CD1 3.93Å; F198-Y222 HydrophobicContact CD2-CD1 3.93Å; F198-Y222 AromaticContact CD2-CD2 3.7Å; F198-Y222 HydrophobicContact CD2-CD2 3.7Å; F198-Y222 HydrophobicContact CD2-CE1 4.37Å; F198-Y222 HydrophobicContact CD2-CE2 4.15Å; F198-Y222 AromaticContact CD2-CG 3.58Å; F198-Y222 HydrophobicContact CD2-CG 3.58Å; F198-Y222 HydrophobicContact CE2-CD1 4.4Å; F198-Y222 HydrophobicContact CE2-CD2 4.25Å; F198-Y222 AromaticContact CE2-CG 3.87Å; F198-Y222 HydrophobicContact CE2-CG 3.87Å
199	K	88.4	Confident	83	Confident	87 Å²	87	65.3 Å²	65.3	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-41.3	177.6	-71.6	-176.8	176.8	178.4	0	112.3	D146 K197 M202 S203	D146-K199 IonicContact OD2-NZ 2.71Å; D146-K199 PolarHBondContact OD2-NZ 3.33Å; K197-K199 PolarHBondContact O-N 3.16Å; K199-M202 PolarHBondContact O-N 3.39Å; K199-S203 WeakPolarHBondContact O-CB 3.46Å; K199-S203 PolarHBondContact O-N 3.19Å; K199-S203 PolarHBondContact O-OG 3.41Å
200	D	88.9	Confident	81.4	Confident	98 Å²	98	75 Å²	75	52%	0.524	37%	0.368	S	S	.	.	H	α-helix	trans	-67.6	-44.4	179.5	-61.6	-13.2	0	0	0	110.6	K197 F198 M202 S203 S204	K197-D200 HydrophobicContact CB-CB 4.26Å; K197-D200 WeakPolarHBondContact CB-OD2 3.42Å; K197-D200 PolarHBondContact O-N 3.17Å; F198-D200 VanDerWaalsContact C-N 3.34Å; F198-D200 PolarHBondContact O-N 3.36Å; D200-M202 PolarHBondContact O-N 3.39Å; D200-S203 PolarHBondContact O-N 3.33Å; D200-S204 PolarHBondContact O-N 3.5Å; D200-S204 VanDerWaalsContact O-N 3.13Å
201	W	90.3	Very high	80.2	Confident	18 Å²	18	75.4 Å²	75.4	7%	0.068	39%	0.385	C	S	.	.	H	α-helix	trans	-59.6	-45.4	175.2	177.3	77.6	0	0	0	112	K197 F198 S204 E218 R221 Y222 H225	K197-W201 PolarHBondContact O-N 2.94Å; F198-W201 HydrophobicContact CD2-CE3 4.26Å; F198-W201 AromaticContact CE2-CE3 3.88Å; F198-W201 HydrophobicContact CE2-CE3 3.88Å; F198-W201 AromaticContact CE2-CZ3 3.83Å; F198-W201 HydrophobicContact CE2-CZ3 3.83Å; F198-W201 HydrophobicContact CZ-CE3 4.3Å; F198-W201 HydrophobicContact CZ-CZ3 4.12Å; F198-W201 PolarHBondContact O-N 2.82Å; W201-S204 PolarHBondContact O-N 2.94Å; W201-S204 PolarHBondContact O-OG 3.32Å; W201-E218 WeakPolarHBondContact CH2-O 3.47Å; W201-R221 HydrophobicContact CH2-CB 3.93Å; W201-R221 HydrophobicContact CZ2-CB 4.21Å; W201-Y222 HydrophobicContact CB-CD2 4.06Å; W201-Y222 HydrophobicContact CB-CE2 4.23Å; W201-Y222 AromaticContact CD2-CD2 3.71Å; W201-Y222 HydrophobicContact CD2-CD2 3.71Å; W201-Y222 HydrophobicContact CD2-CG 4.45Å; W201-Y222 AromaticContact CE3-CD2 3.81Å; W201-Y222 HydrophobicContact CE3-CD2 3.81Å; W201-Y222 HydrophobicContact CE3-CG 4.26Å; W201-Y222 AromaticContact CG-CD2 3.81Å; W201-Y222 HydrophobicContact CG-CD2 3.81Å; W201-Y222 HydrophobicContact CG-CE2 4.4Å; W201-H225 AromaticContact CD1-CD2 3.3Å; W201-H225 AromaticContact CD1-NE2 3.88Å; W201-H225 AromaticContact NE1-CD2 3.02Å; W201-H225 PolarHBondContact NE1-CD2 2.84Å; W201-H225 AromaticContact NE1-CG 3.5Å; W201-H225 AromaticContact NE1-NE2 3.74Å
202	M	85.6	Confident	79.7	Confident	15 Å²	15	79.9 Å²	79.9	7%	0.074	41%	0.409	C	S	.	.	H	α-helix	trans	-64.5	-44.1	177.8	-77.8	-60.7	-69.7	0	0	113.1	F198 K199 D200 S204 K205 R207 L209	F198-M202 HydrophobicContact CD1-CG 3.8Å; F198-M202 HydrophobicContact CE1-CG 3.24Å; F198-M202 HydrophobicContact CE1-SD 4.04Å; F198-M202 HydrophobicContact CE2-CG 4.34Å; F198-M202 HydrophobicContact CZ-CG 3.57Å; F198-M202 HydrophobicContact CZ-SD 3.8Å; F198-M202 WeakPolarHBondContact O-CG 3.34Å; F198-M202 PolarHBondContact O-N 2.9Å; K199-M202 PolarHBondContact O-N 3.39Å; D200-M202 PolarHBondContact O-N 3.39Å; M202-S204 VanDerWaalsContact C-N 3.26Å; M202-S204 PolarHBondContact O-N 3.42Å; M202-K205 PolarHBondContact O-N 3.26Å; M202-R207 HydrophobicContact CE-CB 4.17Å; M202-L209 HydrophobicContact CE-CD1 3.07Å
203	S	82.5	Confident	79.4	Confident	89 Å²	89	80 Å²	80	62%	0.622	41%	0.408	S	S	*	.	H	α-helix	trans	-61.3	-37.8	-179.3	-59.9	0	0	0	0	111.5	K199 D200 K205 R206	K199-S203 WeakPolarHBondContact O-CB 3.46Å; K199-S203 PolarHBondContact O-N 3.19Å; K199-S203 PolarHBondContact O-OG 3.41Å; D200-S203 PolarHBondContact O-N 3.33Å; S203-K205 PolarHBondContact O-N 3.5Å; S203-K205 VanDerWaalsContact O-N 3.12Å; S203-R206 PolarHBondContact O-N 3.2Å
204	S	76.8	Confident	79.1	Confident	82 Å²	82	80.2 Å²	80.2	57%	0.573	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.9	175.5	81.3	0	0	0	0	113.9	D200 W201 M202	D200-S204 PolarHBondContact O-N 3.5Å; D200-S204 VanDerWaalsContact O-N 3.13Å; W201-S204 PolarHBondContact O-N 2.94Å; W201-S204 PolarHBondContact O-OG 3.32Å; M202-S204 VanDerWaalsContact C-N 3.26Å; M202-S204 PolarHBondContact O-N 3.42Å
205	K	73.6	Confident	78.9	Confident	111 Å²	111	82.8 Å²	82.8	48%	0.483	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	9.7	-178	-62.1	-64.5	-179	-176.4	0	114	M202 S203 R207	M202-K205 PolarHBondContact O-N 3.26Å; S203-K205 PolarHBondContact O-N 3.5Å; S203-K205 VanDerWaalsContact O-N 3.12Å; K205-R207 PolarHBondContact O-N 3.19Å
206	R	60.3	Low	78.8	Confident	238 Å²	238	81 Å²	81	90%	0.898	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	32.7	177.7	-59.7	-175.4	179.3	179.7	-0.2	114.2	S203	S203-R206 PolarHBondContact O-N 3.2Å
207	R	62.3	Low	78.6	Confident	118 Å²	118	83.8 Å²	83.8	45%	0.445	41%	0.414	S	S	.	.			trans	-100.8	106.5	175	-68.3	-176.3	179	-171.9	-0.9	109.5	M202 K205 L209 E218	M202-R207 HydrophobicContact CE-CB 4.17Å; K205-R207 PolarHBondContact O-N 3.19Å; R207-L209 HydrophobicContact CB-CD1 4.45Å; R207-L209 PolarHBondContact O-N 3.2Å; R207-L209 VanDerWaalsContact O-N 3.11Å; R207-E218 IonicContact NH1-OE1 2.83Å; R207-E218 PolarHBondContact NH1-OE1 2.68Å
208	N	51.1	Low	78.5	Confident	167 Å²	167	80 Å²	80	89%	0.893	40%	0.398	S	S	*	.			trans	-78.9	85	170.8	-74.4	-22.8	0	0	0	109.4
209	L	55.8	Low	78.6	Confident	79 Å²	79	79.8 Å²	79.8	41%	0.414	40%	0.397	S	S	.	.			trans	-81.6	124.5	168.7	-84.3	137	0	0	0	109.8	M202 R207 G211	M202-L209 HydrophobicContact CE-CD1 3.07Å; R207-L209 HydrophobicContact CB-CD1 4.45Å; R207-L209 PolarHBondContact O-N 3.2Å; R207-L209 VanDerWaalsContact O-N 3.11Å; L209-G211 PolarHBondContact O-N 2.9Å
210	K	54.4	Low	78.9	Confident	219 Å²	219	76 Å²	76	95%	0.952	38%	0.382	S	S	*	.			trans	-86.1	84.4	169	-70.2	-177.8	177.4	-179.1	0	107.9
211	G	68.1	Low	79.2	Confident	49 Å²	49	75.8 Å²	75.8	51%	0.505	37%	0.374	S	S	.	.	S	Bend	trans	153.8	153	173	0	0	0	0	0	114.3	L209	L209-G211 PolarHBondContact O-N 2.9Å
212	D	81.7	Confident	79.4	Confident	96 Å²	96	75 Å²	75	51%	0.513	37%	0.371	S	S	.	.	S	Bend	trans	-82.7	-18.3	179.8	-60.8	-47.5	0	0	0	113.3	F187 G188	F187-D212 CarbonylContact C-O 3.54Å; F187-D212 WeakPolarHBondContact CA-O 3.35Å; F187-D212 HydrophobicContact CB-CB 4.33Å; F187-D212 HydrophobicContact CD1-CB 3.8Å; F187-D212 HydrophobicContact CE1-CB 4.34Å; F187-D212 HydrophobicContact CG-CB 4.12Å; G188-D212 PolarHBondContact N-O 3.48Å
213	R	88.8	Confident	80	Confident	26 Å²	26	74.2 Å²	74.2	10%	0.098	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-91.1	146.7	174.5	-59.9	-172	-57.6	138.1	-11.2	109.9	L183 T184 F187 L393 E396	L183-R213 HydrophobicContact CB-CB 4.32Å; T184-R213 VanDerWaalsContact O-CD 3.26Å; T184-R213 WeakPolarHBondContact O-CD 3.42Å; T184-R213 PolarHBondContact O-NH1 3.01Å; F187-R213 HydrophobicContact CD1-CG 3.87Å; F187-R213 HydrophobicContact CE1-CG 4.23Å; R213-L393 VanDerWaalsContact CZ-O 3.25Å; R213-L393 PolarHBondContact NE-O 3.32Å; R213-L393 PolarHBondContact NH2-O 2.72Å; R213-E396 IonicContact CZ-OE1 2.71Å; R213-E396 IonicContact NH1-OE1 2.68Å; R213-E396 PolarHBondContact NH1-OE1 3.2Å; R213-E396 VanDerWaalsContact NH2-CD 3.31Å; R213-E396 IonicContact NH2-OE1 2.83Å; R213-E396 PolarHBondContact NH2-OE1 2.77Å; R213-E396 IonicContact NH2-OE2 2.94Å; R213-E396 PolarHBondContact NH2-OE2 3.11Å; R213-E396 VanDerWaalsContact NH2-OE2 3.11Å
214	V	89	Confident	80.7	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.042	36%	0.358	C	S	.	.			trans	-131.2	168.1	-168.5	-62.9	0	0	0	0	110.6	T184 M191 F198 I219	T184-V214 HydrophobicContact CG2-CG2 4.11Å; T184-V214 VanDerWaalsContact CG2-O 3.25Å; T184-V214 WeakPolarHBondContact CG2-O 3.31Å; T184-V214 PolarHBondContact N-O 3.41Å; T184-V214 PolarHBondContact OG1-N 2.72Å; T184-V214 PolarHBondContact OG1-O 3.33Å; M191-V214 HydrophobicContact CE-CG2 3.68Å; F198-V214 HydrophobicContact CE1-CB 4.41Å; F198-V214 HydrophobicContact CE1-CG1 3.67Å; F198-V214 HydrophobicContact CE1-CG2 4.43Å; F198-V214 HydrophobicContact CZ-CB 4.35Å; F198-V214 HydrophobicContact CZ-CG1 4.09Å; F198-V214 HydrophobicContact CZ-CG2 4.25Å; V214-I219 HydrophobicContact CG2-CD1 3.63Å; V214-I219 HydrophobicContact CG2-CG1 3.62Å
215	M	89.1	Confident	81.6	Confident	57 Å²	57	74 Å²	74	28%	0.281	35%	0.345	S	S	.	.			trans	-81.3	142.1	176.3	-62.1	-61.5	172.8	0	0	110.6	M182 L183 E217 E218 I219	M182-M215 VanDerWaalsContact C-SD 3.52Å; L183-M215 HydrophobicContact CD2-CE 3.41Å; L183-M215 VanDerWaalsContact CD2-CE 3.41Å; L183-M215 HydrophobicContact CD2-CG 4.46Å; L183-M215 HydrophobicContact CD2-SD 3.74Å; L183-M215 HydrophobicContact CG-CE 3.84Å; L183-M215 HydrophobicContact CG-SD 4.21Å; M215-E217 PolarHBondContact O-N 2.7Å; M215-E217 VanDerWaalsContact O-N 3.14Å; M215-E218 HydrophobicContact CB-CG 4.22Å; M215-E218 PolarHBondContact N-OE2 3.26Å; M215-E218 WeakPolarHBondContact O-CB 3.37Å; M215-E218 PolarHBondContact O-N 3.28Å; M215-I219 PolarHBondContact O-N 3.37Å
216	P	90.4	Very high	82.8	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.058	32%	0.322	C	S	.	.	H	α-helix	trans	-51.9	-35.4	174.3	-28.9	33.9	0	0	0	113.4	W175 M178 M182 T184 E218 I219 A220	W175-P216 HydrophobicContact CE3-CB 3.97Å; W175-P216 HydrophobicContact CZ3-CB 4.19Å; M178-P216 HydrophobicContact CB-CB 3.62Å; M178-P216 HydrophobicContact CB-CG 4.09Å; M178-P216 HydrophobicContact SD-CB 4.2Å; M182-P216 WeakPolarHBondContact O-CD 3.43Å; T184-P216 HydrophobicContact CG2-CG 4.32Å; P216-E218 VanDerWaalsContact C-N 3.3Å; P216-E218 PolarHBondContact O-N 2.83Å; P216-I219 WeakPolarHBondContact O-CB 3.33Å; P216-I219 PolarHBondContact O-N 3.26Å; P216-A220 PolarHBondContact O-N 2.82Å
217	E	89.5	Confident	84.6	Confident	97 Å²	97	57.3 Å²	57.3	45%	0.453	28%	0.279	S	S	.	.	H	α-helix	trans	-63.4	-34.3	176.5	-161.7	-163.2	-167.9	0	0	112.5	M215 R221	M215-E217 PolarHBondContact O-N 2.7Å; M215-E217 VanDerWaalsContact O-N 3.14Å; E217-R221 VanDerWaalsContact O-CG 3.29Å; E217-R221 WeakPolarHBondContact O-CG 3.39Å; E217-R221 PolarHBondContact O-N 3.3Å; E217-R221 IonicContact OE1-CZ 3.16Å; E217-R221 IonicContact OE1-NH1 2.8Å; E217-R221 IonicContact OE1-NH2 2.82Å; E217-R221 PolarHBondContact OE1-NH2 3.37Å; E217-R221 IonicContact OE2-CZ 2.7Å; E217-R221 IonicContact OE2-NH1 2.67Å; E217-R221 PolarHBondContact OE2-NH1 3.21Å; E217-R221 IonicContact OE2-NH2 3.34Å; E217-R221 PolarHBondContact OE2-NH2 3.47Å
218	E	91.2	Very high	86.2	Confident	13 Å²	13	55.5 Å²	55.5	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-71.4	-38.5	175.6	-63.4	-175.3	130	0	0	111.3	W201 R207 M215 P216 R221 Y222	W201-E218 WeakPolarHBondContact CH2-O 3.47Å; R207-E218 IonicContact NH1-OE1 2.83Å; R207-E218 PolarHBondContact NH1-OE1 2.68Å; M215-E218 HydrophobicContact CB-CG 4.22Å; M215-E218 PolarHBondContact N-OE2 3.26Å; M215-E218 WeakPolarHBondContact O-CB 3.37Å; M215-E218 PolarHBondContact O-N 3.28Å; P216-E218 VanDerWaalsContact C-N 3.3Å; P216-E218 PolarHBondContact O-N 2.83Å; E218-R221 PolarHBondContact O-N 3.36Å; E218-Y222 WeakPolarHBondContact O-CB 3.44Å; E218-Y222 PolarHBondContact O-N 2.74Å
219	I	93.4	Very high	88.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-44.4	172.7	-65.8	-63.5	0	0	0	111.4	W175 T184 M191 F198 V214 M215 P216 R221 Y222 Y223	W175-I219 HydrophobicContact CD2-CB 4.27Å; W175-I219 HydrophobicContact CD2-CG2 3.52Å; W175-I219 HydrophobicContact CE3-CB 3.85Å; W175-I219 HydrophobicContact CE3-CG1 4.44Å; W175-I219 HydrophobicContact CE3-CG2 3.6Å; W175-I219 HydrophobicContact CG-CG2 3.95Å; W175-I219 HydrophobicContact CH2-CG2 4.41Å; W175-I219 HydrophobicContact CZ2-CG2 4.32Å; W175-I219 HydrophobicContact CZ3-CB 4.2Å; W175-I219 HydrophobicContact CZ3-CG1 4.28Å; W175-I219 HydrophobicContact CZ3-CG2 4.07Å; T184-I219 HydrophobicContact CG2-CG1 4.3Å; M191-I219 HydrophobicContact CB-CD1 3.94Å; M191-I219 HydrophobicContact CE-CD1 3.68Å; M191-I219 HydrophobicContact CE-CG1 3.9Å; M191-I219 HydrophobicContact SD-CD1 4.19Å; M191-I219 HydrophobicContact SD-CG1 4.21Å; F198-I219 HydrophobicContact CD2-CD1 4.02Å; F198-I219 HydrophobicContact CE2-CD1 3.56Å; F198-I219 HydrophobicContact CZ-CD1 3.98Å; V214-I219 HydrophobicContact CG2-CD1 3.63Å; V214-I219 HydrophobicContact CG2-CG1 3.62Å; M215-I219 PolarHBondContact O-N 3.37Å; P216-I219 WeakPolarHBondContact O-CB 3.33Å; P216-I219 PolarHBondContact O-N 3.26Å; I219-R221 PolarHBondContact O-N 3.06Å; I219-Y222 WeakPolarHBondContact O-CB 3.46Å; I219-Y222 PolarHBondContact O-N 2.72Å; I219-Y223 HydrophobicContact CG2-CD2 3.83Å; I219-Y223 HydrophobicContact CG2-CE1 4.31Å; I219-Y223 HydrophobicContact CG2-CE2 3.19Å; I219-Y223 VanDerWaalsContact CG2-CZ 3.48Å; I219-Y223 WeakPolarHBondContact O-CD2 3.49Å; I219-Y223 PolarHBondContact O-N 3.45Å
220	A	94.1	Very high	90.3	Very high	7 Å²	7	48.4 Å²	48.4	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-45.3	176.2	0	0	0	0	0	111.7	W175 P216 Y222 Y223 K224	W175-A220 HydrophobicContact CB-CB 4.13Å; P216-A220 PolarHBondContact O-N 2.82Å; A220-Y222 VanDerWaalsContact C-N 3.34Å; A220-Y222 PolarHBondContact O-N 3.44Å; A220-Y223 PolarHBondContact O-N 3.04Å; A220-K224 PolarHBondContact O-N 2.73Å
221	R	94.3	Very high	92.3	Very high	95 Å²	95	40.4 Å²	40.4	36%	0.358	22%	0.223	S	C	.	.	H	α-helix	trans	-61.6	-41.3	174.2	-73	179	-169.3	116.2	-9.2	112.1	W201 E217 E218 I219 K224 H225	W201-R221 HydrophobicContact CH2-CB 3.93Å; W201-R221 HydrophobicContact CZ2-CB 4.21Å; E217-R221 VanDerWaalsContact O-CG 3.29Å; E217-R221 WeakPolarHBondContact O-CG 3.39Å; E217-R221 PolarHBondContact O-N 3.3Å; E217-R221 IonicContact OE1-CZ 3.16Å; E217-R221 IonicContact OE1-NH1 2.8Å; E217-R221 IonicContact OE1-NH2 2.82Å; E217-R221 PolarHBondContact OE1-NH2 3.37Å; E217-R221 IonicContact OE2-CZ 2.7Å; E217-R221 IonicContact OE2-NH1 2.67Å; E217-R221 PolarHBondContact OE2-NH1 3.21Å; E217-R221 IonicContact OE2-NH2 3.34Å; E217-R221 PolarHBondContact OE2-NH2 3.47Å; E218-R221 PolarHBondContact O-N 3.36Å; I219-R221 PolarHBondContact O-N 3.06Å; R221-K224 PolarHBondContact O-N 2.73Å; R221-H225 VanDerWaalsContact O-CB 3.32Å; R221-H225 WeakPolarHBondContact O-CB 3.42Å; R221-H225 PolarHBondContact O-N 3.06Å
222	Y	96.2	Very high	93.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-49.3	176.2	166.4	-101	0	0	0	111.2	L193 L196 F198 W201 E218 I219 A220 K224 H225 Y226	L193-Y222 HydrophobicContact CB-CE1 4.33Å; L193-Y222 HydrophobicContact CG-CE1 4.14Å; L193-Y222 PolarHBondContact N-OH 3.31Å; L193-Y222 PolarHBondContact O-OH 3.34Å; L196-Y222 HydrophobicContact CD2-CD2 4.48Å; L196-Y222 HydrophobicContact CD2-CE2 3.79Å; L196-Y222 HydrophobicContact CG-CE2 4.03Å; L196-Y222 PolarHBondContact O-OH 3.4Å; F198-Y222 HydrophobicContact CB-CE2 4.5Å; F198-Y222 AromaticContact CD2-CD1 3.93Å; F198-Y222 HydrophobicContact CD2-CD1 3.93Å; F198-Y222 AromaticContact CD2-CD2 3.7Å; F198-Y222 HydrophobicContact CD2-CD2 3.7Å; F198-Y222 HydrophobicContact CD2-CE1 4.37Å; F198-Y222 HydrophobicContact CD2-CE2 4.15Å; F198-Y222 AromaticContact CD2-CG 3.58Å; F198-Y222 HydrophobicContact CD2-CG 3.58Å; F198-Y222 HydrophobicContact CE2-CD1 4.4Å; F198-Y222 HydrophobicContact CE2-CD2 4.25Å; F198-Y222 AromaticContact CE2-CG 3.87Å; F198-Y222 HydrophobicContact CE2-CG 3.87Å; W201-Y222 HydrophobicContact CB-CD2 4.06Å; W201-Y222 HydrophobicContact CB-CE2 4.23Å; W201-Y222 AromaticContact CD2-CD2 3.71Å; W201-Y222 HydrophobicContact CD2-CD2 3.71Å; W201-Y222 HydrophobicContact CD2-CG 4.45Å; W201-Y222 AromaticContact CE3-CD2 3.81Å; W201-Y222 HydrophobicContact CE3-CD2 3.81Å; W201-Y222 HydrophobicContact CE3-CG 4.26Å; W201-Y222 AromaticContact CG-CD2 3.81Å; W201-Y222 HydrophobicContact CG-CD2 3.81Å; W201-Y222 HydrophobicContact CG-CE2 4.4Å; E218-Y222 WeakPolarHBondContact O-CB 3.44Å; E218-Y222 PolarHBondContact O-N 2.74Å; I219-Y222 WeakPolarHBondContact O-CB 3.46Å; I219-Y222 PolarHBondContact O-N 2.72Å; A220-Y222 VanDerWaalsContact C-N 3.34Å; A220-Y222 PolarHBondContact O-N 3.44Å; Y222-K224 PolarHBondContact O-N 2.99Å; Y222-H225 CarbonylContact O-C 3.57Å; Y222-H225 PolarHBondContact O-N 2.88Å; Y222-Y226 WeakPolarHBondContact O-CB 3.3Å; Y222-Y226 PolarHBondContact O-N 2.86Å
223	Y	97.6	Very high	94.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-41.7	178.9	-65	-31.5	0	0	0	113.1	P70 I73 W175 M191 L193 I219 A220 H225 Y226 V227	P70-Y223 HydrophobicContact CB-CE1 4.4Å; P70-Y223 HydrophobicContact CB-CE2 4.27Å; P70-Y223 HydrophobicContact CG-CE2 4.3Å; I73-Y223 HydrophobicContact CD1-CG 4.34Å; W175-Y223 AromaticContact CD1-CE2 3.46Å; W175-Y223 VanDerWaalsContact CD1-CE2 3.46Å; W175-Y223 HydrophobicContact CD2-CE2 4.26Å; W175-Y223 HydrophobicContact CG-CD2 4.29Å; W175-Y223 AromaticContact CG-CE2 3.84Å; W175-Y223 HydrophobicContact CG-CE2 3.84Å; W175-Y223 AromaticContact NE1-CE2 3.61Å; M191-Y223 WeakPolarHBondContact O-CE1 3.45Å; M191-Y223 PolarHBondContact O-OH 3.44Å; M191-Y223 VanDerWaalsContact O-OH 3.05Å; L193-Y223 HydrophobicContact CD1-CD1 3.45Å; L193-Y223 VanDerWaalsContact CD1-CD1 3.45Å; L193-Y223 HydrophobicContact CD1-CE1 3.85Å; L193-Y223 HydrophobicContact CD1-CG 4.41Å; L193-Y223 HydrophobicContact CD2-CD1 4.47Å; L193-Y223 HydrophobicContact CD2-CE1 4.02Å; L193-Y223 HydrophobicContact CG-CD1 3.77Å; L193-Y223 HydrophobicContact CG-CE1 3.63Å; I219-Y223 HydrophobicContact CG2-CD2 3.83Å; I219-Y223 HydrophobicContact CG2-CE1 4.31Å; I219-Y223 HydrophobicContact CG2-CE2 3.19Å; I219-Y223 VanDerWaalsContact CG2-CZ 3.48Å; I219-Y223 WeakPolarHBondContact O-CD2 3.49Å; I219-Y223 PolarHBondContact O-N 3.45Å; A220-Y223 PolarHBondContact O-N 3.04Å; Y223-H225 VanDerWaalsContact C-N 3.3Å; Y223-H225 PolarHBondContact O-N 2.93Å; Y223-Y226 WeakPolarHBondContact O-CB 3.42Å; Y223-Y226 PolarHBondContact O-N 3.36Å; Y223-V227 PolarHBondContact O-N 3.49Å
224	K	96.8	Very high	94.9	Very high	100 Å²	100	40.2 Å²	40.2	44%	0.435	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-42.6	173.4	-175.2	174.3	-177.8	172.7	0	111.5	A220 R221 Y222 N228	A220-K224 PolarHBondContact O-N 2.73Å; R221-K224 PolarHBondContact O-N 2.73Å; Y222-K224 PolarHBondContact O-N 2.99Å; K224-N228 PolarHBondContact O-ND2 2.83Å
225	H	96.7	Very high	95.3	Very high	65 Å²	65	39.9 Å²	39.9	30%	0.301	20%	0.203	S	C	.	.	H	α-helix	trans	-68.3	-39.7	177.3	-171.6	68.2	0	0	0	112.3	W201 R221 Y222 Y223 V227 N228 V229	W201-H225 AromaticContact CD1-CD2 3.3Å; W201-H225 AromaticContact CD1-NE2 3.88Å; W201-H225 AromaticContact NE1-CD2 3.02Å; W201-H225 PolarHBondContact NE1-CD2 2.84Å; W201-H225 AromaticContact NE1-CG 3.5Å; W201-H225 AromaticContact NE1-NE2 3.74Å; R221-H225 VanDerWaalsContact O-CB 3.32Å; R221-H225 WeakPolarHBondContact O-CB 3.42Å; R221-H225 PolarHBondContact O-N 3.06Å; Y222-H225 CarbonylContact O-C 3.57Å; Y222-H225 PolarHBondContact O-N 2.88Å; Y223-H225 VanDerWaalsContact C-N 3.3Å; Y223-H225 PolarHBondContact O-N 2.93Å; H225-V227 PolarHBondContact O-N 3.05Å; H225-N228 WeakPolarHBondContact O-CA 3.15Å; H225-N228 WeakPolarHBondContact O-CB 3.39Å; H225-N228 PolarHBondContact O-N 3.07Å; H225-V229 VanDerWaalsContact CE1-CG1 3.41Å; H225-V229 WeakPolarHBondContact CE1-CG1 3.33Å; H225-V229 WeakPolarHBondContact NE2-CG1 3.26Å; H225-V229 WeakPolarHBondContact O-CG2 3.35Å; H225-V229 PolarHBondContact O-N 3.09Å
226	Y	98	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-54.7	-48.8	177.6	-179.1	-81	0	0	0	111.5	I73 Y77 L193 P194 L196 Y222 Y223 N228 V229 M230 L232	I73-Y226 HydrophobicContact CG2-CD1 3.6Å; I73-Y226 HydrophobicContact CG2-CE1 3.7Å; Y77-Y226 WeakPolarHBondContact CD1-OH 3.33Å; Y77-Y226 HydrophobicContact CD2-CE1 4.21Å; Y77-Y226 WeakPolarHBondContact CD2-OH 3.27Å; Y77-Y226 WeakPolarHBondContact CE2-OH 3.36Å; Y77-Y226 HydrophobicContact CG-CE1 4.45Å; L193-Y226 HydrophobicContact CB-CD1 4.41Å; L193-Y226 HydrophobicContact CB-CD2 3.64Å; L193-Y226 HydrophobicContact CB-CE1 4.17Å; L193-Y226 HydrophobicContact CB-CE2 3.32Å; L193-Y226 HydrophobicContact CB-CG 4.18Å; L193-Y226 HydrophobicContact CD1-CD1 3.7Å; L193-Y226 HydrophobicContact CD1-CD2 4.11Å; L193-Y226 HydrophobicContact CD1-CE1 3.98Å; L193-Y226 HydrophobicContact CD1-CE2 4.35Å; L193-Y226 HydrophobicContact CD1-CG 3.77Å; L193-Y226 HydrophobicContact CG-CD2 4.45Å; L193-Y226 HydrophobicContact CG-CE2 4.47Å; P194-Y226 VanDerWaalsContact O-CE2 3.25Å; P194-Y226 WeakPolarHBondContact O-CE2 3.37Å; P194-Y226 PolarHBondContact O-OH 2.84Å; L196-Y226 HydrophobicContact CB-CD2 3.9Å; L196-Y226 HydrophobicContact CB-CE2 3.99Å; L196-Y226 HydrophobicContact CD2-CD2 3.98Å; Y222-Y226 WeakPolarHBondContact O-CB 3.3Å; Y222-Y226 PolarHBondContact O-N 2.86Å; Y223-Y226 WeakPolarHBondContact O-CB 3.42Å; Y223-Y226 PolarHBondContact O-N 3.36Å; Y226-N228 PolarHBondContact O-N 2.93Å; Y226-V229 PolarHBondContact O-N 2.81Å; Y226-M230 HydrophobicContact CD1-CG 4.02Å; Y226-M230 HydrophobicContact CD2-CE 4.18Å; Y226-M230 HydrophobicContact CD2-CG 4.2Å; Y226-M230 HydrophobicContact CE1-CB 4.27Å; Y226-M230 HydrophobicContact CE1-CG 3.72Å; Y226-M230 HydrophobicContact CE2-CE 3.59Å; Y226-M230 HydrophobicContact CE2-CG 3.92Å; Y226-M230 HydrophobicContact CG-CG 4.24Å; Y226-M230 WeakPolarHBondContact O-CB 3.37Å; Y226-M230 WeakPolarHBondContact O-CG 3.33Å; Y226-M230 PolarHBondContact O-N 2.88Å; Y226-L232 HydrophobicContact CD1-CD1 4.32Å; Y226-L232 HydrophobicContact CE1-CD1 3.9Å
227	V	98.3	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.7	-34	178.1	177.6	0	0	0	0	111.8	I73 P171 Y223 H225 L232 Q233 F236	I73-V227 HydrophobicContact CD1-CG2 4.14Å; I73-V227 HydrophobicContact CG1-CG2 4.02Å; I73-V227 HydrophobicContact CG2-CG2 3.9Å; P171-V227 HydrophobicContact CB-CB 4.33Å; P171-V227 HydrophobicContact CB-CG2 3.65Å; P171-V227 HydrophobicContact CG-CB 4.23Å; P171-V227 HydrophobicContact CG-CG1 4.26Å; P171-V227 HydrophobicContact CG-CG2 4.01Å; Y223-V227 PolarHBondContact O-N 3.49Å; H225-V227 PolarHBondContact O-N 3.05Å; V227-L232 HydrophobicContact CG1-CB 3.88Å; V227-L232 PolarHBondContact O-N 2.95Å; V227-Q233 VanDerWaalsContact CG1-CD 3.44Å; V227-Q233 HydrophobicContact CG1-CG 4.11Å; V227-Q233 VanDerWaalsContact CG1-NE2 3.29Å; V227-F236 HydrophobicContact CG1-CD2 3.71Å; V227-F236 HydrophobicContact CG1-CE2 3.78Å; V227-F236 HydrophobicContact CG1-CG 4.1Å; V227-F236 HydrophobicContact CG1-CZ 4.2Å; V227-F236 HydrophobicContact CG2-CE1 4.17Å; V227-F236 HydrophobicContact CG2-CE2 4.23Å; V227-F236 HydrophobicContact CG2-CZ 3.88Å
228	N	96.6	Very high	96.3	Very high	80 Å²	80	37.4 Å²	37.4	43%	0.428	19%	0.188	S	C	.	.	H	α-helix	trans	-69.6	-55.9	175.1	-71.6	-58.1	0	0	0	112.3	K224 H225 Y226 M230 G231 Q233	K224-N228 PolarHBondContact O-ND2 2.83Å; H225-N228 WeakPolarHBondContact O-CA 3.15Å; H225-N228 WeakPolarHBondContact O-CB 3.39Å; H225-N228 PolarHBondContact O-N 3.07Å; Y226-N228 PolarHBondContact O-N 2.93Å; N228-M230 VanDerWaalsContact C-N 3.29Å; N228-M230 PolarHBondContact O-N 3.05Å; N228-G231 PolarHBondContact O-N 2.99Å; N228-G231 VanDerWaalsContact O-N 3.07Å; N228-Q233 PolarHBondContact ND2-NE2 3.09Å; N228-Q233 VanDerWaalsContact OD1-CD 3.27Å; N228-Q233 VanDerWaalsContact OD1-CG 3.28Å; N228-Q233 WeakPolarHBondContact OD1-CG 3.09Å; N228-Q233 PolarHBondContact OD1-NE2 3.25Å
229	V	96.2	Very high	96.5	Very high	74 Å²	74	39.2 Å²	39.2	45%	0.448	20%	0.198	S	C	.	.	H	α-helix	trans	-71.2	-25.3	-172	-61	0	0	0	0	113.3	L196 H225 Y226 G231	L196-V229 HydrophobicContact CD2-CG2 3.89Å; H225-V229 VanDerWaalsContact CE1-CG1 3.41Å; H225-V229 WeakPolarHBondContact CE1-CG1 3.33Å; H225-V229 WeakPolarHBondContact NE2-CG1 3.26Å; H225-V229 WeakPolarHBondContact O-CG2 3.35Å; H225-V229 PolarHBondContact O-N 3.09Å; Y226-V229 PolarHBondContact O-N 2.81Å; V229-G231 VanDerWaalsContact C-N 3.28Å
230	M	96.8	Very high	96.6	Very high	22 Å²	22	39.5 Å²	39.5	11%	0.108	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	4.7	173.4	-61.4	-52.9	-169.1	0	0	113.4	Y77 Y82 G195 L196 Y226 N228 L232	Y77-M230 HydrophobicContact CD2-CB 4.13Å; Y77-M230 HydrophobicContact CD2-CG 4.14Å; Y77-M230 HydrophobicContact CE2-CB 4.25Å; Y77-M230 HydrophobicContact CE2-CE 4.23Å; Y77-M230 HydrophobicContact CE2-CG 3.97Å; Y77-M230 HydrophobicContact CE2-SD 3.88Å; Y82-M230 PolarHBondContact OH-O 3.05Å; G195-M230 VanDerWaalsContact C-CE 3.41Å; G195-M230 WeakPolarHBondContact O-CE 3.46Å; L196-M230 HydrophobicContact CB-CE 3.48Å; L196-M230 VanDerWaalsContact CB-CE 3.48Å; Y226-M230 HydrophobicContact CD1-CG 4.02Å; Y226-M230 HydrophobicContact CD2-CE 4.18Å; Y226-M230 HydrophobicContact CD2-CG 4.2Å; Y226-M230 HydrophobicContact CE1-CB 4.27Å; Y226-M230 HydrophobicContact CE1-CG 3.72Å; Y226-M230 HydrophobicContact CE2-CE 3.59Å; Y226-M230 HydrophobicContact CE2-CG 3.92Å; Y226-M230 HydrophobicContact CG-CG 4.24Å; Y226-M230 WeakPolarHBondContact O-CB 3.37Å; Y226-M230 WeakPolarHBondContact O-CG 3.33Å; Y226-M230 PolarHBondContact O-N 2.88Å; N228-M230 VanDerWaalsContact C-N 3.29Å; N228-M230 PolarHBondContact O-N 3.05Å; M230-L232 VanDerWaalsContact C-N 3.29Å; M230-L232 HydrophobicContact CB-CD1 4.01Å; M230-L232 HydrophobicContact CB-CD2 4.39Å; M230-L232 HydrophobicContact CB-CG 3.79Å; M230-L232 PolarHBondContact O-N 3.31Å
231	G	96.6	Very high	96.7	Very high	51 Å²	51	41.4 Å²	41.4	53%	0.526	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	27.2	176.9	0	0	0	0	0	114.5	N228 V229	N228-G231 PolarHBondContact O-N 2.99Å; N228-G231 VanDerWaalsContact O-N 3.07Å; V229-G231 VanDerWaalsContact C-N 3.28Å
232	L	98	Very high	96.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.			trans	-89.6	-13.2	-173.6	-54.3	179.1	0	0	0	113.3	I73 Y77 S80 Y82 Y226 V227 M230 K234 N235 F236	I73-L232 HydrophobicContact CG2-CD1 4.37Å; Y77-L232 HydrophobicContact CD2-CD1 4.29Å; Y77-L232 HydrophobicContact CD2-CD2 4.46Å; S80-L232 VanDerWaalsContact OG-CD2 3.29Å; S80-L232 WeakPolarHBondContact OG-CD2 3.34Å; Y82-L232 HydrophobicContact CE2-CD2 4.49Å; Y226-L232 HydrophobicContact CD1-CD1 4.32Å; Y226-L232 HydrophobicContact CE1-CD1 3.9Å; V227-L232 HydrophobicContact CG1-CB 3.88Å; V227-L232 PolarHBondContact O-N 2.95Å; M230-L232 VanDerWaalsContact C-N 3.29Å; M230-L232 HydrophobicContact CB-CD1 4.01Å; M230-L232 HydrophobicContact CB-CD2 4.39Å; M230-L232 HydrophobicContact CB-CG 3.79Å; M230-L232 PolarHBondContact O-N 3.31Å; L232-K234 PolarHBondContact O-N 2.75Å; L232-N235 WeakPolarHBondContact O-CB 3.09Å; L232-N235 PolarHBondContact O-N 3.35Å; L232-F236 HydrophobicContact CB-CD2 4.4Å; L232-F236 HydrophobicContact CB-CE2 3.9Å; L232-F236 WeakPolarHBondContact O-CD2 3.44Å
