A0A096MX16_PAPAN Loading...

ATP-dependent RNA helicase

ATP-binding RNA helicase involved in the biogenesis of 60S ribosomal subunits. RNA helicase.

AlphaFold DB , UniProt , Accession A0A096MX16, Species PAPAN (Papio anubis, Olive baboon), Gene DDX51, Length 658 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	27.7	Very low	27.9	Very low	233 Å²	233	166.1 Å²	166.1	100%	1.148	83%	0.83	S	S	*	*				0	90.6	0	-64.4	-87.6	-136.5	0	0	106.6
2	S	30.7	Very low	28.3	Very low	88 Å²	88	163.3 Å²	163.3	62%	0.615	83%	0.833	S	S	*	*				100.7	132.9	60.8	63.1	0	0	0	0	111.6
3	L	25	Very low	28.5	Very low	140 Å²	140	165.8 Å²	165.8	73%	0.733	84%	0.84	S	S	*	*			trans	84.8	128.1	156.3	-56.1	149.9	0	0	0	115.3
4	F	27.1	Very low	28.6	Very low	186 Å²	186	161.4 Å²	161.4	82%	0.816	84%	0.841	S	S	*	*			cis	-140.5	139.7	26.6	-86.9	-92.1	0	0	0	113
5	Y	28.1	Very low	28.6	Very low	229 Å²	229	157.5 Å²	157.5	90%	0.898	84%	0.841	S	S	*	*			trans	-107.3	134.8	172.3	-146.2	-100.7	0	0	0	106.5
6	V	27.1	Very low	28.7	Very low	136 Å²	136	153.4 Å²	153.4	82%	0.824	84%	0.837	S	S	*	*			trans	-115.8	132.9	175.9	176.8	0	0	0	0	110.1
7	A	25.2	Very low	29.1	Very low	94 Å²	94	150.4 Å²	150.4	78%	0.777	84%	0.837	S	S	*	*			trans	-69.4	140.6	-160.1	0	0	0	0	0	115.6
8	R	28.7	Very low	29.1	Very low	239 Å²	239	148 Å²	148	90%	0.902	84%	0.84	S	S	*	*			trans	-88.6	127	157.5	-69.7	-176.6	-177.2	178.5	1.7	108.2	Q10	R8-Q10 PolarHBondContact O-N 2.8Å
9	Y	25.2	Very low	29.3	Very low	239 Å²	239	144 Å²	144	94%	0.937	83%	0.834	S	S	*	*			trans	-64.4	115.6	178.6	-142.8	-100.6	0	0	0	110
10	Q	28.1	Very low	29.9	Very low	181 Å²	181	143.2 Å²	143.2	85%	0.846	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-91.4	132.1	168.7	-77.4	178.2	-15.1	0	0	108.9	R8	R8-Q10 PolarHBondContact O-N 2.8Å
11	G	33.6	Very low	30.2	Very low	62 Å²	62	146.1 Å²	146.1	64%	0.639	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-70.2	161.8	167	0	0	0	0	0	111.1	E13	G11-E13 PolarHBondContact O-N 3.19Å
12	P	32.5	Very low	30.7	Very low	133 Å²	133	138.3 Å²	138.3	86%	0.864	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.1	120.1	-168.5	31.9	-30.9	0	0	0	111.3
13	E	30.9	Very low	31	Very low	196 Å²	196	138.6 Å²	138.6	92%	0.916	83%	0.827	S	S	*	*			trans	-135.2	121.5	149.3	-85.4	-166.8	166.4	0	0	109.9	G11	G11-E13 PolarHBondContact O-N 3.19Å
14	A	30.6	Very low	31.6	Very low	104 Å²	104	140.3 Å²	140.3	86%	0.86	83%	0.831	S	S	*	*			trans	-157.9	130.6	150.6	0	0	0	0	0	104
15	A	28.6	Very low	32.3	Very low	102 Å²	102	135.6 Å²	135.6	84%	0.843	83%	0.827	S	S	*	*			cis	-163	172.1	27.2	0	0	0	0	0	106.7
16	A	29.6	Very low	33	Very low	93 Å²	93	126.5 Å²	126.5	77%	0.769	80%	0.803	S	S	*	*			cis	-165.7	154.2	-9.6	0	0	0	0	0	105.6
17	A	35.9	Very low	34	Very low	102 Å²	102	123.3 Å²	123.3	84%	0.843	79%	0.79	S	S	*	*			trans	56.7	102.9	152.6	0	0	0	0	0	120.8
18	A	30	Very low	35	Very low	107 Å²	107	126.1 Å²	126.1	88%	0.884	79%	0.787	S	S	*	*				172.3	139.1	127.2	0	0	0	0	0	112.8
19	G	33.1	Very low	36.6	Very low	72 Å²	72	116.7 Å²	116.7	74%	0.742	76%	0.764	S	S	*	*			trans	11.1	143.4	164.3	0	0	0	0	0	123.8
20	P	40.3	Very low	37.9	Very low	128 Å²	128	114.9 Å²	114.9	83%	0.831	76%	0.756	S	S	*	*	S	Bend	trans	-92.5	104.5	177.3	35.1	-25.5	0	0	0	111
21	E	36	Very low	39.1	Very low	204 Å²	204	109.2 Å²	109.2	95%	0.953	74%	0.74	S	S	*	*	S	Bend	trans	-171	100.3	155.8	-108.3	171.9	-152.2	0	0	108.5