233	Q	97.3	Very high	96.9	Very high	61 Å²	61	42 Å²	42	29%	0.285	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-50	-38.3	-171	-70.1	-61.9	-12	0	0	114.5	V227 N228 N235 F236	V227-Q233 VanDerWaalsContact CG1-CD 3.44Å; V227-Q233 HydrophobicContact CG1-CG 4.11Å; V227-Q233 VanDerWaalsContact CG1-NE2 3.29Å; N228-Q233 PolarHBondContact ND2-NE2 3.09Å; N228-Q233 VanDerWaalsContact OD1-CD 3.27Å; N228-Q233 VanDerWaalsContact OD1-CG 3.28Å; N228-Q233 WeakPolarHBondContact OD1-CG 3.09Å; N228-Q233 PolarHBondContact OD1-NE2 3.25Å; Q233-N235 PolarHBondContact O-N 2.98Å; Q233-N235 VanDerWaalsContact O-N 3.07Å; Q233-F236 PolarHBondContact O-N 2.91Å
234	K	96.1	Very high	96.9	Very high	106 Å²	106	44 Å²	44	46%	0.461	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-56.3	-28.3	179.3	65.8	177.5	-177.2	175.6	0	113.5	L232 R237	L232-K234 PolarHBondContact O-N 2.75Å; K234-R237 PolarHBondContact O-NH1 3.48Å
235	N	98.1	Very high	96.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-88.8	-4.9	-178.5	-52	-46.3	0	0	0	112.9	S80 Y160 H163 L164 V165 L232 Q233	S80-N235 PolarHBondContact OG-ND2 3.03Å; S80-N235 VanDerWaalsContact OG-ND2 3.16Å; Y160-N235 PolarHBondContact OH-OD1 3.38Å; Y160-N235 VanDerWaalsContact OH-OD1 3.06Å; H163-N235 PolarHBondContact CE1-ND2 3.17Å; H163-N235 PolarHBondContact NE2-ND2 3.09Å; L164-N235 CarbonylContact C-O 3.58Å; V165-N235 PolarHBondContact N-O 2.93Å; L232-N235 WeakPolarHBondContact O-CB 3.09Å; L232-N235 PolarHBondContact O-N 3.35Å; Q233-N235 PolarHBondContact O-N 2.98Å; Q233-N235 VanDerWaalsContact O-N 3.07Å
236	F	98.2	Very high	96.7	Very high	12 Å²	12	38.4 Å²	38.4	5%	0.053	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.7	-174.9	-76.6	-108.8	0	0	0	111.8	N68 I73 S76 V165 P171 V227 L232 Q233	N68-F236 HydrophobicContact CB-CD1 4.04Å; N68-F236 HydrophobicContact CB-CE1 3.99Å; I73-F236 HydrophobicContact CB-CZ 4.39Å; I73-F236 HydrophobicContact CG1-CE1 3.89Å; I73-F236 HydrophobicContact CG1-CZ 3.87Å; S76-F236 WeakPolarHBondContact OG-CE2 3.46Å; V165-F236 HydrophobicContact CB-CD1 3.89Å; V165-F236 HydrophobicContact CB-CD2 4.35Å; V165-F236 HydrophobicContact CB-CE1 3.98Å; V165-F236 HydrophobicContact CB-CE2 4.41Å; V165-F236 HydrophobicContact CB-CG 4.1Å; V165-F236 HydrophobicContact CB-CZ 4.24Å; V165-F236 HydrophobicContact CG1-CD1 3.86Å; V165-F236 HydrophobicContact CG1-CE1 3.67Å; V165-F236 HydrophobicContact CG1-CZ 4.22Å; V165-F236 HydrophobicContact CG2-CD1 4.45Å; V165-F236 HydrophobicContact CG2-CD2 4.27Å; V165-F236 HydrophobicContact CG2-CE1 4.2Å; V165-F236 HydrophobicContact CG2-CE2 3.97Å; V165-F236 HydrophobicContact CG2-CG 4.5Å; V165-F236 HydrophobicContact CG2-CZ 3.94Å; P171-F236 HydrophobicContact CB-CE1 4.42Å; P171-F236 HydrophobicContact CG-CD1 4.06Å; P171-F236 HydrophobicContact CG-CE1 4.41Å; V227-F236 HydrophobicContact CG1-CD2 3.71Å; V227-F236 HydrophobicContact CG1-CE2 3.78Å; V227-F236 HydrophobicContact CG1-CG 4.1Å; V227-F236 HydrophobicContact CG1-CZ 4.2Å; V227-F236 HydrophobicContact CG2-CE1 4.17Å; V227-F236 HydrophobicContact CG2-CE2 4.23Å; V227-F236 HydrophobicContact CG2-CZ 3.88Å; L232-F236 HydrophobicContact CB-CD2 4.4Å; L232-F236 HydrophobicContact CB-CE2 3.9Å; L232-F236 WeakPolarHBondContact O-CD2 3.44Å; Q233-F236 PolarHBondContact O-N 2.91Å
237	R	96.4	Very high	96.2	Very high	44 Å²	44	40.1 Å²	40.1	17%	0.166	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	110.8	168.7	-60.9	-65.5	179.1	-86.7	1.7	108.9	L164 V165 L166 G167 K234 T240	L164-R237 HydrophobicContact CD1-CG 3.72Å; L164-R237 HydrophobicContact CD2-CG 4.34Å; L164-R237 HydrophobicContact CG-CG 4.22Å; V165-R237 PolarHBondContact O-N 2.93Å; L166-R237 HydrophobicContact CD2-CB 3.83Å; L166-R237 HydrophobicContact CD2-CG 4.22Å; G167-R237 PolarHBondContact N-O 3.05Å; G167-R237 VanDerWaalsContact N-O 3.09Å; K234-R237 PolarHBondContact O-NH1 3.48Å; R237-T240 PolarHBondContact O-OG1 3.41Å
238	E	95	Very high	94.9	Very high	56 Å²	56	42.5 Å²	42.5	26%	0.262	23%	0.232	S	C	.	.			trans	-81.5	165	177.8	-58.3	-173.8	-170.9	0	0	111	G167 P171 T240 Q285	G167-E238 CarbonylContact O-C 3.24Å; P171-E238 WeakPolarHBondContact CD-OE1 3.36Å; E238-T240 PolarHBondContact O-N 2.59Å; E238-T240 VanDerWaalsContact O-N 3.15Å; E238-T240 PolarHBondContact O-OG1 3.44Å; E238-Q285 PolarHBondContact O-NE2 3.47Å
239	N	95.5	Very high	93.1	Very high	50 Å²	50	46.1 Å²	46.1	27%	0.267	24%	0.241	S	C	.	.	S	Bend	trans	54.2	31.5	179.1	-58.8	-65.5	0	0	0	113.9	G167 Y241 Q285 R286	G167-N239 PolarHBondContact O-N 2.85Å; N239-Y241 WeakPolarHBondContact O-CD2 3.41Å; N239-Q285 CarbonylContact O-C 3.21Å; N239-Q285 WeakPolarHBondContact O-CA 3.45Å; N239-R286 HydrophobicContact CB-CB 4.28Å; N239-R286 VanDerWaalsContact CB-O 3.32Å; N239-R286 WeakPolarHBondContact CB-O 3.25Å; N239-R286 PolarHBondContact O-N 2.84Å
240	T	96	Very high	90.9	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.5	-179.4	-53.8	0	0	0	0	110.3	L166 G167 K168 R237 E238 I242 F295	L166-T240 HydrophobicContact CB-CG2 4.1Å; L166-T240 HydrophobicContact CD1-CG2 4.4Å; L166-T240 HydrophobicContact CD2-CG2 4.1Å; L166-T240 HydrophobicContact CG-CG2 4.42Å; G167-T240 CarbonylContact C-O 3.56Å; G167-T240 PolarHBondContact O-N 2.88Å; K168-T240 PolarHBondContact N-O 3.33Å; R237-T240 PolarHBondContact O-OG1 3.41Å; E238-T240 PolarHBondContact O-N 2.59Å; E238-T240 VanDerWaalsContact O-N 3.15Å; E238-T240 PolarHBondContact O-OG1 3.44Å; T240-I242 HydrophobicContact CG2-CD1 4.19Å; T240-F295 HydrophobicContact CG2-CD1 4.35Å; T240-F295 HydrophobicContact CG2-CE1 3.26Å; T240-F295 HydrophobicContact CG2-CZ 3.41Å; T240-F295 VanDerWaalsContact CG2-CZ 3.41Å
241	Y	96.2	Very high	88.3	Confident	48 Å²	48	57.7 Å²	57.7	19%	0.188	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.9	-177.8	-63.8	-96.8	0	0	0	109.5	K168 N239 G283 Y284 R286	K168-Y241 HydrophobicContact CB-CD1 4.49Å; K168-Y241 HydrophobicContact CB-CE1 3.98Å; K168-Y241 HydrophobicContact CD-CD1 4.36Å; K168-Y241 HydrophobicContact CD-CE1 4.19Å; K168-Y241 HydrophobicContact CG-CD1 3.89Å; K168-Y241 HydrophobicContact CG-CE1 3.8Å; N239-Y241 WeakPolarHBondContact O-CD2 3.41Å; Y241-G283 CarbonylContact O-C 3.54Å; Y241-G283 WeakPolarHBondContact O-CA 3.33Å; Y241-Y284 VanDerWaalsContact CB-CZ 3.44Å; Y241-Y284 HydrophobicContact CD2-CD2 4.11Å; Y241-Y284 AromaticContact CD2-CE2 3.52Å; Y241-Y284 HydrophobicContact CD2-CE2 3.52Å; Y241-Y284 AromaticContact CD2-CZ 3.98Å; Y241-Y284 HydrophobicContact CE2-CE2 4.3Å; Y241-Y284 HydrophobicContact CG-CE1 4.39Å; Y241-Y284 AromaticContact CG-CE2 3.75Å; Y241-Y284 HydrophobicContact CG-CE2 3.75Å; Y241-Y284 AromaticContact CG-CZ 3.69Å; Y241-Y284 PolarHBondContact N-O 3.26Å; Y241-Y284 PolarHBondContact O-N 3.24Å; Y241-R286 HydrophobicContact CE2-CB 4.16Å
242	I	97.4	Very high	85.7	Confident	27 Å²	27	63.9 Å²	63.9	14%	0.138	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	132.1	179.7	-48.3	-50	0	0	0	109.1	I66 L166 T240 V245 I281 R282 F295 F465	I66-I242 HydrophobicContact CD1-CG1 4.35Å; I66-I242 HydrophobicContact CD1-CG2 4.39Å; I66-I242 HydrophobicContact CG1-CG1 4.39Å; I66-I242 HydrophobicContact CG2-CG1 3.82Å; L166-I242 HydrophobicContact CB-CD1 4.09Å; L166-I242 HydrophobicContact CD1-CD1 3.55Å; L166-I242 HydrophobicContact CG-CD1 4.46Å; T240-I242 HydrophobicContact CG2-CD1 4.19Å; I242-V245 HydrophobicContact CG2-CG2 3.69Å; I242-I281 HydrophobicContact CD1-CG2 4.05Å; I242-I281 HydrophobicContact CG2-CG2 3.99Å; I242-R282 WeakPolarHBondContact CG2-O 3.43Å; I242-F295 HydrophobicContact CD1-CE2 4.43Å; I242-F295 HydrophobicContact CD1-CZ 3.78Å; I242-F465 HydrophobicContact CB-CB 4.37Å; I242-F465 HydrophobicContact CB-CD1 4.34Å; I242-F465 HydrophobicContact CB-CG 4.25Å; I242-F465 HydrophobicContact CG2-CB 3.89Å; I242-F465 HydrophobicContact CG2-CD2 4.18Å; I242-F465 HydrophobicContact CG2-CG 3.94Å
243	T	96.9	Very high	83.1	Confident	81 Å²	81	67 Å²	67	50%	0.497	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-25.6	178.6	56.3	0	0	0	0	112.4	R282 Y284	T243-R282 PolarHBondContact N-O 3.42Å; T243-R282 PolarHBondContact OG1-O 3.02Å; T243-Y284 HydrophobicContact CG2-CD1 3.95Å; T243-Y284 HydrophobicContact CG2-CE1 4Å
244	S	97.3	Very high	80.2	Confident	40 Å²	40	71.6 Å²	71.6	28%	0.28	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	138.3	175.9	-171.4	0	0	0	0	111.9	I281 R282 F465	S244-I281 WeakPolarHBondContact O-CA 3.45Å; S244-R282 PolarHBondContact N-O 3.02Å; S244-R282 PolarHBondContact O-N 2.78Å; S244-F465 CarbonylContact C-O 3.58Å; S244-F465 WeakPolarHBondContact CA-O 3.09Å
245	V	96.7	Very high	77.4	Confident	6 Å²	6	73.9 Å²	73.9	4%	0.036	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	116	166.3	177.3	0	0	0	0	107.2	I66 I242 W279 E280 I281 V302 F465 L466	I66-V245 HydrophobicContact CD1-CG2 3.51Å; I242-V245 HydrophobicContact CG2-CG2 3.69Å; V245-W279 HydrophobicContact CG1-CE3 3.62Å; V245-W279 HydrophobicContact CG1-CZ3 3.94Å; V245-E280 WeakPolarHBondContact CA-O 3.04Å; V245-I281 HydrophobicContact CG2-CG1 4.32Å; V245-I281 HydrophobicContact CG2-CG2 4.23Å; V245-V302 HydrophobicContact CG1-CG1 4.44Å; V245-F465 HydrophobicContact CB-CD2 4.06Å; V245-F465 HydrophobicContact CG2-CD2 3.56Å; V245-F465 HydrophobicContact CG2-CE2 4.07Å; V245-F465 HydrophobicContact CG2-CG 4.47Å; V245-F465 PolarHBondContact N-O 3.35Å; V245-L466 HydrophobicContact CB-CD2 3.82Å; V245-L466 HydrophobicContact CG1-CD2 4.02Å
246	S	93.7	Very high	74.8	Confident	43 Å²	43	77.6 Å²	77.6	30%	0.301	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	161	-177.6	72.1	0	0	0	0	111.4	E280	S246-E280 PolarHBondContact N-O 2.96Å; S246-E280 PolarHBondContact O-N 3.36Å
247	R	87.6	Confident	71.9	Confident	35 Å²	35	82 Å²	82	13%	0.132	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	133.1	167.6	-70.4	-168.6	-177.9	-78.4	4.2	110.1	Y249 W279 E500 A501	R247-Y249 HydrophobicContact CB-CD2 4.49Å; R247-Y249 HydrophobicContact CB-CE2 4Å; R247-Y249 PolarHBondContact O-N 3Å; R247-W279 HydrophobicContact CG-CD2 4.45Å; R247-W279 HydrophobicContact CG-CE3 4.18Å; R247-W279 HydrophobicContact CG-CH2 4.08Å; R247-W279 HydrophobicContact CG-CZ2 4.34Å; R247-W279 HydrophobicContact CG-CZ3 4.01Å; R247-E500 IonicContact CZ-OE1 3.59Å; R247-E500 IonicContact NE-OE1 3.18Å; R247-E500 PolarHBondContact NE-OE1 3.29Å; R247-E500 IonicContact NH2-OE1 2.67Å; R247-E500 PolarHBondContact NH2-OE1 3.08Å; R247-A501 PolarHBondContact NH2-O 3.48Å
248	L	69.6	Low	69.2	Low	51 Å²	51	89.3 Å²	89.3	27%	0.267	49%	0.485	S	S	.	.			trans	-79.8	117.7	162.7	-70.2	-178.8	0	0	0	110	N278 E280 F298	L248-N278 PolarHBondContact N-O 3.17Å; L248-E280 HydrophobicContact CD1-CB 4.25Å; L248-E280 HydrophobicContact CD2-CB 4.38Å; L248-E280 HydrophobicContact CG-CB 3.91Å; L248-F298 HydrophobicContact CD1-CD1 4.05Å; L248-F298 HydrophobicContact CD1-CE1 3.35Å; L248-F298 HydrophobicContact CD1-CZ 4.17Å; L248-F298 HydrophobicContact CG-CE1 4.42Å
249	Y	59.6	Low	66.2	Low	155 Å²	155	94.7 Å²	94.7	61%	0.608	52%	0.515	S	S	*	.			trans	-90.5	96.9	160.6	-62.5	-90.3	0	0	0	106.5	R247 D251	R247-Y249 HydrophobicContact CB-CD2 4.49Å; R247-Y249 HydrophobicContact CB-CE2 4Å; R247-Y249 PolarHBondContact O-N 3Å; Y249-D251 PolarHBondContact O-N 2.91Å
250	R	49.8	Very low	63.5	Low	188 Å²	188	101.1 Å²	101.1	71%	0.709	54%	0.541	S	S	*	.			trans	-84.1	107.5	164.4	-74.3	-171.1	-175.9	-177.8	1.2	107.4	Q252	R250-Q252 PolarHBondContact O-N 3.19Å
251	D	42.6	Very low	60.5	Low	152 Å²	152	107.6 Å²	107.6	81%	0.813	58%	0.575	S	S	*	*			trans	-69.3	120.1	163.5	-76	-25.5	0	0	0	107.9	Y249 G253	Y249-D251 PolarHBondContact O-N 2.91Å; D251-G253 VanDerWaalsContact C-N 3.32Å; D251-G253 PolarHBondContact O-N 3.33Å; D251-G253 VanDerWaalsContact O-N 3.08Å
252	Q	41.7	Very low	57.5	Low	180 Å²	180	112.9 Å²	112.9	84%	0.841	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	95.6	162	-80.3	-165.8	1.1	0	0	106.8	R250	R250-Q252 PolarHBondContact O-N 3.19Å
253	G	42.7	Very low	54.5	Low	66 Å²	66	116.9 Å²	116.9	68%	0.68	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.8	-14.2	178.6	0	0	0	0	0	117.4	D251 N255	D251-G253 VanDerWaalsContact C-N 3.32Å; D251-G253 PolarHBondContact O-N 3.33Å; D251-G253 VanDerWaalsContact O-N 3.08Å; G253-N255 PolarHBondContact O-N 3.43Å
254	D	38.2	Very low	51.7	Low	158 Å²	158	118.5 Å²	118.5	85%	0.845	65%	0.645	S	S	*	*			trans	-100.9	58	179.3	-143.9	16.5	0	0	0	111.8
255	N	37	Very low	48.8	Very low	153 Å²	153	125.2 Å²	125.2	82%	0.818	67%	0.67	S	S	*	*			trans	-91.6	102.6	150.1	-90	-3.9	0	0	0	105.9	G253 S257	G253-N255 PolarHBondContact O-N 3.43Å; N255-S257 PolarHBondContact O-N 3.36Å
256	G	43.7	Very low	45.5	Very low	78 Å²	78	133.2 Å²	133.2	80%	0.804	71%	0.706	S	S	*	*			trans	-56.2	105.8	171.1	0	0	0	0	0	110.7
257	S	36	Very low	42.6	Very low	106 Å²	106	138 Å²	138	74%	0.741	73%	0.728	S	S	*	*			trans	-145	106.8	156.2	41.1	0	0	0	0	106.8	N255 D259	N255-S257 PolarHBondContact O-N 3.36Å; S257-D259 PolarHBondContact O-N 3.13Å
258	Q	40.3	Very low	40.2	Very low	196 Å²	196	145 Å²	145	92%	0.916	76%	0.762	S	S	*	*			trans	-55.7	121.3	164.6	-68.1	179.5	-10.9	0	0	108.1
259	D	31.6	Very low	38.3	Very low	169 Å²	169	149.9 Å²	149.9	90%	0.904	79%	0.788	S	S	*	*			trans	-158.2	142.6	137.7	-117.4	-22.2	0	0	0	112	S257	S257-D259 PolarHBondContact O-N 3.13Å
260	K	38.6	Very low	37.1	Very low	185 Å²	185	151.7 Å²	151.7	80%	0.804	80%	0.802	S	S	*	*			trans	-82	154.2	-173.3	-74.1	178.3	174.3	177.1	0	112.4
261	D	34.4	Very low	36.4	Very low	142 Å²	142	151.9 Å²	151.9	76%	0.759	81%	0.808	S	S	*	*			trans	71.2	114.7	153	-67.1	-27.9	0	0	0	118.9
262	I	33.2	Very low	36	Very low	160 Å²	160	149.4 Å²	149.4	82%	0.821	80%	0.803	S	S	*	*				169.4	124.4	102.2	-80.9	167.1	0	0	0	110.3
263	S	34	Very low	35.8	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	80%	0.801	S	S	*	*			trans	48.8	135.1	142.6	-155.4	0	0	0	0	123.2
264	T	38.1	Very low	35.5	Very low	115 Å²	115	156.5 Å²	156.5	71%	0.706	81%	0.813	S	S	*	*			trans	-66.7	156.2	179.7	52.4	0	0	0	0	116.5
265	K	34.8	Very low	35.8	Very low	181 Å²	181	152.6 Å²	152.6	79%	0.787	79%	0.794	S	S	*	*			trans	87.8	102.4	157.6	-57.6	179	-178.3	176.8	0	116.5
266	H	28.6	Very low	36.6	Very low	175 Å²	175	151.7 Å²	151.7	81%	0.81	78%	0.783	S	S	*	*				178.9	147.7	106.1	-107.9	-70.9	0	0	0	113.7
267	L	33	Very low	37.7	Very low	143 Å²	143	154.3 Å²	154.3	75%	0.749	77%	0.769	S	S	*	*			trans	80	97.9	163.5	-83.6	81.9	0	0	0	119.4	N269	L267-N269 PolarHBondContact O-N 3.25Å
268	Q	36.5	Very low	40.1	Very low	183 Å²	183	151 Å²	151	86%	0.855	74%	0.742	S	S	*	*			trans	-34.4	114.2	139.9	-76.1	162.3	-36.2	0	0	111.8
269	N	29.3	Very low	42.6	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	70%	0.7	S	S	*	*			trans	-150.7	80.4	144.4	-105.8	-23.4	0	0	0	106.8	L267 K271	L267-N269 PolarHBondContact O-N 3.25Å; N269-K271 PolarHBondContact O-N 3.4Å
270	Q	35.5	Very low	45.7	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	66%	0.66	S	S	*	*			trans	-66.5	80.6	168.1	-77.5	-175.6	-5.1	0	0	109.1
271	K	34	Very low	48.4	Very low	193 Å²	193	125.8 Å²	125.8	84%	0.839	62%	0.622	S	S	*	*			trans	-92.2	87.9	142.4	-81.3	-178.8	176.9	175.2	0	105.5	N269 K273	N269-K271 PolarHBondContact O-N 3.4Å; K271-K273 VanDerWaalsContact C-N 3.25Å; K271-K273 PolarHBondContact O-N 3.45Å
272	S	34.2	Very low	51.4	Low	100 Å²	100	124.4 Å²	124.4	70%	0.699	61%	0.606	S	S	*	*			trans	-58.1	98.4	161.5	45.4	0	0	0	0	106.9	F274	S272-F274 PolarHBondContact O-N 3.05Å
273	K	38.4	Very low	54.4	Low	183 Å²	183	117.1 Å²	117.1	80%	0.796	57%	0.57	S	S	*	*			trans	-51.7	113.3	170	-79.2	175.5	174.5	175.4	0	106.5	K271 V275	K271-K273 VanDerWaalsContact C-N 3.25Å; K271-K273 PolarHBondContact O-N 3.45Å; K273-V275 PolarHBondContact O-N 3.25Å
274	F	35.7	Very low	57.4	Low	212 Å²	212	115.4 Å²	115.4	93%	0.93	55%	0.548	S	S	*	.			trans	-55.5	96.9	174.6	-78.7	-97.2	0	0	0	109.1	S272 K276	S272-F274 PolarHBondContact O-N 3.05Å; F274-K276 PolarHBondContact O-N 3.24Å
275	V	45	Very low	60.1	Low	75 Å²	75	112.9 Å²	112.9	46%	0.455	53%	0.528	S	S	.	.			trans	-72.5	116.7	167	-178.8	0	0	0	0	105.8	K273 R277	K273-V275 PolarHBondContact O-N 3.25Å; V275-R277 WeakPolarHBondContact O-CG 3.42Å; V275-R277 PolarHBondContact O-N 3.42Å
276	K	53.1	Low	62.9	Low	135 Å²	135	109.3 Å²	109.3	59%	0.587	51%	0.509	S	S	*	.			trans	-64.5	102.6	177.8	-159.8	176.5	178.3	-169	0	107.9	F274 N278 E300	F274-K276 PolarHBondContact O-N 3.24Å; K276-N278 PolarHBondContact O-N 2.95Å; K276-E300 WeakPolarHBondContact CE-OE1 3.47Å; K276-E300 IonicContact NZ-OE1 2.74Å; K276-E300 PolarHBondContact NZ-OE1 2.92Å
277	R	67.8	Low	65.8	Low	132 Å²	132	104.2 Å²	104.2	50%	0.498	49%	0.487	S	S	.	.			trans	-86.8	94	-175.5	-65.5	178.2	-173.4	168.4	-1.4	109.7	V275	V275-R277 WeakPolarHBondContact O-CG 3.42Å; V275-R277 PolarHBondContact O-N 3.42Å
278	N	86.1	Confident	68.1	Low	36 Å²	36	102.2 Å²	102.2	19%	0.193	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-73.1	149	174.6	-61.1	-22.1	0	0	0	110.4	T60 L248 K276 F298 A299	T60-N278 HydrophobicContact CG2-CB 4.1Å; T60-N278 VanDerWaalsContact CG2-CG 3.41Å; T60-N278 VanDerWaalsContact CG2-ND2 3.29Å; T60-N278 WeakPolarHBondContact CG2-ND2 3.16Å; T60-N278 PolarHBondContact OG1-ND2 3.33Å; L248-N278 PolarHBondContact N-O 3.17Å; K276-N278 PolarHBondContact O-N 2.95Å; N278-F298 HydrophobicContact CB-CB 4.47Å; N278-A299 CarbonylContact C-O 3.44Å; N278-A299 WeakPolarHBondContact CA-O 3.44Å
279	W	93.6	Very high	70	Confident	4 Å²	4	97.5 Å²	97.5	2%	0.015	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	137	165.6	-68.8	96	0	0	0	109.7	V245 R247 I281 F298 A299 V302 E500 N502 L503	V245-W279 HydrophobicContact CG1-CE3 3.62Å; V245-W279 HydrophobicContact CG1-CZ3 3.94Å; R247-W279 HydrophobicContact CG-CD2 4.45Å; R247-W279 HydrophobicContact CG-CE3 4.18Å; R247-W279 HydrophobicContact CG-CH2 4.08Å; R247-W279 HydrophobicContact CG-CZ2 4.34Å; R247-W279 HydrophobicContact CG-CZ3 4.01Å; W279-I281 HydrophobicContact CB-CD1 3.93Å; W279-F298 CarbonylContact O-C 3.03Å; W279-F298 WeakPolarHBondContact O-CA 3.43Å; W279-A299 HydrophobicContact CB-CB 4.47Å; W279-A299 PolarHBondContact N-O 3.22Å; W279-A299 PolarHBondContact O-N 3.46Å; W279-V302 HydrophobicContact CB-CG2 3.57Å; W279-V302 HydrophobicContact CD2-CB 4.5Å; W279-V302 HydrophobicContact CD2-CG2 3.98Å; W279-V302 HydrophobicContact CG-CB 4.37Å; W279-V302 HydrophobicContact CG-CG2 3.49Å; W279-V302 VanDerWaalsContact CG-CG2 3.49Å; W279-E500 HydrophobicContact CH2-CG 3.54Å; W279-E500 HydrophobicContact CZ2-CG 3.7Å; W279-N502 PolarHBondContact NE1-O 3.13Å; W279-N502 VanDerWaalsContact NE1-O 3.16Å; W279-L503 HydrophobicContact CH2-CB 4.22Å; W279-L503 HydrophobicContact CH2-CD1 4.38Å; W279-L503 HydrophobicContact CH2-CD2 4.23Å; W279-L503 HydrophobicContact CZ2-CB 3.73Å; W279-L503 HydrophobicContact CZ2-CD1 4.34Å; W279-L503 HydrophobicContact CZ2-CG 4.43Å
280	E	94.9	Very high	72.4	Confident	18 Å²	18	92.5 Å²	92.5	8%	0.084	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.8	165.4	-177.5	-177.2	-103.6	0	0	108.8	V245 S246 L248 R282 F298	V245-E280 WeakPolarHBondContact CA-O 3.04Å; S246-E280 PolarHBondContact N-O 2.96Å; S246-E280 PolarHBondContact O-N 3.36Å; L248-E280 HydrophobicContact CD1-CB 4.25Å; L248-E280 HydrophobicContact CD2-CB 4.38Å; L248-E280 HydrophobicContact CG-CB 3.91Å; E280-R282 HydrophobicContact CG-CG 4.19Å; E280-R282 IonicContact OE1-CZ 3.96Å; E280-R282 IonicContact OE1-NE 3.69Å; E280-R282 IonicContact OE1-NH2 3.09Å; E280-R282 PolarHBondContact OE1-NH2 3.49Å; E280-R282 IonicContact OE2-CZ 3.43Å; E280-R282 IonicContact OE2-NE 3.25Å; E280-R282 PolarHBondContact OE2-NE 3.29Å; E280-R282 IonicContact OE2-NH2 3.91Å; E280-R282 PolarHBondContact OE2-NH2 3.29Å; E280-F298 HydrophobicContact CB-CD1 4.11Å; E280-F298 HydrophobicContact CB-CE1 3.83Å; E280-F298 HydrophobicContact CG-CD1 4.33Å; E280-F298 HydrophobicContact CG-CE1 3.7Å; E280-F298 HydrophobicContact CG-CZ 4.43Å
281	I	96.3	Very high	74.9	Confident	0 Å²	0	87.1 Å²	87.1	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.9	179.1	-55.9	91.8	0	0	0	107.8	V64 L166 I242 S244 V245 W279 F295 C296 L297 A299 V302	V64-I281 HydrophobicContact CB-CD1 4.4Å; V64-I281 HydrophobicContact CG1-CG1 4.48Å; V64-I281 HydrophobicContact CG2-CD1 4.36Å; L166-I281 HydrophobicContact CD1-CG2 4.4Å; I242-I281 HydrophobicContact CD1-CG2 4.05Å; I242-I281 HydrophobicContact CG2-CG2 3.99Å; S244-I281 WeakPolarHBondContact O-CA 3.45Å; V245-I281 HydrophobicContact CG2-CG1 4.32Å; V245-I281 HydrophobicContact CG2-CG2 4.23Å; W279-I281 HydrophobicContact CB-CD1 3.93Å; I281-F295 HydrophobicContact CG2-CE2 4.42Å; I281-C296 WeakPolarHBondContact O-CA 3.36Å; I281-L297 HydrophobicContact CB-CB 4.48Å; I281-L297 PolarHBondContact N-O 2.69Å; I281-L297 PolarHBondContact O-N 3Å; I281-A299 HydrophobicContact CD1-CB 3.75Å; I281-V302 HydrophobicContact CD1-CG2 3.95Å; I281-V302 HydrophobicContact CG1-CG2 4.2Å
282	R	96.9	Very high	77.7	Confident	113 Å²	113	83.2 Å²	83.2	43%	0.426	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.3	177.2	-62.4	178.2	-179.8	-96.6	-6.2	110.4	I242 T243 S244 E280 F295 C296	I242-R282 WeakPolarHBondContact CG2-O 3.43Å; T243-R282 PolarHBondContact N-O 3.42Å; T243-R282 PolarHBondContact OG1-O 3.02Å; S244-R282 PolarHBondContact N-O 3.02Å; S244-R282 PolarHBondContact O-N 2.78Å; E280-R282 HydrophobicContact CG-CG 4.19Å; E280-R282 IonicContact OE1-CZ 3.96Å; E280-R282 IonicContact OE1-NE 3.69Å; E280-R282 IonicContact OE1-NH2 3.09Å; E280-R282 PolarHBondContact OE1-NH2 3.49Å; E280-R282 IonicContact OE2-CZ 3.43Å; E280-R282 IonicContact OE2-NE 3.25Å; E280-R282 PolarHBondContact OE2-NE 3.29Å; E280-R282 IonicContact OE2-NH2 3.91Å; E280-R282 PolarHBondContact OE2-NH2 3.29Å; R282-F295 WeakPolarHBondContact CA-O 3.34Å; R282-C296 HydrophobicContact CG-CB 4.4Å
283	G	96.9	Very high	80.5	Confident	6 Å²	6	80.5 Å²	80.5	6%	0.062	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	-166.3	178.3	0	0	0	0	0	112.2	Y241 P294 F295	Y241-G283 CarbonylContact O-C 3.54Å; Y241-G283 WeakPolarHBondContact O-CA 3.33Å; G283-P294 CarbonylContact O-C 3.58Å; G283-P294 WeakPolarHBondContact O-CA 3.35Å; G283-F295 PolarHBondContact N-O 3.41Å; G283-F295 PolarHBondContact O-N 2.87Å
284	Y	96.3	Very high	83.3	Confident	75 Å²	75	76.8 Å²	76.8	29%	0.294	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.8	171	62.8	-87.8	0	0	0	111.2	Y241 T243 H292 V293 F295	Y241-Y284 VanDerWaalsContact CB-CZ 3.44Å; Y241-Y284 HydrophobicContact CD2-CD2 4.11Å; Y241-Y284 AromaticContact CD2-CE2 3.52Å; Y241-Y284 HydrophobicContact CD2-CE2 3.52Å; Y241-Y284 AromaticContact CD2-CZ 3.98Å; Y241-Y284 HydrophobicContact CE2-CE2 4.3Å; Y241-Y284 HydrophobicContact CG-CE1 4.39Å; Y241-Y284 AromaticContact CG-CE2 3.75Å; Y241-Y284 HydrophobicContact CG-CE2 3.75Å; Y241-Y284 AromaticContact CG-CZ 3.69Å; Y241-Y284 PolarHBondContact N-O 3.26Å; Y241-Y284 PolarHBondContact O-N 3.24Å; T243-Y284 HydrophobicContact CG2-CD1 3.95Å; T243-Y284 HydrophobicContact CG2-CE1 4Å; Y284-H292 HydrophobicContact CD2-CB 3.98Å; Y284-H292 AromaticContact CD2-CD2 3.8Å; Y284-H292 AromaticContact CD2-CG 3.85Å; Y284-H292 AromaticContact CE2-CD2 3.86Å; Y284-H292 HydrophobicContact CG-CB 4.37Å; Y284-V293 CarbonylContact C-O 3.54Å; Y284-V293 WeakPolarHBondContact CA-O 3.49Å; Y284-F295 VanDerWaalsContact N-CE1 3.31Å
285	Q	95.3	Very high	86.1	Confident	61 Å²	61	68.9 Å²	68.9	29%	0.285	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.6	168.8	-170.4	173.9	18.7	0	0	109.3	E238 N239 H292 V293	E238-Q285 PolarHBondContact O-NE2 3.47Å; N239-Q285 CarbonylContact O-C 3.21Å; N239-Q285 WeakPolarHBondContact O-CA 3.45Å; Q285-H292 WeakPolarHBondContact O-CA 3.19Å; Q285-V293 PolarHBondContact N-O 2.85Å; Q285-V293 PolarHBondContact O-N 3.24Å
286	R	93.9	Very high	88.4	Confident	106 Å²	106	67.8 Å²	67.8	40%	0.4	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.8	174.3	-174.4	179.6	66	-176.2	-2	109.7	N239 Y241	N239-R286 HydrophobicContact CB-CB 4.28Å; N239-R286 VanDerWaalsContact CB-O 3.32Å; N239-R286 WeakPolarHBondContact CB-O 3.25Å; N239-R286 PolarHBondContact O-N 2.84Å; Y241-R286 HydrophobicContact CE2-CB 4.16Å
287	I	89.8	Confident	90.3	Very high	69 Å²	69	62.9 Å²	62.9	35%	0.354	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-99.4	162	-179.2	-55	-176.3	0	0	0	109.9	I26 G289 G290 S291 V293	I26-I287 HydrophobicContact CD1-CD1 3.96Å; I287-G289 PolarHBondContact O-N 3.17Å; I287-G290 PolarHBondContact O-N 2.86Å; I287-G290 VanDerWaalsContact O-N 3.12Å; I287-S291 PolarHBondContact N-O 3.19Å; I287-V293 HydrophobicContact CD1-CB 4.21Å; I287-V293 HydrophobicContact CD1-CG2 3.33Å; I287-V293 HydrophobicContact CG1-CG2 4.2Å
288	A	80.8	Confident	91.5	Very high	100 Å²	100	58.7 Å²	58.7	83%	0.826	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	130	169	0	0	0	0	0	110.3
289	G	75.7	Confident	92	Very high	85 Å²	85	57 Å²	57	88%	0.876	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.8	-5.7	-174	0	0	0	0	0	115.2	I287 S291	I287-G289 PolarHBondContact O-N 3.17Å; G289-S291 VanDerWaalsContact C-N 3.34Å
290	G	79.4	Confident	92	Very high	47 Å²	47	58.7 Å²	58.7	49%	0.485	34%	0.343	S	S	.	.	S	Bend	trans	87	-0.9	174.7	0	0	0	0	0	114.8	I287	I287-G290 PolarHBondContact O-N 2.86Å; I287-G290 VanDerWaalsContact O-N 3.12Å
291	S	88.8	Confident	92.1	Very high	80 Å²	80	58.2 Å²	58.2	56%	0.559	34%	0.341	S	S	*	.			trans	-65.3	148.8	171.9	-59.8	0	0	0	0	111.7	I287 G289	I287-S291 PolarHBondContact N-O 3.19Å; G289-S291 VanDerWaalsContact C-N 3.34Å
292	H	93.2	Very high	92.2	Very high	111 Å²	111	58.2 Å²	58.2	51%	0.514	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.8	177.6	-58.2	144.5	0	0	0	110	Y284 Q285	Y284-H292 HydrophobicContact CD2-CB 3.98Å; Y284-H292 AromaticContact CD2-CD2 3.8Å; Y284-H292 AromaticContact CD2-CG 3.85Å; Y284-H292 AromaticContact CE2-CD2 3.86Å; Y284-H292 HydrophobicContact CG-CB 4.37Å; Q285-H292 WeakPolarHBondContact O-CA 3.19Å
293	V	93.6	Very high	92.3	Very high	43 Å²	43	52.8 Å²	52.8	26%	0.261	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.5	173.5	176.7	0	0	0	0	109	I26 Y284 Q285 I287	I26-V293 HydrophobicContact CD1-CG1 4.15Å; I26-V293 HydrophobicContact CD1-CG2 4.01Å; Y284-V293 CarbonylContact C-O 3.54Å; Y284-V293 WeakPolarHBondContact CA-O 3.49Å; Q285-V293 PolarHBondContact N-O 2.85Å; Q285-V293 PolarHBondContact O-N 3.24Å; I287-V293 HydrophobicContact CD1-CB 4.21Å; I287-V293 HydrophobicContact CD1-CG2 3.33Å; I287-V293 HydrophobicContact CG1-CG2 4.2Å
294	P	96	Very high	92.3	Very high	105 Å²	105	52.5 Å²	52.5	68%	0.682	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	150.3	177	30.7	-34.3	0	0	0	110.9	G283	G283-P294 CarbonylContact O-C 3.58Å; G283-P294 WeakPolarHBondContact O-CA 3.35Å
295	F	94	Very high	92.4	Very high	46 Å²	46	49.2 Å²	49.2	20%	0.202	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	158.9	172.4	68.7	-94.8	0	0	0	111.3	L166 T240 I242 I281 R282 G283 Y284 L297	L166-F295 HydrophobicContact CD1-CE2 4.32Å; L166-F295 HydrophobicContact CD1-CZ 4.31Å; T240-F295 HydrophobicContact CG2-CD1 4.35Å; T240-F295 HydrophobicContact CG2-CE1 3.26Å; T240-F295 HydrophobicContact CG2-CZ 3.41Å; T240-F295 VanDerWaalsContact CG2-CZ 3.41Å; I242-F295 HydrophobicContact CD1-CE2 4.43Å; I242-F295 HydrophobicContact CD1-CZ 3.78Å; I281-F295 HydrophobicContact CG2-CE2 4.42Å; R282-F295 WeakPolarHBondContact CA-O 3.34Å; G283-F295 PolarHBondContact N-O 3.41Å; G283-F295 PolarHBondContact O-N 2.87Å; Y284-F295 VanDerWaalsContact N-CE1 3.31Å; F295-L297 HydrophobicContact CD2-CD1 4Å; F295-L297 HydrophobicContact CD2-CG 3.85Å; F295-L297 HydrophobicContact CE2-CD1 4.03Å; F295-L297 HydrophobicContact CE2-CG 4.28Å
296	C	93.8	Very high	92.3	Very high	51 Å²	51	47.4 Å²	47.4	35%	0.345	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.8	170.4	-173.8	0	0	0	0	108.4	I281 R282	I281-C296 WeakPolarHBondContact O-CA 3.36Å; R282-C296 HydrophobicContact CG-CB 4.4Å
297	L	93.3	Very high	92.2	Very high	32 Å²	32	43.2 Å²	43.2	17%	0.168	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.2	-179.8	-62.3	171.9	0	0	0	109.9	L164 L166 I281 F295	L164-L297 HydrophobicContact CD2-CD1 3.69Å; L166-L297 HydrophobicContact CD1-CD1 4.2Å; I281-L297 HydrophobicContact CB-CB 4.48Å; I281-L297 PolarHBondContact N-O 2.69Å; I281-L297 PolarHBondContact O-N 3Å; F295-L297 HydrophobicContact CD2-CD1 4Å; F295-L297 HydrophobicContact CD2-CG 3.85Å; F295-L297 HydrophobicContact CE2-CD1 4.03Å; F295-L297 HydrophobicContact CE2-CG 4.28Å
298	F	94.1	Very high	92	Very high	45 Å²	45	40.8 Å²	40.8	20%	0.197	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.8	171.6	-60.9	-70.7	0	0	0	110.5	T60 L61 L248 N278 W279 E280	T60-F298 CarbonylContact C-O 3.59Å; T60-F298 WeakPolarHBondContact CA-O 3.32Å; T60-F298 HydrophobicContact CG2-CB 4.36Å; L61-F298 PolarHBondContact N-O 3.49Å; L248-F298 HydrophobicContact CD1-CD1 4.05Å; L248-F298 HydrophobicContact CD1-CE1 3.35Å; L248-F298 HydrophobicContact CD1-CZ 4.17Å; L248-F298 HydrophobicContact CG-CE1 4.42Å; N278-F298 HydrophobicContact CB-CB 4.47Å; W279-F298 CarbonylContact O-C 3.03Å; W279-F298 WeakPolarHBondContact O-CA 3.43Å; E280-F298 HydrophobicContact CB-CD1 4.11Å; E280-F298 HydrophobicContact CB-CE1 3.83Å; E280-F298 HydrophobicContact CG-CD1 4.33Å; E280-F298 HydrophobicContact CG-CE1 3.7Å; E280-F298 HydrophobicContact CG-CZ 4.43Å
299	A	95.1	Very high	92.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	144.6	178	0	0	0	0	0	113.2	L61 V64 N278 W279 I281 N301 V302	L61-A299 CarbonylContact O-C 3.6Å; L61-A299 WeakPolarHBondContact O-CA 3.46Å; V64-A299 HydrophobicContact CB-CB 4.07Å; V64-A299 HydrophobicContact CG2-CB 3.68Å; N278-A299 CarbonylContact C-O 3.44Å; N278-A299 WeakPolarHBondContact CA-O 3.44Å; W279-A299 HydrophobicContact CB-CB 4.47Å; W279-A299 PolarHBondContact N-O 3.22Å; W279-A299 PolarHBondContact O-N 3.46Å; I281-A299 HydrophobicContact CD1-CB 3.75Å; A299-N301 WeakPolarHBondContact CB-O 3.45Å; A299-V302 HydrophobicContact CB-CG2 4.35Å
300	E	94.3	Very high	92.3	Very high	39 Å²	39	39.4 Å²	39.4	18%	0.182	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-40.2	169.4	-63.5	-168.1	-178.7	0	0	110.5	T60 L61 K276 N502 K536	T60-E300 HydrophobicContact CG2-CG 3.9Å; L61-E300 PolarHBondContact O-N 2.9Å; K276-E300 WeakPolarHBondContact CE-OE1 3.47Å; K276-E300 IonicContact NZ-OE1 2.74Å; K276-E300 PolarHBondContact NZ-OE1 2.92Å; E300-N502 VanDerWaalsContact O-CB 3.26Å; E300-N502 WeakPolarHBondContact O-CB 3.45Å; E300-K536 IonicContact OE2-NZ 2.73Å; E300-K536 PolarHBondContact OE2-NZ 3Å
301	N	96.8	Very high	92.7	Very high	8 Å²	8	39 Å²	39	4%	0.043	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.1	-177.8	-53.5	-91.1	0	0	0	111.1	P62 V63 V64 A299 N502 F504 L529	P62-N301 WeakPolarHBondContact O-CB 3.27Å; P62-N301 PolarHBondContact O-N 3.06Å; P62-N301 PolarHBondContact O-ND2 2.73Å; V63-N301 WeakPolarHBondContact CA-O 3.49Å; V63-N301 HydrophobicContact CG2-CB 4.36Å; V64-N301 PolarHBondContact N-O 3.48Å; A299-N301 WeakPolarHBondContact CB-O 3.45Å; N301-N502 CarbonylContact C-O 3.57Å; N301-N502 VanDerWaalsContact CA-O 3.28Å; N301-N502 WeakPolarHBondContact CA-O 3.25Å; N301-N502 WeakPolarHBondContact OD1-CB 2.91Å; N301-N502 PolarHBondContact OD1-OD1 3.11Å; N301-F504 HydrophobicContact CB-CD2 4.41Å; N301-F504 HydrophobicContact CB-CE2 3.96Å; N301-L529 HydrophobicContact CB-CD2 4.31Å
302	V	98.3	Very high	92.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.3	172.8	175.2	0	0	0	0	109.3	V64 I66 V245 W279 I281 A299 L304 N502 L503 F504	V64-V302 CarbonylContact O-C 3.37Å; V64-V302 VanDerWaalsContact O-CA 3.31Å; V64-V302 WeakPolarHBondContact O-CA 3.46Å; I66-V302 HydrophobicContact CD1-CG1 3.86Å; I66-V302 HydrophobicContact CG1-CG1 4.3Å; V245-V302 HydrophobicContact CG1-CG1 4.44Å; W279-V302 HydrophobicContact CB-CG2 3.57Å; W279-V302 HydrophobicContact CD2-CB 4.5Å; W279-V302 HydrophobicContact CD2-CG2 3.98Å; W279-V302 HydrophobicContact CG-CB 4.37Å; W279-V302 HydrophobicContact CG-CG2 3.49Å; W279-V302 VanDerWaalsContact CG-CG2 3.49Å; I281-V302 HydrophobicContact CD1-CG2 3.95Å; I281-V302 HydrophobicContact CG1-CG2 4.2Å; A299-V302 HydrophobicContact CB-CG2 4.35Å; V302-L304 HydrophobicContact CG1-CD2 4.17Å; V302-N502 PolarHBondContact N-O 3.13Å; V302-L503 HydrophobicContact CB-CD1 3.77Å; V302-L503 HydrophobicContact CG1-CD1 3.79Å; V302-L503 CarbonylContact O-C 3.59Å; V302-L503 WeakPolarHBondContact O-CA 3.46Å; V302-F504 PolarHBondContact O-N 2.86Å
303	A	98.6	Very high	92.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.9	174.2	0	0	0	0	0	110.6	V64 I65 I66 L75 F504 L506	V64-A303 PolarHBondContact O-N 3.43Å; I65-A303 WeakPolarHBondContact CA-O 3.41Å; I65-A303 HydrophobicContact CG1-CB 4.24Å; I66-A303 PolarHBondContact N-O 3Å; L75-A303 HydrophobicContact CD2-CB 3.69Å; A303-F504 CarbonylContact C-O 3.43Å; A303-F504 WeakPolarHBondContact CA-O 3.41Å; A303-F504 HydrophobicContact CB-CB 4.17Å; A303-L506 HydrophobicContact CB-CD1 3.89Å
304	L	98.3	Very high	92.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	111	176.9	-54.7	178.7	0	0	0	109.5	I66 V302 F465 L466 L473 L503 F504 A505 L506 L509	I66-L304 HydrophobicContact CD1-CD2 4.16Å; V302-L304 HydrophobicContact CG1-CD2 4.17Å; L304-F465 HydrophobicContact CD2-CE2 3.94Å; L304-F465 HydrophobicContact CD2-CZ 4.26Å; L304-L466 HydrophobicContact CD1-CD1 3.84Å; L304-L473 HydrophobicContact CD1-CD1 4.34Å; L304-L503 HydrophobicContact CD1-CD1 4.14Å; L304-L503 HydrophobicContact CD1-CD2 4.23Å; L304-L503 HydrophobicContact CD1-CG 4.33Å; L304-L503 HydrophobicContact CD2-CD1 4.24Å; L304-L503 HydrophobicContact CG-CD1 3.93Å; L304-F504 PolarHBondContact N-O 2.77Å; L304-A505 HydrophobicContact CB-CB 4.43Å; L304-L506 PolarHBondContact O-N 2.83Å; L304-L509 HydrophobicContact CB-CD1 3.62Å
305	A	97.2	Very high	92.9	Very high	6 Å²	6	30.4 Å²	30.4	5%	0.05	17%	0.171	C	C	.	.			trans	-128.6	37	179.8	0	0	0	0	0	110.9	I65 I66 G67 G307	I65-A305 HydrophobicContact CG2-CB 4.1Å; I66-A305 CarbonylContact O-C 3.06Å; I66-A305 VanDerWaalsContact O-CA 3.29Å; I66-A305 WeakPolarHBondContact O-CA 3.25Å; I66-A305 PolarHBondContact O-N 2.87Å; G67-A305 WeakPolarHBondContact CA-O 3.19Å; A305-G307 PolarHBondContact O-N 3.16Å
306	T	93.6	Very high	93	Very high	23 Å²	23	36.9 Å²	36.9	14%	0.141	20%	0.202	C	C	.	.			trans	-77.8	-15.8	-169.7	55.4	0	0	0	0	114.3	I66 F465	I66-T306 HydrophobicContact CB-CG2 4.5Å; I66-T306 HydrophobicContact CG2-CG2 3.79Å; I66-T306 PolarHBondContact O-N 3.45Å; T306-F465 HydrophobicContact CG2-CE1 4.19Å; T306-F465 HydrophobicContact CG2-CZ 3.91Å
307	G	91.3	Very high	93.1	Very high	18 Å²	18	36 Å²	36	19%	0.186	20%	0.195	C	C	.	.			trans	67.4	-163.8	-173.2	0	0	0	0	0	112.1	A305 P461	A305-G307 PolarHBondContact O-N 3.16Å; G307-P461 WeakPolarHBondContact O-CB 3.31Å
308	T	86.9	Confident	93.3	Very high	17 Å²	17	40.7 Å²	40.7	10%	0.104	22%	0.216	C	C	.	.	S	Bend	trans	-130.4	1.6	-171.4	49.5	0	0	0	0	114.6	D310 S459 H460 P461 C483 P508	T308-D310 VanDerWaalsContact C-N 3.33Å; T308-S459 CarbonylContact O-C 3.58Å; T308-S459 WeakPolarHBondContact O-CB 3.49Å; T308-S459 PolarHBondContact O-OG 3.06Å; T308-S459 VanDerWaalsContact O-OG 3.09Å; T308-H460 CarbonylContact O-C 3.58Å; T308-H460 VanDerWaalsContact O-C 3.24Å; T308-H460 PolarHBondContact O-N 3.36Å; T308-H460 VanDerWaalsContact O-O 3.07Å; T308-P461 HydrophobicContact CG2-CB 4.28Å; T308-P461 HydrophobicContact CG2-CG 4.45Å; T308-C483 HydrophobicContact CG2-CB 3.9Å; T308-P508 HydrophobicContact CG2-CB 3.51Å
309	L	81.9	Confident	93.4	Very high	96 Å²	96	39.7 Å²	39.7	50%	0.503	22%	0.218	S	C	.	.			trans	-93.1	11	-175.4	-64.5	175.7	0	0	0	113.3	A174 M178 S459	A174-L309 HydrophobicContact CB-CB 4.14Å; A174-L309 HydrophobicContact CB-CD1 3.66Å; A174-L309 HydrophobicContact CB-CG 4.45Å; M178-L309 HydrophobicContact CE-CD1 3.54Å; L309-S459 WeakPolarHBondContact CD2-OG 3.42Å
310	D	80.1	Confident	93.5	Very high	60 Å²	60	40 Å²	40	32%	0.321	22%	0.22	S	C	.	.	S	Bend	trans	-81.8	-32.3	-171.7	-87.9	-23.4	0	0	0	113.8	K168 T308 N462	K168-D310 IonicContact NZ-OD1 4Å; K168-D310 PolarHBondContact NZ-OD1 2.95Å; K168-D310 IonicContact NZ-OD2 3.11Å; K168-D310 PolarHBondContact NZ-OD2 3.27Å; T308-D310 VanDerWaalsContact C-N 3.33Å; D310-N462 HydrophobicContact CB-CB 3.53Å
311	S	88.2	Confident	93.6	Very high	38 Å²	38	45.4 Å²	45.4	27%	0.266	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	105.9	-177.9	-65.8	0	0	0	0	110.4	S459 H460 N462	S311-S459 CarbonylContact O-C 3.6Å; S311-S459 WeakPolarHBondContact O-CA 3.11Å; S311-S459 VanDerWaalsContact O-CB 3.25Å; S311-S459 WeakPolarHBondContact O-CB 3.38Å; S311-H460 WeakPolarHBondContact CB-O 3.49Å; S311-H460 PolarHBondContact N-O 3.16Å; S311-H460 VanDerWaalsContact N-O 3.09Å; S311-H460 PolarHBondContact O-N 3.26Å; S311-N462 WeakPolarHBondContact OG-CB 3.25Å
312	P	92	Very high	93.6	Very high	47 Å²	47	47.1 Å²	47.1	31%	0.305	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	148.2	173.7	-23.5	34.1	0	0	0	112.3	H314 H327	P312-H314 PolarHBondContact O-CD2 3.36Å; P312-H314 VanDerWaalsContact O-CD2 3.25Å; P312-H327 HydrophobicContact CB-CB 3.63Å; P312-H327 HydrophobicContact CG-CB 4.02Å
313	A	92.5	Very high	93.3	Very high	14 Å²	14	52.8 Å²	52.8	12%	0.116	29%	0.291	C	S	.	.			trans	-82.3	141.3	172.8	0	0	0	0	0	110.6	I457 G458	A313-I457 HydrophobicContact CB-CD1 4.19Å; A313-I457 HydrophobicContact CB-CG1 3.84Å; A313-I457 WeakPolarHBondContact O-CG1 3.35Å; A313-G458 WeakPolarHBondContact CB-O 3.38Å; A313-G458 PolarHBondContact N-O 3.04Å
314	H	94.4	Very high	93.1	Very high	84 Å²	84	53.7 Å²	53.7	39%	0.389	30%	0.295	S	S	.	.			trans	-107.5	152.5	-178	-68.5	-107.7	0	0	0	111.2	P312 E316 E320 E321 H327	P312-H314 PolarHBondContact O-CD2 3.36Å; P312-H314 VanDerWaalsContact O-CD2 3.25Å; H314-E316 VanDerWaalsContact C-N 3.31Å; H314-E320 WeakPolarHBondContact CA-OE1 3.42Å; H314-E320 IonicContact ND1-OE1 3.16Å; H314-E321 IonicContact CE1-OE1 3.28Å; H314-E321 IonicContact ND1-OE1 3.79Å; H314-H327 AromaticContact CE1-CD2 3.75Å; H314-H327 AromaticContact CE1-CE1 3.9Å; H314-H327 AromaticContact CE1-NE2 3.64Å; H314-H327 AromaticContact CG-NE2 3.97Å; H314-H327 AromaticContact ND1-CD2 3.71Å; H314-H327 AromaticContact ND1-CE1 3.83Å; H314-H327 AromaticContact ND1-NE2 3.29Å; H314-H327 PolarHBondContact ND1-NE2 3.46Å
315	L	95.6	Very high	93	Very high	14 Å²	14	54.3 Å²	54.3	7%	0.073	30%	0.298	C	S	.	.			trans	-75.9	-22.2	175.7	-67.9	165.5	0	0	0	112.4	V317 E320 V351 V427 F430 V455 I457	L315-V317 HydrophobicContact CB-CG1 4.06Å; L315-V317 HydrophobicContact CB-CG2 3.93Å; L315-V317 HydrophobicContact CD1-CG2 4.39Å; L315-E320 WeakPolarHBondContact CA-OE2 3.44Å; L315-E320 WeakPolarHBondContact CB-OE2 2.96Å; L315-E320 VanDerWaalsContact N-CD 3.28Å; L315-E320 PolarHBondContact N-OE1 3.42Å; L315-E320 PolarHBondContact N-OE2 2.74Å; L315-V351 HydrophobicContact CD1-CG1 4.34Å; L315-V351 HydrophobicContact CD2-CG1 4.17Å; L315-V427 HydrophobicContact CD1-CB 4.11Å; L315-V427 HydrophobicContact CD1-CG2 4.21Å; L315-F430 HydrophobicContact CD1-CE2 4.18Å; L315-F430 HydrophobicContact CD1-CZ 4.28Å; L315-V455 HydrophobicContact CD1-CG1 3.89Å; L315-V455 HydrophobicContact CD1-CG2 3.75Å; L315-V455 HydrophobicContact CD2-CG1 4.49Å; L315-V455 HydrophobicContact CG-CG1 3.76Å; L315-I457 HydrophobicContact CD2-CD1 3.91Å; L315-I457 HydrophobicContact CD2-CG2 4.47Å; L315-I457 HydrophobicContact CG-CD1 4.17Å
316	E	96.1	Very high	92.9	Very high	183 Å²	183	55.6 Å²	55.6	86%	0.855	30%	0.303	S	S	*	.			trans	61.7	45.1	-175.2	-57.7	178.3	172.9	0	0	111.9	H314 E320	H314-E316 VanDerWaalsContact C-N 3.31Å; E316-E320 PolarHBondContact N-OE2 3.29Å
317	V	96.9	Very high	93	Very high	33 Å²	33	55.7 Å²	55.7	20%	0.2	30%	0.302	C	S	.	.			trans	-114.4	154.8	-179.1	-62.1	0	0	0	0	112.4	L315 G319 E320 V427 L428 F430	L315-V317 HydrophobicContact CB-CG1 4.06Å; L315-V317 HydrophobicContact CB-CG2 3.93Å; L315-V317 HydrophobicContact CD1-CG2 4.39Å; V317-G319 PolarHBondContact O-N 2.67Å; V317-E320 HydrophobicContact CG2-CB 4.08Å; V317-E320 PolarHBondContact N-OE2 2.9Å; V317-E320 WeakPolarHBondContact O-CB 3.25Å; V317-E320 PolarHBondContact O-N 2.9Å; V317-V427 HydrophobicContact CG2-CG1 4.45Å; V317-L428 WeakPolarHBondContact CB-O 3.1Å; V317-F430 HydrophobicContact CG2-CD2 3.93Å; V317-F430 HydrophobicContact CG2-CE2 3.8Å
318	E	97.6	Very high	93	Very high	129 Å²	129	56.1 Å²	56.1	60%	0.603	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-56.3	129.8	176.7	-171.3	-158.8	151	0	0	110.7	S429 F430 K431	E318-S429 CarbonylContact O-C 3.51Å; E318-S429 VanDerWaalsContact O-CA 3.25Å; E318-S429 WeakPolarHBondContact O-CA 3.45Å; E318-S429 WeakPolarHBondContact O-CB 3.46Å; E318-F430 PolarHBondContact O-N 2.71Å; E318-K431 IonicContact OE1-NZ 3.15Å; E318-K431 PolarHBondContact OE1-NZ 3.45Å; E318-K431 IonicContact OE2-NZ 3.75Å; E318-K431 PolarHBondContact OE2-NZ 3.03Å
319	G	96.3	Very high	93.2	Very high	24 Å²	24	56 Å²	56	25%	0.247	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	6	177.1	0	0	0	0	0	115.5	V317 E321 L322 F430	V317-G319 PolarHBondContact O-N 2.67Å; G319-E321 PolarHBondContact O-N 3.4Å; G319-L322 VanDerWaalsContact O-CB 3.27Å; G319-L322 WeakPolarHBondContact O-CB 3.48Å; G319-L322 VanDerWaalsContact O-CD1 3.31Å; G319-L322 WeakPolarHBondContact O-CD1 3.44Å; G319-L322 WeakPolarHBondContact O-CG 3.44Å; G319-L322 PolarHBondContact O-N 3.46Å; G319-L322 VanDerWaalsContact O-N 3.1Å; G319-F430 WeakPolarHBondContact CA-O 3.47Å; G319-F430 WeakPolarHBondContact O-CB 3.09Å
320	E	97.1	Very high	93.5	Very high	7 Å²	7	54.1 Å²	54.1	3%	0.033	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25	176.8	-174.5	167.6	-165.9	0	0	113.6	H314 L315 E316 V317 L322 V325 H327 F430	H314-E320 WeakPolarHBondContact CA-OE1 3.42Å; H314-E320 IonicContact ND1-OE1 3.16Å; L315-E320 WeakPolarHBondContact CA-OE2 3.44Å; L315-E320 WeakPolarHBondContact CB-OE2 2.96Å; L315-E320 VanDerWaalsContact N-CD 3.28Å; L315-E320 PolarHBondContact N-OE1 3.42Å; L315-E320 PolarHBondContact N-OE2 2.74Å; E316-E320 PolarHBondContact N-OE2 3.29Å; V317-E320 HydrophobicContact CG2-CB 4.08Å; V317-E320 PolarHBondContact N-OE2 2.9Å; V317-E320 WeakPolarHBondContact O-CB 3.25Å; V317-E320 PolarHBondContact O-N 2.9Å; E320-L322 PolarHBondContact O-N 2.78Å; E320-V325 HydrophobicContact CG-CG1 4.32Å; E320-V325 VanDerWaalsContact O-CB 3.3Å; E320-V325 WeakPolarHBondContact O-CB 3.36Å; E320-V325 WeakPolarHBondContact O-CG1 3.33Å; E320-H327 IonicContact OE1-CD2 2.73Å; E320-H327 IonicContact OE1-CE1 2.83Å; E320-H327 IonicContact OE1-NE2 2.81Å; E320-H327 PolarHBondContact OE1-NE2 2.91Å; E320-F430 HydrophobicContact CB-CD2 4.26Å; E320-F430 HydrophobicContact CB-CE2 4.34Å; E320-F430 HydrophobicContact CG-CE2 4.44Å
321	E	96.1	Very high	94	Very high	153 Å²	153	55.9 Å²	55.9	72%	0.715	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	5.9	176.8	-57	-57.8	129.3	0	0	113.7	H314 G319	H314-E321 IonicContact CE1-OE1 3.28Å; H314-E321 IonicContact ND1-OE1 3.79Å; G319-E321 PolarHBondContact O-N 3.4Å
322	L	95.9	Very high	94.1	Very high	44 Å²	44	54 Å²	54	23%	0.23	29%	0.288	C	S	.	.	S	Bend	trans	-69.2	144.7	-179.8	-71.5	167.7	0	0	0	111.1	G319 E320 F324 V325 F430	G319-L322 VanDerWaalsContact O-CB 3.27Å; G319-L322 WeakPolarHBondContact O-CB 3.48Å; G319-L322 VanDerWaalsContact O-CD1 3.31Å; G319-L322 WeakPolarHBondContact O-CD1 3.44Å; G319-L322 WeakPolarHBondContact O-CG 3.44Å; G319-L322 PolarHBondContact O-N 3.46Å; G319-L322 VanDerWaalsContact O-N 3.1Å; E320-L322 PolarHBondContact O-N 2.78Å; L322-F324 HydrophobicContact CB-CD1 3.86Å; L322-F324 HydrophobicContact CB-CE1 3.59Å; L322-F324 HydrophobicContact CB-CZ 4.3Å; L322-F324 HydrophobicContact CD1-CE1 3.67Å; L322-F324 HydrophobicContact CD1-CZ 4Å; L322-F324 HydrophobicContact CG-CE1 4.2Å; L322-F324 PolarHBondContact O-N 2.89Å; L322-V325 HydrophobicContact CB-CG2 4.27Å; L322-V325 WeakPolarHBondContact O-CB 2.99Å; L322-V325 PolarHBondContact O-N 3.44Å; L322-F430 HydrophobicContact CD1-CB 4.07Å
323	P	93.8	Very high	94	Very high	119 Å²	119	52 Å²	52	77%	0.773	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-9.4	-170.9	-25.1	34.3	0	0	0	117.3
324	F	93.1	Very high	93.8	Very high	18 Å²	18	53.3 Å²	53.3	8%	0.079	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-1.3	176.9	69.1	-92.5	0	0	0	113.1	L322 F430 K431 M434 A452 A453	L322-F324 HydrophobicContact CB-CD1 3.86Å; L322-F324 HydrophobicContact CB-CE1 3.59Å; L322-F324 HydrophobicContact CB-CZ 4.3Å; L322-F324 HydrophobicContact CD1-CE1 3.67Å; L322-F324 HydrophobicContact CD1-CZ 4Å; L322-F324 HydrophobicContact CG-CE1 4.2Å; L322-F324 PolarHBondContact O-N 2.89Å; F324-F430 HydrophobicContact CE2-CD1 4.22Å; F324-F430 HydrophobicContact CZ-CB 4.14Å; F324-K431 WeakPolarHBondContact CZ-O 3.48Å; F324-M434 HydrophobicContact CB-CE 3.52Å; F324-M434 HydrophobicContact CB-SD 3.71Å; F324-M434 HydrophobicContact CD1-CE 4.07Å; F324-M434 HydrophobicContact CD1-SD 3.18Å; F324-M434 WeakPolarHBondContact CD1-SD 3.31Å; F324-M434 HydrophobicContact CD2-CE 3.93Å; F324-M434 HydrophobicContact CD2-SD 4.04Å; F324-M434 HydrophobicContact CE1-SD 3.67Å; F324-M434 HydrophobicContact CE2-SD 4.47Å; F324-M434 HydrophobicContact CG-CE 3.59Å; F324-M434 HydrophobicContact CG-SD 3.37Å; F324-M434 WeakPolarHBondContact CG-SD 3.44Å; F324-M434 HydrophobicContact CZ-SD 4.3Å; F324-A452 WeakPolarHBondContact O-CA 3.48Å; F324-A453 PolarHBondContact O-N 3.29Å
325	V	96.4	Very high	93.6	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122	174.5	-171.7	0	0	0	0	107.6	E320 L322 F430 A453 V455	E320-V325 HydrophobicContact CG-CG1 4.32Å; E320-V325 VanDerWaalsContact O-CB 3.3Å; E320-V325 WeakPolarHBondContact O-CB 3.36Å; E320-V325 WeakPolarHBondContact O-CG1 3.33Å; L322-V325 HydrophobicContact CB-CG2 4.27Å; L322-V325 WeakPolarHBondContact O-CB 2.99Å; L322-V325 PolarHBondContact O-N 3.44Å; V325-F430 HydrophobicContact CG1-CE2 4.26Å; V325-F430 HydrophobicContact CG1-CZ 4.28Å; V325-F430 HydrophobicContact CG2-CB 4.35Å; V325-F430 HydrophobicContact CG2-CD1 4.05Å; V325-F430 HydrophobicContact CG2-CD2 4.14Å; V325-F430 HydrophobicContact CG2-CE1 4.34Å; V325-F430 HydrophobicContact CG2-CE2 4.42Å; V325-F430 HydrophobicContact CG2-CG 3.92Å; V325-A453 CarbonylContact C-O 3.48Å; V325-A453 WeakPolarHBondContact CA-O 3.49Å; V325-A453 HydrophobicContact CG1-CB 4.31Å; V325-A453 HydrophobicContact CG2-CB 4.25Å; V325-V455 HydrophobicContact CG1-CG2 3.92Å
326	F	95.8	Very high	93.2	Very high	33 Å²	33	49.2 Å²	49.2	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	148.8	-179.6	-53.2	-59	0	0	0	110.1	E331 F332 A335 A452 A453 V454 V455	F326-E331 HydrophobicContact CB-CB 4.11Å; F326-E331 HydrophobicContact CD1-CB 3.9Å; F326-E331 HydrophobicContact CG-CB 4.2Å; F326-F332 HydrophobicContact CD2-CD2 4.36Å; F326-A335 HydrophobicContact CE2-CB 3.75Å; F326-A335 HydrophobicContact CZ-CB 3.71Å; F326-A452 HydrophobicContact CD2-CB 4.26Å; F326-A452 HydrophobicContact CE2-CB 3.75Å; F326-A453 PolarHBondContact N-O 3.35Å; F326-V454 HydrophobicContact CB-CG1 4.36Å; F326-V454 HydrophobicContact CD2-CG2 4.45Å; F326-V454 CarbonylContact O-C 3.4Å; F326-V454 WeakPolarHBondContact O-CA 3.37Å; F326-V455 PolarHBondContact O-N 2.68Å
327	H	95.2	Very high	92.6	Very high	25 Å²	25	46.6 Å²	46.6	12%	0.116	26%	0.26	C	S	.	.			trans	-118.9	5.6	-179.5	-66.1	74.8	0	0	0	112.7	P312 H314 E320 E331 V455	P312-H327 HydrophobicContact CB-CB 3.63Å; P312-H327 HydrophobicContact CG-CB 4.02Å; H314-H327 AromaticContact CE1-CD2 3.75Å; H314-H327 AromaticContact CE1-CE1 3.9Å; H314-H327 AromaticContact CE1-NE2 3.64Å; H314-H327 AromaticContact CG-NE2 3.97Å; H314-H327 AromaticContact ND1-CD2 3.71Å; H314-H327 AromaticContact ND1-CE1 3.83Å; H314-H327 AromaticContact ND1-NE2 3.29Å; H314-H327 PolarHBondContact ND1-NE2 3.46Å; E320-H327 IonicContact OE1-CD2 2.73Å; E320-H327 IonicContact OE1-CE1 2.83Å; E320-H327 IonicContact OE1-NE2 2.81Å; E320-H327 PolarHBondContact OE1-NE2 2.91Å; H327-E331 PolarHBondContact N-OE2 3.48Å; H327-V455 WeakPolarHBondContact CA-O 3.5Å
328	S	91.8	Very high	91.9	Very high	28 Å²	28	52.2 Å²	52.2	20%	0.196	28%	0.281	C	S	.	.	S	Bend	trans	-143.3	151.1	-177.9	74.5	0	0	0	0	112.9	E331 F332	S328-E331 PolarHBondContact N-OE2 2.8Å; S328-E331 PolarHBondContact O-N 3.06Å; S328-E331 WeakPolarHBondContact OG-CB 3.43Å; S328-E331 WeakPolarHBondContact OG-CG 3.47Å; S328-E331 PolarHBondContact OG-N 2.68Å; S328-E331 PolarHBondContact OG-OE2 3.37Å; S328-F332 PolarHBondContact O-N 3.36Å
329	M	89.8	Confident	90.5	Very high	14 Å²	14	56 Å²	56	7%	0.069	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-42	174.3	-78.1	-61.4	-61.6	0	0	113.1	E179 M182 E331 F332 G333 T356 A360 C363 L456	E179-M329 HydrophobicContact CB-CB 4.33Å; E179-M329 HydrophobicContact CB-CE 4.28Å; E179-M329 HydrophobicContact CG-CE 4.17Å; M182-M329 HydrophobicContact CE-CE 3.66Å; M182-M329 HydrophobicContact SD-CE 4.12Å; M329-E331 PolarHBondContact O-N 3.24Å; M329-F332 HydrophobicContact CE-CD1 4.49Å; M329-F332 PolarHBondContact O-N 3.45Å; M329-F332 HydrophobicContact SD-CD1 4.37Å; M329-G333 PolarHBondContact O-N 3.49Å; M329-T356 HydrophobicContact CG-CG2 3.66Å; M329-A360 HydrophobicContact SD-CB 3.64Å; M329-C363 HydrophobicContact CE-CB 4.26Å; M329-L456 HydrophobicContact SD-CD1 4.03Å
330	P	89	Confident	89.1	Confident	57 Å²	57	62.3 Å²	62.3	37%	0.37	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-40.7	177.5	-29	38.6	0	0	0	114.4	N177 F332 A334	N177-P330 WeakPolarHBondContact O-CG 3.5Å; P330-F332 VanDerWaalsContact C-N 3.35Å; P330-A334 VanDerWaalsContact O-CB 3.26Å; P330-A334 WeakPolarHBondContact O-CB 3.29Å; P330-A334 PolarHBondContact O-N 2.82Å
331	E	90.5	Very high	87.8	Confident	96 Å²	96	62.3 Å²	62.3	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-44	175.9	-72.5	164.5	163.2	0	0	111.1	F326 H327 S328 M329 A334 A335	F326-E331 HydrophobicContact CB-CB 4.11Å; F326-E331 HydrophobicContact CD1-CB 3.9Å; F326-E331 HydrophobicContact CG-CB 4.2Å; H327-E331 PolarHBondContact N-OE2 3.48Å; S328-E331 PolarHBondContact N-OE2 2.8Å; S328-E331 PolarHBondContact O-N 3.06Å; S328-E331 WeakPolarHBondContact OG-CB 3.43Å; S328-E331 WeakPolarHBondContact OG-CG 3.47Å; S328-E331 PolarHBondContact OG-N 2.68Å; S328-E331 PolarHBondContact OG-OE2 3.37Å; M329-E331 PolarHBondContact O-N 3.24Å; E331-A334 PolarHBondContact O-N 2.86Å; E331-A335 PolarHBondContact O-N 3.39Å
332	F	91.3	Very high	85.8	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-48.6	177.2	-179.6	-129.5	0	0	0	112.2	F326 S328 M329 P330 A334 A335 I336 L341 V348 A360 C363 A364 V454	F326-F332 HydrophobicContact CD2-CD2 4.36Å; S328-F332 PolarHBondContact O-N 3.36Å; M329-F332 HydrophobicContact CE-CD1 4.49Å; M329-F332 PolarHBondContact O-N 3.45Å; M329-F332 HydrophobicContact SD-CD1 4.37Å; P330-F332 VanDerWaalsContact C-N 3.35Å; F332-A334 VanDerWaalsContact C-N 3.31Å; F332-A334 PolarHBondContact O-N 2.68Å; F332-A335 WeakPolarHBondContact O-CB 3.26Å; F332-A335 PolarHBondContact O-N 3.48Å; F332-I336 HydrophobicContact CD1-CD1 4.16Å; F332-I336 HydrophobicContact CD2-CD1 4.4Å; F332-I336 HydrophobicContact CD2-CG1 4.44Å; F332-I336 HydrophobicContact CE1-CD1 3.69Å; F332-I336 HydrophobicContact CE2-CD1 3.96Å; F332-I336 HydrophobicContact CE2-CG1 4.08Å; F332-I336 HydrophobicContact CG-CD1 4.49Å; F332-I336 HydrophobicContact CZ-CD1 3.59Å; F332-I336 HydrophobicContact CZ-CG1 4.21Å; F332-I336 WeakPolarHBondContact O-CG1 3.35Å; F332-I336 PolarHBondContact O-N 2.94Å; F332-L341 HydrophobicContact CD2-CD1 4.26Å; F332-L341 HydrophobicContact CE2-CD1 3.87Å; F332-V348 HydrophobicContact CE2-CG1 3.88Å; F332-V348 HydrophobicContact CE2-CG2 4.37Å; F332-V348 HydrophobicContact CZ-CG1 4.15Å; F332-A360 HydrophobicContact CD1-CB 4.31Å; F332-A360 HydrophobicContact CE1-CB 4.2Å; F332-C363 HydrophobicContact CE1-CB 4.24Å; F332-A364 HydrophobicContact CE1-CB 4.48Å; F332-A364 HydrophobicContact CZ-CB 4.06Å; F332-V454 HydrophobicContact CB-CG1 4.03Å; F332-V454 HydrophobicContact CB-CG2 4.3Å; F332-V454 HydrophobicContact CD1-CG2 4.29Å; F332-V454 HydrophobicContact CD2-CG2 3.41Å; F332-V454 VanDerWaalsContact CD2-CG2 3.41Å; F332-V454 HydrophobicContact CE1-CG2 4.49Å; F332-V454 HydrophobicContact CE2-CG2 3.68Å; F332-V454 HydrophobicContact CG-CG1 4.17Å; F332-V454 HydrophobicContact CG-CG2 3.75Å; F332-V454 HydrophobicContact CZ-CG2 4.21Å
333	G	89.5	Confident	83.9	Confident	4 Å²	4	58.5 Å²	58.5	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-41.3	175.8	0	0	0	0	0	112.2	M329 A335 I336 N337	M329-G333 PolarHBondContact O-N 3.49Å; G333-A335 VanDerWaalsContact C-N 3.33Å; G333-A335 PolarHBondContact O-N 3.15Å; G333-I336 PolarHBondContact O-N 3.02Å; G333-N337 WeakPolarHBondContact O-CB 3.44Å; G333-N337 VanDerWaalsContact O-CG 3.26Å; G333-N337 PolarHBondContact O-N 3.25Å; G333-N337 PolarHBondContact O-ND2 3.01Å
334	A	88.7	Confident	82.1	Confident	41 Å²	41	65.7 Å²	65.7	34%	0.339	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-35.7	174.3	0	0	0	0	0	112.8	P330 E331 F332 K338	P330-A334 VanDerWaalsContact O-CB 3.26Å; P330-A334 WeakPolarHBondContact O-CB 3.29Å; P330-A334 PolarHBondContact O-N 2.82Å; E331-A334 PolarHBondContact O-N 2.86Å; F332-A334 VanDerWaalsContact C-N 3.31Å; F332-A334 PolarHBondContact O-N 2.68Å; A334-K338 WeakPolarHBondContact O-CB 3.41Å; A334-K338 VanDerWaalsContact O-CG 3.29Å; A334-K338 WeakPolarHBondContact O-CG 3.38Å; A334-K338 PolarHBondContact O-N 3.4Å; A334-K338 VanDerWaalsContact O-N 3.12Å
335	A	88.8	Confident	81	Confident	6 Å²	6	67 Å²	67	5%	0.05	34%	0.338	C	S	.	.	H	α-helix	trans	-67.3	-41.7	175.6	0	0	0	0	0	112.2	F326 E331 F332 G333 K340 L341	F326-A335 HydrophobicContact CE2-CB 3.75Å; F326-A335 HydrophobicContact CZ-CB 3.71Å; E331-A335 PolarHBondContact O-N 3.39Å; F332-A335 WeakPolarHBondContact O-CB 3.26Å; F332-A335 PolarHBondContact O-N 3.48Å; G333-A335 VanDerWaalsContact C-N 3.33Å; G333-A335 PolarHBondContact O-N 3.15Å; A335-K340 PolarHBondContact O-N 3.44Å; A335-L341 HydrophobicContact CB-CD1 3.91Å