22	G	39.4	Very low	40.4	Very low	69 Å²	69	115.2 Å²	115.2	71%	0.711	74%	0.743	S	S	*	*			trans	151.1	-7.6	172.2	0	0	0	0	0	118.8	E24	G22-E24 PolarHBondContact O-N 3.49Å
23	A	35.3	Very low	42	Very low	94 Å²	94	111.3 Å²	111.3	78%	0.777	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-14.3	-168.4	0	0	0	0	0	116.4
24	E	39.3	Very low	43.4	Very low	177 Å²	177	107.4 Å²	107.4	83%	0.827	71%	0.707	S	S	*	*	H	α-helix	trans	-79.9	-17.7	-176.2	-72.4	-166.9	152.5	0	0	114.7	G22	G22-E24 PolarHBondContact O-N 3.49Å
25	A	40.6	Very low	45	Very low	87 Å²	87	107 Å²	107	72%	0.719	69%	0.69	S	S	*	*	H	α-helix	trans	-78	-24.8	-177.9	0	0	0	0	0	114
26	G	43.1	Very low	47.1	Very low	38 Å²	38	108.1 Å²	108.1	39%	0.392	68%	0.677	S	S	.	*	H	α-helix	trans	-85.3	-30.7	-172.2	0	0	0	0	0	115.5	R30	G26-R30 PolarHBondContact O-N 3.09Å
27	A	47.1	Very low	49	Very low	68 Å²	68	112.9 Å²	112.9	56%	0.562	68%	0.676	S	S	*	*	H	α-helix	trans	-74.8	-38.8	-178	0	0	0	0	0	112	G29 R30 A31	A27-G29 PolarHBondContact O-N 3.48Å; A27-R30 PolarHBondContact O-N 3.36Å; A27-A31 PolarHBondContact O-N 3.5Å
28	H	47.9	Very low	50.4	Low	154 Å²	154	113 Å²	113	71%	0.713	66%	0.662	S	S	*	*	H	α-helix	trans	-65.9	-34.9	175.1	-95.4	-72.9	0	0	0	112.8	R32	H28-R32 WeakPolarHBondContact O-CB 3.41Å; H28-R32 PolarHBondContact O-N 3.28Å; H28-R32 VanDerWaalsContact O-N 3.14Å
29	G	62.2	Low	52.5	Low	41 Å²	41	112.6 Å²	112.6	42%	0.423	64%	0.641	S	S	.	*	H	α-helix	trans	-65.2	-41.7	177.1	0	0	0	0	0	113.3	A27 R32 A33	A27-G29 PolarHBondContact O-N 3.48Å; G29-R32 PolarHBondContact O-N 3.12Å; G29-A33 WeakPolarHBondContact O-CB 3.45Å; G29-A33 PolarHBondContact O-N 3.17Å
30	R	51.4	Low	54	Low	200 Å²	200	111.8 Å²	111.8	76%	0.755	62%	0.624	S	S	*	*	H	α-helix	trans	-70.9	-38.6	179.7	-65.4	-176.7	-140.8	174.6	4.7	112.5	G26 A27 R32 L34	G26-R30 PolarHBondContact O-N 3.09Å; A27-R30 PolarHBondContact O-N 3.36Å; R30-R32 VanDerWaalsContact C-N 3.33Å; R30-L34 WeakPolarHBondContact O-CB 3.49Å; R30-L34 PolarHBondContact O-N 2.69Å; R30-L34 VanDerWaalsContact O-N 3.09Å
31	A	54.3	Low	55.5	Low	62 Å²	62	114.1 Å²	114.1	51%	0.512	62%	0.617	S	S	.	*	H	α-helix	trans	-64	-39.5	175.5	0	0	0	0	0	111.8	A27 L34 L35	A27-A31 PolarHBondContact O-N 3.5Å; A31-L34 PolarHBondContact O-N 2.76Å; A31-L35 PolarHBondContact O-N 2.74Å; A31-L35 VanDerWaalsContact O-N 3.13Å
32	R	61.2	Low	57.1	Low	189 Å²	189	107 Å²	107	71%	0.713	59%	0.592	S	S	*	*	H	α-helix	trans	-70	-42.1	179	-153.2	171.8	-173.9	160.7	1	112.4	H28 G29 R30 L34 L35 E36	H28-R32 WeakPolarHBondContact O-CB 3.41Å; H28-R32 PolarHBondContact O-N 3.28Å; H28-R32 VanDerWaalsContact O-N 3.14Å; G29-R32 PolarHBondContact O-N 3.12Å; R30-R32 VanDerWaalsContact C-N 3.33Å; R32-L34 VanDerWaalsContact C-N 3.31Å; R32-L34 PolarHBondContact O-N 2.68Å; R32-L35 PolarHBondContact O-N 2.7Å; R32-E36 PolarHBondContact O-N 2.87Å
33	A	65.4	Low	58.5	Low	51 Å²	51	111.7 Å²	111.7	42%	0.421	59%	0.588	S	S	.	*	H	α-helix	trans	-64.4	-33.6	175.4	0	0	0	0	0	113	G29 R37	G29-A33 WeakPolarHBondContact O-CB 3.45Å; G29-A33 PolarHBondContact O-N 3.17Å; A33-R37 PolarHBondContact O-N 2.6Å
34	L	59.5	Low	60.1	Low	113 Å²	113	112.4 Å²	112.4	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-72.6	-35.5	176.5	-158.9	130.3	0	0	0	111.7	R30 A31 R32 R37 L38	R30-L34 WeakPolarHBondContact O-CB 3.49Å; R30-L34 PolarHBondContact O-N 2.69Å; R30-L34 VanDerWaalsContact O-N 3.09Å; A31-L34 PolarHBondContact O-N 2.76Å; R32-L34 VanDerWaalsContact C-N 3.31Å; R32-L34 PolarHBondContact O-N 2.68Å; L34-R37 PolarHBondContact O-N 3.28Å; L34-L38 HydrophobicContact CD2-CD1 3.9Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 2.8Å; L34-L38 VanDerWaalsContact O-N 3.1Å
35	L	65.3	Low	61.3	Low	96 Å²	96	113 Å²	113	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-67.4	-42.2	175.2	-127.6	155.6	0	0	0	112	A31 R32 R37 L38 Q39	A31-L35 PolarHBondContact O-N 2.74Å; A31-L35 VanDerWaalsContact O-N 3.13Å; R32-L35 PolarHBondContact O-N 2.7Å; L35-R37 PolarHBondContact O-N 3.16Å; L35-L38 PolarHBondContact O-N 2.91Å; L35-Q39 HydrophobicContact CD2-CG 4.33Å; L35-Q39 WeakPolarHBondContact O-CG 3.48Å; L35-Q39 PolarHBondContact O-N 2.81Å
36	E	71.8	Confident	62.3	Low	125 Å²	125	115.7 Å²	115.7	58%	0.584	57%	0.568	S	S	*	*	H	α-helix	trans	-63.6	-39.9	175.2	-77.4	179.4	171.9	0	0	112.4	R32 L38 Q39 S40	R32-E36 PolarHBondContact O-N 2.87Å; E36-L38 VanDerWaalsContact C-N 3.35Å; E36-L38 PolarHBondContact O-N 2.93Å; E36-Q39 PolarHBondContact O-N 2.91Å; E36-S40 PolarHBondContact O-N 3.49Å; E36-S40 PolarHBondContact O-OG 2.97Å
37	R	69.7	Low	62.9	Low	194 Å²	194	121 Å²	121	73%	0.732	58%	0.583	S	S	*	*	H	α-helix	trans	-66.9	-32.2	174.9	-81.8	-178.1	168.8	-178.5	-2.1	113.8	A33 L34 L35 S40 R41	A33-R37 PolarHBondContact O-N 2.6Å; L34-R37 PolarHBondContact O-N 3.28Å; L35-R37 PolarHBondContact O-N 3.16Å; R37-S40 PolarHBondContact O-OG 3.06Å; R37-S40 VanDerWaalsContact O-OG 3.05Å; R37-R41 PolarHBondContact O-N 3.03Å
38	L	65.9	Low	63.4	Low	105 Å²	105	125.7 Å²	125.7	55%	0.55	59%	0.593	S	S	.	*	H	α-helix	trans	-74.1	-36.8	175	-72.9	171.4	0	0	0	111.3	L34 L35 E36 A42	L34-L38 HydrophobicContact CD2-CD1 3.9Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 2.8Å; L34-L38 VanDerWaalsContact O-N 3.1Å; L35-L38 PolarHBondContact O-N 2.91Å; E36-L38 VanDerWaalsContact C-N 3.35Å; E36-L38 PolarHBondContact O-N 2.93Å; L38-A42 WeakPolarHBondContact O-CB 3.3Å; L38-A42 PolarHBondContact O-N 3.41Å; L38-A42 VanDerWaalsContact O-N 3.1Å
39	Q	73.1	Confident	63.4	Low	98 Å²	98	128.8 Å²	128.8	46%	0.458	60%	0.599	S	S	.	*	H	α-helix	trans	-70.6	-36.7	176.4	-72	178.8	-2.7	0	0	112.6	L35 E36 A42 R43	L35-Q39 HydrophobicContact CD2-CG 4.33Å; L35-Q39 WeakPolarHBondContact O-CG 3.48Å; L35-Q39 PolarHBondContact O-N 2.81Å; E36-Q39 PolarHBondContact O-N 2.91Å; Q39-A42 PolarHBondContact O-N 3.3Å; Q39-R43 WeakPolarHBondContact O-CG 3.5Å; Q39-R43 PolarHBondContact O-N 3.11Å; Q39-R43 VanDerWaalsContact O-N 3.11Å
40	S	66	Low	62.4	Low	55 Å²	55	134.8 Å²	134.8	39%	0.385	62%	0.615	S	S	.	*	H	α-helix	trans	-65.1	-44.1	175.1	65.8	0	0	0	0	112	E36 R37 A42 R43 E44	E36-S40 PolarHBondContact O-N 3.49Å; E36-S40 PolarHBondContact O-OG 2.97Å; R37-S40 PolarHBondContact O-OG 3.06Å; R37-S40 VanDerWaalsContact O-OG 3.05Å; S40-A42 VanDerWaalsContact C-N 3.3Å; S40-A42 PolarHBondContact O-N 3.27Å; S40-R43 PolarHBondContact O-N 3.09Å; S40-E44 PolarHBondContact O-N 3.23Å
41	R	70.6	Confident	62	Low	177 Å²	177	130.9 Å²	130.9	67%	0.668	62%	0.616	S	S	*	*	H	α-helix	trans	-64.6	-31.2	174.7	-80.9	-177	168.9	-179.6	-1.9	113.7	R37 R45	R37-R41 PolarHBondContact O-N 3.03Å; R41-R45 WeakPolarHBondContact O-CG 3.26Å; R41-R45 PolarHBondContact O-N 3.49Å
42	A	69.6	Low	61.2	Low	53 Å²	53	132.4 Å²	132.4	44%	0.438	63%	0.629	S	S	.	*	H	α-helix	trans	-69.4	-38.2	174.6	0	0	0	0	0	111.8	L38 Q39 S40 R45 Q46	L38-A42 WeakPolarHBondContact O-CB 3.3Å; L38-A42 PolarHBondContact O-N 3.41Å; L38-A42 VanDerWaalsContact O-N 3.1Å; Q39-A42 PolarHBondContact O-N 3.3Å; S40-A42 VanDerWaalsContact C-N 3.3Å; S40-A42 PolarHBondContact O-N 3.27Å; A42-R45 PolarHBondContact O-N 3.42Å; A42-Q46 PolarHBondContact O-N 2.93Å; A42-Q46 VanDerWaalsContact O-N 3.13Å