336	I	87.1	Confident	80.5	Confident	6 Å²	6	69 Å²	69	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-50.3	173.4	-64.1	173.7	0	0	0	110.2	F332 G333 K338 R339 L341 C363 N367 I369	F332-I336 HydrophobicContact CD1-CD1 4.16Å; F332-I336 HydrophobicContact CD2-CD1 4.4Å; F332-I336 HydrophobicContact CD2-CG1 4.44Å; F332-I336 HydrophobicContact CE1-CD1 3.69Å; F332-I336 HydrophobicContact CE2-CD1 3.96Å; F332-I336 HydrophobicContact CE2-CG1 4.08Å; F332-I336 HydrophobicContact CG-CD1 4.49Å; F332-I336 HydrophobicContact CZ-CD1 3.59Å; F332-I336 HydrophobicContact CZ-CG1 4.21Å; F332-I336 WeakPolarHBondContact O-CG1 3.35Å; F332-I336 PolarHBondContact O-N 2.94Å; G333-I336 PolarHBondContact O-N 3.02Å; I336-K338 VanDerWaalsContact C-N 3.26Å; I336-K338 PolarHBondContact O-N 2.79Å; I336-R339 WeakPolarHBondContact O-CA 3.31Å; I336-R339 PolarHBondContact O-N 3.39Å; I336-L341 HydrophobicContact CG1-CD1 3.99Å; I336-C363 VanDerWaalsContact CD1-SG 3.53Å; I336-N367 HydrophobicContact CG2-CB 4.24Å; I336-I369 HydrophobicContact CD1-CD1 4.19Å; I336-I369 HydrophobicContact CG1-CD1 3.93Å; I336-I369 HydrophobicContact CG2-CD1 4.36Å
337	N	83.8	Confident	80.4	Confident	129 Å²	129	68.9 Å²	68.9	69%	0.69	35%	0.351	S	S	*	.	H	α-helix	trans	-61.9	-32.6	-176.5	-75.1	-27.9	0	0	0	113.2	G333 R339	G333-N337 WeakPolarHBondContact O-CB 3.44Å; G333-N337 VanDerWaalsContact O-CG 3.26Å; G333-N337 PolarHBondContact O-N 3.25Å; G333-N337 PolarHBondContact O-ND2 3.01Å; N337-R339 PolarHBondContact O-N 2.6Å; N337-R339 VanDerWaalsContact O-N 3.14Å
338	K	81.8	Confident	80.4	Confident	150 Å²	150	67.7 Å²	67.7	65%	0.652	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	6.3	173	-71.6	175.2	-178.2	177.5	0	113.3	A334 I336 K340	A334-K338 WeakPolarHBondContact O-CB 3.41Å; A334-K338 VanDerWaalsContact O-CG 3.29Å; A334-K338 WeakPolarHBondContact O-CG 3.38Å; A334-K338 PolarHBondContact O-N 3.4Å; A334-K338 VanDerWaalsContact O-N 3.12Å; I336-K338 VanDerWaalsContact C-N 3.26Å; I336-K338 PolarHBondContact O-N 2.79Å; K338-K340 HydrophobicContact CB-CG 4.08Å; K338-K340 PolarHBondContact O-N 3.47Å; K338-K340 VanDerWaalsContact O-N 3.08Å
339	R	68	Low	80.6	Confident	209 Å²	209	66.4 Å²	66.4	79%	0.789	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	25.2	-173.4	-63.1	-173	178.9	-177.6	0.1	113.8	I336 N337 L341	I336-R339 WeakPolarHBondContact O-CA 3.31Å; I336-R339 PolarHBondContact O-N 3.39Å; N337-R339 PolarHBondContact O-N 2.6Å; N337-R339 VanDerWaalsContact O-N 3.14Å; R339-L341 PolarHBondContact O-N 3.09Å
340	K	67.8	Low	81	Confident	157 Å²	157	65.7 Å²	65.7	68%	0.683	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.1	175.9	-70.1	-173.3	173.9	-171.1	0	112.4	A335 K338	A335-K340 PolarHBondContact O-N 3.44Å; K338-K340 HydrophobicContact CB-CG 4.08Å; K338-K340 PolarHBondContact O-N 3.47Å; K338-K340 VanDerWaalsContact O-N 3.08Å
341	L	69.6	Low	81.5	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.037	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	5.5	-170.5	-56.9	174.7	0	0	0	113.8	F332 A335 I336 R339 V348 I369 A452	F332-L341 HydrophobicContact CD2-CD1 4.26Å; F332-L341 HydrophobicContact CE2-CD1 3.87Å; A335-L341 HydrophobicContact CB-CD1 3.91Å; I336-L341 HydrophobicContact CG1-CD1 3.99Å; R339-L341 PolarHBondContact O-N 3.09Å; L341-V348 HydrophobicContact CD1-CG2 4.33Å; L341-V348 HydrophobicContact CD2-CG2 4.44Å; L341-I369 HydrophobicContact CB-CD1 3.94Å; L341-A452 HydrophobicContact CD1-CB 4.3Å; L341-A452 HydrophobicContact CD2-CB 3.8Å
342	C	54.8	Low	81.8	Confident	62 Å²	62	59.2 Å²	59.2	42%	0.419	30%	0.3	S	S	.	.			trans	-93.5	133.6	-176	-60.6	0	0	0	0	112.3
343	G	55.9	Low	81.9	Confident	54 Å²	54	60.2 Å²	60.2	56%	0.557	31%	0.307	S	S	*	.	S	Bend	trans	132.7	-166.6	172.9	0	0	0	0	0	113.4	A345	G343-A345 PolarHBondContact O-N 2.81Å
344	R	56.2	Low	82.1	Confident	271 Å²	271	61.5 Å²	61.5	100%	1.023	32%	0.32	S	S	*	.	S	Bend	trans	-73.8	46	172.1	-138.6	-175.5	-164.2	-170.8	4.1	111
345	A	69.8	Low	82.3	Confident	44 Å²	44	61.2 Å²	61.2	36%	0.364	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-90.8	162.4	-169.3	0	0	0	0	0	111.9	G343	G343-A345 PolarHBondContact O-N 2.81Å
346	D	86.2	Confident	82.4	Confident	57 Å²	57	64.3 Å²	64.3	31%	0.305	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-54.2	149.5	172.4	-63.1	-57.5	0	0	0	111.1	K449 S451	D346-K449 HydrophobicContact CB-CG 4.46Å; D346-K449 IonicContact OD1-NZ 3.52Å; D346-K449 WeakPolarHBondContact OD2-CE 3.5Å; D346-K449 IonicContact OD2-NZ 2.69Å; D346-K449 PolarHBondContact OD2-NZ 2.93Å; D346-S451 WeakPolarHBondContact O-CB 3.26Å; D346-S451 PolarHBondContact O-OG 3.18Å
347	P	92.4	Very high	82.8	Confident	30 Å²	30	64 Å²	64	20%	0.195	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65	157.3	-175.7	25.7	-34.9	0	0	0	113.5	P370 I372 K449 L450 S451	P347-P370 CarbonylContact C-O 3.59Å; P347-P370 WeakPolarHBondContact CA-O 3.5Å; P347-P370 HydrophobicContact CB-CB 4.02Å; P347-P370 WeakPolarHBondContact CB-O 3.24Å; P347-I372 HydrophobicContact CB-CD1 4.06Å; P347-I372 HydrophobicContact CB-CG1 3.88Å; P347-I372 HydrophobicContact CG-CD1 3.49Å; P347-I372 VanDerWaalsContact CG-CD1 3.49Å; P347-I372 HydrophobicContact CG-CG1 3.88Å; P347-K449 WeakPolarHBondContact CD-O 3.42Å; P347-L450 CarbonylContact O-C 3.54Å; P347-L450 VanDerWaalsContact O-CA 3.27Å; P347-L450 WeakPolarHBondContact O-CA 3.34Å; P347-S451 PolarHBondContact O-N 3.14Å; P347-S451 PolarHBondContact O-OG 3.1Å
348	V	94.8	Very high	83.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	131.7	166.2	173.2	0	0	0	0	109.3	F332 L341 I350 I369 P370 I372 S451 A452 V454	F332-V348 HydrophobicContact CE2-CG1 3.88Å; F332-V348 HydrophobicContact CE2-CG2 4.37Å; F332-V348 HydrophobicContact CZ-CG1 4.15Å; L341-V348 HydrophobicContact CD1-CG2 4.33Å; L341-V348 HydrophobicContact CD2-CG2 4.44Å; V348-I350 HydrophobicContact CG1-CG1 4.14Å; V348-I369 HydrophobicContact CB-CG2 4.19Å; V348-I369 HydrophobicContact CG2-CG2 3.53Å; V348-P370 PolarHBondContact N-O 3.24Å; V348-I372 PolarHBondContact O-N 2.74Å; V348-S451 WeakPolarHBondContact CG2-OG 3.29Å; V348-A452 WeakPolarHBondContact CA-O 3.28Å; V348-A452 HydrophobicContact CG2-CB 4.29Å; V348-V454 HydrophobicContact CG1-CG2 3.78Å
349	L	97.3	Very high	83.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	125.8	170.4	-175	76.8	0	0	0	109.8	V351 I372 V374 V427 F430 C436 L438 L450 A452 A453 V454	L349-V351 HydrophobicContact CD2-CG2 3.75Å; L349-V351 HydrophobicContact CG-CG2 3.93Å; L349-I372 CarbonylContact C-O 3.48Å; L349-I372 WeakPolarHBondContact CA-O 3.38Å; L349-I372 HydrophobicContact CD1-CB 3.99Å; L349-I372 HydrophobicContact CD1-CG2 3.48Å; L349-I372 VanDerWaalsContact CD1-CG2 3.48Å; L349-V374 HydrophobicContact CD1-CB 4.4Å; L349-V374 HydrophobicContact CD1-CG2 3.49Å; L349-V374 VanDerWaalsContact CD1-CG2 3.49Å; L349-V427 HydrophobicContact CD2-CG2 3.97Å; L349-F430 HydrophobicContact CD2-CE1 3.7Å; L349-F430 HydrophobicContact CD2-CZ 4.24Å; L349-C436 HydrophobicContact CD2-CB 4.26Å; L349-L438 HydrophobicContact CD1-CD1 4.48Å; L349-L438 HydrophobicContact CD1-CD2 4.38Å; L349-L450 HydrophobicContact CB-CD1 3.64Å; L349-L450 HydrophobicContact CB-CD2 3.84Å; L349-L450 HydrophobicContact CB-CG 4.37Å; L349-L450 HydrophobicContact CD2-CD1 4.09Å; L349-L450 HydrophobicContact CG-CD1 4.41Å; L349-A452 PolarHBondContact N-O 3.39Å; L349-A453 HydrophobicContact CB-CB 4.06Å; L349-A453 HydrophobicContact CD2-CB 4.12Å; L349-A453 CarbonylContact O-C 3.46Å; L349-A453 WeakPolarHBondContact O-CA 3.41Å; L349-V454 PolarHBondContact O-N 2.97Å
350	I	98.2	Very high	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.1	172.1	-60.1	177.3	0	0	0	108.1	V348 A357 A360 V361 A364 V371 I372 H373 V374	V348-I350 HydrophobicContact CG1-CG1 4.14Å; I350-A357 HydrophobicContact CG2-CB 4.26Å; I350-A360 VanDerWaalsContact CD1-C 3.47Å; I350-A360 HydrophobicContact CD1-CB 3.88Å; I350-A360 HydrophobicContact CG1-CB 4.43Å; I350-A360 HydrophobicContact CG2-CB 4.08Å; I350-V361 HydrophobicContact CB-CG2 4.46Å; I350-V361 HydrophobicContact CD1-CB 4.29Å; I350-V361 HydrophobicContact CD1-CG2 3.77Å; I350-V361 HydrophobicContact CG2-CG2 4.21Å; I350-A364 HydrophobicContact CD1-CB 4.36Å; I350-V371 HydrophobicContact CD1-CG1 3.8Å; I350-V371 HydrophobicContact CD1-CG2 4.36Å; I350-V371 HydrophobicContact CG1-CG1 4.21Å; I350-I372 PolarHBondContact N-O 2.73Å; I350-H373 CarbonylContact O-C 3.58Å; I350-H373 WeakPolarHBondContact O-CA 3.02Å; I350-V374 PolarHBondContact O-N 2.8Å
351	V	98.3	Very high	86.5	Confident	8 Å²	8	34.5 Å²	34.5	5%	0.048	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.5	-176.7	-170.4	0	0	0	0	110.3	L315 L349 V374 V427 V454 V455 L456 I457	L315-V351 HydrophobicContact CD1-CG1 4.34Å; L315-V351 HydrophobicContact CD2-CG1 4.17Å; L349-V351 HydrophobicContact CD2-CG2 3.75Å; L349-V351 HydrophobicContact CG-CG2 3.93Å; V351-V374 WeakPolarHBondContact CA-O 3.43Å; V351-V427 HydrophobicContact CG1-CG2 4.41Å; V351-V427 HydrophobicContact CG2-CG2 3.78Å; V351-V454 PolarHBondContact N-O 3.15Å; V351-V455 HydrophobicContact CG2-CG2 4.39Å; V351-L456 CarbonylContact O-C 3.52Å; V351-L456 WeakPolarHBondContact O-CA 3.49Å; V351-L456 PolarHBondContact O-N 3.49Å; V351-I457 HydrophobicContact CG1-CG2 4.08Å
352	G	96.9	Very high	87.6	Confident	8 Å²	8	35 Å²	35	8%	0.082	21%	0.205	C	C	.	.			trans	135	165	178.4	0	0	0	0	0	112.2	H373 V374	G352-H373 PolarHBondContact O-NE2 3.34Å; G352-V374 PolarHBondContact N-O 2.82Å
353	S	94.4	Very high	89.4	Confident	21 Å²	21	32.5 Å²	32.5	15%	0.147	19%	0.188	C	C	.	.	S	Bend	trans	-132.3	22.1	178.6	67.2	0	0	0	0	112.7
354	G	93.6	Very high	91.1	Very high	31 Å²	31	29.9 Å²	29.9	32%	0.32	16%	0.162	S	C	.	.	S	Bend	trans	-94.2	-179	176.6	0	0	0	0	0	112.3	T356 A357 A358	G354-T356 PolarHBondContact O-N 2.84Å; G354-A357 PolarHBondContact O-N 3.01Å; G354-A358 PolarHBondContact O-N 3.13Å; G354-A358 VanDerWaalsContact O-N 3.1Å
355	L	91.9	Very high	92.7	Very high	36 Å²	36	20.5 Å²	20.5	19%	0.188	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-41.1	-180	-62.1	173.3	0	0	0	112	I185 A357 A358 D359 I385 F386 L389 Y397	I185-L355 HydrophobicContact CD1-CD1 3.72Å; I185-L355 HydrophobicContact CG1-CD1 3.78Å; I185-L355 HydrophobicContact CG2-CD1 4.49Å; L355-A357 VanDerWaalsContact C-N 3.29Å; L355-A357 PolarHBondContact O-N 2.83Å; L355-A358 CarbonylContact O-C 3.56Å; L355-A358 WeakPolarHBondContact O-CB 3.38Å; L355-A358 PolarHBondContact O-N 3.3Å; L355-A358 VanDerWaalsContact O-N 3.07Å; L355-D359 WeakPolarHBondContact O-CB 3.42Å; L355-D359 VanDerWaalsContact O-CG 3.29Å; L355-D359 PolarHBondContact O-N 2.87Å; L355-I385 HydrophobicContact CD1-CG1 3.99Å; L355-I385 HydrophobicContact CD2-CB 4.48Å; L355-I385 HydrophobicContact CD2-CG1 4.04Å; L355-I385 HydrophobicContact CD2-CG2 3.6Å; L355-I385 HydrophobicContact CG-CG1 3.99Å; L355-I385 HydrophobicContact CG-CG2 3.84Å; L355-F386 HydrophobicContact CD2-CE1 4.3Å; L355-L389 HydrophobicContact CD2-CD1 3.65Å; L355-Y397 HydrophobicContact CD2-CD1 4.07Å; L355-Y397 HydrophobicContact CD2-CD2 4.32Å; L355-Y397 HydrophobicContact CD2-CE1 4.19Å; L355-Y397 HydrophobicContact CD2-CE2 4.46Å; L355-Y397 HydrophobicContact CD2-CG 4.15Å
356	T	92.2	Very high	93.5	Very high	71 Å²	71	23.7 Å²	23.7	44%	0.436	14%	0.138	S	C	.	.	H	α-helix	trans	-61.8	-35.2	176.2	-45.1	0	0	0	0	112.7	M329 G354 D359 A360 L456	M329-T356 HydrophobicContact CG-CG2 3.66Å; G354-T356 PolarHBondContact O-N 2.84Å; T356-D359 WeakPolarHBondContact O-CB 3.38Å; T356-A360 PolarHBondContact O-N 3.47Å; T356-L456 HydrophobicContact CG2-CB 4.48Å; T356-L456 HydrophobicContact CG2-CD1 4.23Å; T356-L456 HydrophobicContact CG2-CD2 3.99Å; T356-L456 HydrophobicContact CG2-CG 4.46Å; T356-L456 WeakPolarHBondContact O-CD1 3.25Å
357	A	95.3	Very high	93.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-69	-40.4	174	0	0	0	0	0	111.3	I350 G354 L355 D359 A360 V361 L456	I350-A357 HydrophobicContact CG2-CB 4.26Å; G354-A357 PolarHBondContact O-N 3.01Å; L355-A357 VanDerWaalsContact C-N 3.29Å; L355-A357 PolarHBondContact O-N 2.83Å; A357-D359 VanDerWaalsContact C-N 3.33Å; A357-D359 PolarHBondContact O-N 3.27Å; A357-A360 WeakPolarHBondContact O-CB 3.46Å; A357-A360 PolarHBondContact O-N 2.85Å; A357-V361 WeakPolarHBondContact O-CG2 3.36Å; A357-V361 PolarHBondContact O-N 2.95Å; A357-L456 HydrophobicContact CB-CB 4.18Å
358	A	95.1	Very high	93.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-38.7	174.7	0	0	0	0	0	112.6	G354 L355 V361 L362 F386 Y397 V400	G354-A358 PolarHBondContact O-N 3.13Å; G354-A358 VanDerWaalsContact O-N 3.1Å; L355-A358 CarbonylContact O-C 3.56Å; L355-A358 WeakPolarHBondContact O-CB 3.38Å; L355-A358 PolarHBondContact O-N 3.3Å; L355-A358 VanDerWaalsContact O-N 3.07Å; A358-V361 WeakPolarHBondContact O-CB 3.19Å; A358-V361 PolarHBondContact O-N 3.02Å; A358-L362 WeakPolarHBondContact O-CG 3.43Å; A358-L362 PolarHBondContact O-N 3.19Å; A358-F386 HydrophobicContact CB-CE1 3.57Å; A358-F386 HydrophobicContact CB-CZ 3.78Å; A358-Y397 HydrophobicContact CB-CD1 3.84Å; A358-Y397 HydrophobicContact CB-CE1 4.13Å; A358-V400 HydrophobicContact CB-CB 4.22Å; A358-V400 HydrophobicContact CB-CG1 3.88Å; A358-V400 HydrophobicContact CB-CG2 4.18Å
359	D	93.5	Very high	93.2	Very high	24 Å²	24	29.6 Å²	29.6	13%	0.128	17%	0.168	C	C	.	.	H	α-helix	trans	-56.4	-50.4	170.6	-78.3	-17.7	0	0	0	110.6	M182 L355 T356 A357 V361 L362 C363 Y397	M182-D359 HydrophobicContact CE-CB 3.65Å; M182-D359 WeakPolarHBondContact CE-O 3.18Å; M182-D359 HydrophobicContact SD-CB 3.3Å; M182-D359 WeakPolarHBondContact SD-CB 3.29Å; L355-D359 WeakPolarHBondContact O-CB 3.42Å; L355-D359 VanDerWaalsContact O-CG 3.29Å; L355-D359 PolarHBondContact O-N 2.87Å; T356-D359 WeakPolarHBondContact O-CB 3.38Å; A357-D359 VanDerWaalsContact C-N 3.33Å; A357-D359 PolarHBondContact O-N 3.27Å; D359-V361 VanDerWaalsContact C-N 3.3Å; D359-V361 PolarHBondContact O-N 3.36Å; D359-L362 PolarHBondContact O-N 3.08Å; D359-L362 VanDerWaalsContact O-N 3.16Å; D359-C363 WeakPolarHBondContact O-CB 3.49Å; D359-C363 PolarHBondContact O-N 3.07Å; D359-Y397 WeakPolarHBondContact OD1-CE1 3.21Å; D359-Y397 PolarHBondContact OD1-OH 2.76Å
360	A	94.6	Very high	93	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.7	-40.2	175.1	0	0	0	0	0	112.8	M329 F332 I350 T356 A357 C363 A364 L456	M329-A360 HydrophobicContact SD-CB 3.64Å; F332-A360 HydrophobicContact CD1-CB 4.31Å; F332-A360 HydrophobicContact CE1-CB 4.2Å; I350-A360 VanDerWaalsContact CD1-C 3.47Å; I350-A360 HydrophobicContact CD1-CB 3.88Å; I350-A360 HydrophobicContact CG1-CB 4.43Å; I350-A360 HydrophobicContact CG2-CB 4.08Å; T356-A360 PolarHBondContact O-N 3.47Å; A357-A360 WeakPolarHBondContact O-CB 3.46Å; A357-A360 PolarHBondContact O-N 2.85Å; A360-C363 PolarHBondContact O-N 3.19Å; A360-A364 WeakPolarHBondContact O-CB 3.47Å; A360-A364 PolarHBondContact O-N 3.36Å; A360-L456 HydrophobicContact CB-CD1 3.37Å
361	V	95.3	Very high	92.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-48.3	175.5	170.5	0	0	0	0	110.2	I350 A357 A358 D359 C363 A364 Y365 V371 H373 V400 M403 Y419	I350-V361 HydrophobicContact CB-CG2 4.46Å; I350-V361 HydrophobicContact CD1-CB 4.29Å; I350-V361 HydrophobicContact CD1-CG2 3.77Å; I350-V361 HydrophobicContact CG2-CG2 4.21Å; A357-V361 WeakPolarHBondContact O-CG2 3.36Å; A357-V361 PolarHBondContact O-N 2.95Å; A358-V361 WeakPolarHBondContact O-CB 3.19Å; A358-V361 PolarHBondContact O-N 3.02Å; D359-V361 VanDerWaalsContact C-N 3.3Å; D359-V361 PolarHBondContact O-N 3.36Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 2.85Å; V361-A364 PolarHBondContact O-N 3.36Å; V361-Y365 WeakPolarHBondContact O-CB 3.28Å; V361-Y365 PolarHBondContact O-N 2.9Å; V361-V371 HydrophobicContact CG2-CG1 4.3Å; V361-H373 HydrophobicContact CG2-CB 4.47Å; V361-V400 HydrophobicContact CB-CG1 4.41Å; V361-V400 HydrophobicContact CG1-CG1 4.24Å; V361-V400 HydrophobicContact CG1-CG2 4.27Å; V361-M403 HydrophobicContact CG1-CE 3.93Å; V361-Y419 HydrophobicContact CG1-CD2 3.84Å; V361-Y419 HydrophobicContact CG1-CE2 3.65Å; V361-Y419 HydrophobicContact CG2-CE2 4.21Å
362	L	93.2	Very high	92.7	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-41.2	177.9	-69.5	169.9	0	0	0	111.7	A358 D359 Y365 N366 E396 V400	A358-L362 WeakPolarHBondContact O-CG 3.43Å; A358-L362 PolarHBondContact O-N 3.19Å; D359-L362 PolarHBondContact O-N 3.08Å; D359-L362 VanDerWaalsContact O-N 3.16Å; L362-Y365 PolarHBondContact O-N 2.77Å; L362-N366 VanDerWaalsContact O-CB 3.27Å; L362-N366 WeakPolarHBondContact O-CB 3.27Å; L362-N366 PolarHBondContact O-N 3.18Å; L362-N366 PolarHBondContact O-ND2 3.41Å; L362-E396 HydrophobicContact CD1-CB 3.91Å; L362-E396 HydrophobicContact CD1-CG 4.01Å; L362-V400 HydrophobicContact CD1-CG2 4.11Å; L362-V400 HydrophobicContact CD2-CG2 3.67Å; L362-V400 HydrophobicContact CG-CG2 3.6Å
363	C	91.5	Very high	92.8	Very high	10 Å²	10	31 Å²	31	7%	0.068	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-49.4	177.7	-173	0	0	0	0	111.7	M182 M329 F332 I336 D359 A360 V361 N367	M182-C363 HydrophobicContact CE-CB 3.73Å; M329-C363 HydrophobicContact CE-CB 4.26Å; F332-C363 HydrophobicContact CE1-CB 4.24Å; I336-C363 VanDerWaalsContact CD1-SG 3.53Å; D359-C363 WeakPolarHBondContact O-CB 3.49Å; D359-C363 PolarHBondContact O-N 3.07Å; A360-C363 PolarHBondContact O-N 3.19Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 2.85Å; C363-N367 PolarHBondContact O-N 2.85Å; C363-N367 PolarHBondContact O-ND2 2.84Å
364	A	91.7	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-48.3	177.1	0	0	0	0	0	111.5	F332 I350 A360 V361 N366 N367 N368 I369 V371	F332-A364 HydrophobicContact CE1-CB 4.48Å; F332-A364 HydrophobicContact CZ-CB 4.06Å; I350-A364 HydrophobicContact CD1-CB 4.36Å; A360-A364 WeakPolarHBondContact O-CB 3.47Å; A360-A364 PolarHBondContact O-N 3.36Å; V361-A364 PolarHBondContact O-N 3.36Å; A364-N366 PolarHBondContact O-N 3.17Å; A364-N367 CarbonylContact O-C 3.55Å; A364-N367 PolarHBondContact O-N 3.46Å; A364-N367 VanDerWaalsContact O-N 3.08Å; A364-N368 PolarHBondContact O-N 3.2Å; A364-I369 HydrophobicContact CB-CB 4.23Å; A364-I369 PolarHBondContact O-N 3.23Å; A364-V371 HydrophobicContact CB-CG2 3.52Å
365	Y	89.6	Confident	93.1	Very high	73 Å²	73	28.7 Å²	28.7	29%	0.286	15%	0.154	S	C	.	.	H	α-helix	trans	-60.7	-44	-178.6	-170.4	-90.9	0	0	0	112.1	V361 L362 N367 N368 M403 D418	V361-Y365 WeakPolarHBondContact O-CB 3.28Å; V361-Y365 PolarHBondContact O-N 2.9Å; L362-Y365 PolarHBondContact O-N 2.77Å; Y365-N367 PolarHBondContact O-N 3.21Å; Y365-N368 PolarHBondContact O-N 3.21Å; Y365-N368 VanDerWaalsContact O-N 3.07Å; Y365-M403 HydrophobicContact CD2-SD 4.43Å; Y365-M403 HydrophobicContact CE2-SD 4.19Å; Y365-D418 HydrophobicContact CE2-CB 4.37Å
366	N	88.6	Confident	93.2	Very high	112 Å²	112	34.6 Å²	34.6	60%	0.599	17%	0.173	S	C	*	.	H	α-helix	trans	-67.9	-19.1	178.2	-69.4	-15.4	0	0	0	113.3	L362 A364	L362-N366 VanDerWaalsContact O-CB 3.27Å; L362-N366 WeakPolarHBondContact O-CB 3.27Å; L362-N366 PolarHBondContact O-N 3.18Å; L362-N366 PolarHBondContact O-ND2 3.41Å; A364-N366 PolarHBondContact O-N 3.17Å
367	N	88	Confident	93.2	Very high	71 Å²	71	36.3 Å²	36.3	38%	0.38	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	10.2	174.6	-75.7	-82.2	0	0	0	113	I336 C363 A364 Y365 I369	I336-N367 HydrophobicContact CG2-CB 4.24Å; C363-N367 PolarHBondContact O-N 2.85Å; C363-N367 PolarHBondContact O-ND2 2.84Å; A364-N367 CarbonylContact O-C 3.55Å; A364-N367 PolarHBondContact O-N 3.46Å; A364-N367 VanDerWaalsContact O-N 3.08Å; Y365-N367 PolarHBondContact O-N 3.21Å; N367-I369 VanDerWaalsContact C-N 3.3Å; N367-I369 HydrophobicContact CB-CD1 3.97Å; N367-I369 HydrophobicContact CB-CG1 4.08Å; N367-I369 PolarHBondContact O-N 2.89Å
368	N	88.4	Confident	93.1	Very high	136 Å²	136	43.4 Å²	43.4	73%	0.727	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	40	-177.2	-51	-68.1	0	0	0	113.2	A364 Y365	A364-N368 PolarHBondContact O-N 3.2Å; Y365-N368 PolarHBondContact O-N 3.21Å; Y365-N368 VanDerWaalsContact O-N 3.07Å
369	I	90.5	Very high	92.9	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	20%	0.203	C	C	.	.			trans	-101.2	122.4	176.6	-57.4	173.6	0	0	0	108.2	I336 L341 V348 A364 N367 V371	I336-I369 HydrophobicContact CD1-CD1 4.19Å; I336-I369 HydrophobicContact CG1-CD1 3.93Å; I336-I369 HydrophobicContact CG2-CD1 4.36Å; L341-I369 HydrophobicContact CB-CD1 3.94Å; V348-I369 HydrophobicContact CB-CG2 4.19Å; V348-I369 HydrophobicContact CG2-CG2 3.53Å; A364-I369 HydrophobicContact CB-CB 4.23Å; A364-I369 PolarHBondContact O-N 3.23Å; N367-I369 VanDerWaalsContact C-N 3.3Å; N367-I369 HydrophobicContact CB-CD1 3.97Å; N367-I369 HydrophobicContact CB-CG1 4.08Å; N367-I369 PolarHBondContact O-N 2.89Å; I369-V371 WeakPolarHBondContact O-CG2 3.2Å
370	P	92.5	Very high	92.7	Very high	36 Å²	36	48.1 Å²	48.1	23%	0.234	23%	0.228	C	C	.	.			trans	-60.5	138.9	177.7	-23.9	34.1	0	0	0	112.2	P347 V348 D418	P347-P370 CarbonylContact C-O 3.59Å; P347-P370 WeakPolarHBondContact CA-O 3.5Å; P347-P370 HydrophobicContact CB-CB 4.02Å; P347-P370 WeakPolarHBondContact CB-O 3.24Å; V348-P370 PolarHBondContact N-O 3.24Å; P370-D418 CarbonylContact C-O 3.49Å; P370-D418 WeakPolarHBondContact CA-O 3.24Å
371	V	94.8	Very high	92.5	Very high	3 Å²	3	50 Å²	50	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.6	-173.2	178.6	0	0	0	0	112.4	I350 V361 A364 I369 H373 D418 Y419 T420	I350-V371 HydrophobicContact CD1-CG1 3.8Å; I350-V371 HydrophobicContact CD1-CG2 4.36Å; I350-V371 HydrophobicContact CG1-CG1 4.21Å; V361-V371 HydrophobicContact CG2-CG1 4.3Å; A364-V371 HydrophobicContact CB-CG2 3.52Å; I369-V371 WeakPolarHBondContact O-CG2 3.2Å; V371-H373 HydrophobicContact CG1-CB 4.12Å; V371-D418 PolarHBondContact N-O 3.38Å; V371-Y419 HydrophobicContact CB-CD2 3.92Å; V371-Y419 HydrophobicContact CG1-CD2 3.86Å; V371-Y419 HydrophobicContact CG1-CE2 4.17Å; V371-Y419 CarbonylContact O-C 3.58Å; V371-Y419 WeakPolarHBondContact O-CA 2.95Å; V371-T420 PolarHBondContact O-N 3.29Å
372	I	96.2	Very high	92	Very high	6 Å²	6	55 Å²	55	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.6	160.5	-65.2	175.7	0	0	0	107.6	P347 V348 L349 I350 V374 F422 L438 F448 L450	P347-I372 HydrophobicContact CB-CD1 4.06Å; P347-I372 HydrophobicContact CB-CG1 3.88Å; P347-I372 HydrophobicContact CG-CD1 3.49Å; P347-I372 VanDerWaalsContact CG-CD1 3.49Å; P347-I372 HydrophobicContact CG-CG1 3.88Å; V348-I372 PolarHBondContact O-N 2.74Å; L349-I372 CarbonylContact C-O 3.48Å; L349-I372 WeakPolarHBondContact CA-O 3.38Å; L349-I372 HydrophobicContact CD1-CB 3.99Å; L349-I372 HydrophobicContact CD1-CG2 3.48Å; L349-I372 VanDerWaalsContact CD1-CG2 3.48Å; I350-I372 PolarHBondContact N-O 2.73Å; I372-V374 HydrophobicContact CG2-CG2 4Å; I372-F422 HydrophobicContact CG2-CD2 3.66Å; I372-F422 HydrophobicContact CG2-CE2 3.64Å; I372-L438 HydrophobicContact CG2-CD1 4.31Å; I372-F448 HydrophobicContact CD1-CB 3.88Å; I372-F448 HydrophobicContact CD1-CD1 3.73Å; I372-F448 HydrophobicContact CD1-CG 3.89Å; I372-L450 HydrophobicContact CD1-CD2 4.09Å
373	H	97.6	Very high	91.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	110.3	-177.6	-175.9	-165.5	0	0	0	111.2	I350 G352 V361 V371 F375 Y419 T420 S421 F422	I350-H373 CarbonylContact O-C 3.58Å; I350-H373 WeakPolarHBondContact O-CA 3.02Å; G352-H373 PolarHBondContact O-NE2 3.34Å; V361-H373 HydrophobicContact CG2-CB 4.47Å; V371-H373 HydrophobicContact CG1-CB 4.12Å; H373-F375 AromaticContact CD2-CD1 3.92Å; H373-F375 AromaticContact NE2-CD1 3.85Å; H373-Y419 HydrophobicContact CB-CD2 4.49Å; H373-Y419 HydrophobicContact CB-CE2 3.55Å; H373-Y419 AromaticContact ND1-CE2 3.71Å; H373-Y419 AromaticContact ND1-CZ 3.65Å; H373-Y419 PolarHBondContact ND1-OH 3.01Å; H373-T420 PolarHBondContact N-O 3.34Å; H373-S421 CarbonylContact O-C 3.59Å; H373-S421 WeakPolarHBondContact O-CA 3.23Å; H373-F422 PolarHBondContact O-N 3.01Å
374	V	97.6	Very high	91.6	Very high	1 Å²	1	56 Å²	56	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.6	-175.1	178.3	0	0	0	0	111.3	L349 I350 V351 G352 I372 F422 H425 L438	L349-V374 HydrophobicContact CD1-CB 4.4Å; L349-V374 HydrophobicContact CD1-CG2 3.49Å; L349-V374 VanDerWaalsContact CD1-CG2 3.49Å; I350-V374 PolarHBondContact O-N 2.8Å; V351-V374 WeakPolarHBondContact CA-O 3.43Å; G352-V374 PolarHBondContact N-O 2.82Å; I372-V374 HydrophobicContact CG2-CG2 4Å; V374-F422 HydrophobicContact CG2-CB 3.96Å; V374-F422 HydrophobicContact CG2-CG 4.42Å; V374-H425 HydrophobicContact CG1-CB 3.96Å; V374-H425 WeakPolarHBondContact CG1-O 3.49Å; V374-L438 HydrophobicContact CG1-CD2 4.39Å; V374-L438 HydrophobicContact CG2-CD1 3.51Å; V374-L438 HydrophobicContact CG2-CD2 3.95Å; V374-L438 HydrophobicContact CG2-CG 4.4Å
375	F	96.4	Very high	91.4	Very high	3 Å²	3	58.3 Å²	58.3	1%	0.013	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	148.9	174.2	48.2	-83.8	0	0	0	112.3	H373 R377 V379 M404 F422 P423 E424 H425	H373-F375 AromaticContact CD2-CD1 3.92Å; H373-F375 AromaticContact NE2-CD1 3.85Å; F375-R377 VanDerWaalsContact C-N 3.34Å; F375-R377 WeakPolarHBondContact CD2-O 3.49Å; F375-R377 WeakPolarHBondContact CE2-O 3.31Å; F375-R377 PolarHBondContact O-N 3.19Å; F375-V379 HydrophobicContact CE2-CG2 3.94Å; F375-V379 HydrophobicContact CZ-CG2 3.89Å; F375-M404 HydrophobicContact CD1-CE 4.09Å; F375-M404 HydrophobicContact CD2-CE 4.18Å; F375-M404 HydrophobicContact CE1-CE 3.66Å; F375-M404 HydrophobicContact CE1-CG 4.31Å; F375-M404 HydrophobicContact CE2-CE 3.73Å; F375-M404 HydrophobicContact CG-CE 4.36Å; F375-M404 HydrophobicContact CZ-CB 4.4Å; F375-M404 HydrophobicContact CZ-CE 3.47Å; F375-M404 VanDerWaalsContact CZ-CE 3.47Å; F375-M404 HydrophobicContact CZ-CG 4.43Å; F375-F422 PolarHBondContact N-O 3.36Å; F375-P423 HydrophobicContact CD2-CB 4.3Å; F375-P423 HydrophobicContact CE2-CB 3.47Å; F375-P423 VanDerWaalsContact CE2-CB 3.47Å; F375-P423 HydrophobicContact CZ-CB 3.7Å; F375-P423 CarbonylContact O-C 3.47Å; F375-E424 PolarHBondContact O-N 2.95Å; F375-H425 CarbonylContact C-O 3.51Å; F375-H425 PolarHBondContact O-N 2.95Å
376	R	94.3	Very high	91.4	Very high	160 Å²	160	54.9 Å²	54.9	60%	0.604	28%	0.278	S	S	*	.	S	Bend	trans	-75.6	-21.8	-174.9	-61.3	-180	-174.3	173.8	0.4	113.4
377	R	92.9	Very high	91.2	Very high	107 Å²	107	53.6 Å²	53.6	40%	0.404	27%	0.267	S	S	.	.	S	Bend	trans	-84.4	158.3	-176.4	-67.1	-176	179.7	178.4	0.1	111.6	F375 D381 S383 L384 E424	F375-R377 VanDerWaalsContact C-N 3.34Å; F375-R377 WeakPolarHBondContact CD2-O 3.49Å; F375-R377 WeakPolarHBondContact CE2-O 3.31Å; F375-R377 PolarHBondContact O-N 3.19Å; R377-D381 HydrophobicContact CB-CB 4.38Å; R377-D381 WeakPolarHBondContact CD-OD2 3.41Å; R377-S383 VanDerWaalsContact CZ-OG 3.31Å; R377-S383 PolarHBondContact NH1-O 3.2Å; R377-S383 PolarHBondContact NH1-OG 2.93Å; R377-L384 HydrophobicContact CB-CD2 4.36Å; R377-E424 PolarHBondContact O-N 3.07Å
378	R	92.8	Very high	91.1	Very high	148 Å²	148	56 Å²	56	56%	0.558	28%	0.276	S	S	*	.			trans	-72.4	146.2	165.4	-74.8	-177.6	-73.9	179.3	-0.8	109.9	T380 D381 E424	R378-T380 PolarHBondContact O-N 2.97Å; R378-D381 HydrophobicContact CB-CB 4.48Å; R378-D381 WeakPolarHBondContact O-CB 3.2Å; R378-D381 PolarHBondContact O-N 2.8Å; R378-E424 HydrophobicContact CB-CG 4.42Å; R378-E424 VanDerWaalsContact CD-OE1 3.25Å; R378-E424 WeakPolarHBondContact CD-OE1 3.32Å; R378-E424 HydrophobicContact CG-CG 3.42Å; R378-E424 VanDerWaalsContact CG-CG 3.42Å; R378-E424 WeakPolarHBondContact CG-OE1 3.26Å; R378-E424 WeakPolarHBondContact CG-OE2 3.44Å; R378-E424 IonicContact NE-OE1 2.62Å
379	V	90.7	Very high	91.1	Very high	17 Å²	17	50.5 Å²	50.5	10%	0.103	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.6	174.9	-167.2	0	0	0	0	111.5	F375 D381 L384 Y401 M404 C405 P423	F375-V379 HydrophobicContact CE2-CG2 3.94Å; F375-V379 HydrophobicContact CZ-CG2 3.89Å; V379-D381 VanDerWaalsContact C-N 3.28Å; V379-D381 PolarHBondContact O-N 2.96Å; V379-L384 WeakPolarHBondContact O-CD1 3.2Å; V379-Y401 HydrophobicContact CG1-CE2 3.94Å; V379-Y401 PolarHBondContact O-OH 3.24Å; V379-M404 HydrophobicContact CG1-CB 4.25Å; V379-C405 HydrophobicContact CG1-CB 4.33Å; V379-C405 WeakPolarHBondContact CG1-SG 3.35Å; V379-P423 HydrophobicContact CG2-CB 3.66Å; V379-P423 HydrophobicContact CG2-CG 4Å
380	T	89.4	Confident	91	Very high	107 Å²	107	53.8 Å²	53.8	66%	0.656	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-1	177.3	53.8	0	0	0	0	114	R378 K387	R378-T380 PolarHBondContact O-N 2.97Å; T380-K387 PolarHBondContact O-NZ 3.17Å
381	D	89.7	Confident	90.8	Very high	40 Å²	40	58.4 Å²	58.4	21%	0.214	29%	0.286	C	S	.	.			trans	-60.4	127.5	179.2	-173	-29.4	0	0	0	111	R377 R378 V379 S383 L384 K387	R377-D381 HydrophobicContact CB-CB 4.38Å; R377-D381 WeakPolarHBondContact CD-OD2 3.41Å; R378-D381 HydrophobicContact CB-CB 4.48Å; R378-D381 WeakPolarHBondContact O-CB 3.2Å; R378-D381 PolarHBondContact O-N 2.8Å; V379-D381 VanDerWaalsContact C-N 3.28Å; V379-D381 PolarHBondContact O-N 2.96Å; D381-S383 PolarHBondContact O-N 3.43Å; D381-S383 WeakPolarHBondContact OD1-CA 3.39Å; D381-S383 VanDerWaalsContact OD1-CB 3.23Å; D381-S383 WeakPolarHBondContact OD1-CB 3.47Å; D381-S383 PolarHBondContact OD1-N 3.01Å; D381-S383 PolarHBondContact OD1-OG 3.43Å; D381-S383 PolarHBondContact OD2-OG 3.33Å; D381-L384 HydrophobicContact CB-CG 4.25Å; D381-L384 PolarHBondContact O-N 2.94Å; D381-K387 PolarHBondContact O-NZ 2.87Å
382	P	85.9	Confident	90.5	Very high	104 Å²	104	67.9 Å²	67.9	68%	0.675	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.6	179.1	28.4	-35.3	0	0	0	113.3	L384	P382-L384 PolarHBondContact O-N 3.24Å
383	S	86.1	Confident	90	Very high	49 Å²	49	70.9 Å²	70.9	34%	0.343	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.8	179.4	73.9	0	0	0	0	114	R377 D381 I385	R377-S383 VanDerWaalsContact CZ-OG 3.31Å; R377-S383 PolarHBondContact NH1-O 3.2Å; R377-S383 PolarHBondContact NH1-OG 2.93Å; D381-S383 PolarHBondContact O-N 3.43Å; D381-S383 WeakPolarHBondContact OD1-CA 3.39Å; D381-S383 VanDerWaalsContact OD1-CB 3.23Å; D381-S383 WeakPolarHBondContact OD1-CB 3.47Å; D381-S383 PolarHBondContact OD1-N 3.01Å; D381-S383 PolarHBondContact OD1-OG 3.43Å; D381-S383 PolarHBondContact OD2-OG 3.33Å; S383-I385 PolarHBondContact O-N 3.04Å
384	L	89.9	Confident	89.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.346	C	S	.	.			trans	-68.5	127.1	172.5	-73.1	177.9	0	0	0	110.5	R377 V379 D381 P382 F386 K387 Y401	R377-L384 HydrophobicContact CB-CD2 4.36Å; V379-L384 WeakPolarHBondContact O-CD1 3.2Å; D381-L384 HydrophobicContact CB-CG 4.25Å; D381-L384 PolarHBondContact O-N 2.94Å; P382-L384 PolarHBondContact O-N 3.24Å; L384-F386 HydrophobicContact CB-CD2 4.29Å; L384-F386 PolarHBondContact O-N 3.05Å; L384-F386 VanDerWaalsContact O-N 3.13Å; L384-K387 PolarHBondContact O-N 3.16Å; L384-Y401 HydrophobicContact CD1-CE2 4.23Å
385	I	88.1	Confident	89.5	Confident	48 Å²	48	75.1 Å²	75.1	25%	0.246	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-59.3	-29	-175.4	-168.4	62.6	0	0	0	113.1	L355 S383 K387 Q388 L389	L355-I385 HydrophobicContact CD1-CG1 3.99Å; L355-I385 HydrophobicContact CD2-CB 4.48Å; L355-I385 HydrophobicContact CD2-CG1 4.04Å; L355-I385 HydrophobicContact CD2-CG2 3.6Å; L355-I385 HydrophobicContact CG-CG1 3.99Å; L355-I385 HydrophobicContact CG-CG2 3.84Å; S383-I385 PolarHBondContact O-N 3.04Å; I385-K387 PolarHBondContact O-N 2.87Å; I385-Q388 HydrophobicContact CD1-CB 4.42Å; I385-Q388 WeakPolarHBondContact O-CB 3.4Å; I385-Q388 PolarHBondContact O-N 2.87Å; I385-L389 PolarHBondContact O-N 3.22Å
386	F	89.4	Confident	89.3	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-59.3	-30	-178.8	-51.8	-64.7	0	0	0	113.7	L355 A358 L384 Q388 Y397 H398 Y401 M404	L355-F386 HydrophobicContact CD2-CE1 4.3Å; A358-F386 HydrophobicContact CB-CE1 3.57Å; A358-F386 HydrophobicContact CB-CZ 3.78Å; L384-F386 HydrophobicContact CB-CD2 4.29Å; L384-F386 PolarHBondContact O-N 3.05Å; L384-F386 VanDerWaalsContact O-N 3.13Å; F386-Q388 VanDerWaalsContact C-N 3.31Å; F386-Y397 HydrophobicContact CE1-CD1 4.46Å; F386-H398 PolarHBondContact O-NE2 2.56Å; F386-Y401 HydrophobicContact CB-CD2 3.75Å; F386-Y401 HydrophobicContact CB-CG 3.75Å; F386-Y401 AromaticContact CD2-CD2 3.87Å; F386-Y401 HydrophobicContact CD2-CD2 3.87Å; F386-Y401 HydrophobicContact CD2-CG 4.49Å; F386-Y401 HydrophobicContact CG-CD2 4.07Å; F386-Y401 HydrophobicContact CG-CG 4.27Å; F386-M404 HydrophobicContact CD2-CE 4.49Å; F386-M404 HydrophobicContact CD2-SD 4.07Å; F386-M404 HydrophobicContact CE2-CE 4.01Å; F386-M404 HydrophobicContact CE2-SD 3.62Å; F386-M404 HydrophobicContact CZ-SD 4.19Å
387	K	83.6	Confident	89.3	Confident	86 Å²	86	69.6 Å²	69.6	37%	0.374	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-77.7	-19.1	177.4	-66.3	178.3	178.1	170.8	0	113.3	T380 D381 L384 I385 Y401	T380-K387 PolarHBondContact O-NZ 3.17Å; D381-K387 PolarHBondContact O-NZ 2.87Å; L384-K387 PolarHBondContact O-N 3.16Å; I385-K387 PolarHBondContact O-N 2.87Å; K387-Y401 WeakPolarHBondContact CE-OH 3.47Å
388	Q	86.2	Confident	89.4	Confident	122 Å²	122	66.2 Å²	66.2	57%	0.57	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-10.3	-178.1	-56.6	175.1	15.8	0	0	111.8	I385 F386	I385-Q388 HydrophobicContact CD1-CB 4.42Å; I385-Q388 WeakPolarHBondContact O-CB 3.4Å; I385-Q388 PolarHBondContact O-N 2.87Å; F386-Q388 VanDerWaalsContact C-N 3.31Å
389	L	87.9	Confident	89.4	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	33%	0.331	C	S	.	.	S	Bend	trans	-96.2	126.7	179.8	-66.9	-178.9	0	0	0	110.7	I185 L355 I385 Q391 Y394 Y397 H398	I185-L389 HydrophobicContact CG2-CD2 4.48Å; L355-L389 HydrophobicContact CD2-CD1 3.65Å; I385-L389 PolarHBondContact O-N 3.22Å; L389-Q391 PolarHBondContact O-N 3.47Å; L389-Y394 HydrophobicContact CB-CD2 3.7Å; L389-Y394 HydrophobicContact CB-CE2 4.41Å; L389-Y394 HydrophobicContact CB-CG 4.06Å; L389-Y394 HydrophobicContact CD1-CG 4.25Å; L389-Y394 HydrophobicContact CD2-CD2 3.95Å; L389-Y394 HydrophobicContact CD2-CE2 3.89Å; L389-Y394 HydrophobicContact CD2-CG 4.36Å; L389-Y394 HydrophobicContact CG-CD2 4.27Å; L389-Y394 HydrophobicContact CG-CG 4.46Å; L389-Y397 HydrophobicContact CD1-CD2 3.88Å; L389-Y397 HydrophobicContact CD1-CG 4.24Å; L389-H398 PolarHBondContact O-NE2 2.94Å
390	P	88.7	Confident	89.6	Confident	72 Å²	72	62.8 Å²	62.8	47%	0.468	33%	0.326	S	S	.	.			trans	-61.8	125.8	173.5	-25.7	34.3	0	0	0	113.1	K392 L393 Y394	P390-K392 VanDerWaalsContact C-N 3.28Å; P390-K392 PolarHBondContact O-N 3Å; P390-L393 HydrophobicContact CB-CB 4.48Å; P390-L393 HydrophobicContact CB-CD1 4.25Å; P390-L393 HydrophobicContact CB-CG 4.47Å; P390-L393 HydrophobicContact CG-CD1 4.3Å; P390-L393 PolarHBondContact O-N 3.34Å; P390-Y394 WeakPolarHBondContact O-CD2 3.31Å; P390-Y394 PolarHBondContact O-N 3.4Å
391	Q	89.3	Confident	89.8	Confident	133 Å²	133	59.8 Å²	59.8	62%	0.621	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-37.8	-176.3	-175.2	177.1	7.4	0	0	113.9	L389 L393 Y394 P395 H398	L389-Q391 PolarHBondContact O-N 3.47Å; Q391-L393 VanDerWaalsContact C-N 3.27Å; Q391-L393 PolarHBondContact O-N 3.34Å; Q391-Y394 CarbonylContact O-C 3.53Å; Q391-Y394 PolarHBondContact O-N 3.28Å; Q391-P395 WeakPolarHBondContact O-CA 3.25Å; Q391-P395 WeakPolarHBondContact O-CD 3.49Å; Q391-P395 VanDerWaalsContact O-N 3.16Å; Q391-H398 VanDerWaalsContact CA-CD2 3.44Å; Q391-H398 WeakPolarHBondContact CA-CD2 3.37Å; Q391-H398 WeakPolarHBondContact CA-NE2 3.47Å; Q391-H398 HydrophobicContact CG-CB 4Å; Q391-H398 PolarHBondContact N-NE2 3.09Å
392	K	88.4	Confident	90	Very high	203 Å²	203	63.6 Å²	63.6	88%	0.883	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.2	179.3	-173.6	178.5	178.1	-176.5	0	112.6	P390	P390-K392 VanDerWaalsContact C-N 3.28Å; P390-K392 PolarHBondContact O-N 3Å
393	L	86	Confident	90.4	Very high	69 Å²	69	59 Å²	59	36%	0.361	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-31.4	-178.5	-68.3	174.8	0	0	0	112.2	F187 R213 P390 Q391 P395	F187-L393 HydrophobicContact CE1-CD1 4.39Å; F187-L393 HydrophobicContact CE1-CD2 4.3Å; F187-L393 HydrophobicContact CZ-CD1 3.9Å; F187-L393 HydrophobicContact CZ-CD2 4.28Å; R213-L393 VanDerWaalsContact CZ-O 3.25Å; R213-L393 PolarHBondContact NE-O 3.32Å; R213-L393 PolarHBondContact NH2-O 2.72Å; P390-L393 HydrophobicContact CB-CB 4.48Å; P390-L393 HydrophobicContact CB-CD1 4.25Å; P390-L393 HydrophobicContact CB-CG 4.47Å; P390-L393 HydrophobicContact CG-CD1 4.3Å; P390-L393 PolarHBondContact O-N 3.34Å; Q391-L393 VanDerWaalsContact C-N 3.27Å; Q391-L393 PolarHBondContact O-N 3.34Å; L393-P395 WeakPolarHBondContact O-CD 3.4Å
394	Y	91.9	Very high	90.8	Very high	15 Å²	15	56.6 Å²	56.6	6%	0.059	27%	0.272	C	S	.	.			trans	-127.2	51.2	-170.9	-57.7	-73.1	0	0	0	113.1	I185 L389 P390 Q391 E396 Y397 H398	I185-Y394 HydrophobicContact CG2-CE1 4.16Å; I185-Y394 WeakPolarHBondContact O-CE1 3.38Å; I185-Y394 PolarHBondContact O-OH 3.04Å; L389-Y394 HydrophobicContact CB-CD2 3.7Å; L389-Y394 HydrophobicContact CB-CE2 4.41Å; L389-Y394 HydrophobicContact CB-CG 4.06Å; L389-Y394 HydrophobicContact CD1-CG 4.25Å; L389-Y394 HydrophobicContact CD2-CD2 3.95Å; L389-Y394 HydrophobicContact CD2-CE2 3.89Å; L389-Y394 HydrophobicContact CD2-CG 4.36Å; L389-Y394 HydrophobicContact CG-CD2 4.27Å; L389-Y394 HydrophobicContact CG-CG 4.46Å; P390-Y394 WeakPolarHBondContact O-CD2 3.31Å; P390-Y394 PolarHBondContact O-N 3.4Å; Q391-Y394 CarbonylContact O-C 3.53Å; Q391-Y394 PolarHBondContact O-N 3.28Å; Y394-E396 PolarHBondContact O-N 3.11Å; Y394-Y397 HydrophobicContact CD1-CD2 4.11Å; Y394-Y397 HydrophobicContact CD1-CE2 4.33Å; Y394-Y397 HydrophobicContact CG-CD2 4.42Å; Y394-Y397 PolarHBondContact O-N 3.07Å; Y394-H398 PolarHBondContact O-CD2 3.43Å; Y394-H398 PolarHBondContact O-N 3.1Å
395	P	91.9	Very high	90.9	Very high	74 Å²	74	59.3 Å²	59.3	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-30.9	-174.9	25.9	-35.7	0	0	0	113.1	Q391 L393 H398 K399	Q391-P395 WeakPolarHBondContact O-CA 3.25Å; Q391-P395 WeakPolarHBondContact O-CD 3.49Å; Q391-P395 VanDerWaalsContact O-N 3.16Å; L393-P395 WeakPolarHBondContact O-CD 3.4Å; P395-H398 PolarHBondContact O-N 2.9Å; P395-K399 PolarHBondContact O-N 3.43Å
396	E	92.2	Very high	91	Very high	44 Å²	44	60.9 Å²	60.9	21%	0.206	30%	0.303	C	S	.	.	H	α-helix	trans	-65	-40.3	179.1	69.1	-81.7	-160.8	0	0	112.8	R213 L362 Y394 K399 V400	R213-E396 IonicContact CZ-OE1 2.71Å; R213-E396 IonicContact NH1-OE1 2.68Å; R213-E396 PolarHBondContact NH1-OE1 3.2Å; R213-E396 VanDerWaalsContact NH2-CD 3.31Å; R213-E396 IonicContact NH2-OE1 2.83Å; R213-E396 PolarHBondContact NH2-OE1 2.77Å; R213-E396 IonicContact NH2-OE2 2.94Å; R213-E396 PolarHBondContact NH2-OE2 3.11Å; R213-E396 VanDerWaalsContact NH2-OE2 3.11Å; L362-E396 HydrophobicContact CD1-CB 3.91Å; L362-E396 HydrophobicContact CD1-CG 4.01Å; Y394-E396 PolarHBondContact O-N 3.11Å; E396-K399 WeakPolarHBondContact O-CB 3.48Å; E396-K399 PolarHBondContact O-N 3.27Å; E396-V400 PolarHBondContact O-N 2.67Å
397	Y	94.4	Very high	91	Very high	3 Å²	3	63.9 Å²	63.9	1%	0.012	32%	0.317	C	S	.	.	H	α-helix	trans	-74.3	-32.2	177.5	-66.8	-53.9	0	0	0	111.7	I185 L355 A358 D359 F386 L389 Y394 K399 V400 Y401	I185-Y397 HydrophobicContact CD1-CD2 4.23Å; I185-Y397 HydrophobicContact CD1-CE2 3.24Å; I185-Y397 WeakPolarHBondContact CD1-OH 3.22Å; L355-Y397 HydrophobicContact CD2-CD1 4.07Å; L355-Y397 HydrophobicContact CD2-CD2 4.32Å; L355-Y397 HydrophobicContact CD2-CE1 4.19Å; L355-Y397 HydrophobicContact CD2-CE2 4.46Å; L355-Y397 HydrophobicContact CD2-CG 4.15Å; A358-Y397 HydrophobicContact CB-CD1 3.84Å; A358-Y397 HydrophobicContact CB-CE1 4.13Å; D359-Y397 WeakPolarHBondContact OD1-CE1 3.21Å; D359-Y397 PolarHBondContact OD1-OH 2.76Å; F386-Y397 HydrophobicContact CE1-CD1 4.46Å; L389-Y397 HydrophobicContact CD1-CD2 3.88Å; L389-Y397 HydrophobicContact CD1-CG 4.24Å; Y394-Y397 HydrophobicContact CD1-CD2 4.11Å; Y394-Y397 HydrophobicContact CD1-CE2 4.33Å; Y394-Y397 HydrophobicContact CG-CD2 4.42Å; Y394-Y397 PolarHBondContact O-N 3.07Å; Y397-K399 VanDerWaalsContact C-N 3.34Å; Y397-V400 PolarHBondContact O-N 3.18Å; Y397-Y401 PolarHBondContact O-N 3.04Å
398	H	94	Very high	91	Very high	37 Å²	37	62.7 Å²	62.7	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-67.1	-35.2	170.8	-83.7	-96.1	0	0	0	112.3	F386 L389 Q391 Y394 P395 Y401 H402	F386-H398 PolarHBondContact O-NE2 2.56Å; L389-H398 PolarHBondContact O-NE2 2.94Å; Q391-H398 VanDerWaalsContact CA-CD2 3.44Å; Q391-H398 WeakPolarHBondContact CA-CD2 3.37Å; Q391-H398 WeakPolarHBondContact CA-NE2 3.47Å; Q391-H398 HydrophobicContact CG-CB 4Å; Q391-H398 PolarHBondContact N-NE2 3.09Å; Y394-H398 PolarHBondContact O-CD2 3.43Å; Y394-H398 PolarHBondContact O-N 3.1Å; P395-H398 PolarHBondContact O-N 2.9Å; H398-Y401 PolarHBondContact O-N 3.23Å; H398-H402 WeakPolarHBondContact O-CB 3.48Å; H398-H402 PolarHBondContact O-N 3.16Å
399	K	93.4	Very high	90.8	Very high	92 Å²	92	59.5 Å²	59.5	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-47.8	171.4	-176.2	-174.8	176.7	-173.3	0	110.9	P395 E396 Y397 Y401 H402 M403	P395-K399 PolarHBondContact O-N 3.43Å; E396-K399 WeakPolarHBondContact O-CB 3.48Å; E396-K399 PolarHBondContact O-N 3.27Å; Y397-K399 VanDerWaalsContact C-N 3.34Å; K399-Y401 PolarHBondContact O-N 2.99Å; K399-H402 PolarHBondContact O-N 3.36Å; K399-M403 WeakPolarHBondContact O-CG 3.4Å; K399-M403 PolarHBondContact O-N 2.96Å
400	V	94.8	Very high	90.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-47.3	176	177.7	0	0	0	0	111	A358 V361 L362 E396 Y397 H402 M403 M404	A358-V400 HydrophobicContact CB-CB 4.22Å; A358-V400 HydrophobicContact CB-CG1 3.88Å; A358-V400 HydrophobicContact CB-CG2 4.18Å; V361-V400 HydrophobicContact CB-CG1 4.41Å; V361-V400 HydrophobicContact CG1-CG1 4.24Å; V361-V400 HydrophobicContact CG1-CG2 4.27Å; L362-V400 HydrophobicContact CD1-CG2 4.11Å; L362-V400 HydrophobicContact CD2-CG2 3.67Å; L362-V400 HydrophobicContact CG-CG2 3.6Å; E396-V400 PolarHBondContact O-N 2.67Å; Y397-V400 PolarHBondContact O-N 3.18Å; V400-H402 VanDerWaalsContact C-N 3.33Å; V400-H402 PolarHBondContact O-N 3.3Å; V400-M403 HydrophobicContact CG2-CE 4.32Å; V400-M403 WeakPolarHBondContact O-CB 3.47Å; V400-M403 PolarHBondContact O-N 3.03Å; V400-M403 VanDerWaalsContact O-N 3.16Å; V400-M404 HydrophobicContact CG1-CG 4.37Å; V400-M404 HydrophobicContact CG1-SD 4.19Å; V400-M404 WeakPolarHBondContact O-CG 3.44Å; V400-M404 PolarHBondContact O-N 2.76Å
401	Y	94.9	Very high	89	Confident	45 Å²	45	61.2 Å²	61.2	18%	0.176	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-40	178.3	-179.2	-109.3	0	0	0	112.7	V379 L384 F386 K387 Y397 H398 K399 M403 M404 C405	V379-Y401 HydrophobicContact CG1-CE2 3.94Å; V379-Y401 PolarHBondContact O-OH 3.24Å; L384-Y401 HydrophobicContact CD1-CE2 4.23Å; F386-Y401 HydrophobicContact CB-CD2 3.75Å; F386-Y401 HydrophobicContact CB-CG 3.75Å; F386-Y401 AromaticContact CD2-CD2 3.87Å; F386-Y401 HydrophobicContact CD2-CD2 3.87Å; F386-Y401 HydrophobicContact CD2-CG 4.49Å; F386-Y401 HydrophobicContact CG-CD2 4.07Å; F386-Y401 HydrophobicContact CG-CG 4.27Å; K387-Y401 WeakPolarHBondContact CE-OH 3.47Å; Y397-Y401 PolarHBondContact O-N 3.04Å; H398-Y401 PolarHBondContact O-N 3.23Å; K399-Y401 PolarHBondContact O-N 2.99Å; Y401-M403 VanDerWaalsContact C-N 3.35Å; Y401-M403 PolarHBondContact O-N 2.89Å; Y401-M404 HydrophobicContact CD2-SD 4.49Å; Y401-M404 WeakPolarHBondContact O-CB 3.3Å; Y401-M404 PolarHBondContact O-N 2.91Å; Y401-C405 PolarHBondContact O-N 2.83Å; Y401-C405 PolarHBondContact O-SG 3.05Å
402	H	93.6	Very high	87.5	Confident	119 Å²	119	62.5 Å²	62.5	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-42.5	174.2	-176.8	80.9	0	0	0	111.9	H398 K399 V400 C405 T406	H398-H402 WeakPolarHBondContact O-CB 3.48Å; H398-H402 PolarHBondContact O-N 3.16Å; K399-H402 PolarHBondContact O-N 3.36Å; V400-H402 VanDerWaalsContact C-N 3.33Å; V400-H402 PolarHBondContact O-N 3.3Å; H402-C405 PolarHBondContact O-N 3.5Å; H402-T406 PolarHBondContact O-N 3.07Å; H402-T406 PolarHBondContact O-OG1 3.19Å
403	M	94.6	Very high	86.1	Confident	7 Å²	7	55.6 Å²	55.6	3%	0.034	31%	0.308	C	S	.	.	H	α-helix	trans	-63.5	-41.5	173.3	-66	-171.4	-57.8	0	0	111.5	V361 Y365 K399 V400 Y401 C405 T406 Q407 Y419	V361-M403 HydrophobicContact CG1-CE 3.93Å; Y365-M403 HydrophobicContact CD2-SD 4.43Å; Y365-M403 HydrophobicContact CE2-SD 4.19Å; K399-M403 WeakPolarHBondContact O-CG 3.4Å; K399-M403 PolarHBondContact O-N 2.96Å; V400-M403 HydrophobicContact CG2-CE 4.32Å; V400-M403 WeakPolarHBondContact O-CB 3.47Å; V400-M403 PolarHBondContact O-N 3.03Å; V400-M403 VanDerWaalsContact O-N 3.16Å; Y401-M403 VanDerWaalsContact C-N 3.35Å; Y401-M403 PolarHBondContact O-N 2.89Å; M403-C405 PolarHBondContact O-N 3.4Å; M403-T406 PolarHBondContact O-N 3.16Å; M403-Q407 WeakPolarHBondContact O-CB 3.34Å; M403-Q407 PolarHBondContact O-N 2.92Å; M403-Y419 HydrophobicContact CB-CD1 3.82Å; M403-Y419 HydrophobicContact CB-CE1 3.64Å; M403-Y419 HydrophobicContact CB-CG 4.41Å; M403-Y419 HydrophobicContact CE-CD2 4.39Å; M403-Y419 WeakPolarHBondContact O-CE1 3.49Å; M403-Y419 HydrophobicContact SD-CG 4.39Å
404	M	94.4	Very high	84.8	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-55.8	-37.9	174.3	-68.2	168.6	71.6	0	0	112.4	F375 V379 F386 V400 Y401 T408 Y419 S421	F375-M404 HydrophobicContact CD1-CE 4.09Å; F375-M404 HydrophobicContact CD2-CE 4.18Å; F375-M404 HydrophobicContact CE1-CE 3.66Å; F375-M404 HydrophobicContact CE1-CG 4.31Å; F375-M404 HydrophobicContact CE2-CE 3.73Å; F375-M404 HydrophobicContact CG-CE 4.36Å; F375-M404 HydrophobicContact CZ-CB 4.4Å; F375-M404 HydrophobicContact CZ-CE 3.47Å; F375-M404 VanDerWaalsContact CZ-CE 3.47Å; F375-M404 HydrophobicContact CZ-CG 4.43Å; V379-M404 HydrophobicContact CG1-CB 4.25Å; F386-M404 HydrophobicContact CD2-CE 4.49Å; F386-M404 HydrophobicContact CD2-SD 4.07Å; F386-M404 HydrophobicContact CE2-CE 4.01Å; F386-M404 HydrophobicContact CE2-SD 3.62Å; F386-M404 HydrophobicContact CZ-SD 4.19Å; V400-M404 HydrophobicContact CG1-CG 4.37Å; V400-M404 HydrophobicContact CG1-SD 4.19Å; V400-M404 WeakPolarHBondContact O-CG 3.44Å; V400-M404 PolarHBondContact O-N 2.76Å; Y401-M404 HydrophobicContact CD2-SD 4.49Å; Y401-M404 WeakPolarHBondContact O-CB 3.3Å; Y401-M404 PolarHBondContact O-N 2.91Å; M404-T408 PolarHBondContact O-OG1 2.79Å; M404-Y419 WeakPolarHBondContact CG-OH 3.09Å; M404-S421 PolarHBondContact O-OG 3.47Å
405	C	91.4	Very high	83.3	Confident	56 Å²	56	61.3 Å²	61.3	38%	0.378	34%	0.343	S	S	.	.	H	α-helix	trans	-76.1	-47.7	178.2	-64.4	0	0	0	0	113.3	V379 Y401 H402 M403 T408	V379-C405 HydrophobicContact CG1-CB 4.33Å; V379-C405 WeakPolarHBondContact CG1-SG 3.35Å; Y401-C405 PolarHBondContact O-N 2.83Å; Y401-C405 PolarHBondContact O-SG 3.05Å; H402-C405 PolarHBondContact O-N 3.5Å; M403-C405 PolarHBondContact O-N 3.4Å; C405-T408 PolarHBondContact O-OG1 2.82Å
406	T	89.5	Confident	81.7	Confident	82 Å²	82	63.1 Å²	63.1	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-90.1	-26.5	-165.3	53	0	0	0	0	114.1	H402 M403	H402-T406 PolarHBondContact O-N 3.07Å; H402-T406 PolarHBondContact O-OG1 3.19Å; M403-T406 PolarHBondContact O-N 3.16Å
407	Q	88.8	Confident	80.7	Confident	63 Å²	63	63.5 Å²	63.5	29%	0.294	37%	0.365	S	S	.	.	S	Bend	trans	-110.3	44.5	-175.3	-58.6	179.7	23.7	0	0	110.6	M403 S417 Y419 S421	M403-Q407 WeakPolarHBondContact O-CB 3.34Å; M403-Q407 PolarHBondContact O-N 2.92Å; Q407-S417 PolarHBondContact OE1-OG 3.11Å; Q407-S417 VanDerWaalsContact OE1-OG 3.14Å; Q407-Y419 HydrophobicContact CB-CD1 3.87Å; Q407-Y419 HydrophobicContact CB-CE1 4.25Å; Q407-Y419 PolarHBondContact OE1-O 3.29Å; Q407-Y419 VanDerWaalsContact OE1-O 3.06Å; Q407-S421 PolarHBondContact O-N 3.26Å; Q407-S421 PolarHBondContact O-OG 3.09Å
408	T	84.8	Confident	80.3	Confident	61 Å²	61	68.1 Å²	68.1	37%	0.374	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-74.3	136.1	177.7	-57.9	0	0	0	0	110	M404 C405 S410 S421 P423	M404-T408 PolarHBondContact O-OG1 2.79Å; C405-T408 PolarHBondContact O-OG1 2.82Å; T408-S410 PolarHBondContact O-N 3.12Å; T408-S421 VanDerWaalsContact CA-OG 3.25Å; T408-S421 WeakPolarHBondContact CA-OG 3.42Å; T408-S421 PolarHBondContact OG1-OG 3.08Å; T408-P423 HydrophobicContact CG2-CG 3.87Å
409	Y	81.9	Confident	80.3	Confident	54 Å²	54	66.4 Å²	66.4	21%	0.212	38%	0.382	C	S	.	.			trans	-54.5	121.4	176.1	179.6	-95.4	0	0	0	111.5	T420 S421 F422 K446	Y409-T420 HydrophobicContact CD2-CG2 4.03Å; Y409-T420 HydrophobicContact CG-CG2 4.41Å; Y409-S421 WeakPolarHBondContact CB-O 3.37Å; Y409-S421 PolarHBondContact N-O 2.79Å; Y409-F422 HydrophobicContact CD1-CD1 4.35Å; Y409-F422 AromaticContact CD1-CE1 3.68Å; Y409-F422 HydrophobicContact CD1-CE1 3.68Å; Y409-F422 HydrophobicContact CD1-CZ 4.21Å; Y409-F422 AromaticContact CD2-CE1 3.66Å; Y409-F422 HydrophobicContact CD2-CE1 3.66Å; Y409-F422 HydrophobicContact CD2-CE2 4.15Å; Y409-F422 AromaticContact CD2-CZ 3.3Å; Y409-F422 HydrophobicContact CD2-CZ 3.3Å; Y409-F422 HydrophobicContact CE1-CE1 4.32Å; Y409-F422 HydrophobicContact CE2-CE1 4.29Å; Y409-F422 HydrophobicContact CE2-CZ 4.01Å; Y409-F422 HydrophobicContact CG-CD1 4.07Å; Y409-F422 AromaticContact CG-CE1 3.31Å; Y409-F422 HydrophobicContact CG-CE1 3.31Å; Y409-F422 HydrophobicContact CG-CE2 4.23Å; Y409-F422 AromaticContact CG-CZ 3.41Å; Y409-F422 HydrophobicContact CG-CZ 3.41Å; Y409-F422 VanDerWaalsContact CG-CZ 3.41Å; Y409-K446 HydrophobicContact CE1-CD 4.1Å; Y409-K446 VanDerWaalsContact CZ-NZ 3.31Å; Y409-K446 PolarHBondContact OH-NZ 3.01Å
410	S	74.1	Confident	80.3	Confident	54 Å²	54	62.5 Å²	62.5	38%	0.378	37%	0.366	S	S	.	.			trans	-110.6	141.9	167.4	-177.8	0	0	0	0	109.7	T408 D412 S413	T408-S410 PolarHBondContact O-N 3.12Å; S410-D412 PolarHBondContact O-N 2.87Å; S410-S413 WeakPolarHBondContact CB-OG 3.27Å; S410-S413 PolarHBondContact O-N 2.95Å; S410-S413 PolarHBondContact O-OG 2.79Å; S410-S413 VanDerWaalsContact O-OG 3.1Å
411	A	63.9	Low	80.3	Confident	74 Å²	74	62.5 Å²	62.5	61%	0.612	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.6	179	0	0	0	0	0	113
412	D	58.2	Low	80.4	Confident	160 Å²	160	60.4 Å²	60.4	86%	0.856	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-2.6	-176.5	-57.6	-36.3	0	0	0	113.6	S410	S410-D412 PolarHBondContact O-N 2.87Å
413	S	59.8	Low	80.5	Confident	58 Å²	58	55.7 Å²	55.7	41%	0.406	34%	0.338	S	S	.	.	S	Bend	trans	-120	123	-178.7	54.3	0	0	0	0	110.8	S410	S410-S413 WeakPolarHBondContact CB-OG 3.27Å; S410-S413 PolarHBondContact O-N 2.95Å; S410-S413 PolarHBondContact O-OG 2.79Å; S410-S413 VanDerWaalsContact O-OG 3.1Å
414	D	57.9	Low	80.5	Confident	141 Å²	141	58.6 Å²	58.6	75%	0.754	35%	0.351	S	S	*	.			trans	-62.9	138.5	169.4	-139.8	13.1	0	0	0	108.6	S416	D414-S416 PolarHBondContact O-N 3.08Å; D414-S416 PolarHBondContact O-OG 2.87Å
415	P	60	Low	80.6	Confident	63 Å²	63	60.3 Å²	60.3	41%	0.409	36%	0.359	S	S	.	.	S	Bend	trans	-72.1	63.5	178	30.1	-32.7	0	0	0	110.4
416	S	58.6	Low	80.8	Confident	113 Å²	113	64 Å²	64	79%	0.79	37%	0.365	S	S	*	.			trans	-84.1	-2.9	173.7	59.3	0	0	0	0	112.4	D414	D414-S416 PolarHBondContact O-N 3.08Å; D414-S416 PolarHBondContact O-OG 2.87Å
417	S	70.8	Confident	81.2	Confident	51 Å²	51	60.4 Å²	60.4	36%	0.357	34%	0.343	S	S	.	.	S	Bend	trans	-81.3	141.8	173.6	-179	0	0	0	0	110.5	Q407 Y419	Q407-S417 PolarHBondContact OE1-OG 3.11Å; Q407-S417 VanDerWaalsContact OE1-OG 3.14Å; S417-Y419 VanDerWaalsContact CB-O 3.24Å; S417-Y419 WeakPolarHBondContact CB-O 3.45Å; S417-Y419 PolarHBondContact O-N 2.91Å; S417-Y419 PolarHBondContact OG-N 2.99Å; S417-Y419 PolarHBondContact OG-O 3.47Å
418	D	86.7	Confident	81.6	Confident	100 Å²	100	59.7 Å²	59.7	54%	0.535	34%	0.341	S	S	.	.	S	Bend	trans	-59.3	-14.9	172.9	-61.9	-39.7	0	0	0	112.8	Y365 P370 V371	Y365-D418 HydrophobicContact CE2-CB 4.37Å; P370-D418 CarbonylContact C-O 3.49Å; P370-D418 WeakPolarHBondContact CA-O 3.24Å; V371-D418 PolarHBondContact N-O 3.38Å
419	Y	93.5	Very high	82.2	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	139.3	174.2	172.2	-81.2	0	0	0	111.1	V361 V371 H373 M403 M404 Q407 S417	V361-Y419 HydrophobicContact CG1-CD2 3.84Å; V361-Y419 HydrophobicContact CG1-CE2 3.65Å; V361-Y419 HydrophobicContact CG2-CE2 4.21Å; V371-Y419 HydrophobicContact CB-CD2 3.92Å; V371-Y419 HydrophobicContact CG1-CD2 3.86Å; V371-Y419 HydrophobicContact CG1-CE2 4.17Å; V371-Y419 CarbonylContact O-C 3.58Å; V371-Y419 WeakPolarHBondContact O-CA 2.95Å; H373-Y419 HydrophobicContact CB-CD2 4.49Å; H373-Y419 HydrophobicContact CB-CE2 3.55Å; H373-Y419 AromaticContact ND1-CE2 3.71Å; H373-Y419 AromaticContact ND1-CZ 3.65Å; H373-Y419 PolarHBondContact ND1-OH 3.01Å; M403-Y419 HydrophobicContact CB-CD1 3.82Å; M403-Y419 HydrophobicContact CB-CE1 3.64Å; M403-Y419 HydrophobicContact CB-CG 4.41Å; M403-Y419 HydrophobicContact CE-CD2 4.39Å; M403-Y419 WeakPolarHBondContact O-CE1 3.49Å; M403-Y419 HydrophobicContact SD-CG 4.39Å; M404-Y419 WeakPolarHBondContact CG-OH 3.09Å; Q407-Y419 HydrophobicContact CB-CD1 3.87Å; Q407-Y419 HydrophobicContact CB-CE1 4.25Å; Q407-Y419 PolarHBondContact OE1-O 3.29Å; Q407-Y419 VanDerWaalsContact OE1-O 3.06Å; S417-Y419 VanDerWaalsContact CB-O 3.24Å; S417-Y419 WeakPolarHBondContact CB-O 3.45Å; S417-Y419 PolarHBondContact O-N 2.91Å; S417-Y419 PolarHBondContact OG-N 2.99Å; S417-Y419 PolarHBondContact OG-O 3.47Å
420	T	94.4	Very high	83	Confident	10 Å²	10	54.6 Å²	54.6	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	127.4	173	-56	0	0	0	0	110.4	V371 H373 Y409 F422	V371-T420 PolarHBondContact O-N 3.29Å; H373-T420 PolarHBondContact N-O 3.34Å; Y409-T420 HydrophobicContact CD2-CG2 4.03Å; Y409-T420 HydrophobicContact CG-CG2 4.41Å; T420-F422 HydrophobicContact CG2-CD2 4.16Å; T420-F422 HydrophobicContact CG2-CE2 3.51Å; T420-F422 HydrophobicContact CG2-CZ 4.14Å
421	S	95.3	Very high	84.1	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.6	176	68.6	0	0	0	0	112.9	H373 M404 Q407 T408 Y409 P423	H373-S421 CarbonylContact O-C 3.59Å; H373-S421 WeakPolarHBondContact O-CA 3.23Å; M404-S421 PolarHBondContact O-OG 3.47Å; Q407-S421 PolarHBondContact O-N 3.26Å; Q407-S421 PolarHBondContact O-OG 3.09Å; T408-S421 VanDerWaalsContact CA-OG 3.25Å; T408-S421 WeakPolarHBondContact CA-OG 3.42Å; T408-S421 PolarHBondContact OG1-OG 3.08Å; Y409-S421 WeakPolarHBondContact CB-O 3.37Å; Y409-S421 PolarHBondContact N-O 2.79Å; S421-P423 WeakPolarHBondContact O-CD 3.4Å