43	R	68.3	Low	60.1	Low	168 Å²	168	129.6 Å²	129.6	63%	0.634	64%	0.635	S	S	*	*	H	α-helix	trans	-69.4	-41.7	175.9	-70.5	176.6	-176.7	-178.4	2.5	112.2	Q39 S40 R45 Q46 Q47	Q39-R43 WeakPolarHBondContact O-CG 3.5Å; Q39-R43 PolarHBondContact O-N 3.11Å; Q39-R43 VanDerWaalsContact O-N 3.11Å; S40-R43 PolarHBondContact O-N 3.09Å; R43-R45 VanDerWaalsContact C-N 3.3Å; R43-R45 PolarHBondContact O-N 3Å; R43-Q46 PolarHBondContact O-N 2.83Å; R43-Q46 VanDerWaalsContact O-N 3.13Å; R43-Q47 PolarHBondContact O-N 2.9Å
44	E	68.9	Low	58.6	Low	110 Å²	110	133.8 Å²	133.8	51%	0.514	66%	0.655	S	S	.	*	H	α-helix	trans	-60	-39.5	173.7	-75.1	173.7	174.3	0	0	112	S40 Q46 Q47 Q48	S40-E44 PolarHBondContact O-N 3.23Å; E44-Q46 VanDerWaalsContact C-N 3.34Å; E44-Q46 PolarHBondContact O-N 2.85Å; E44-Q47 PolarHBondContact O-N 3.21Å; E44-Q48 WeakPolarHBondContact O-CG 3.27Å; E44-Q48 PolarHBondContact O-N 2.88Å; E44-Q48 VanDerWaalsContact O-N 3.08Å
45	R	65.1	Low	57.4	Low	190 Å²	190	138 Å²	138	72%	0.717	67%	0.672	S	S	*	*	H	α-helix	trans	-71	-25.3	175.7	-78.8	-177.7	169.1	-157.7	-2.8	114.1	R41 A42 R43	R41-R45 WeakPolarHBondContact O-CG 3.26Å; R41-R45 PolarHBondContact O-N 3.49Å; A42-R45 PolarHBondContact O-N 3.42Å; R43-R45 VanDerWaalsContact C-N 3.3Å; R43-R45 PolarHBondContact O-N 3Å
46	Q	61.5	Low	55.9	Low	142 Å²	142	138.1 Å²	138.1	66%	0.664	69%	0.687	S	S	*	*	H	α-helix	trans	-77.5	-38.1	172.3	-83.4	178.5	-29	0	0	111.4	A42 R43 E44 Q48 R49	A42-Q46 PolarHBondContact O-N 2.93Å; A42-Q46 VanDerWaalsContact O-N 3.13Å; R43-Q46 PolarHBondContact O-N 2.83Å; R43-Q46 VanDerWaalsContact O-N 3.13Å; E44-Q46 VanDerWaalsContact C-N 3.34Å; E44-Q46 PolarHBondContact O-N 2.85Å; Q46-Q48 VanDerWaalsContact C-N 3.31Å; Q46-Q48 PolarHBondContact O-N 3.41Å; Q46-R49 PolarHBondContact O-N 3.2Å; Q46-R49 VanDerWaalsContact O-N 3.15Å
47	Q	56.9	Low	53.9	Low	151 Å²	151	137.1 Å²	137.1	71%	0.706	70%	0.7	S	S	*	*	H	α-helix	trans	-68.1	-28.3	175.6	-73.5	175.5	-6.8	0	0	113	R43 E44 R49	R43-Q47 PolarHBondContact O-N 2.9Å; E44-Q47 PolarHBondContact O-N 3.21Å; Q47-R49 VanDerWaalsContact C-N 3.26Å; Q47-R49 PolarHBondContact O-N 3.48Å
48	Q	57.2	Low	52.1	Low	165 Å²	165	132.2 Å²	132.2	77%	0.771	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-1.6	173.4	-71.7	176.9	5.8	0	0	114.2	E44 Q46	E44-Q48 WeakPolarHBondContact O-CG 3.27Å; E44-Q48 PolarHBondContact O-N 2.88Å; E44-Q48 VanDerWaalsContact O-N 3.08Å; Q46-Q48 VanDerWaalsContact C-N 3.31Å; Q46-Q48 PolarHBondContact O-N 3.41Å
49	R	46.7	Very low	50.6	Low	220 Å²	220	133.2 Å²	133.2	83%	0.83	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	0.8	-175.3	-100.1	-176.9	172.4	-169.2	-2.5	115	Q46 Q47	Q46-R49 PolarHBondContact O-N 3.2Å; Q46-R49 VanDerWaalsContact O-N 3.15Å; Q47-R49 VanDerWaalsContact C-N 3.26Å; Q47-R49 PolarHBondContact O-N 3.48Å
50	E	41.5	Very low	48.6	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-87.5	126.4	173.1	-73.8	-175	162.9	0	0	110.8
51	P	42.6	Very low	47	Very low	119 Å²	119	142 Å²	142	77%	0.773	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-74.5	146.2	170.7	29.9	-30.3	0	0	0	110.7
52	A	37.7	Very low	45.2	Very low	94 Å²	94	139.6 Å²	139.6	78%	0.777	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-55	141.2	179.9	0	0	0	0	0	112.6	T54	A52-T54 PolarHBondContact O-N 3.05Å
53	P	38.3	Very low	43.3	Very low	129 Å²	129	142.2 Å²	142.2	84%	0.838	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.8	124.1	-179.8	30.5	-30.6	0	0	0	111.3
54	T	34.4	Very low	41.5	Very low	139 Å²	139	140.2 Å²	140.2	85%	0.853	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.8	132.6	159.2	12.2	0	0	0	0	110.2	A52 A56	A52-T54 PolarHBondContact O-N 3.05Å; T54-A56 PolarHBondContact O-N 3.37Å
55	E	34.4	Very low	39.7	Very low	201 Å²	201	145 Å²	145	94%	0.939	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-52.7	130.2	172.1	-70.1	175.6	142.9	0	0	111.6
56	A	33	Very low	38	Very low	99 Å²	99	144.3 Å²	144.3	82%	0.818	81%	0.81	S	S	*	*			trans	-132.9	136.4	167.9	0	0	0	0	0	110.3	T54	T54-A56 PolarHBondContact O-N 3.37Å
57	A	30.2	Very low	36.5	Very low	104 Å²	104	149.2 Å²	149.2	86%	0.86	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-64.1	167.7	-174.6	0	0	0	0	0	115
58	A	32.8	Very low	35.2	Very low	92 Å²	92	154 Å²	154	76%	0.76	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-53	157.3	-169.5	0	0	0	0	0	117.7
59	P	34.3	Very low	34	Very low	126 Å²	126	157.8 Å²	157.8	82%	0.818	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-93.5	151.7	-177.5	36.9	-31.9	0	0	0	113.3
60	T	30.2	Very low	33.5	Very low	147 Å²	147	153.2 Å²	153.2	90%	0.902	84%	0.84	S	S	*	*			trans	-115	147	162.1	22.7	0	0	0	0	110.2
61	E	32.5	Very low	32.9	Very low	189 Å²	189	156.7 Å²	156.7	88%	0.883	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-63.9	163.5	-162.6	-66.7	-174.1	147.7	0	0	117.7
62	P	33.3	Very low	32.2	Very low	128 Å²	128	162.6 Å²	162.6	83%	0.831	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-95.8	137	179.5	35.9	-29.1	0	0	0	113.6
63	A	30.1	Very low	31.9	Very low	107 Å²	107	169.8 Å²	169.8	88%	0.884	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-99.9	130.2	167.2	0	0	0	0	0	111.9
64	T	29.9	Very low	31.4	Very low	126 Å²	126	174.8 Å²	174.8	77%	0.773	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-70.4	145.1	177.5	61.5	0	0	0	0	114.1
65	R	30.5	Very low	31.1	Very low	210 Å²	210	178.9 Å²	178.9	79%	0.792	86%	0.862	S	S	*	*				149.2	135.7	115.3	-97.2	176.3	165.5	178.5	-0.5	116
66	K	29.7	Very low	30.9	Very low	176 Å²	176	176.3 Å²	176.3	77%	0.765	85%	0.854	S	S	*	*			trans	91	99.7	139.9	-75.5	175	-179.4	-178	0	120.7
67	R	30.3	Very low	30.6	Very low	246 Å²	246	179 Å²	179	93%	0.928	86%	0.855	S	S	*	*			trans	-43	140.7	150.1	-71.7	170	147.6	-179.2	-6.1	114
68	R	29.8	Very low	30.4	Very low	252 Å²	252	177.7 Å²	177.7	95%	0.951	85%	0.852	S	S	*	*			trans	-130.7	133.5	155.6	-84.6	-177.7	129.4	178.4	-0.4	111.1
69	R	31.8	Very low	30.2	Very low	243 Å²	243	177.4 Å²	177.4	92%	0.917	85%	0.85	S	S	*	*			trans	-89.3	166.4	174.7	-96	-174.4	176.8	-172	-0	111.3
70	P	35.5	Very low	29.9	Very low	125 Å²	125	180.5 Å²	180.5	81%	0.812	85%	0.853	S	S	*	*			trans	-87.1	155	-161.7	35.1	-33.9	0	0	0	113.4
71	R	29.5	Very low	29.8	Very low	239 Å²	239	179.3 Å²	179.3	90%	0.902	85%	0.851	S	S	*	*			trans	-110.1	121.6	174.9	-94.4	-175.1	166.7	-178.1	-3.4	111.8
72	R	28.8	Very low	29.5	Very low	242 Å²	242	174.1 Å²	174.1	91%	0.913	85%	0.848	S	S	*	*			trans	-55	147.7	151.6	-88.4	173.6	158.2	179.3	-4.6	110.6
73	R	30.9	Very low	29.3	Very low	245 Å²	245	173.7 Å²	173.7	93%	0.925	85%	0.848	S	S	*	*			trans	-141.7	140.8	144	-100.1	-173.8	173.6	-171.1	-3.5	111.3
74	R	27.1	Very low	29.9	Very low	234 Å²	234	174.1 Å²	174.1	88%	0.883	84%	0.842	S	S	*	*			trans	-118.7	138.7	-175.1	-166.3	-179.5	177.4	-170.8	-1.6	106.4