422	F	95.8	Very high	85.5	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	76.1	176.8	-73.6	-97.8	0	0	0	109.3	I372 H373 V374 F375 Y409 T420 H425 L438 F448	I372-F422 HydrophobicContact CG2-CD2 3.66Å; I372-F422 HydrophobicContact CG2-CE2 3.64Å; H373-F422 PolarHBondContact O-N 3.01Å; V374-F422 HydrophobicContact CG2-CB 3.96Å; V374-F422 HydrophobicContact CG2-CG 4.42Å; F375-F422 PolarHBondContact N-O 3.36Å; Y409-F422 HydrophobicContact CD1-CD1 4.35Å; Y409-F422 AromaticContact CD1-CE1 3.68Å; Y409-F422 HydrophobicContact CD1-CE1 3.68Å; Y409-F422 HydrophobicContact CD1-CZ 4.21Å; Y409-F422 AromaticContact CD2-CE1 3.66Å; Y409-F422 HydrophobicContact CD2-CE1 3.66Å; Y409-F422 HydrophobicContact CD2-CE2 4.15Å; Y409-F422 AromaticContact CD2-CZ 3.3Å; Y409-F422 HydrophobicContact CD2-CZ 3.3Å; Y409-F422 HydrophobicContact CE1-CE1 4.32Å; Y409-F422 HydrophobicContact CE2-CE1 4.29Å; Y409-F422 HydrophobicContact CE2-CZ 4.01Å; Y409-F422 HydrophobicContact CG-CD1 4.07Å; Y409-F422 AromaticContact CG-CE1 3.31Å; Y409-F422 HydrophobicContact CG-CE1 3.31Å; Y409-F422 HydrophobicContact CG-CE2 4.23Å; Y409-F422 AromaticContact CG-CZ 3.41Å; Y409-F422 HydrophobicContact CG-CZ 3.41Å; Y409-F422 VanDerWaalsContact CG-CZ 3.41Å; T420-F422 HydrophobicContact CG2-CD2 4.16Å; T420-F422 HydrophobicContact CG2-CE2 3.51Å; T420-F422 HydrophobicContact CG2-CZ 4.14Å; F422-H425 HydrophobicContact CB-CB 4.02Å; F422-H425 AromaticContact CD1-CD2 3.9Å; F422-H425 AromaticContact CD1-NE2 3.91Å; F422-L438 HydrophobicContact CD1-CD1 4.22Å; F422-L438 HydrophobicContact CE1-CD1 4.48Å; F422-L438 HydrophobicContact CG-CD1 4.31Å; F422-F448 AromaticContact CE1-CE2 3.95Å; F422-F448 HydrophobicContact CE1-CE2 3.95Å; F422-F448 AromaticContact CE1-CZ 3.58Å; F422-F448 HydrophobicContact CE1-CZ 3.58Å; F422-F448 HydrophobicContact CE2-CZ 4.43Å; F422-F448 AromaticContact CZ-CE1 3.86Å; F422-F448 HydrophobicContact CZ-CE1 3.86Å; F422-F448 AromaticContact CZ-CE2 3.99Å; F422-F448 HydrophobicContact CZ-CE2 3.99Å; F422-F448 AromaticContact CZ-CZ 3.36Å; F422-F448 HydrophobicContact CZ-CZ 3.36Å
423	P	95.2	Very high	87.2	Confident	20 Å²	20	52.6 Å²	52.6	13%	0.13	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	150.5	173.1	29.7	-35	0	0	0	110.9	F375 V379 T408 S421 H425	F375-P423 HydrophobicContact CD2-CB 4.3Å; F375-P423 HydrophobicContact CE2-CB 3.47Å; F375-P423 VanDerWaalsContact CE2-CB 3.47Å; F375-P423 HydrophobicContact CZ-CB 3.7Å; F375-P423 CarbonylContact O-C 3.47Å; V379-P423 HydrophobicContact CG2-CB 3.66Å; V379-P423 HydrophobicContact CG2-CG 4Å; T408-P423 HydrophobicContact CG2-CG 3.87Å; S421-P423 WeakPolarHBondContact O-CD 3.4Å; P423-H425 PolarHBondContact O-N 2.88Å; P423-H425 PolarHBondContact O-ND1 3.21Å
424	E	95.6	Very high	88.7	Confident	69 Å²	69	52.6 Å²	52.6	32%	0.322	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	33.3	-179	-58.2	-174.7	108.2	0	0	113.7	F375 R377 R378 V441	F375-E424 PolarHBondContact O-N 2.95Å; R377-E424 PolarHBondContact O-N 3.07Å; R378-E424 HydrophobicContact CB-CG 4.42Å; R378-E424 VanDerWaalsContact CD-OE1 3.25Å; R378-E424 WeakPolarHBondContact CD-OE1 3.32Å; R378-E424 HydrophobicContact CG-CG 3.42Å; R378-E424 VanDerWaalsContact CG-CG 3.42Å; R378-E424 WeakPolarHBondContact CG-OE1 3.26Å; R378-E424 WeakPolarHBondContact CG-OE2 3.44Å; R378-E424 IonicContact NE-OE1 2.62Å; E424-V441 HydrophobicContact CB-CB 4.41Å; E424-V441 HydrophobicContact CB-CG1 3.78Å; E424-V441 HydrophobicContact CB-CG2 3.8Å; E424-V441 WeakPolarHBondContact O-CG1 3.43Å; E424-V441 PolarHBondContact O-N 3.13Å
425	H	95.9	Very high	90.5	Very high	36 Å²	36	49.5 Å²	49.5	17%	0.167	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.5	173.2	-71.6	68.1	0	0	0	110.5	V374 F375 F422 P423 Q439 S440	V374-H425 HydrophobicContact CG1-CB 3.96Å; V374-H425 WeakPolarHBondContact CG1-O 3.49Å; F375-H425 CarbonylContact C-O 3.51Å; F375-H425 PolarHBondContact O-N 2.95Å; F422-H425 HydrophobicContact CB-CB 4.02Å; F422-H425 AromaticContact CD1-CD2 3.9Å; F422-H425 AromaticContact CD1-NE2 3.91Å; P423-H425 PolarHBondContact O-N 2.88Å; P423-H425 PolarHBondContact O-ND1 3.21Å; H425-Q439 CarbonylContact C-O 3.53Å; H425-Q439 VanDerWaalsContact CA-O 3.31Å; H425-Q439 WeakPolarHBondContact CA-O 3.45Å; H425-S440 WeakPolarHBondContact NE2-CB 3.39Å
426	R	96.8	Very high	92.3	Very high	133 Å²	133	46.5 Å²	46.5	50%	0.502	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.2	170.3	65.8	178.3	179.9	177.6	0.1	110.5	L428 L438 Q439	R426-L428 HydrophobicContact CG-CD2 4.43Å; R426-L438 CarbonylContact O-C 3.53Å; R426-L438 WeakPolarHBondContact O-CA 3.31Å; R426-Q439 HydrophobicContact CG-CB 4.3Å; R426-Q439 PolarHBondContact N-O 3.22Å; R426-Q439 PolarHBondContact O-N 3.25Å
427	V	97.8	Very high	94.1	Very high	6 Å²	6	42.9 Å²	42.9	4%	0.036	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.3	166.7	-173.7	0	0	0	0	108.4	L315 V317 L349 V351 F430 L438	L315-V427 HydrophobicContact CD1-CB 4.11Å; L315-V427 HydrophobicContact CD1-CG2 4.21Å; V317-V427 HydrophobicContact CG2-CG1 4.45Å; L349-V427 HydrophobicContact CD2-CG2 3.97Å; V351-V427 HydrophobicContact CG1-CG2 4.41Å; V351-V427 HydrophobicContact CG2-CG2 3.78Å; V427-F430 HydrophobicContact CB-CZ 4.49Å; V427-F430 HydrophobicContact CG1-CD2 4.35Å; V427-F430 HydrophobicContact CG1-CE1 4.03Å; V427-F430 HydrophobicContact CG1-CE2 3.86Å; V427-F430 HydrophobicContact CG1-CZ 3.69Å; V427-F430 HydrophobicContact CG2-CZ 4.41Å; V427-L438 HydrophobicContact CB-CD2 4.3Å; V427-L438 HydrophobicContact CG2-CD2 3.75Å
428	L	97.3	Very high	95.4	Very high	49 Å²	49	40.5 Å²	40.5	26%	0.257	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-36.9	174.4	-73.2	-174.5	0	0	0	113	V317 R426 I437 Q439 K445	V317-L428 WeakPolarHBondContact CB-O 3.1Å; R426-L428 HydrophobicContact CG-CD2 4.43Å; L428-I437 HydrophobicContact CB-CB 4.29Å; L428-I437 HydrophobicContact CB-CG2 4.27Å; L428-I437 HydrophobicContact CD1-CG2 4.16Å; L428-I437 PolarHBondContact N-O 3.44Å; L428-Q439 HydrophobicContact CD1-CB 3.63Å; L428-Q439 HydrophobicContact CD1-CG 4.26Å; L428-Q439 HydrophobicContact CD2-CB 4.15Å; L428-Q439 HydrophobicContact CG-CB 3.68Å; L428-K445 HydrophobicContact CD1-CD 3.97Å; L428-K445 HydrophobicContact CD1-CG 4.13Å
429	S	97.8	Very high	95.8	Very high	6 Å²	6	37 Å²	37	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	158.7	177.1	55.3	0	0	0	0	111	E318 K431 C436 I437	E318-S429 CarbonylContact O-C 3.51Å; E318-S429 VanDerWaalsContact O-CA 3.25Å; E318-S429 WeakPolarHBondContact O-CA 3.45Å; E318-S429 WeakPolarHBondContact O-CB 3.46Å; S429-K431 WeakPolarHBondContact OG-CE 3.48Å; S429-C436 WeakPolarHBondContact O-CA 3.41Å; S429-I437 PolarHBondContact O-N 3.08Å; S429-I437 WeakPolarHBondContact OG-CD1 3.42Å
430	F	97.9	Very high	95.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.7	165.7	-57.8	-82.1	0	0	0	108.8	L315 V317 E318 G319 E320 L322 F324 V325 L349 V427 C436 A453 V455	L315-F430 HydrophobicContact CD1-CE2 4.18Å; L315-F430 HydrophobicContact CD1-CZ 4.28Å; V317-F430 HydrophobicContact CG2-CD2 3.93Å; V317-F430 HydrophobicContact CG2-CE2 3.8Å; E318-F430 PolarHBondContact O-N 2.71Å; G319-F430 WeakPolarHBondContact CA-O 3.47Å; G319-F430 WeakPolarHBondContact O-CB 3.09Å; E320-F430 HydrophobicContact CB-CD2 4.26Å; E320-F430 HydrophobicContact CB-CE2 4.34Å; E320-F430 HydrophobicContact CG-CE2 4.44Å; L322-F430 HydrophobicContact CD1-CB 4.07Å; F324-F430 HydrophobicContact CE2-CD1 4.22Å; F324-F430 HydrophobicContact CZ-CB 4.14Å; V325-F430 HydrophobicContact CG1-CE2 4.26Å; V325-F430 HydrophobicContact CG1-CZ 4.28Å; V325-F430 HydrophobicContact CG2-CB 4.35Å; V325-F430 HydrophobicContact CG2-CD1 4.05Å; V325-F430 HydrophobicContact CG2-CD2 4.14Å; V325-F430 HydrophobicContact CG2-CE1 4.34Å; V325-F430 HydrophobicContact CG2-CE2 4.42Å; V325-F430 HydrophobicContact CG2-CG 3.92Å; L349-F430 HydrophobicContact CD2-CE1 3.7Å; L349-F430 HydrophobicContact CD2-CZ 4.24Å; V427-F430 HydrophobicContact CB-CZ 4.49Å; V427-F430 HydrophobicContact CG1-CD2 4.35Å; V427-F430 HydrophobicContact CG1-CE1 4.03Å; V427-F430 HydrophobicContact CG1-CE2 3.86Å; V427-F430 HydrophobicContact CG1-CZ 3.69Å; V427-F430 HydrophobicContact CG2-CZ 4.41Å; F430-C436 HydrophobicContact CD1-CB 3.99Å; F430-C436 HydrophobicContact CE1-CB 4.21Å; F430-A453 HydrophobicContact CD1-CB 4.15Å; F430-A453 HydrophobicContact CE1-CB 3.44Å; F430-A453 VanDerWaalsContact CE1-CB 3.44Å; F430-A453 HydrophobicContact CZ-CB 4.05Å; F430-V455 HydrophobicContact CZ-CG2 4.27Å
431	K	97.1	Very high	95.8	Very high	61 Å²	61	42.2 Å²	42.2	27%	0.265	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	151.8	-178.2	-59.4	-56.8	-179.1	-169.3	0	110.3	E318 F324 S429 D433 M434 K435	E318-K431 IonicContact OE1-NZ 3.15Å; E318-K431 PolarHBondContact OE1-NZ 3.45Å; E318-K431 IonicContact OE2-NZ 3.75Å; E318-K431 PolarHBondContact OE2-NZ 3.03Å; F324-K431 WeakPolarHBondContact CZ-O 3.48Å; S429-K431 WeakPolarHBondContact OG-CE 3.48Å; K431-D433 WeakPolarHBondContact CB-OD1 3.06Å; K431-D433 PolarHBondContact O-N 3.47Å; K431-D433 VanDerWaalsContact O-N 3.16Å; K431-M434 PolarHBondContact O-N 3.42Å; K431-M434 VanDerWaalsContact O-N 3.08Å; K431-K435 HydrophobicContact CB-CB 4.42Å; K431-K435 PolarHBondContact N-O 3.29Å
432	S	93.6	Very high	95.6	Very high	108 Å²	108	47.1 Å²	47.1	76%	0.755	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.2	-177.2	53	0	0	0	0	113.7	M434	S432-M434 PolarHBondContact O-N 3.31Å
433	D	92.6	Very high	95.4	Very high	77 Å²	77	48.8 Å²	48.8	41%	0.412	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	22.9	174.1	70.7	-22.5	0	0	0	113.3	K431 K435	K431-D433 WeakPolarHBondContact CB-OD1 3.06Å; K431-D433 PolarHBondContact O-N 3.47Å; K431-D433 VanDerWaalsContact O-N 3.16Å; D433-K435 VanDerWaalsContact C-N 3.29Å; D433-K435 PolarHBondContact O-N 2.91Å; D433-K435 VanDerWaalsContact OD2-CD 3.22Å; D433-K435 WeakPolarHBondContact OD2-CD 3.19Å; D433-K435 WeakPolarHBondContact OD2-CE 3.31Å; D433-K435 IonicContact OD2-NZ 2.65Å; D433-K435 PolarHBondContact OD2-NZ 3.02Å
434	M	92.9	Very high	95.3	Very high	58 Å²	58	52.6 Å²	52.6	29%	0.286	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	31.7	177.9	-54.3	-75.8	-64	0	0	113.5	F324 K431 S432 L450 S451	F324-M434 HydrophobicContact CB-CE 3.52Å; F324-M434 HydrophobicContact CB-SD 3.71Å; F324-M434 HydrophobicContact CD1-CE 4.07Å; F324-M434 HydrophobicContact CD1-SD 3.18Å; F324-M434 WeakPolarHBondContact CD1-SD 3.31Å; F324-M434 HydrophobicContact CD2-CE 3.93Å; F324-M434 HydrophobicContact CD2-SD 4.04Å; F324-M434 HydrophobicContact CE1-SD 3.67Å; F324-M434 HydrophobicContact CE2-SD 4.47Å; F324-M434 HydrophobicContact CG-CE 3.59Å; F324-M434 HydrophobicContact CG-SD 3.37Å; F324-M434 WeakPolarHBondContact CG-SD 3.44Å; F324-M434 HydrophobicContact CZ-SD 4.3Å; K431-M434 PolarHBondContact O-N 3.42Å; K431-M434 VanDerWaalsContact O-N 3.08Å; S432-M434 PolarHBondContact O-N 3.31Å; M434-L450 WeakPolarHBondContact CB-O 3.14Å; M434-L450 PolarHBondContact O-N 3.41Å; M434-S451 WeakPolarHBondContact CE-O 3.42Å
435	K	95.3	Very high	95.3	Very high	76 Å²	76	55.7 Å²	55.7	33%	0.33	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.9	174.6	-65.4	177.9	-170.7	147.2	0	111.6	K431 D433 I447 F448	K431-K435 HydrophobicContact CB-CB 4.42Å; K431-K435 PolarHBondContact N-O 3.29Å; D433-K435 VanDerWaalsContact C-N 3.29Å; D433-K435 PolarHBondContact O-N 2.91Å; D433-K435 VanDerWaalsContact OD2-CD 3.22Å; D433-K435 WeakPolarHBondContact OD2-CD 3.19Å; D433-K435 WeakPolarHBondContact OD2-CE 3.31Å; D433-K435 IonicContact OD2-NZ 2.65Å; D433-K435 PolarHBondContact OD2-NZ 3.02Å; K435-I447 HydrophobicContact CB-CG2 3.99Å; K435-I447 HydrophobicContact CD-CG2 3.84Å; K435-I447 HydrophobicContact CG-CG2 4.28Å; K435-F448 CarbonylContact C-O 3.51Å; K435-F448 WeakPolarHBondContact CA-O 3.29Å
436	C	96.6	Very high	95.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.9	166.3	76.3	0	0	0	0	111	L349 S429 F430 I447 F448 L450	L349-C436 HydrophobicContact CD2-CB 4.26Å; S429-C436 WeakPolarHBondContact O-CA 3.41Å; F430-C436 HydrophobicContact CD1-CB 3.99Å; F430-C436 HydrophobicContact CE1-CB 4.21Å; C436-I447 WeakPolarHBondContact O-CA 3.25Å; C436-F448 PolarHBondContact N-O 2.85Å; C436-F448 PolarHBondContact O-N 3.36Å; C436-L450 HydrophobicContact CB-CD1 3.62Å; C436-L450 HydrophobicContact CB-CG 4.43Å
437	I	97.4	Very high	95	Very high	36 Å²	36	55.5 Å²	55.5	19%	0.185	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.5	171.1	-51.9	-175.6	0	0	0	107.7	L428 S429 K445 K446 I447	L428-I437 HydrophobicContact CB-CB 4.29Å; L428-I437 HydrophobicContact CB-CG2 4.27Å; L428-I437 HydrophobicContact CD1-CG2 4.16Å; L428-I437 PolarHBondContact N-O 3.44Å; S429-I437 PolarHBondContact O-N 3.08Å; S429-I437 WeakPolarHBondContact OG-CD1 3.42Å; I437-K445 HydrophobicContact CG2-CB 4.38Å; I437-K446 CarbonylContact C-O 3.55Å; I437-K446 WeakPolarHBondContact CA-O 3.39Å; I437-I447 HydrophobicContact CG1-CG1 4.38Å
438	L	96.9	Very high	94.8	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	147.3	172.6	-58.3	-173	0	0	0	110.1	L349 I372 V374 F422 R426 V427 K445 K446 F448	L349-L438 HydrophobicContact CD1-CD1 4.48Å; L349-L438 HydrophobicContact CD1-CD2 4.38Å; I372-L438 HydrophobicContact CG2-CD1 4.31Å; V374-L438 HydrophobicContact CG1-CD2 4.39Å; V374-L438 HydrophobicContact CG2-CD1 3.51Å; V374-L438 HydrophobicContact CG2-CD2 3.95Å; V374-L438 HydrophobicContact CG2-CG 4.4Å; F422-L438 HydrophobicContact CD1-CD1 4.22Å; F422-L438 HydrophobicContact CE1-CD1 4.48Å; F422-L438 HydrophobicContact CG-CD1 4.31Å; R426-L438 CarbonylContact O-C 3.53Å; R426-L438 WeakPolarHBondContact O-CA 3.31Å; V427-L438 HydrophobicContact CB-CD2 4.3Å; V427-L438 HydrophobicContact CG2-CD2 3.75Å; L438-K445 CarbonylContact O-C 3.5Å; L438-K445 VanDerWaalsContact O-CA 3.27Å; L438-K445 WeakPolarHBondContact O-CA 3.47Å; L438-K446 PolarHBondContact N-O 3.29Å; L438-K446 PolarHBondContact O-N 3.42Å; L438-F448 HydrophobicContact CB-CE2 4.38Å; L438-F448 HydrophobicContact CD1-CD2 3.73Å; L438-F448 HydrophobicContact CD1-CE2 3.72Å; L438-F448 HydrophobicContact CG-CD2 3.95Å; L438-F448 HydrophobicContact CG-CE2 4.18Å
439	Q	96.4	Very high	94.7	Very high	27 Å²	27	59.5 Å²	59.5	13%	0.126	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.1	173	-174.7	-179.2	49.2	0	0	110.4	H425 R426 L428 G443 L444 K445	H425-Q439 CarbonylContact C-O 3.53Å; H425-Q439 VanDerWaalsContact CA-O 3.31Å; H425-Q439 WeakPolarHBondContact CA-O 3.45Å; R426-Q439 HydrophobicContact CG-CB 4.3Å; R426-Q439 PolarHBondContact N-O 3.22Å; R426-Q439 PolarHBondContact O-N 3.25Å; L428-Q439 HydrophobicContact CD1-CB 3.63Å; L428-Q439 HydrophobicContact CD1-CG 4.26Å; L428-Q439 HydrophobicContact CD2-CB 4.15Å; L428-Q439 HydrophobicContact CG-CB 3.68Å; Q439-G443 PolarHBondContact NE2-O 3.09Å; Q439-L444 WeakPolarHBondContact CA-O 3.27Å; Q439-K445 HydrophobicContact CB-CG 4.46Å; Q439-K445 HydrophobicContact CG-CG 4.3Å
440	S	94.5	Very high	94.4	Very high	12 Å²	12	59.3 Å²	59.3	8%	0.084	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	163.2	170.3	68.1	0	0	0	0	111.4	H425 S442 G443 L444	H425-S440 WeakPolarHBondContact NE2-CB 3.39Å; S440-S442 PolarHBondContact O-N 2.83Å; S440-S442 PolarHBondContact OG-N 2.96Å; S440-S442 PolarHBondContact OG-OG 3.37Å; S440-G443 PolarHBondContact O-N 3.1Å; S440-G443 PolarHBondContact OG-N 3.4Å; S440-L444 PolarHBondContact N-O 3.36Å; S440-L444 WeakPolarHBondContact OG-CB 3.47Å; S440-L444 PolarHBondContact OG-N 2.94Å; S440-L444 VanDerWaalsContact OG-N 3.11Å
441	V	92.3	Very high	94.2	Very high	107 Å²	107	60.2 Å²	60.2	65%	0.648	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.4	168.5	-74.1	0	0	0	0	113.9	E424 G443	E424-V441 HydrophobicContact CB-CB 4.41Å; E424-V441 HydrophobicContact CB-CG1 3.78Å; E424-V441 HydrophobicContact CB-CG2 3.8Å; E424-V441 WeakPolarHBondContact O-CG1 3.43Å; E424-V441 PolarHBondContact O-N 3.13Å; V441-G443 PolarHBondContact O-N 2.67Å
442	S	90.8	Very high	94.1	Very high	104 Å²	104	57.4 Å²	57.4	73%	0.727	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-2.1	174	60	0	0	0	0	113.9	S440 L444	S440-S442 PolarHBondContact O-N 2.83Å; S440-S442 PolarHBondContact OG-N 2.96Å; S440-S442 PolarHBondContact OG-OG 3.37Å; S442-L444 VanDerWaalsContact C-N 3.35Å
443	G	92.3	Very high	94.2	Very high	35 Å²	35	52.3 Å²	52.3	36%	0.361	28%	0.28	S	S	.	.			trans	88.2	-4.2	178.6	0	0	0	0	0	114.8	Q439 S440 V441 K445	Q439-G443 PolarHBondContact NE2-O 3.09Å; S440-G443 PolarHBondContact O-N 3.1Å; S440-G443 PolarHBondContact OG-N 3.4Å; V441-G443 PolarHBondContact O-N 2.67Å; G443-K445 PolarHBondContact O-N 3.06Å
444	L	92.8	Very high	94.4	Very high	101 Å²	101	48.6 Å²	48.6	53%	0.529	26%	0.26	S	S	.	.			trans	-64.9	126.7	178.9	-174	69.4	0	0	0	110.1	Q439 S440 S442	Q439-L444 WeakPolarHBondContact CA-O 3.27Å; S440-L444 PolarHBondContact N-O 3.36Å; S440-L444 WeakPolarHBondContact OG-CB 3.47Å; S440-L444 PolarHBondContact OG-N 2.94Å; S440-L444 VanDerWaalsContact OG-N 3.11Å; S442-L444 VanDerWaalsContact C-N 3.35Å
445	K	95.2	Very high	94.7	Very high	133 Å²	133	45.9 Å²	45.9	58%	0.578	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.1	179.1	-61.9	-179	-175	177.6	0	110.6	L428 I437 L438 Q439 G443	L428-K445 HydrophobicContact CD1-CD 3.97Å; L428-K445 HydrophobicContact CD1-CG 4.13Å; I437-K445 HydrophobicContact CG2-CB 4.38Å; L438-K445 CarbonylContact O-C 3.5Å; L438-K445 VanDerWaalsContact O-CA 3.27Å; L438-K445 WeakPolarHBondContact O-CA 3.47Å; Q439-K445 HydrophobicContact CB-CG 4.46Å; Q439-K445 HydrophobicContact CG-CG 4.3Å; G443-K445 PolarHBondContact O-N 3.06Å
446	K	92.7	Very high	94.7	Very high	51 Å²	51	43 Å²	43	22%	0.222	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.1	174.4	-71.7	-170.1	171	179.8	0	110.6	Y409 I437 L438 F448	Y409-K446 HydrophobicContact CE1-CD 4.1Å; Y409-K446 VanDerWaalsContact CZ-NZ 3.31Å; Y409-K446 PolarHBondContact OH-NZ 3.01Å; I437-K446 CarbonylContact C-O 3.55Å; I437-K446 WeakPolarHBondContact CA-O 3.39Å; L438-K446 PolarHBondContact N-O 3.29Å; L438-K446 PolarHBondContact O-N 3.42Å; K446-F448 HydrophobicContact CB-CD2 4.38Å; K446-F448 HydrophobicContact CB-CE2 3.56Å; K446-F448 HydrophobicContact CB-CZ 4.02Å; K446-F448 HydrophobicContact CD-CZ 4.35Å
447	I	95.1	Very high	94.6	Very high	115 Å²	115	46 Å²	46	59%	0.59	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	128	-177.9	-55	178	0	0	0	107.8	K435 C436 I437	K435-I447 HydrophobicContact CB-CG2 3.99Å; K435-I447 HydrophobicContact CD-CG2 3.84Å; K435-I447 HydrophobicContact CG-CG2 4.28Å; C436-I447 WeakPolarHBondContact O-CA 3.25Å; I437-I447 HydrophobicContact CG1-CG1 4.38Å
448	F	93.8	Very high	94.3	Very high	25 Å²	25	46.4 Å²	46.4	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	139	177.1	-64.3	-86.1	0	0	0	109.8	I372 F422 K435 C436 L438 K446 L450	I372-F448 HydrophobicContact CD1-CB 3.88Å; I372-F448 HydrophobicContact CD1-CD1 3.73Å; I372-F448 HydrophobicContact CD1-CG 3.89Å; F422-F448 AromaticContact CE1-CE2 3.95Å; F422-F448 HydrophobicContact CE1-CE2 3.95Å; F422-F448 AromaticContact CE1-CZ 3.58Å; F422-F448 HydrophobicContact CE1-CZ 3.58Å; F422-F448 HydrophobicContact CE2-CZ 4.43Å; F422-F448 AromaticContact CZ-CE1 3.86Å; F422-F448 HydrophobicContact CZ-CE1 3.86Å; F422-F448 AromaticContact CZ-CE2 3.99Å; F422-F448 HydrophobicContact CZ-CE2 3.99Å; F422-F448 AromaticContact CZ-CZ 3.36Å; F422-F448 HydrophobicContact CZ-CZ 3.36Å; K435-F448 CarbonylContact C-O 3.51Å; K435-F448 WeakPolarHBondContact CA-O 3.29Å; C436-F448 PolarHBondContact N-O 2.85Å; C436-F448 PolarHBondContact O-N 3.36Å; L438-F448 HydrophobicContact CB-CE2 4.38Å; L438-F448 HydrophobicContact CD1-CD2 3.73Å; L438-F448 HydrophobicContact CD1-CE2 3.72Å; L438-F448 HydrophobicContact CG-CD2 3.95Å; L438-F448 HydrophobicContact CG-CE2 4.18Å; K446-F448 HydrophobicContact CB-CD2 4.38Å; K446-F448 HydrophobicContact CB-CE2 3.56Å; K446-F448 HydrophobicContact CB-CZ 4.02Å; K446-F448 HydrophobicContact CD-CZ 4.35Å; F448-L450 HydrophobicContact CB-CD2 4.31Å
449	K	93.7	Very high	94	Very high	113 Å²	113	48.1 Å²	48.1	49%	0.491	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	138	170.3	-168.7	177.6	178.1	-127.2	0	108.8	D346 P347	D346-K449 HydrophobicContact CB-CG 4.46Å; D346-K449 IonicContact OD1-NZ 3.52Å; D346-K449 WeakPolarHBondContact OD2-CE 3.5Å; D346-K449 IonicContact OD2-NZ 2.69Å; D346-K449 PolarHBondContact OD2-NZ 2.93Å; P347-K449 WeakPolarHBondContact CD-O 3.42Å
450	L	93.3	Very high	93.7	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	29%	0.286	C	S	.	.			trans	-129.1	154.9	-170.8	-55.1	178.5	0	0	0	111.5	P347 L349 I372 M434 C436 F448 A453	P347-L450 CarbonylContact O-C 3.54Å; P347-L450 VanDerWaalsContact O-CA 3.27Å; P347-L450 WeakPolarHBondContact O-CA 3.34Å; L349-L450 HydrophobicContact CB-CD1 3.64Å; L349-L450 HydrophobicContact CB-CD2 3.84Å; L349-L450 HydrophobicContact CB-CG 4.37Å; L349-L450 HydrophobicContact CD2-CD1 4.09Å; L349-L450 HydrophobicContact CG-CD1 4.41Å; I372-L450 HydrophobicContact CD1-CD2 4.09Å; M434-L450 WeakPolarHBondContact CB-O 3.14Å; M434-L450 PolarHBondContact O-N 3.41Å; C436-L450 HydrophobicContact CB-CD1 3.62Å; C436-L450 HydrophobicContact CB-CG 4.43Å; F448-L450 HydrophobicContact CB-CD2 4.31Å; L450-A453 HydrophobicContact CD1-CB 4.34Å
451	S	92.4	Very high	93.6	Very high	22 Å²	22	50.2 Å²	50.2	15%	0.154	29%	0.285	C	S	.	.	S	Bend	trans	-91.8	-29.9	164.1	53.4	0	0	0	0	112.6	D346 P347 V348 M434	D346-S451 WeakPolarHBondContact O-CB 3.26Å; D346-S451 PolarHBondContact O-OG 3.18Å; P347-S451 PolarHBondContact O-N 3.14Å; P347-S451 PolarHBondContact O-OG 3.1Å; V348-S451 WeakPolarHBondContact CG2-OG 3.29Å; M434-S451 WeakPolarHBondContact CE-O 3.42Å
452	A	94.9	Very high	93.6	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.017	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	167.3	171.1	0	0	0	0	0	110.8	F324 F326 L341 V348 L349	F324-A452 WeakPolarHBondContact O-CA 3.48Å; F326-A452 HydrophobicContact CD2-CB 4.26Å; F326-A452 HydrophobicContact CE2-CB 3.75Å; L341-A452 HydrophobicContact CD1-CB 4.3Å; L341-A452 HydrophobicContact CD2-CB 3.8Å; V348-A452 WeakPolarHBondContact CA-O 3.28Å; V348-A452 HydrophobicContact CG2-CB 4.29Å; L349-A452 PolarHBondContact N-O 3.39Å
453	A	96.8	Very high	93.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.1	167	0	0	0	0	0	110.2	F324 V325 F326 L349 F430 L450	F324-A453 PolarHBondContact O-N 3.29Å; V325-A453 CarbonylContact C-O 3.48Å; V325-A453 WeakPolarHBondContact CA-O 3.49Å; V325-A453 HydrophobicContact CG1-CB 4.31Å; V325-A453 HydrophobicContact CG2-CB 4.25Å; F326-A453 PolarHBondContact N-O 3.35Å; L349-A453 HydrophobicContact CB-CB 4.06Å; L349-A453 HydrophobicContact CD2-CB 4.12Å; L349-A453 CarbonylContact O-C 3.46Å; L349-A453 WeakPolarHBondContact O-CA 3.41Å; F430-A453 HydrophobicContact CD1-CB 4.15Å; F430-A453 HydrophobicContact CE1-CB 3.44Å; F430-A453 VanDerWaalsContact CE1-CB 3.44Å; F430-A453 HydrophobicContact CZ-CB 4.05Å; L450-A453 HydrophobicContact CD1-CB 4.34Å
454	V	97.3	Very high	93.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	110	179.2	-158.8	0	0	0	0	108.2	F326 F332 V348 L349 V351 L456	F326-V454 HydrophobicContact CB-CG1 4.36Å; F326-V454 HydrophobicContact CD2-CG2 4.45Å; F326-V454 CarbonylContact O-C 3.4Å; F326-V454 WeakPolarHBondContact O-CA 3.37Å; F332-V454 HydrophobicContact CB-CG1 4.03Å; F332-V454 HydrophobicContact CB-CG2 4.3Å; F332-V454 HydrophobicContact CD1-CG2 4.29Å; F332-V454 HydrophobicContact CD2-CG2 3.41Å; F332-V454 VanDerWaalsContact CD2-CG2 3.41Å; F332-V454 HydrophobicContact CE1-CG2 4.49Å; F332-V454 HydrophobicContact CE2-CG2 3.68Å; F332-V454 HydrophobicContact CG-CG1 4.17Å; F332-V454 HydrophobicContact CG-CG2 3.75Å; F332-V454 HydrophobicContact CZ-CG2 4.21Å; V348-V454 HydrophobicContact CG1-CG2 3.78Å; L349-V454 PolarHBondContact O-N 2.97Å; V351-V454 PolarHBondContact N-O 3.15Å; V454-L456 HydrophobicContact CG1-CD1 3.71Å; V454-L456 HydrophobicContact CG1-CD2 4.12Å; V454-L456 HydrophobicContact CG1-CG 3.79Å
455	V	97.9	Very high	94.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	104	-176.7	179.9	0	0	0	0	109	L315 V325 F326 H327 V351 F430 I457	L315-V455 HydrophobicContact CD1-CG1 3.89Å; L315-V455 HydrophobicContact CD1-CG2 3.75Å; L315-V455 HydrophobicContact CD2-CG1 4.49Å; L315-V455 HydrophobicContact CG-CG1 3.76Å; V325-V455 HydrophobicContact CG1-CG2 3.92Å; F326-V455 PolarHBondContact O-N 2.68Å; H327-V455 WeakPolarHBondContact CA-O 3.5Å; V351-V455 HydrophobicContact CG2-CG2 4.39Å; F430-V455 HydrophobicContact CZ-CG2 4.27Å; V455-I457 HydrophobicContact CG1-CD1 4.08Å; V455-I457 HydrophobicContact CG1-CG1 4Å; V455-I457 HydrophobicContact CG1-CG2 4.25Å
456	L	96.1	Very high	94.1	Very high	14 Å²	14	34.4 Å²	34.4	7%	0.073	19%	0.192	C	C	.	.			trans	-124	64.2	-173	-61	171.4	0	0	0	110.1	M329 V351 T356 A357 A360 V454	M329-L456 HydrophobicContact SD-CD1 4.03Å; V351-L456 CarbonylContact O-C 3.52Å; V351-L456 WeakPolarHBondContact O-CA 3.49Å; V351-L456 PolarHBondContact O-N 3.49Å; T356-L456 HydrophobicContact CG2-CB 4.48Å; T356-L456 HydrophobicContact CG2-CD1 4.23Å; T356-L456 HydrophobicContact CG2-CD2 3.99Å; T356-L456 HydrophobicContact CG2-CG 4.46Å; T356-L456 WeakPolarHBondContact O-CD1 3.25Å; A357-L456 HydrophobicContact CB-CB 4.18Å; A360-L456 HydrophobicContact CB-CD1 3.37Å; V454-L456 HydrophobicContact CG1-CD1 3.71Å; V454-L456 HydrophobicContact CG1-CD2 4.12Å; V454-L456 HydrophobicContact CG1-CG 3.79Å
457	I	94	Very high	94.1	Very high	63 Å²	63	39.2 Å²	39.2	32%	0.323	21%	0.213	S	C	.	.	S	Bend	trans	-102.6	10.9	-173.6	61.9	173.2	0	0	0	113.7	A313 L315 V351 V455	A313-I457 HydrophobicContact CB-CD1 4.19Å; A313-I457 HydrophobicContact CB-CG1 3.84Å; A313-I457 WeakPolarHBondContact O-CG1 3.35Å; L315-I457 HydrophobicContact CD2-CD1 3.91Å; L315-I457 HydrophobicContact CD2-CG2 4.47Å; L315-I457 HydrophobicContact CG-CD1 4.17Å; V351-I457 HydrophobicContact CG1-CG2 4.08Å; V455-I457 HydrophobicContact CG1-CD1 4.08Å; V455-I457 HydrophobicContact CG1-CG1 4Å; V455-I457 HydrophobicContact CG1-CG2 4.25Å
458	G	90.9	Very high	94	Very high	46 Å²	46	39.5 Å²	39.5	47%	0.474	21%	0.212	S	C	.	.			trans	114.6	-174.2	-178.2	0	0	0	0	0	112.3	A313	A313-G458 WeakPolarHBondContact CB-O 3.38Å; A313-G458 PolarHBondContact N-O 3.04Å
459	S	91	Very high	94	Very high	38 Å²	38	43.9 Å²	43.9	27%	0.266	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	165.1	-179.7	44.8	0	0	0	0	110.5	T308 L309 S311	T308-S459 CarbonylContact O-C 3.58Å; T308-S459 WeakPolarHBondContact O-CB 3.49Å; T308-S459 PolarHBondContact O-OG 3.06Å; T308-S459 VanDerWaalsContact O-OG 3.09Å; L309-S459 WeakPolarHBondContact CD2-OG 3.42Å; S311-S459 CarbonylContact O-C 3.6Å; S311-S459 WeakPolarHBondContact O-CA 3.11Å; S311-S459 VanDerWaalsContact O-CB 3.25Å; S311-S459 WeakPolarHBondContact O-CB 3.38Å
460	H	90.1	Very high	94	Very high	75 Å²	75	38.5 Å²	38.5	35%	0.347	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	150.3	-177.9	-60.3	-75.9	0	0	0	110.1	T308 S311	T308-H460 CarbonylContact O-C 3.58Å; T308-H460 VanDerWaalsContact O-C 3.24Å; T308-H460 PolarHBondContact O-N 3.36Å; T308-H460 VanDerWaalsContact O-O 3.07Å; S311-H460 WeakPolarHBondContact CB-O 3.49Å; S311-H460 PolarHBondContact N-O 3.16Å; S311-H460 VanDerWaalsContact N-O 3.09Å; S311-H460 PolarHBondContact O-N 3.26Å
461	P	91.8	Very high	94.1	Very high	8 Å²	8	39.7 Å²	39.7	5%	0.052	22%	0.217	C	C	.	.			trans	-62.7	138	168.7	29.3	-33.5	0	0	0	110	G307 T308 L463 I481 L509	G307-P461 WeakPolarHBondContact O-CB 3.31Å; T308-P461 HydrophobicContact CG2-CB 4.28Å; T308-P461 HydrophobicContact CG2-CG 4.45Å; P461-L463 HydrophobicContact CB-CG 4.31Å; P461-L463 PolarHBondContact O-N 3.47Å; P461-I481 WeakPolarHBondContact CD-O 3.39Å; P461-I481 HydrophobicContact CG-CB 4.26Å; P461-I481 HydrophobicContact CG-CG2 4Å; P461-I481 WeakPolarHBondContact CG-O 3.46Å; P461-L509 HydrophobicContact CB-CD2 3.51Å; P461-L509 HydrophobicContact CG-CD2 3.92Å