75	R	28.5	Very low	29.8	Very low	225 Å²	225	177.7 Å²	177.7	85%	0.849	85%	0.85	S	S	*	*			trans	13.5	144	158.9	-65.1	-174.8	173.5	-171.4	-3.1	120.8
76	L	30.4	Very low	29.8	Very low	148 Å²	148	171.8 Å²	171.8	78%	0.775	85%	0.846	S	S	*	*				-176.9	131.7	107.9	-93.1	160.4	0	0	0	113.3
77	N	27.5	Very low	29.8	Very low	154 Å²	154	173.7 Å²	173.7	82%	0.824	85%	0.848	S	S	*	*			trans	41.6	141.9	139.4	-65.7	2.5	0	0	0	124.7
78	G	25.6	Very low	29.7	Very low	77 Å²	77	169.5 Å²	169.5	79%	0.794	84%	0.839	S	S	*	*			trans	166.9	70.7	153.8	0	0	0	0	0	117.3
79	A	27.4	Very low	29.5	Very low	87 Å²	87	161 Å²	161	72%	0.719	83%	0.83	S	S	*	*			trans	40.8	134.8	138.4	0	0	0	0	0	125.4
80	E	28.9	Very low	29.4	Very low	191 Å²	191	159 Å²	159	89%	0.893	83%	0.828	S	S	*	*			trans	72.9	136.6	138.5	-68.6	172.6	-172.7	0	0	119.5
81	S	28.1	Very low	29	Very low	122 Å²	122	164.8 Å²	164.8	85%	0.853	83%	0.833	S	S	*	*			cis	-167.2	163.8	36.1	48.3	0	0	0	0	111.5
82	G	26	Very low	29	Very low	80 Å²	80	165.4 Å²	165.4	83%	0.825	84%	0.836	S	S	*	*			trans	119.1	95.2	150	0	0	0	0	0	117
83	S	29.4	Very low	28.9	Very low	118 Å²	118	163.4 Å²	163.4	83%	0.825	83%	0.834	S	S	*	*			trans	-94.4	-156.4	-176.1	49.9	0	0	0	0	113.1
84	P	43.2	Very low	28.9	Very low	117 Å²	117	155 Å²	155	76%	0.76	82%	0.816	S	S	*	*				-128	174.9	-103.9	37.4	-17.8	0	0	0	114.1
85	E	28.1	Very low	29	Very low	201 Å²	201	151.5 Å²	151.5	94%	0.939	82%	0.815	S	S	*	*			trans	-138.1	133.2	152.3	-105	-176.5	175.9	0	0	111.9
86	A	29.1	Very low	28.8	Very low	86 Å²	86	144 Å²	144	71%	0.711	81%	0.808	S	S	*	*			trans	-107.9	156.3	-179.3	0	0	0	0	0	108.9
87	R	29	Very low	28.8	Very low	216 Å²	216	146 Å²	146	82%	0.815	81%	0.814	S	S	*	*				172	138	108.3	-96.5	173.9	172	-170.4	2.6	114.6
88	Q	28.4	Very low	28.8	Very low	158 Å²	158	146.2 Å²	146.2	74%	0.738	81%	0.814	S	S	*	*			trans	85.7	109.2	134.9	-73.7	172.1	20.9	0	0	119.9
89	G	27.1	Very low	29	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	81%	0.811	S	S	*	*			trans	-84.6	174.3	149.6	0	0	0	0	0	112.7
90	K	28.4	Very low	28.9	Very low	202 Å²	202	146.1 Å²	146.1	88%	0.878	81%	0.813	S	S	*	*			trans	-150.5	115.3	156.9	-111.5	173	-178.4	174	0	109.3
91	R	28.1	Very low	29	Very low	246 Å²	246	141.1 Å²	141.1	93%	0.928	81%	0.805	S	S	*	*			trans	-74	143.2	153.8	-80.8	174.6	158.7	179.5	-6.4	108.5
92	R	29.4	Very low	28.9	Very low	251 Å²	251	143.9 Å²	143.9	95%	0.947	80%	0.804	S	S	*	*			trans	-143.4	162.9	142.7	-85.3	-162.9	170.8	179.7	-4.7	109.6
93	K	27.2	Very low	29	Very low	201 Å²	201	145.3 Å²	145.3	87%	0.874	80%	0.802	S	S	*	*			trans	-132.3	153.8	-143	-163.3	-159.2	-178.6	-173.5	0	107.4
94	A	29.2	Very low	29	Very low	67 Å²	67	144 Å²	144	55%	0.554	79%	0.793	S	S	*	*			trans	81.8	150.7	142.8	0	0	0	0	0	121.5
95	D	29.1	Very low	28.3	Very low	162 Å²	162	146.6 Å²	146.6	87%	0.866	80%	0.795	S	S	*	*			trans	82.9	130.1	160.5	-45.2	-33.6	0	0	0	115.6
96	G	26	Very low	28.3	Very low	68 Å²	68	144.7 Å²	144.7	70%	0.701	79%	0.791	S	S	*	*			cis	147.8	141.6	10.1	0	0	0	0	0	108.3
97	E	30.3	Very low	28.3	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	79%	0.79	S	S	*	*			trans	79	105	154.9	-63.7	177.8	160.2	0	0	121.7
98	D	27.1	Very low	29	Very low	157 Å²	157	140.6 Å²	140.6	84%	0.84	79%	0.792	S	S	*	*				79.3	141.2	98.4	-142.6	15.5	0	0	0	123
99	A	30.1	Very low	28.9	Very low	87 Å²	87	136.7 Å²	136.7	72%	0.719	79%	0.794	S	S	*	*			trans	70.8	118.9	150.2	0	0	0	0	0	121.7
100	G	25.8	Very low	29.1	Very low	75 Å²	75	142.1 Å²	142.1	77%	0.773	80%	0.8	S	S	*	*				127.4	110.9	98	0	0	0	0	0	118.6
101	A	29.1	Very low	29.5	Very low	87 Å²	87	138.5 Å²	138.5	72%	0.719	80%	0.797	S	S	*	*			trans	87.5	110.8	130.4	0	0	0	0	0	121.7
102	E	27.3	Very low	29.5	Very low	180 Å²	180	132 Å²	132	84%	0.841	79%	0.789	S	S	*	*				58.4	124.8	116.9	-62.6	178.5	169.1	0	0	120.5
103	S	28.1	Very low	29.5	Very low	110 Å²	110	126 Å²	126	77%	0.769	79%	0.786	S	S	*	*				162.2	135.3	86	46.3	0	0	0	0	114.2
104	S	28.9	Very low	29.4	Very low	91 Å²	91	119.4 Å²	119.4	64%	0.636	78%	0.775	S	S	*	*			trans	58.5	122.3	134.7	66.1	0	0	0	0	124.7
105	E	29.2	Very low	29.3	Very low	171 Å²	171	122.1 Å²	122.1	80%	0.799	79%	0.79	S	S	*	*				66.9	118.5	120.2	-60.6	177.2	171.3	0	0	120.5
106	D	27.8	Very low	29.3	Very low	160 Å²	160	118.3 Å²	118.3	86%	0.856	78%	0.776	S	S	*	*				174.2	140.7	104.5	-97.2	-30.8	0	0	0	112.8
107	A	28.9	Very low	29.4	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	78%	0.779	S	S	*	*			trans	-107.2	-173.4	157.3	0	0	0	0	0	107.1
108	P	44.1	Very low	29.2	Very low	132 Å²	132	121 Å²	121	86%	0.857	78%	0.775	S	S	*	*			cis	-134.8	-173.5	-7.6	36.1	-15.2	0	0	0	112.9
109	G	26.7	Very low	29.3	Very low	76 Å²	76	117.5 Å²	117.5	78%	0.784	77%	0.768	S	S	*	*			trans	161.3	103.7	158.7	0	0	0	0	0	116.4
110	E	30.7	Very low	29.8	Very low	188 Å²	188	119.5 Å²	119.5	88%	0.879	77%	0.774	S	S	*	*			trans	-78.5	166.3	149.5	-61.4	-172	149.1	0	0	109.6
111	P	36	Very low	29.8	Very low	126 Å²	126	119.2 Å²	119.2	82%	0.818	77%	0.771	S	S	*	*				-146.9	170.3	90.2	34.4	-14.4	0	0	0	116.4
112	S	27.8	Very low	29.7	Very low	109 Å²	109	124 Å²	124	76%	0.762	78%	0.778	S	S	*	*			trans	-65.7	158.6	-180	57.8	0	0	0	0	119.1
113	S	29.7	Very low	30.4	Very low	124 Å²	124	120 Å²	120	87%	0.867	77%	0.768	S	S	*	*			trans	-175	136.3	134.8	57.9	0	0	0	0	108.3
114	G	24.8	Very low	30.4	Very low	64 Å²	64	119.5 Å²	119.5	66%	0.66	77%	0.765	S	S	*	*			cis	129.4	127.2	13.6	0	0	0	0	0	110.2
115	S	28.7	Very low	30.4	Very low	123 Å²	123	121 Å²	121	86%	0.86	78%	0.775	S	S	*	*			trans	73.7	147.5	162.6	70.1	0	0	0	0	120
116	S	27.6	Very low	30.2	Very low	82 Å²	82	115.9 Å²	115.9	57%	0.573	77%	0.768	S	S	*	*			cis	-175.6	159.9	-15	51.2	0	0	0	0	109
117	E	28.1	Very low	30.1	Very low	164 Å²	164	113.7 Å²	113.7	77%	0.766	77%	0.765	S	S	*	*			trans	67.3	142.6	145.7	-69.6	150.5	-173.5	0	0	118.3
118	D	27.4	Very low	30	Very low	151 Å²	151	114.5 Å²	114.5	81%	0.807	77%	0.766	S	S	*	*			cis	-161.8	155.9	26.9	-115.7	-30.8	0	0	0	111.4
119	A	28.5	Very low	29.2	Very low	84 Å²	84	116.5 Å²	116.5	69%	0.694	76%	0.764	S	S	*	*			trans	-81	-164.6	164.3	0	0	0	0	0	109.4
120	P	40.3	Very low	29.3	Very low	129 Å²	129	120.5 Å²	120.5	84%	0.838	77%	0.767	S	S	*	*			cis	-143.5	175.6	7	39.6	-17.8	0	0	0	117.3
121	G	25.8	Very low	29	Very low	68 Å²	68	115.7 Å²	115.7	70%	0.701	76%	0.759	S	S	*	*				101.1	93.7	124.7	0	0	0	0	0	120.7
122	E	26.8	Very low	28.9	Very low	187 Å²	187	115.7 Å²	115.7	87%	0.874	76%	0.759	S	S	*	*				52.7	167.3	111.1	-85.8	-166	-166.1	0	0	122.9
123	P	41.8	Very low	28.8	Very low	96 Å²	96	114.1 Å²	114.1	62%	0.623	76%	0.761	S	S	*	*			cis	-146	174.8	-21.1	34.5	-12.9	0	0	0	117.3
124	S	27.9	Very low	28.5	Very low	101 Å²	101	117.1 Å²	117.1	71%	0.706	76%	0.761	S	S	*	*				86	142.3	129	67.3	0	0	0	0	125.9
125	S	29.1	Very low	29.1	Very low	122 Å²	122	119.1 Å²	119.1	85%	0.853	76%	0.762	S	S	*	*			trans	91.2	127.4	148.8	75.9	0	0	0	0	116