462	N	92.3	Very high	94.2	Very high	44 Å²	44	41.5 Å²	41.5	24%	0.235	22%	0.221	C	C	.	.			trans	-91.2	101.7	172.3	-172.7	-20.7	0	0	0	109.7	D310 S311 S464 F465	D310-N462 HydrophobicContact CB-CB 3.53Å; S311-N462 WeakPolarHBondContact OG-CB 3.25Å; N462-S464 WeakPolarHBondContact OD1-CB 3.49Å; N462-S464 PolarHBondContact OD1-N 3.38Å; N462-S464 VanDerWaalsContact OD1-N 3.16Å; N462-S464 PolarHBondContact OD1-OG 3.34Å; N462-F465 WeakPolarHBondContact O-CE1 3.34Å
463	L	95.4	Very high	94.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	22%	0.221	C	C	.	.			trans	-112	24.3	178.2	-62.1	-179.5	0	0	0	112	P461 F465 L466 Q469 I481 L509	P461-L463 HydrophobicContact CB-CG 4.31Å; P461-L463 PolarHBondContact O-N 3.47Å; L463-F465 HydrophobicContact CD2-CE1 4.35Å; L463-F465 HydrophobicContact CD2-CZ 3.82Å; L463-F465 PolarHBondContact O-N 3.03Å; L463-L466 HydrophobicContact CB-CD1 4.33Å; L463-L466 HydrophobicContact CD2-CD1 4.38Å; L463-L466 WeakPolarHBondContact O-CB 3.36Å; L463-L466 PolarHBondContact O-N 3.25Å; L463-Q469 VanDerWaalsContact CB-O 3.25Å; L463-Q469 WeakPolarHBondContact CB-O 3.42Å; L463-Q469 WeakPolarHBondContact O-CA 3.29Å; L463-I481 HydrophobicContact CD1-CB 4.12Å; L463-I481 HydrophobicContact CD1-CG1 4.03Å; L463-I481 HydrophobicContact CD1-CG2 4.23Å; L463-L509 HydrophobicContact CD1-CD2 4.32Å; L463-L509 HydrophobicContact CD2-CD2 4.47Å
464	S	95.4	Very high	94.2	Very high	78 Å²	78	41.4 Å²	41.4	55%	0.545	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.7	-177.6	55.3	0	0	0	0	114.9	N462 L466	N462-S464 WeakPolarHBondContact OD1-CB 3.49Å; N462-S464 PolarHBondContact OD1-N 3.38Å; N462-S464 VanDerWaalsContact OD1-N 3.16Å; N462-S464 PolarHBondContact OD1-OG 3.34Å; S464-L466 VanDerWaalsContact C-N 3.28Å; S464-L466 PolarHBondContact O-N 2.64Å
465	F	96	Very high	94	Very high	15 Å²	15	46.8 Å²	46.8	7%	0.066	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.7	174.2	56.8	-98.1	0	0	0	113.9	I66 I242 S244 V245 L304 T306 N462 L463	I66-F465 HydrophobicContact CD1-CE2 4.15Å; I66-F465 HydrophobicContact CG2-CZ 4.14Å; I242-F465 HydrophobicContact CB-CB 4.37Å; I242-F465 HydrophobicContact CB-CD1 4.34Å; I242-F465 HydrophobicContact CB-CG 4.25Å; I242-F465 HydrophobicContact CG2-CB 3.89Å; I242-F465 HydrophobicContact CG2-CD2 4.18Å; I242-F465 HydrophobicContact CG2-CG 3.94Å; S244-F465 CarbonylContact C-O 3.58Å; S244-F465 WeakPolarHBondContact CA-O 3.09Å; V245-F465 HydrophobicContact CB-CD2 4.06Å; V245-F465 HydrophobicContact CG2-CD2 3.56Å; V245-F465 HydrophobicContact CG2-CE2 4.07Å; V245-F465 HydrophobicContact CG2-CG 4.47Å; V245-F465 PolarHBondContact N-O 3.35Å; L304-F465 HydrophobicContact CD2-CE2 3.94Å; L304-F465 HydrophobicContact CD2-CZ 4.26Å; T306-F465 HydrophobicContact CG2-CE1 4.19Å; T306-F465 HydrophobicContact CG2-CZ 3.91Å; N462-F465 WeakPolarHBondContact O-CE1 3.34Å; L463-F465 HydrophobicContact CD2-CE1 4.35Å; L463-F465 HydrophobicContact CD2-CZ 3.82Å; L463-F465 PolarHBondContact O-N 3.03Å
466	L	96.3	Very high	93.8	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	26%	0.264	C	S	.	.	S	Bend	trans	-99.3	152.7	172.7	-67.3	170.7	0	0	0	110.7	V245 L304 L463 S464 E468 Q469 L473	V245-L466 HydrophobicContact CB-CD2 3.82Å; V245-L466 HydrophobicContact CG1-CD2 4.02Å; L304-L466 HydrophobicContact CD1-CD1 3.84Å; L463-L466 HydrophobicContact CB-CD1 4.33Å; L463-L466 HydrophobicContact CD2-CD1 4.38Å; L463-L466 WeakPolarHBondContact O-CB 3.36Å; L463-L466 PolarHBondContact O-N 3.25Å; S464-L466 VanDerWaalsContact C-N 3.28Å; S464-L466 PolarHBondContact O-N 2.64Å; L466-E468 PolarHBondContact O-N 3.45Å; L466-Q469 PolarHBondContact O-N 2.65Å; L466-Q469 VanDerWaalsContact O-N 3.13Å; L466-L473 HydrophobicContact CD1-CD1 4.05Å
467	K	92.6	Very high	93.7	Very high	151 Å²	151	53 Å²	53	66%	0.657	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-53.7	130.4	170.8	-174.9	-174.4	178.1	-157.4	0	109.9	Q469 G470	K467-Q469 PolarHBondContact O-N 3.33Å; K467-Q469 VanDerWaalsContact O-N 3.12Å; K467-G470 PolarHBondContact O-N 3Å
468	E	91.9	Very high	93.7	Very high	121 Å²	121	54.2 Å²	54.2	57%	0.565	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	51.2	35.7	179.1	-65	164.5	-142.5	0	0	112.6	L466 G470 C471	L466-E468 PolarHBondContact O-N 3.45Å; E468-G470 PolarHBondContact O-N 2.68Å; E468-C471 PolarHBondContact O-N 2.83Å; E468-C471 VanDerWaalsContact O-N 3.08Å; E468-C471 PolarHBondContact O-SG 3.03Å
469	Q	93.6	Very high	93.8	Very high	118 Å²	118	56.7 Å²	56.7	55%	0.551	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	53.8	24	-175.8	-50.9	-169.8	31.8	0	0	114.4	L463 L466 K467 C471	L463-Q469 VanDerWaalsContact CB-O 3.25Å; L463-Q469 WeakPolarHBondContact CB-O 3.42Å; L463-Q469 WeakPolarHBondContact O-CA 3.29Å; L466-Q469 PolarHBondContact O-N 2.65Å; L466-Q469 VanDerWaalsContact O-N 3.13Å; K467-Q469 PolarHBondContact O-N 3.33Å; K467-Q469 VanDerWaalsContact O-N 3.12Å; Q469-C471 VanDerWaalsContact C-N 3.27Å; Q469-C471 PolarHBondContact O-N 2.62Å
470	G	94.3	Very high	93.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	70.9	14.3	-178.7	0	0	0	0	0	114.8	K467 E468 Y472 L473 I481	K467-G470 PolarHBondContact O-N 3Å; E468-G470 PolarHBondContact O-N 2.68Å; G470-Y472 PolarHBondContact O-N 2.71Å; G470-Y472 VanDerWaalsContact O-N 3.08Å; G470-L473 VanDerWaalsContact O-CB 3.25Å; G470-L473 WeakPolarHBondContact O-CB 3.42Å; G470-L473 PolarHBondContact O-N 3.01Å; G470-I481 WeakPolarHBondContact O-CD1 3.26Å
471	C	94.9	Very high	94.1	Very high	26 Å²	26	55 Å²	55	18%	0.176	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-50.4	-37.4	179.2	-68.7	0	0	0	0	112.5	E468 Q469 L473 G474 S477	E468-C471 PolarHBondContact O-N 2.83Å; E468-C471 VanDerWaalsContact O-N 3.08Å; E468-C471 PolarHBondContact O-SG 3.03Å; Q469-C471 VanDerWaalsContact C-N 3.27Å; Q469-C471 PolarHBondContact O-N 2.62Å; C471-L473 PolarHBondContact O-N 2.83Å; C471-L473 VanDerWaalsContact O-N 3.08Å; C471-G474 PolarHBondContact O-N 3.06Å; C471-G474 VanDerWaalsContact O-N 3.09Å; C471-S477 WeakPolarHBondContact O-CA 3.48Å
472	Y	95.1	Very high	94.1	Very high	61 Å²	61	56.1 Å²	56.1	24%	0.239	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58.9	-20.8	177.7	76.8	-87.2	0	0	0	114.2	G470 K499 E500	G470-Y472 PolarHBondContact O-N 2.71Å; G470-Y472 VanDerWaalsContact O-N 3.08Å; Y472-K499 WeakPolarHBondContact O-CD 3.33Å; Y472-E500 HydrophobicContact CE2-CB 4.46Å; Y472-E500 WeakPolarHBondContact CE2-OE2 3.44Å; Y472-E500 PolarHBondContact OH-OE2 3.48Å
473	L	96.3	Very high	93.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-81.8	-18.3	179.3	-60.6	171.5	0	0	0	113.3	L304 L466 G470 C471 V488 E489 C497 E500 L503	L304-L473 HydrophobicContact CD1-CD1 4.34Å; L466-L473 HydrophobicContact CD1-CD1 4.05Å; G470-L473 VanDerWaalsContact O-CB 3.25Å; G470-L473 WeakPolarHBondContact O-CB 3.42Å; G470-L473 PolarHBondContact O-N 3.01Å; C471-L473 PolarHBondContact O-N 2.83Å; C471-L473 VanDerWaalsContact O-N 3.08Å; L473-V488 HydrophobicContact CB-CG1 4.04Å; L473-V488 HydrophobicContact CB-CG2 4.4Å; L473-E489 PolarHBondContact O-N 3.36Å; L473-C497 HydrophobicContact CD2-CB 4.25Å; L473-E500 HydrophobicContact CD2-CB 3.78Å; L473-L503 HydrophobicContact CD1-CD2 3.78Å; L473-L503 HydrophobicContact CD2-CD2 3.94Å
474	G	95.8	Very high	93.3	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-78.5	164.7	-178.1	0	0	0	0	0	112.5	C471 N476 I481 P487 K499	C471-G474 PolarHBondContact O-N 3.06Å; C471-G474 VanDerWaalsContact O-N 3.09Å; G474-N476 PolarHBondContact O-N 3.25Å; G474-I481 VanDerWaalsContact CA-CD1 3.42Å; G474-I481 VanDerWaalsContact N-CD1 3.32Å; G474-P487 VanDerWaalsContact CA-O 3.31Å; G474-P487 WeakPolarHBondContact CA-O 3.29Å; G474-K499 PolarHBondContact O-NZ 3.47Å
475	H	92.9	Very high	93.1	Very high	112 Å²	112	63.4 Å²	63.4	52%	0.519	34%	0.341	S	S	.	.	S	Bend	trans	-54	-38.5	174.1	-71.6	-68.5	0	0	0	112.6	N486 P487 E489	H475-N486 PolarHBondContact N-OD1 3.41Å; H475-N486 VanDerWaalsContact N-OD1 3.1Å; H475-P487 PolarHBondContact N-O 3.49Å; H475-E489 IonicContact ND1-OE1 3.83Å; H475-E489 IonicContact ND1-OE2 3.21Å
476	N	94.2	Very high	93	Very high	73 Å²	73	63 Å²	63	39%	0.39	34%	0.339	S	S	.	.	S	Bend	trans	-111.7	109	172.2	-173.5	-16.3	0	0	0	110.3	G474 S478 Q479 N486	G474-N476 PolarHBondContact O-N 3.25Å; N476-S478 PolarHBondContact O-N 2.71Å; N476-S478 WeakPolarHBondContact OD1-CB 3.13Å; N476-S478 PolarHBondContact OD1-N 3.26Å; N476-S478 PolarHBondContact OD1-OG 2.94Å; N476-Q479 HydrophobicContact CB-CB 4.35Å; N476-Q479 HydrophobicContact CB-CG 4.27Å; N476-Q479 PolarHBondContact O-N 3.05Å; N476-N486 PolarHBondContact N-OD1 3.03Å; N476-N486 PolarHBondContact O-ND2 3.26Å
477	S	93.4	Very high	93	Very high	74 Å²	74	63.6 Å²	63.6	52%	0.517	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.1	-178	54	0	0	0	0	114.6	C471	C471-S477 WeakPolarHBondContact O-CA 3.48Å
478	S	92.8	Very high	93.2	Very high	87 Å²	87	56.6 Å²	56.6	61%	0.608	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-5.5	178.3	69.9	0	0	0	0	113.9	N476	N476-S478 PolarHBondContact O-N 2.71Å; N476-S478 WeakPolarHBondContact OD1-CB 3.13Å; N476-S478 PolarHBondContact OD1-N 3.26Å; N476-S478 PolarHBondContact OD1-OG 2.94Å
479	Q	93.1	Very high	93.4	Very high	99 Å²	99	53.3 Å²	53.3	46%	0.463	30%	0.298	S	S	.	.	S	Bend	trans	-116	149.6	-175.8	-65.8	-64.7	-45.6	0	0	110.5	N476 N486	N476-Q479 HydrophobicContact CB-CB 4.35Å; N476-Q479 HydrophobicContact CB-CG 4.27Å; N476-Q479 PolarHBondContact O-N 3.05Å; Q479-N486 HydrophobicContact CB-CB 4.47Å; Q479-N486 PolarHBondContact O-ND2 3.49Å
480	P	92.9	Very high	93.6	Very high	69 Å²	69	48.7 Å²	48.7	45%	0.448	28%	0.278	S	S	.	.			trans	-62.5	152.2	174.1	27.3	-34.5	0	0	0	111.3	T482 N486	P480-T482 PolarHBondContact O-N 2.91Å; P480-N486 WeakPolarHBondContact O-CB 3.45Å; P480-N486 PolarHBondContact O-ND2 3.47Å
481	I	94.4	Very high	93.8	Very high	9 Å²	9	51.9 Å²	51.9	5%	0.046	30%	0.295	C	S	.	.			trans	-67.8	128.4	174.7	-57.9	-58.1	0	0	0	109.7	P461 L463 G470 G474 N486 V488 L509	P461-I481 WeakPolarHBondContact CD-O 3.39Å; P461-I481 HydrophobicContact CG-CB 4.26Å; P461-I481 HydrophobicContact CG-CG2 4Å; P461-I481 WeakPolarHBondContact CG-O 3.46Å; L463-I481 HydrophobicContact CD1-CB 4.12Å; L463-I481 HydrophobicContact CD1-CG1 4.03Å; L463-I481 HydrophobicContact CD1-CG2 4.23Å; G470-I481 WeakPolarHBondContact O-CD1 3.26Å; G474-I481 VanDerWaalsContact CA-CD1 3.42Å; G474-I481 VanDerWaalsContact N-CD1 3.32Å; I481-N486 WeakPolarHBondContact CA-O 3.3Å; I481-V488 HydrophobicContact CD1-CG2 4.31Å; I481-V488 HydrophobicContact CG2-CG2 3.85Å; I481-L509 HydrophobicContact CG2-CD2 4.31Å
482	T	91.8	Very high	93.9	Very high	31 Å²	31	52.3 Å²	52.3	19%	0.19	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-142.7	148	175.4	65.4	0	0	0	0	110.2	P480 K484 G485 N486 P487	P480-T482 PolarHBondContact O-N 2.91Å; T482-K484 VanDerWaalsContact C-N 3.25Å; T482-K484 PolarHBondContact O-N 3Å; T482-G485 WeakPolarHBondContact OG1-CA 3.5Å; T482-G485 PolarHBondContact OG1-N 3.43Å; T482-G485 VanDerWaalsContact OG1-N 3.07Å; T482-N486 PolarHBondContact N-O 3.41Å; T482-N486 CarbonylContact O-C 3.4Å; T482-N486 PolarHBondContact O-N 3.47Å; T482-N486 VanDerWaalsContact O-O 3.14Å; T482-N486 PolarHBondContact OG1-N 2.87Å; T482-P487 VanDerWaalsContact O-CA 3.26Å; T482-P487 WeakPolarHBondContact O-CA 3.27Å
483	C	85.8	Confident	94	Very high	28 Å²	28	52.2 Å²	52.2	19%	0.189	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.8	-175.3	59.9	0	0	0	0	115.2	T308 P508 G511 N513	T308-C483 HydrophobicContact CG2-CB 3.9Å; C483-P508 WeakPolarHBondContact CA-O 3.27Å; C483-P508 HydrophobicContact CB-CB 4.43Å; C483-P508 WeakPolarHBondContact CB-O 3.33Å; C483-G511 WeakPolarHBondContact O-CA 3.37Å; C483-N513 WeakPolarHBondContact CB-OD1 3.44Å; C483-N513 PolarHBondContact SG-OD1 3.2Å
484	K	85.6	Confident	94	Very high	182 Å²	182	54 Å²	54	79%	0.791	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-34.8	-176.9	-69	-174.4	179.8	-175	0	114	T482	T482-K484 VanDerWaalsContact C-N 3.25Å; T482-K484 PolarHBondContact O-N 3Å
485	G	90.7	Very high	94.1	Very high	67 Å²	67	54 Å²	54	69%	0.691	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-36.3	-173.8	0	0	0	0	0	113.4	T482	T482-G485 WeakPolarHBondContact OG1-CA 3.5Å; T482-G485 PolarHBondContact OG1-N 3.43Å; T482-G485 VanDerWaalsContact OG1-N 3.07Å
486	N	94.9	Very high	94.4	Very high	6 Å²	6	50 Å²	50	3%	0.032	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-154.2	68	-175.4	-171.5	36.1	0	0	0	110.2	H475 N476 Q479 P480 I481 T482	H475-N486 PolarHBondContact N-OD1 3.41Å; H475-N486 VanDerWaalsContact N-OD1 3.1Å; N476-N486 PolarHBondContact N-OD1 3.03Å; N476-N486 PolarHBondContact O-ND2 3.26Å; Q479-N486 HydrophobicContact CB-CB 4.47Å; Q479-N486 PolarHBondContact O-ND2 3.49Å; P480-N486 WeakPolarHBondContact O-CB 3.45Å; P480-N486 PolarHBondContact O-ND2 3.47Å; I481-N486 WeakPolarHBondContact CA-O 3.3Å; T482-N486 PolarHBondContact N-O 3.41Å; T482-N486 CarbonylContact O-C 3.4Å; T482-N486 PolarHBondContact O-N 3.47Å; T482-N486 VanDerWaalsContact O-O 3.14Å; T482-N486 PolarHBondContact OG1-N 2.87Å
487	P	95.6	Very high	94.6	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.143	28%	0.275	C	S	.	.			trans	-66.4	161.1	177.5	28.3	-34.1	0	0	0	110.7	G474 H475 T482 E489 L509	G474-P487 VanDerWaalsContact CA-O 3.31Å; G474-P487 WeakPolarHBondContact CA-O 3.29Å; H475-P487 PolarHBondContact N-O 3.49Å; T482-P487 VanDerWaalsContact O-CA 3.26Å; T482-P487 WeakPolarHBondContact O-CA 3.27Å; P487-E489 PolarHBondContact O-N 2.81Å; P487-L509 CarbonylContact C-O 3.59Å; P487-L509 WeakPolarHBondContact CA-O 3.27Å; P487-L509 WeakPolarHBondContact CB-O 3.4Å
488	V	96.9	Very high	94.7	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.018	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-61.3	129.1	171	175.5	0	0	0	0	109	L473 I481 V490 A505 L509 V510	L473-V488 HydrophobicContact CB-CG1 4.04Å; L473-V488 HydrophobicContact CB-CG2 4.4Å; I481-V488 HydrophobicContact CD1-CG2 4.31Å; I481-V488 HydrophobicContact CG2-CG2 3.85Å; V488-V490 HydrophobicContact CG1-CG1 4.04Å; V488-V490 PolarHBondContact O-N 3.47Å; V488-A505 HydrophobicContact CB-CB 4.04Å; V488-A505 HydrophobicContact CG1-CB 3.65Å; V488-A505 HydrophobicContact CG2-CB 4.43Å; V488-L509 HydrophobicContact CG2-CB 4.26Å; V488-L509 PolarHBondContact N-O 2.73Å; V488-V510 HydrophobicContact CB-CG1 4.25Å
489	E	97.3	Very high	94.8	Very high	53 Å²	53	47.2 Å²	47.2	25%	0.248	26%	0.264	C	S	.	.			trans	-81.2	113.8	179.6	-174.9	173.1	-163.9	0	0	109.9	L473 H475 P487 C497 V498 K499	L473-E489 PolarHBondContact O-N 3.36Å; H475-E489 IonicContact ND1-OE1 3.83Å; H475-E489 IonicContact ND1-OE2 3.21Å; P487-E489 PolarHBondContact O-N 2.81Å; E489-C497 WeakPolarHBondContact O-CA 3.15Å; E489-V498 HydrophobicContact CG-CB 4.11Å; E489-V498 HydrophobicContact CG-CG2 3.91Å; E489-V498 PolarHBondContact O-N 3.38Å; E489-K499 WeakPolarHBondContact OE2-CE 3.4Å; E489-K499 IonicContact OE2-NZ 3.78Å; E489-K499 PolarHBondContact OE2-NZ 3.17Å; E489-K499 VanDerWaalsContact OE2-NZ 3.17Å
490	V	97.9	Very high	94.8	Very high	21 Å²	21	44.1 Å²	44.1	13%	0.127	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-123	154.7	-179.6	-62.4	0	0	0	0	111.4	V488 A492 E496 A505 V510	V488-V490 HydrophobicContact CG1-CG1 4.04Å; V488-V490 PolarHBondContact O-N 3.47Å; V490-A492 PolarHBondContact O-N 2.86Å; V490-E496 CarbonylContact C-O 3.5Å; V490-E496 VanDerWaalsContact CA-O 3.24Å; V490-E496 WeakPolarHBondContact CA-O 3.37Å; V490-A505 HydrophobicContact CG1-CB 4Å; V490-V510 HydrophobicContact CB-CG1 4.34Å; V490-V510 HydrophobicContact CG1-CG1 3.55Å; V490-V510 HydrophobicContact CG2-CB 4.09Å; V490-V510 HydrophobicContact CG2-CG1 3.8Å
491	D	97.8	Very high	94.8	Very high	66 Å²	66	43.3 Å²	43.3	35%	0.353	25%	0.249	S	C	.	.			trans	-63.6	131	166.3	171.9	-89.1	0	0	0	110.2	Y493 T494 Y495 E496	D491-Y493 PolarHBondContact O-N 3.25Å; D491-Y493 VanDerWaalsContact O-N 3.11Å; D491-Y493 PolarHBondContact OD1-N 3.14Å; D491-Y493 VanDerWaalsContact OD1-N 3.08Å; D491-T494 VanDerWaalsContact CB-OG1 3.27Å; D491-T494 WeakPolarHBondContact CB-OG1 3.45Å; D491-T494 VanDerWaalsContact CG-OG1 3.24Å; D491-T494 PolarHBondContact O-N 2.65Å; D491-T494 WeakPolarHBondContact OD1-CB 3.39Å; D491-T494 WeakPolarHBondContact OD1-CG2 3.33Å; D491-T494 PolarHBondContact OD1-N 3.17Å; D491-T494 PolarHBondContact OD1-OG1 2.88Å; D491-Y495 WeakPolarHBondContact O-CA 3.13Å; D491-Y495 PolarHBondContact O-N 3.02Å; D491-E496 PolarHBondContact N-O 2.62Å
492	A	95.9	Very high	94.9	Very high	35 Å²	35	45.3 Å²	45.3	29%	0.289	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.2	-168.6	0	0	0	0	0	114.2	P128 V129 V490	P128-A492 HydrophobicContact CG-CB 3.84Å; V129-A492 WeakPolarHBondContact CG2-O 3.48Å; V490-A492 PolarHBondContact O-N 2.86Å
493	Y	97.1	Very high	95.1	Very high	60 Å²	60	43.9 Å²	43.9	24%	0.235	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-19.3	-174	-57.2	-69.2	0	0	0	114.1	E115 P128 V129 D491 G524	E115-Y493 VanDerWaalsContact CA-CE1 3.48Å; E115-Y493 HydrophobicContact CB-CD1 4.08Å; E115-Y493 HydrophobicContact CB-CD2 4.31Å; E115-Y493 HydrophobicContact CB-CE1 3.79Å; E115-Y493 HydrophobicContact CB-CE2 3.98Å; E115-Y493 HydrophobicContact CB-CG 4.34Å; E115-Y493 HydrophobicContact CG-CE1 4.15Å; E115-Y493 HydrophobicContact CG-CE2 3.88Å; E115-Y493 WeakPolarHBondContact CG-OH 3.46Å; E115-Y493 WeakPolarHBondContact OE1-CE2 3.08Å; E115-Y493 PolarHBondContact OE1-OH 3.01Å; P128-Y493 HydrophobicContact CB-CE1 3.95Å; P128-Y493 HydrophobicContact CG-CD1 4.08Å; P128-Y493 HydrophobicContact CG-CE1 3.53Å; V129-Y493 HydrophobicContact CG2-CD1 3.78Å; D491-Y493 PolarHBondContact O-N 3.25Å; D491-Y493 VanDerWaalsContact O-N 3.11Å; D491-Y493 PolarHBondContact OD1-N 3.14Å; D491-Y493 VanDerWaalsContact OD1-N 3.08Å; Y493-G524 WeakPolarHBondContact O-CA 3.38Å
494	T	97.7	Very high	95.8	Very high	36 Å²	36	42.6 Å²	42.6	22%	0.221	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-16.8	-179.1	64.9	0	0	0	0	113.8	D491 E496 G524 V525 C528	D491-T494 VanDerWaalsContact CB-OG1 3.27Å; D491-T494 WeakPolarHBondContact CB-OG1 3.45Å; D491-T494 VanDerWaalsContact CG-OG1 3.24Å; D491-T494 PolarHBondContact O-N 2.65Å; D491-T494 WeakPolarHBondContact OD1-CB 3.39Å; D491-T494 WeakPolarHBondContact OD1-CG2 3.33Å; D491-T494 PolarHBondContact OD1-N 3.17Å; D491-T494 PolarHBondContact OD1-OG1 2.88Å; T494-E496 PolarHBondContact O-N 3.23Å; T494-E496 VanDerWaalsContact O-N 3.17Å; T494-E496 PolarHBondContact OG1-N 2.63Å; T494-G524 CarbonylContact O-C 3.44Å; T494-V525 PolarHBondContact O-N 2.98Å; T494-C528 HydrophobicContact CG2-CB 4.04Å
495	Y	98.3	Very high	96.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.204	C	C	.	.			trans	59.7	16.1	-175.1	-79.9	-117.5	0	0	0	113.9	N127 V129 A130 D491 F504 A505 V510 D512 G521	N127-Y495 HydrophobicContact CB-CE2 4.42Å; N127-Y495 WeakPolarHBondContact CB-OH 3.48Å; V129-Y495 HydrophobicContact CB-CE2 4.14Å; A130-Y495 WeakPolarHBondContact CB-OH 3.38Å; D491-Y495 WeakPolarHBondContact O-CA 3.13Å; D491-Y495 PolarHBondContact O-N 3.02Å; Y495-F504 WeakPolarHBondContact O-CA 3.24Å; Y495-A505 WeakPolarHBondContact CD1-O 3.49Å; Y495-A505 PolarHBondContact O-N 2.9Å; Y495-V510 HydrophobicContact CD1-CG2 4.09Å; Y495-V510 HydrophobicContact CE1-CG2 3.73Å; Y495-D512 PolarHBondContact OH-OD2 3.11Å; Y495-G521 VanDerWaalsContact CD1-CA 3.4Å
496	E	98.3	Very high	96.6	Very high	30 Å²	30	30.7 Å²	30.7	14%	0.14	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-74.9	136.1	171.6	-169.5	170.7	-135.1	0	0	109.5	V490 D491 T494 V498 N502 F504 R532	V490-E496 CarbonylContact C-O 3.5Å; V490-E496 VanDerWaalsContact CA-O 3.24Å; V490-E496 WeakPolarHBondContact CA-O 3.37Å; D491-E496 PolarHBondContact N-O 2.62Å; T494-E496 PolarHBondContact O-N 3.23Å; T494-E496 VanDerWaalsContact O-N 3.17Å; T494-E496 PolarHBondContact OG1-N 2.63Å; E496-V498 PolarHBondContact O-N 2.98Å; E496-N502 WeakPolarHBondContact OE1-CA 3.47Å; E496-N502 PolarHBondContact OE1-N 2.89Å; E496-F504 HydrophobicContact CB-CD1 3.85Å; E496-F504 HydrophobicContact CB-CE1 3.66Å; E496-F504 HydrophobicContact CB-CZ 4.39Å; E496-F504 HydrophobicContact CG-CD1 4.38Å; E496-F504 HydrophobicContact CG-CE1 4.1Å; E496-F504 HydrophobicContact CG-CZ 4.37Å; E496-R532 IonicContact OE1-CZ 3.83Å; E496-R532 VanDerWaalsContact OE1-CZ 3.28Å; E496-R532 IonicContact OE1-NH1 2.76Å; E496-R532 PolarHBondContact OE1-NH1 2.97Å; E496-R532 IonicContact OE1-NH2 3.96Å; E496-R532 PolarHBondContact OE1-NH2 2.79Å; E496-R532 IonicContact OE2-CZ 3.3Å; E496-R532 IonicContact OE2-NH2 3.38Å; E496-R532 PolarHBondContact OE2-NH2 3.41Å
497	C	97.8	Very high	96.7	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.02	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-60.3	122.6	175.9	-65.8	0	0	0	0	109.9	L473 E489 K499 E500 L503	L473-C497 HydrophobicContact CD2-CB 4.25Å; E489-C497 WeakPolarHBondContact O-CA 3.15Å; C497-K499 PolarHBondContact O-N 2.7Å; C497-K499 VanDerWaalsContact O-N 3.14Å; C497-E500 HydrophobicContact CB-CB 4.14Å; C497-E500 CarbonylContact O-C 3.53Å; C497-E500 PolarHBondContact O-N 2.79Å; C497-L503 HydrophobicContact CB-CB 4.29Å; C497-L503 WeakPolarHBondContact CB-O 3.43Å; C497-L503 PolarHBondContact N-O 3.19Å; C497-L503 PolarHBondContact SG-O 3.34Å
498	V	96.6	Very high	96.7	Very high	88 Å²	88	30.3 Å²	30.3	53%	0.533	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.8	-176.7	173.9	0	0	0	0	111.5	E489 E496	E489-V498 HydrophobicContact CG-CB 4.11Å; E489-V498 HydrophobicContact CG-CG2 3.91Å; E489-V498 PolarHBondContact O-N 3.38Å; E496-V498 PolarHBondContact O-N 2.98Å
499	K	94.2	Very high	96.6	Very high	83 Å²	83	30.2 Å²	30.2	36%	0.361	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.6	-175.5	-63.1	174.2	-176.1	169.5	0	113.3	Y472 G474 E489 C497	Y472-K499 WeakPolarHBondContact O-CD 3.33Å; G474-K499 PolarHBondContact O-NZ 3.47Å; E489-K499 WeakPolarHBondContact OE2-CE 3.4Å; E489-K499 IonicContact OE2-NZ 3.78Å; E489-K499 PolarHBondContact OE2-NZ 3.17Å; E489-K499 VanDerWaalsContact OE2-NZ 3.17Å; C497-K499 PolarHBondContact O-N 2.7Å; C497-K499 VanDerWaalsContact O-N 3.14Å
500	E	93.4	Very high	96.6	Very high	34 Å²	34	28 Å²	28	16%	0.159	16%	0.158	C	C	.	.	S	Bend	trans	-153	100.6	-171.8	-165.6	69.6	-106	0	0	112.6	R247 W279 Y472 L473 C497 L503	R247-E500 IonicContact CZ-OE1 3.59Å; R247-E500 IonicContact NE-OE1 3.18Å; R247-E500 PolarHBondContact NE-OE1 3.29Å; R247-E500 IonicContact NH2-OE1 2.67Å; R247-E500 PolarHBondContact NH2-OE1 3.08Å; W279-E500 HydrophobicContact CH2-CG 3.54Å; W279-E500 HydrophobicContact CZ2-CG 3.7Å; Y472-E500 HydrophobicContact CE2-CB 4.46Å; Y472-E500 WeakPolarHBondContact CE2-OE2 3.44Å; Y472-E500 PolarHBondContact OH-OE2 3.48Å; L473-E500 HydrophobicContact CD2-CB 3.78Å; C497-E500 HydrophobicContact CB-CB 4.14Å; C497-E500 CarbonylContact O-C 3.53Å; C497-E500 PolarHBondContact O-N 2.79Å; E500-L503 HydrophobicContact CB-CB 4.09Å; E500-L503 HydrophobicContact CB-CD2 4.07Å; E500-L503 HydrophobicContact CG-CB 3.84Å; E500-L503 HydrophobicContact CG-CD2 3.85Å; E500-L503 WeakPolarHBondContact O-CB 3.35Å; E500-L503 PolarHBondContact O-N 3.48Å
501	A	93.2	Very high	96.4	Very high	53 Å²	53	27.9 Å²	27.9	44%	0.438	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	147.1	-177.6	0	0	0	0	0	113.3	R247 L503	R247-A501 PolarHBondContact NH2-O 3.48Å; A501-L503 PolarHBondContact O-N 3.36Å
502	N	95.4	Very high	96.2	Very high	51 Å²	51	24.8 Å²	24.8	27%	0.273	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	13.7	-176.5	-42.9	-69.6	0	0	0	114	W279 E300 N301 V302 E496 R532	W279-N502 PolarHBondContact NE1-O 3.13Å; W279-N502 VanDerWaalsContact NE1-O 3.16Å; E300-N502 VanDerWaalsContact O-CB 3.26Å; E300-N502 WeakPolarHBondContact O-CB 3.45Å; N301-N502 CarbonylContact C-O 3.57Å; N301-N502 VanDerWaalsContact CA-O 3.28Å; N301-N502 WeakPolarHBondContact CA-O 3.25Å; N301-N502 WeakPolarHBondContact OD1-CB 2.91Å; N301-N502 PolarHBondContact OD1-OD1 3.11Å; V302-N502 PolarHBondContact N-O 3.13Å; E496-N502 WeakPolarHBondContact OE1-CA 3.47Å; E496-N502 PolarHBondContact OE1-N 2.89Å; N502-R532 PolarHBondContact OD1-NH1 3.47Å
503	L	97.8	Very high	95.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.8	163.8	-172.8	65.1	0	0	0	107.2	W279 V302 L304 L473 C497 E500 A501	W279-L503 HydrophobicContact CH2-CB 4.22Å; W279-L503 HydrophobicContact CH2-CD1 4.38Å; W279-L503 HydrophobicContact CH2-CD2 4.23Å; W279-L503 HydrophobicContact CZ2-CB 3.73Å; W279-L503 HydrophobicContact CZ2-CD1 4.34Å; W279-L503 HydrophobicContact CZ2-CG 4.43Å; V302-L503 HydrophobicContact CB-CD1 3.77Å; V302-L503 HydrophobicContact CG1-CD1 3.79Å; V302-L503 CarbonylContact O-C 3.59Å; V302-L503 WeakPolarHBondContact O-CA 3.46Å; L304-L503 HydrophobicContact CD1-CD1 4.14Å; L304-L503 HydrophobicContact CD1-CD2 4.23Å; L304-L503 HydrophobicContact CD1-CG 4.33Å; L304-L503 HydrophobicContact CD2-CD1 4.24Å; L304-L503 HydrophobicContact CG-CD1 3.93Å; L473-L503 HydrophobicContact CD1-CD2 3.78Å; L473-L503 HydrophobicContact CD2-CD2 3.94Å; C497-L503 HydrophobicContact CB-CB 4.29Å; C497-L503 WeakPolarHBondContact CB-O 3.43Å; C497-L503 PolarHBondContact N-O 3.19Å; C497-L503 PolarHBondContact SG-O 3.34Å; E500-L503 HydrophobicContact CB-CB 4.09Å; E500-L503 HydrophobicContact CB-CD2 4.07Å; E500-L503 HydrophobicContact CG-CB 3.84Å; E500-L503 HydrophobicContact CG-CD2 3.85Å; E500-L503 WeakPolarHBondContact O-CB 3.35Å; E500-L503 PolarHBondContact O-N 3.48Å; A501-L503 PolarHBondContact O-N 3.36Å
504	F	98.6	Very high	95.6	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	152	177.1	-59.9	-92.6	0	0	0	108.8	N301 V302 A303 L304 Y495 E496 V525 C528 L529	N301-F504 HydrophobicContact CB-CD2 4.41Å; N301-F504 HydrophobicContact CB-CE2 3.96Å; V302-F504 PolarHBondContact O-N 2.86Å; A303-F504 CarbonylContact C-O 3.43Å; A303-F504 WeakPolarHBondContact CA-O 3.41Å; A303-F504 HydrophobicContact CB-CB 4.17Å; L304-F504 PolarHBondContact N-O 2.77Å; Y495-F504 WeakPolarHBondContact O-CA 3.24Å; E496-F504 HydrophobicContact CB-CD1 3.85Å; E496-F504 HydrophobicContact CB-CE1 3.66Å; E496-F504 HydrophobicContact CB-CZ 4.39Å; E496-F504 HydrophobicContact CG-CD1 4.38Å; E496-F504 HydrophobicContact CG-CE1 4.1Å; E496-F504 HydrophobicContact CG-CZ 4.37Å; F504-V525 HydrophobicContact CB-CG1 4.49Å; F504-V525 HydrophobicContact CB-CG2 3.95Å; F504-V525 HydrophobicContact CD1-CB 4.25Å; F504-V525 HydrophobicContact CD1-CG1 3.97Å; F504-V525 HydrophobicContact CD1-CG2 3.66Å; F504-V525 HydrophobicContact CD2-CG1 4.36Å; F504-V525 HydrophobicContact CE1-CG1 4.25Å; F504-V525 HydrophobicContact CE1-CG2 4.45Å; F504-V525 HydrophobicContact CG-CG1 4.02Å; F504-V525 HydrophobicContact CG-CG2 4Å; F504-C528 HydrophobicContact CE1-CB 4.23Å; F504-L529 HydrophobicContact CE2-CD2 4.13Å; F504-L529 HydrophobicContact CZ-CD2 4.09Å; F504-L529 HydrophobicContact CZ-CG 4.43Å
505	A	98.2	Very high	95.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	140.3	172.9	0	0	0	0	0	110	L304 V488 V490 Y495 L509 V510	L304-A505 HydrophobicContact CB-CB 4.43Å; V488-A505 HydrophobicContact CB-CB 4.04Å; V488-A505 HydrophobicContact CG1-CB 3.65Å; V488-A505 HydrophobicContact CG2-CB 4.43Å; V490-A505 HydrophobicContact CG1-CB 4Å; Y495-A505 WeakPolarHBondContact CD1-O 3.49Å; Y495-A505 PolarHBondContact O-N 2.9Å; A505-L509 HydrophobicContact CB-CB 4.42Å; A505-V510 HydrophobicContact CB-CG1 3.67Å; A505-V510 WeakPolarHBondContact O-CG1 3.08Å
506	L	96.4	Very high	95.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.151	C	C	.	.			trans	-136.6	160.9	-174.5	-59.7	101.9	0	0	0	112.7	L75 A303 L304 G521 V525	L75-L506 HydrophobicContact CD2-CD1 4.12Å; L75-L506 HydrophobicContact CD2-CD2 4.46Å; A303-L506 HydrophobicContact CB-CD1 3.89Å; L304-L506 PolarHBondContact O-N 2.83Å; L506-G521 WeakPolarHBondContact CD2-O 3.49Å; L506-V525 HydrophobicContact CD1-CG2 4.23Å; L506-V525 HydrophobicContact CD2-CG2 3.99Å; L506-V525 HydrophobicContact CG-CG2 4.24Å
507	G	96	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	66.5	-139.9	173.5	0	0	0	0	0	112.1	L509 V510 D512	G507-L509 PolarHBondContact O-N 3.23Å; G507-V510 VanDerWaalsContact O-CG2 3.26Å; G507-V510 WeakPolarHBondContact O-CG2 3.35Å; G507-V510 PolarHBondContact O-N 3.08Å; G507-D512 CarbonylContact C-O 3.52Å; G507-D512 PolarHBondContact O-N 3Å; G507-D512 VanDerWaalsContact O-N 3.16Å
508	P	95.2	Very high	94.7	Very high	20 Å²	20	26 Å²	26	13%	0.13	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-59.9	-20.5	-174	-28.2	35.9	0	0	0	115.2	T308 C483 V510 G511 D512	T308-P508 HydrophobicContact CG2-CB 3.51Å; C483-P508 WeakPolarHBondContact CA-O 3.27Å; C483-P508 HydrophobicContact CB-CB 4.43Å; C483-P508 WeakPolarHBondContact CB-O 3.33Å; P508-V510 PolarHBondContact O-N 3.01Å; P508-G511 PolarHBondContact O-N 2.92Å; P508-D512 WeakPolarHBondContact CA-O 3.31Å; P508-D512 WeakPolarHBondContact CD-O 3.49Å
509	L	95.8	Very high	94.6	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-62.5	-29.6	175.3	-72	-179.4	0	0	0	112.9	L304 P461 L463 I481 P487 V488 A505 G507	L304-L509 HydrophobicContact CB-CD1 3.62Å; P461-L509 HydrophobicContact CB-CD2 3.51Å; P461-L509 HydrophobicContact CG-CD2 3.92Å; L463-L509 HydrophobicContact CD1-CD2 4.32Å; L463-L509 HydrophobicContact CD2-CD2 4.47Å; I481-L509 HydrophobicContact CG2-CD2 4.31Å; P487-L509 CarbonylContact C-O 3.59Å; P487-L509 WeakPolarHBondContact CA-O 3.27Å; P487-L509 WeakPolarHBondContact CB-O 3.4Å; V488-L509 HydrophobicContact CG2-CB 4.26Å; V488-L509 PolarHBondContact N-O 2.73Å; A505-L509 HydrophobicContact CB-CB 4.42Å; G507-L509 PolarHBondContact O-N 3.23Å
510	V	96.1	Very high	94.8	Very high	5 Å²	5	18 Å²	18	3%	0.03	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-110.2	20.7	-178.6	-58.7	0	0	0	0	112.1	N127 V488 V490 Y495 A505 G507 P508	N127-V510 PolarHBondContact ND2-O 3.37Å; V488-V510 HydrophobicContact CB-CG1 4.25Å; V490-V510 HydrophobicContact CB-CG1 4.34Å; V490-V510 HydrophobicContact CG1-CG1 3.55Å; V490-V510 HydrophobicContact CG2-CB 4.09Å; V490-V510 HydrophobicContact CG2-CG1 3.8Å; Y495-V510 HydrophobicContact CD1-CG2 4.09Å; Y495-V510 HydrophobicContact CE1-CG2 3.73Å; A505-V510 HydrophobicContact CB-CG1 3.67Å; A505-V510 WeakPolarHBondContact O-CG1 3.08Å; G507-V510 VanDerWaalsContact O-CG2 3.26Å; G507-V510 WeakPolarHBondContact O-CG2 3.35Å; G507-V510 PolarHBondContact O-N 3.08Å; P508-V510 PolarHBondContact O-N 3.01Å
511	G	93.8	Very high	94.9	Very high	19 Å²	19	16.4 Å²	16.4	20%	0.196	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.5	-7.6	179.1	0	0	0	0	0	115.7	C483 P508 N513	C483-G511 WeakPolarHBondContact O-CA 3.37Å; P508-G511 PolarHBondContact O-N 2.92Å; G511-N513 PolarHBondContact O-N 3.28Å; G511-N513 PolarHBondContact O-ND2 2.9Å
512	D	94.3	Very high	95.2	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.005	8%	0.076	C	C	.	.			trans	-81.4	85.9	179.6	-70.9	-26	0	0	0	111.4	S125 N127 Y495 G507 P508 F517	S125-D512 WeakPolarHBondContact CB-OD1 3.48Å; S125-D512 PolarHBondContact OG-OD1 3.12Å; N127-D512 VanDerWaalsContact ND2-CG 3.33Å; N127-D512 PolarHBondContact ND2-OD1 2.85Å; N127-D512 PolarHBondContact ND2-OD2 2.6Å; Y495-D512 PolarHBondContact OH-OD2 3.11Å; G507-D512 CarbonylContact C-O 3.52Å; G507-D512 PolarHBondContact O-N 3Å; G507-D512 VanDerWaalsContact O-N 3.16Å; P508-D512 WeakPolarHBondContact CA-O 3.31Å; P508-D512 WeakPolarHBondContact CD-O 3.49Å; D512-F517 HydrophobicContact CB-CB 4.15Å
513	N	89.8	Confident	95.3	Very high	68 Å²	68	11.5 Å²	11.5	36%	0.364	6%	0.063	S	C	.	.			trans	-82.6	-19.6	-173	-68.2	-79.8	0	0	0	114.6	C483 G511	C483-N513 WeakPolarHBondContact CB-OD1 3.44Å; C483-N513 PolarHBondContact SG-OD1 3.2Å; G511-N513 PolarHBondContact O-N 3.28Å; G511-N513 PolarHBondContact O-ND2 2.9Å
514	F	91.4	Very high	95.4	Very high	92 Å²	92	11.5 Å²	11.5	40%	0.404	6%	0.063	S	C	.	.	S	Bend	trans	-102.1	144.4	-178.7	-58.3	-79	0	0	0	111.8	R516 F517 L518	F514-R516 PolarHBondContact O-N 3.43Å; F514-R516 VanDerWaalsContact O-N 3.15Å; F514-F517 HydrophobicContact CB-CD2 3.82Å; F514-F517 HydrophobicContact CB-CE2 4.22Å; F514-F517 AromaticContact CD2-CD2 3.95Å; F514-F517 HydrophobicContact CD2-CD2 3.95Å; F514-F517 AromaticContact CD2-CE2 3.85Å; F514-F517 HydrophobicContact CD2-CE2 3.85Å; F514-F517 HydrophobicContact CG-CD2 4.36Å; F514-F517 HydrophobicContact CG-CE2 4.42Å; F514-F517 PolarHBondContact O-N 3.23Å; F514-L518 PolarHBondContact O-N 3.21Å
515	V	93.1	Very high	95.4	Very high	12 Å²	12	11.4 Å²	11.4	7%	0.073	6%	0.062	C	C	.	.	H	α-helix	trans	-59.2	-28.7	179	178.6	0	0	0	0	112.6	P70 W175 M191 F517 L518 K519	P70-V515 HydrophobicContact CB-CG1 4.18Å; P70-V515 HydrophobicContact CG-CG2 4.14Å; W175-V515 HydrophobicContact CZ2-CG2 4.12Å; M191-V515 HydrophobicContact CB-CB 4.33Å; M191-V515 HydrophobicContact CB-CG1 4.35Å; M191-V515 HydrophobicContact CG-CB 4.21Å; M191-V515 HydrophobicContact CG-CG2 4.26Å; V515-F517 VanDerWaalsContact C-N 3.29Å; V515-F517 PolarHBondContact O-N 3.06Å; V515-L518 HydrophobicContact CB-CD2 4.21Å; V515-L518 HydrophobicContact CG1-CD1 4.38Å; V515-L518 HydrophobicContact CG1-CD2 4.25Å; V515-L518 HydrophobicContact CG1-CG 4.46Å; V515-L518 HydrophobicContact CG2-CD2 4.17Å; V515-L518 VanDerWaalsContact O-CG 3.28Å; V515-L518 WeakPolarHBondContact O-CG 3.24Å; V515-K519 VanDerWaalsContact O-CE 3.27Å; V515-K519 WeakPolarHBondContact O-CE 3.24Å
516	R	92	Very high	95.4	Very high	8 Å²	8	11.4 Å²	11.4	3%	0.03	6%	0.062	C	C	.	.	H	α-helix	trans	-55	-44.3	174.1	-127.5	-177.8	52.5	-161.6	3.1	112.2	D134 D142 W190 F514 K519	D134-R516 WeakPolarHBondContact OD1-CD 3.47Å; D134-R516 WeakPolarHBondContact OD1-CG 3.45Å; D134-R516 IonicContact OD1-CZ 3.81Å; D134-R516 IonicContact OD1-NE 2.68Å; D134-R516 PolarHBondContact OD1-NE 3.19Å; D134-R516 IonicContact OD2-CZ 3.74Å; D134-R516 IonicContact OD2-NE 3.85Å; D134-R516 PolarHBondContact OD2-NE 2.99Å; D134-R516 IonicContact OD2-NH2 2.82Å; D134-R516 PolarHBondContact OD2-NH2 3.19Å; D142-R516 IonicContact OD1-CZ 2.83Å; D142-R516 VanDerWaalsContact OD1-CZ 3.25Å; D142-R516 IonicContact OD1-NH1 3.77Å; D142-R516 PolarHBondContact OD1-NH1 3.32Å; D142-R516 IonicContact OD1-NH2 2.68Å; D142-R516 PolarHBondContact OD1-NH2 3.43Å; D142-R516 IonicContact OD2-NH2 2.86Å; D142-R516 PolarHBondContact OD2-NH2 3.35Å; W190-R516 HydrophobicContact CB-CG 4.24Å; W190-R516 PolarHBondContact O-N 3.44Å; F514-R516 PolarHBondContact O-N 3.43Å; F514-R516 VanDerWaalsContact O-N 3.15Å; R516-K519 WeakPolarHBondContact O-CE 3.41Å
517	F	94.6	Very high	95.5	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.018	7%	0.073	C	C	.	.	H	α-helix	trans	-87.8	-31.6	-171.5	-62.8	-55.7	0	0	0	114.5	R124 A130 D134 D512 F514 V515 K519 G520	R124-F517 HydrophobicContact CB-CE2 3.89Å; R124-F517 HydrophobicContact CB-CZ 3.74Å; A130-F517 HydrophobicContact CB-CB 3.99Å; A130-F517 HydrophobicContact CB-CD1 4.3Å; A130-F517 WeakPolarHBondContact CB-O 3.43Å; D134-F517 HydrophobicContact CB-CD1 3.95Å; D134-F517 HydrophobicContact CB-CE1 3.93Å; D134-F517 VanDerWaalsContact OD2-CE1 3.27Å; D134-F517 WeakPolarHBondContact OD2-CE1 3.5Å; D512-F517 HydrophobicContact CB-CB 4.15Å; F514-F517 HydrophobicContact CB-CD2 3.82Å; F514-F517 HydrophobicContact CB-CE2 4.22Å; F514-F517 AromaticContact CD2-CD2 3.95Å; F514-F517 HydrophobicContact CD2-CD2 3.95Å; F514-F517 AromaticContact CD2-CE2 3.85Å; F514-F517 HydrophobicContact CD2-CE2 3.85Å; F514-F517 HydrophobicContact CG-CD2 4.36Å; F514-F517 HydrophobicContact CG-CE2 4.42Å; F514-F517 PolarHBondContact O-N 3.23Å; V515-F517 VanDerWaalsContact C-N 3.29Å; V515-F517 PolarHBondContact O-N 3.06Å; F517-K519 PolarHBondContact O-N 3.01Å; F517-G520 PolarHBondContact O-N 2.9Å
518	L	93	Very high	95.6	Very high	7 Å²	7	14.7 Å²	14.7	4%	0.037	8%	0.076	C	C	.	.	H	α-helix	trans	-58.9	-18.1	-179.1	58.2	76.6	0	0	0	114.2	P70 S71 C74 F514 V515 G520 G521	P70-L518 HydrophobicContact CB-CD1 4.07Å; P70-L518 HydrophobicContact CB-CD2 3.77Å; P70-L518 HydrophobicContact CG-CD2 3.62Å; S71-L518 WeakPolarHBondContact OG-CB 3.27Å; C74-L518 HydrophobicContact CB-CD1 4.46Å; F514-L518 PolarHBondContact O-N 3.21Å; V515-L518 HydrophobicContact CB-CD2 4.21Å; V515-L518 HydrophobicContact CG1-CD1 4.38Å; V515-L518 HydrophobicContact CG1-CD2 4.25Å; V515-L518 HydrophobicContact CG1-CG 4.46Å; V515-L518 HydrophobicContact CG2-CD2 4.17Å; V515-L518 VanDerWaalsContact O-CG 3.28Å; V515-L518 WeakPolarHBondContact O-CG 3.24Å; L518-G520 VanDerWaalsContact C-N 3.32Å; L518-G521 PolarHBondContact O-N 3.16Å
519	K	94.9	Very high	95.7	Very high	2 Å²	2	14 Å²	14	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-69.7	-31.7	179.6	-65.4	178.7	-87.2	-164	0	111.1	F133 L137 E192 P194 V515 R516 F517 A522 L523	F133-K519 VanDerWaalsContact CD1-C 3.47Å; F133-K519 HydrophobicContact CD1-CB 3.63Å; F133-K519 WeakPolarHBondContact CD1-O 3.44Å; F133-K519 HydrophobicContact CE1-CB 3.79Å; L137-K519 HydrophobicContact CD1-CB 4.28Å; L137-K519 HydrophobicContact CD1-CD 3.77Å; E192-K519 PolarHBondContact O-NZ 3.42Å; P194-K519 HydrophobicContact CG-CD 4.05Å; P194-K519 HydrophobicContact CG-CG 4.45Å; V515-K519 VanDerWaalsContact O-CE 3.27Å; V515-K519 WeakPolarHBondContact O-CE 3.24Å; R516-K519 WeakPolarHBondContact O-CE 3.41Å; F517-K519 PolarHBondContact O-N 3.01Å; K519-A522 WeakPolarHBondContact O-CB 3.49Å; K519-A522 PolarHBondContact O-N 3.43Å; K519-L523 PolarHBondContact O-N 3.44Å
520	G	96.9	Very high	95.7	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-67.3	-36.3	176	0	0	0	0	0	112.8	V129 F517 L518 A522 L523 G524	V129-G520 VanDerWaalsContact CG1-O 3.29Å; V129-G520 WeakPolarHBondContact CG1-O 3.49Å; F517-G520 PolarHBondContact O-N 2.9Å; L518-G520 VanDerWaalsContact C-N 3.32Å; G520-A522 VanDerWaalsContact C-N 3.3Å; G520-A522 PolarHBondContact O-N 3.07Å; G520-L523 WeakPolarHBondContact O-CB 3.35Å; G520-L523 PolarHBondContact O-N 3.48Å; G520-L523 VanDerWaalsContact O-N 3.09Å; G520-G524 PolarHBondContact O-N 2.79Å
521	G	97.3	Very high	95.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.8	-42	172.3	0	0	0	0	0	112.6	Y495 L506 L518 L523 G524 V525	Y495-G521 VanDerWaalsContact CD1-CA 3.4Å; L506-G521 WeakPolarHBondContact CD2-O 3.49Å; L518-G521 PolarHBondContact O-N 3.16Å; G521-L523 VanDerWaalsContact C-N 3.26Å; G521-L523 PolarHBondContact O-N 3.35Å; G521-G524 PolarHBondContact O-N 3.31Å; G521-V525 WeakPolarHBondContact O-CG2 3.48Å; G521-V525 PolarHBondContact O-N 3.36Å
522	A	98.3	Very high	95.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-38	175.5	0	0	0	0	0	112	C74 L75 M78 K519 G520 T526	C74-A522 HydrophobicContact CB-CB 3.94Å; L75-A522 HydrophobicContact CB-CB 4.07Å; L75-A522 HydrophobicContact CD1-CB 4.47Å; M78-A522 HydrophobicContact CE-CB 4.21Å; M78-A522 HydrophobicContact SD-CB 3.86Å; K519-A522 WeakPolarHBondContact O-CB 3.49Å; K519-A522 PolarHBondContact O-N 3.43Å; G520-A522 VanDerWaalsContact C-N 3.3Å; G520-A522 PolarHBondContact O-N 3.07Å; A522-T526 VanDerWaalsContact O-CB 3.29Å; A522-T526 WeakPolarHBondContact O-CB 3.47Å; A522-T526 PolarHBondContact O-N 3.29Å; A522-T526 PolarHBondContact O-OG1 3.42Å
523	L	98.5	Very high	95.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64	-49.5	175.8	-178.1	71	0	0	0	111.5	M78 P84 I109 V110 L114 V129 F133 K519 G520 G521 T526 R527	M78-L523 HydrophobicContact CE-CB 4.04Å; M78-L523 HydrophobicContact CE-CD1 4.45Å; M78-L523 VanDerWaalsContact SD-CA 3.58Å; M78-L523 HydrophobicContact SD-CB 4.23Å; M78-L523 PolarHBondContact SD-N 3.25Å; M78-L523 VanDerWaalsContact SD-N 3.43Å; P84-L523 HydrophobicContact CG-CD1 4.34Å; I109-L523 HydrophobicContact CG2-CD2 4.05Å; V110-L523 HydrophobicContact CB-CD1 4.45Å; V110-L523 HydrophobicContact CG2-CD1 3.59Å; L114-L523 HydrophobicContact CD1-CD2 4.23Å; L114-L523 HydrophobicContact CD1-CG 4.18Å; L114-L523 HydrophobicContact CD2-CD2 3.89Å; L114-L523 HydrophobicContact CD2-CG 4.45Å; V129-L523 HydrophobicContact CG1-CB 4.26Å; V129-L523 HydrophobicContact CG1-CD2 3.93Å; V129-L523 HydrophobicContact CG1-CG 4.36Å; F133-L523 HydrophobicContact CB-CD2 4.16Å; F133-L523 HydrophobicContact CD2-CD2 3.64Å; F133-L523 HydrophobicContact CE2-CD1 4.44Å; F133-L523 HydrophobicContact CE2-CD2 4.15Å; F133-L523 HydrophobicContact CG-CD2 3.96Å; K519-L523 PolarHBondContact O-N 3.44Å; G520-L523 WeakPolarHBondContact O-CB 3.35Å; G520-L523 PolarHBondContact O-N 3.48Å; G520-L523 VanDerWaalsContact O-N 3.09Å; G521-L523 VanDerWaalsContact C-N 3.26Å; G521-L523 PolarHBondContact O-N 3.35Å; L523-T526 PolarHBondContact O-N 2.83Å; L523-R527 WeakPolarHBondContact O-CB 3.25Å; L523-R527 PolarHBondContact O-N 3.06Å
524	G	98.3	Very high	95.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.4	-47.9	179.6	0	0	0	0	0	112.7	Y493 T494 G520 G521 T526 R527 C528	Y493-G524 WeakPolarHBondContact O-CA 3.38Å; T494-G524 CarbonylContact O-C 3.44Å; G520-G524 PolarHBondContact O-N 2.79Å; G521-G524 PolarHBondContact O-N 3.31Å; G524-T526 PolarHBondContact O-N 2.97Å; G524-R527 PolarHBondContact O-N 3.18Å; G524-C528 WeakPolarHBondContact O-CB 3.44Å; G524-C528 PolarHBondContact O-N 3.35Å
525	V	98.7	Very high	95.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-45.6	176.7	177.5	0	0	0	0	110.9	L75 T494 F504 L506 G521 R527 C528 L529	L75-V525 HydrophobicContact CD1-CB 3.86Å; L75-V525 HydrophobicContact CD1-CG1 3.75Å; L75-V525 HydrophobicContact CD2-CG1 4.17Å; T494-V525 PolarHBondContact O-N 2.98Å; F504-V525 HydrophobicContact CB-CG1 4.49Å; F504-V525 HydrophobicContact CB-CG2 3.95Å; F504-V525 HydrophobicContact CD1-CB 4.25Å; F504-V525 HydrophobicContact CD1-CG1 3.97Å; F504-V525 HydrophobicContact CD1-CG2 3.66Å; F504-V525 HydrophobicContact CD2-CG1 4.36Å; F504-V525 HydrophobicContact CE1-CG1 4.25Å; F504-V525 HydrophobicContact CE1-CG2 4.45Å; F504-V525 HydrophobicContact CG-CG1 4.02Å; F504-V525 HydrophobicContact CG-CG2 4Å; L506-V525 HydrophobicContact CD1-CG2 4.23Å; L506-V525 HydrophobicContact CD2-CG2 3.99Å; L506-V525 HydrophobicContact CG-CG2 4.24Å; G521-V525 WeakPolarHBondContact O-CG2 3.48Å; G521-V525 PolarHBondContact O-N 3.36Å; V525-R527 PolarHBondContact O-N 3.08Å; V525-C528 PolarHBondContact O-N 3.41Å; V525-L529 HydrophobicContact CG1-CD1 3.85Å; V525-L529 HydrophobicContact CG1-CG 4.35Å; V525-L529 WeakPolarHBondContact O-CG 3.39Å; V525-L529 PolarHBondContact O-N 3.49Å
526	T	98.6	Very high	94.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-45.4	179.9	-59.4	0	0	0	0	111.4	M78 L79 V110 A522 L523 G524 L529 A530	M78-T526 HydrophobicContact CB-CG2 3.99Å; M78-T526 VanDerWaalsContact CB-OG1 3.27Å; M78-T526 WeakPolarHBondContact CB-OG1 3.45Å; L79-T526 HydrophobicContact CD2-CG2 4.45Å; V110-T526 HydrophobicContact CG1-CG2 4.04Å; V110-T526 HydrophobicContact CG2-CG2 4.24Å; A522-T526 VanDerWaalsContact O-CB 3.29Å; A522-T526 WeakPolarHBondContact O-CB 3.47Å; A522-T526 PolarHBondContact O-N 3.29Å; A522-T526 PolarHBondContact O-OG1 3.42Å; L523-T526 PolarHBondContact O-N 2.83Å; G524-T526 PolarHBondContact O-N 2.97Å; T526-L529 PolarHBondContact O-N 3.45Å; T526-A530 VanDerWaalsContact O-CB 3.25Å; T526-A530 WeakPolarHBondContact O-CB 3.42Å; T526-A530 PolarHBondContact O-N 3.04Å
527	R	98.1	Very high	93.9	Very high	57 Å²	57	33.9 Å²	33.9	22%	0.215	15%	0.154	C	C	.	.	H	α-helix	trans	-59.5	-46.4	175.7	171.3	175	178.4	78.6	-9.3	111.8	V110 D111 Q112 L114 L523 G524 V525 L529 A530 T531	V110-R527 HydrophobicContact CG1-CB 4.19Å; V110-R527 WeakPolarHBondContact O-CB 3.45Å; V110-R527 WeakPolarHBondContact O-CD 3Å; V110-R527 VanDerWaalsContact O-CG 3.27Å; V110-R527 WeakPolarHBondContact O-CG 3.44Å; V110-R527 PolarHBondContact O-NH1 2.9Å; D111-R527 PolarHBondContact O-NH1 2.87Å; D111-R527 VanDerWaalsContact O-NH1 3.12Å; Q112-R527 PolarHBondContact O-NH1 2.84Å; Q112-R527 PolarHBondContact O-NH2 2.91Å; L114-R527 HydrophobicContact CD1-CB 4.3Å; L114-R527 HydrophobicContact CD1-CG 4.48Å; L114-R527 VanDerWaalsContact CG-CD 3.48Å; L523-R527 WeakPolarHBondContact O-CB 3.25Å; L523-R527 PolarHBondContact O-N 3.06Å; G524-R527 PolarHBondContact O-N 3.18Å; V525-R527 PolarHBondContact O-N 3.08Å; R527-L529 PolarHBondContact O-N 3.49Å; R527-A530 PolarHBondContact O-N 3.46Å; R527-T531 WeakPolarHBondContact O-CB 3.02Å; R527-T531 PolarHBondContact O-N 3.12Å; R527-T531 PolarHBondContact O-OG1 2.95Å
528	C	98.1	Very high	92.8	Very high	11 Å²	11	39.5 Å²	39.5	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-50.3	179.3	-176.5	0	0	0	0	111	T494 F504 G524 V525 T531 R532	T494-C528 HydrophobicContact CG2-CB 4.04Å; F504-C528 HydrophobicContact CE1-CB 4.23Å; G524-C528 WeakPolarHBondContact O-CB 3.44Å; G524-C528 PolarHBondContact O-N 3.35Å; V525-C528 PolarHBondContact O-N 3.41Å; C528-T531 PolarHBondContact O-N 2.99Å; C528-R532 WeakPolarHBondContact O-CG 3.36Å; C528-R532 PolarHBondContact O-N 3.21Å; C528-R532 VanDerWaalsContact SG-CZ 3.56Å; C528-R532 PolarHBondContact SG-NE 2.98Å; C528-R532 PolarHBondContact SG-NH2 3.4Å
529	L	97.7	Very high	91.6	Very high	7 Å²	7	44 Å²	44	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-66.3	-42.4	179.9	-66.1	174.3	0	0	0	112.7	V63 L79 I161 N301 F504 V525 T526 R527 T531 R532 Q533	V63-L529 HydrophobicContact CG2-CD1 3.59Å; L79-L529 HydrophobicContact CD2-CD1 3.91Å; I161-L529 HydrophobicContact CD1-CB 3.78Å; N301-L529 HydrophobicContact CB-CD2 4.31Å; F504-L529 HydrophobicContact CE2-CD2 4.13Å; F504-L529 HydrophobicContact CZ-CD2 4.09Å; F504-L529 HydrophobicContact CZ-CG 4.43Å; V525-L529 HydrophobicContact CG1-CD1 3.85Å; V525-L529 HydrophobicContact CG1-CG 4.35Å; V525-L529 WeakPolarHBondContact O-CG 3.39Å; V525-L529 PolarHBondContact O-N 3.49Å; T526-L529 PolarHBondContact O-N 3.45Å; R527-L529 PolarHBondContact O-N 3.49Å; L529-T531 VanDerWaalsContact C-N 3.34Å; L529-T531 PolarHBondContact O-N 3.28Å; L529-R532 PolarHBondContact O-N 3.14Å; L529-Q533 PolarHBondContact O-N 3.25Å
530	A	95.8	Very high	90	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-42.9	176.7	0	0	0	0	0	111.5	V110 T526 R527 R532 Q533 K534	V110-A530 HydrophobicContact CG1-CB 4.38Å; T526-A530 VanDerWaalsContact O-CB 3.25Å; T526-A530 WeakPolarHBondContact O-CB 3.42Å; T526-A530 PolarHBondContact O-N 3.04Å; R527-A530 PolarHBondContact O-N 3.46Å; A530-R532 PolarHBondContact O-N 2.67Å; A530-Q533 PolarHBondContact O-N 3.01Å; A530-K534 WeakPolarHBondContact O-CG 3.36Å; A530-K534 PolarHBondContact O-N 3.08Å
531	T	95.1	Very high	88.3	Confident	52 Å²	52	56.5 Å²	56.5	32%	0.319	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.3	-58.2	0	0	0	0	111.3	R527 C528 L529 K534 K535	R527-T531 WeakPolarHBondContact O-CB 3.02Å; R527-T531 PolarHBondContact O-N 3.12Å; R527-T531 PolarHBondContact O-OG1 2.95Å; C528-T531 PolarHBondContact O-N 2.99Å; L529-T531 VanDerWaalsContact C-N 3.34Å; L529-T531 PolarHBondContact O-N 3.28Å; T531-K534 PolarHBondContact O-N 3.15Å; T531-K535 HydrophobicContact CG2-CD 4.4Å; T531-K535 WeakPolarHBondContact O-CG 3.48Å; T531-K535 PolarHBondContact O-N 2.76Å
532	R	93.6	Very high	86.4	Confident	71 Å²	71	63.6 Å²	63.6	27%	0.268	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-41	175.4	-72.7	174.1	-174.2	-173.1	1	112.1	E496 N502 C528 L529 A530 K535 K536	E496-R532 IonicContact OE1-CZ 3.83Å; E496-R532 VanDerWaalsContact OE1-CZ 3.28Å; E496-R532 IonicContact OE1-NH1 2.76Å; E496-R532 PolarHBondContact OE1-NH1 2.97Å; E496-R532 IonicContact OE1-NH2 3.96Å; E496-R532 PolarHBondContact OE1-NH2 2.79Å; E496-R532 IonicContact OE2-CZ 3.3Å; E496-R532 IonicContact OE2-NH2 3.38Å; E496-R532 PolarHBondContact OE2-NH2 3.41Å; N502-R532 PolarHBondContact OD1-NH1 3.47Å; C528-R532 WeakPolarHBondContact O-CG 3.36Å; C528-R532 PolarHBondContact O-N 3.21Å; C528-R532 VanDerWaalsContact SG-CZ 3.56Å; C528-R532 PolarHBondContact SG-NE 2.98Å; C528-R532 PolarHBondContact SG-NH2 3.4Å; L529-R532 PolarHBondContact O-N 3.14Å; A530-R532 PolarHBondContact O-N 2.67Å; R532-K535 PolarHBondContact O-N 3.18Å; R532-K536 WeakPolarHBondContact O-CG 3.47Å; R532-K536 PolarHBondContact O-N 2.73Å
533	Q	88.5	Confident	84.3	Confident	58 Å²	58	74.1 Å²	74.1	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-45.9	177	-77.4	-174	-15.5	0	0	112.1	L529 A530 K535 K536 Q537	L529-Q533 PolarHBondContact O-N 3.25Å; A530-Q533 PolarHBondContact O-N 3.01Å; Q533-K535 PolarHBondContact O-N 3.34Å; Q533-K536 PolarHBondContact O-N 3.09Å; Q533-Q537 WeakPolarHBondContact O-CG 3.45Å; Q533-Q537 PolarHBondContact O-N 3.2Å
534	K	88.3	Confident	81.9	Confident	83 Å²	83	77.1 Å²	77.1	36%	0.361	37%	0.371	S	S	.	.	H	α-helix	trans	-57.5	-48.2	175.4	-70.2	178.9	-175.9	178.5	0	111.1	D111 A530 T531 K536 Q537 H538	D111-K534 IonicContact OD1-NZ 3.25Å; D111-K534 PolarHBondContact OD1-NZ 3.48Å; A530-K534 WeakPolarHBondContact O-CG 3.36Å; A530-K534 PolarHBondContact O-N 3.08Å; T531-K534 PolarHBondContact O-N 3.15Å; K534-K536 PolarHBondContact O-N 3.31Å; K534-Q537 PolarHBondContact O-N 3.07Å; K534-H538 PolarHBondContact O-CD2 3.38Å; K534-H538 PolarHBondContact O-N 3.4Å
535	K	87.6	Confident	79.4	Confident	141 Å²	141	80.4 Å²	80.4	61%	0.613	40%	0.404	S	S	*	.	H	α-helix	trans	-58.9	-42.7	176.6	-73.1	179.5	179.8	-178.3	0	112.6	T531 R532 Q533 L539	T531-K535 HydrophobicContact CG2-CD 4.4Å; T531-K535 WeakPolarHBondContact O-CG 3.48Å; T531-K535 PolarHBondContact O-N 2.76Å; R532-K535 PolarHBondContact O-N 3.18Å; Q533-K535 PolarHBondContact O-N 3.34Å; K535-L539 WeakPolarHBondContact O-CG 3.43Å; K535-L539 PolarHBondContact O-N 3.2Å; K535-L539 VanDerWaalsContact O-N 3.15Å
536	K	82.5	Confident	76.8	Confident	90 Å²	90	83.3 Å²	83.3	39%	0.391	44%	0.435	S	S	.	.	H	α-helix	trans	-60.6	-46.3	175	-75.5	175.7	179.6	176.8	0	111.1	E300 R532 Q533 K534 L539 F540	E300-K536 IonicContact OE2-NZ 2.73Å; E300-K536 PolarHBondContact OE2-NZ 3Å; R532-K536 WeakPolarHBondContact O-CG 3.47Å; R532-K536 PolarHBondContact O-N 2.73Å; Q533-K536 PolarHBondContact O-N 3.09Å; K534-K536 PolarHBondContact O-N 3.31Å; K536-L539 PolarHBondContact O-N 2.84Å; K536-F540 WeakPolarHBondContact O-CD2 3.33Å; K536-F540 PolarHBondContact O-N 3.47Å
537	Q	77.4	Confident	74.3	Confident	123 Å²	123	91.6 Å²	91.6	58%	0.575	48%	0.479	S	S	*	.	H	α-helix	trans	-62	-45	179.2	-71.9	173.1	-7.3	0	0	112.4	Q533 K534 L539 F540 V541	Q533-Q537 WeakPolarHBondContact O-CG 3.45Å; Q533-Q537 PolarHBondContact O-N 3.2Å; K534-Q537 PolarHBondContact O-N 3.07Å; Q537-L539 VanDerWaalsContact C-N 3.35Å; Q537-L539 PolarHBondContact O-N 3.2Å; Q537-F540 PolarHBondContact O-N 3.34Å; Q537-V541 WeakPolarHBondContact O-CG2 3.49Å; Q537-V541 PolarHBondContact O-N 3.33Å; Q537-V541 VanDerWaalsContact O-N 3.08Å
538	H	71.3	Confident	71.5	Confident	123 Å²	123	92.2 Å²	92.2	57%	0.569	50%	0.503	S	S	*	.	H	α-helix	trans	-59	-43.5	175.9	-78.5	-72.3	0	0	0	112.5	K534 F540 V541 E542	K534-H538 PolarHBondContact O-CD2 3.38Å; K534-H538 PolarHBondContact O-N 3.4Å; H538-F540 VanDerWaalsContact C-N 3.29Å; H538-F540 PolarHBondContact O-N 3.17Å; H538-V541 PolarHBondContact O-N 2.97Å; H538-E542 PolarHBondContact O-N 2.78Å
539	L	68.1	Low	68.8	Low	101 Å²	101	100 Å²	100	53%	0.529	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-31.6	177.1	-72.1	167.4	0	0	0	113.5	K535 K536 Q537 R543	K535-L539 WeakPolarHBondContact O-CG 3.43Å; K535-L539 PolarHBondContact O-N 3.2Å; K535-L539 VanDerWaalsContact O-N 3.15Å; K536-L539 PolarHBondContact O-N 2.84Å; Q537-L539 VanDerWaalsContact C-N 3.35Å; Q537-L539 PolarHBondContact O-N 3.2Å; L539-R543 PolarHBondContact O-N 3.08Å
540	F	62.1	Low	65.7	Low	157 Å²	157	107.7 Å²	107.7	69%	0.689	61%	0.607	S	S	*	*	H	α-helix	trans	-73.4	-38.5	174.7	-77.2	-67	0	0	0	112.1	K536 Q537 H538 R543 G544	K536-F540 WeakPolarHBondContact O-CD2 3.33Å; K536-F540 PolarHBondContact O-N 3.47Å; Q537-F540 PolarHBondContact O-N 3.34Å; H538-F540 VanDerWaalsContact C-N 3.29Å; H538-F540 PolarHBondContact O-N 3.17Å; F540-R543 PolarHBondContact O-N 3.18Å; F540-G544 PolarHBondContact O-N 2.83Å
541	V	61.5	Low	64.2	Low	108 Å²	108	112.9 Å²	112.9	66%	0.655	64%	0.636	S	S	*	*	H	α-helix	trans	-66.8	-43.3	177	175.5	0	0	0	0	111.2	Q537 H538 R543 G544 G545	Q537-V541 WeakPolarHBondContact O-CG2 3.49Å; Q537-V541 PolarHBondContact O-N 3.33Å; Q537-V541 VanDerWaalsContact O-N 3.08Å; H538-V541 PolarHBondContact O-N 2.97Å; V541-R543 VanDerWaalsContact C-N 3.32Å; V541-R543 PolarHBondContact O-N 3.15Å; V541-G544 PolarHBondContact O-N 3.22Å; V541-G545 PolarHBondContact O-N 3.28Å
542	E	56.7	Low	62.6	Low	149 Å²	149	116.1 Å²	116.1	70%	0.696	65%	0.652	S	S	*	*	H	α-helix	trans	-64.4	-33.3	177.3	-74.1	-179.9	172.7	0	0	113.2	H538	H538-E542 PolarHBondContact O-N 2.78Å
543	R	53.6	Low	60.9	Low	221 Å²	221	118.6 Å²	118.6	83%	0.834	67%	0.674	S	S	*	*	H	α-helix	trans	-77.9	-24.6	174.6	-77	-175.4	-176.1	-158.7	1.8	113.8	L539 F540 V541	L539-R543 PolarHBondContact O-N 3.08Å; F540-R543 PolarHBondContact O-N 3.18Å; V541-R543 VanDerWaalsContact C-N 3.32Å; V541-R543 PolarHBondContact O-N 3.15Å
544	G	48.3	Very low	59.2	Low	64 Å²	64	122.2 Å²	122.2	66%	0.66	70%	0.697	S	S	*	*	H	α-helix	trans	-86.5	-12.2	179.3	0	0	0	0	0	114.7	F540 V541	F540-G544 PolarHBondContact O-N 2.83Å; V541-G544 PolarHBondContact O-N 3.22Å
545	G	45.4	Very low	57.4	Low	68 Å²	68	124.6 Å²	124.6	70%	0.701	72%	0.718	S	S	*	*	S	Bend	trans	-88	5.6	-178.9	0	0	0	0	0	115.7	V541	V541-G545 PolarHBondContact O-N 3.28Å
546	G	43.8	Very low	55.4	Low	62 Å²	62	123.5 Å²	123.5	64%	0.639	73%	0.725	S	S	*	*	S	Bend	trans	-90.6	-15.4	-174.5	0	0	0	0	0	116.3
547	D	47.2	Very low	53.5	Low	173 Å²	173	125.9 Å²	125.9	93%	0.925	75%	0.749	S	S	*	*			trans	-114.3	78.2	-178.9	-72.8	-25.5	0	0	0	110.2
548	G	39.2	Very low	51.6	Low	70 Å²	70	126.2 Å²	126.2	72%	0.722	76%	0.763	S	S	*	*			trans	-154.5	82.4	177.6	0	0	0	0	0	110.8
549	I	40.3	Very low	50	Low	174 Å²	174	126.4 Å²	126.4	89%	0.892	78%	0.779	S	S	*	*			trans	-15.7	123.9	171.5	-58.5	161.4	0	0	0	116
550	A	33.6	Very low	48.3	Very low	170 Å²	170	128.7 Å²	128.7	100%	1.405	80%	0.802	S	S	*	*				-148	0	130	0	0	0	0	0	109.2

Retrieved 550 of 550 residues in 294.7 ms (Link to these results)

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