126	G	25.7	Very low	29	Very low	63 Å²	63	118 Å²	118	65%	0.649	75%	0.754	S	S	*	*			cis	139	104.8	17.4	0	0	0	0	0	105.5
127	S	26.3	Very low	28.9	Very low	115 Å²	115	119.5 Å²	119.5	80%	0.804	77%	0.765	S	S	*	*				92.6	149.8	97.2	64.1	0	0	0	0	115.1
128	S	26.8	Very low	28.9	Very low	100 Å²	100	117.5 Å²	117.5	70%	0.699	77%	0.769	S	S	*	*			trans	70.8	113.4	167	47.7	0	0	0	0	118.1
129	E	27.4	Very low	28.8	Very low	175 Å²	175	115 Å²	115	82%	0.818	77%	0.769	S	S	*	*				68.6	108.1	72.3	-70.7	-173	161.5	0	0	112.5
130	D	27.3	Very low	28.8	Very low	159 Å²	159	116.5 Å²	116.5	85%	0.85	78%	0.775	S	S	*	*				166.1	133.8	114.5	-94.2	-30.9	0	0	0	112.4
131	A	26	Very low	28.2	Very low	87 Å²	87	114.8 Å²	114.8	72%	0.719	77%	0.772	S	S	*	*			trans	-82.4	156.5	156.4	0	0	0	0	0	108.1
132	P	32.5	Very low	28.2	Very low	126 Å²	126	120.7 Å²	120.7	82%	0.818	78%	0.781	S	S	*	*				-154.9	162	86.3	36	-15.9	0	0	0	116.4
133	G	25.6	Very low	28.2	Very low	77 Å²	77	116.8 Å²	116.8	79%	0.794	78%	0.78	S	S	*	*				78.3	122.6	129.8	0	0	0	0	0	120.8
134	E	24	Very low	27.7	Very low	187 Å²	187	117 Å²	117	87%	0.874	79%	0.79	S	S	*	*			trans	-60.4	-170.3	162.2	-40	178.3	138.1	0	0	112.7
135	P	37.3	Very low	28.2	Very low	105 Å²	105	118 Å²	118	68%	0.682	79%	0.794	S	S	*	*			cis	-142.1	-179	-4.9	30.8	-6.2	0	0	0	116.2
136	S	25.9	Very low	28.2	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	80%	0.798	S	S	*	*			trans	85.7	122.5	140.6	71.9	0	0	0	0	123.2
137	S	25.5	Very low	28.5	Very low	114 Å²	114	120.7 Å²	120.7	80%	0.797	80%	0.801	S	S	*	*				76.7	124	129.1	72.2	0	0	0	0	121.4
138	S	28.7	Very low	29.5	Very low	123 Å²	123	120.7 Å²	120.7	86%	0.86	80%	0.798	S	S	*	*				-161.9	121	120	58.6	0	0	0	0	110.6
139	A	26.2	Very low	29.8	Very low	97 Å²	97	124 Å²	124	80%	0.802	81%	0.807	S	S	*	*			trans	-87.3	158.8	175.2	0	0	0	0	0	112.1
140	S	28	Very low	30.5	Very low	116 Å²	116	122 Å²	122	81%	0.811	81%	0.807	S	S	*	*			trans	-175.6	109.4	140.1	17.1	0	0	0	0	107.4
141	A	27.9	Very low	31.2	Very low	94 Å²	94	120.2 Å²	120.2	78%	0.777	80%	0.803	S	S	*	*				82.5	137.5	87.3	0	0	0	0	0	111.2
142	E	25.6	Very low	31.8	Very low	192 Å²	192	119 Å²	119	90%	0.897	80%	0.8	S	S	*	*			cis	-168.5	139.4	-6.8	-111.9	-170.8	168.6	0	0	104.3
143	A	27.1	Very low	32.3	Very low	104 Å²	104	120.7 Å²	120.7	86%	0.86	80%	0.801	S	S	*	*			trans	-162.3	110	150.4	0	0	0	0	0	108.1
144	A	30.3	Very low	33.2	Very low	101 Å²	101	122.9 Å²	122.9	84%	0.835	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.5	150.8	-178.2	0	0	0	0	0	112.4
145	P	37.9	Very low	34.2	Very low	121 Å²	121	122.1 Å²	122.1	79%	0.786	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-95.2	142.9	174	35.6	-28.9	0	0	0	112
146	D	31	Very low	34.7	Very low	174 Å²	174	119.2 Å²	119.2	93%	0.93	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.4	138.3	158.4	-80.1	-37.6	0	0	0	110
147	G	31.9	Very low	35.5	Very low	69 Å²	69	118.1 Å²	118.1	71%	0.711	79%	0.793	S	S	*	*			trans	-130.7	-178.9	164	0	0	0	0	0	110.6
148	P	46.3	Very low	36.8	Very low	114 Å²	114	122 Å²	122	74%	0.74	80%	0.796	S	S	*	*			cis	-125.7	152	-39.6	35.8	-22.1	0	0	0	111
149	L	32.5	Very low	37.9	Very low	171 Å²	171	119.1 Å²	119.1	90%	0.895	79%	0.786	S	S	*	*			trans	-135.4	100.7	155.6	-81.5	169.9	0	0	0	108.4	P151	L149-P151 WeakPolarHBondContact O-CD 3.31Å
150	V	42.6	Very low	39.1	Very low	133 Å²	133	126.3 Å²	126.3	81%	0.806	79%	0.792	S	S	*	*			trans	-82.7	130.5	167.9	-173.3	0	0	0	0	107.8
151	P	42	Very low	40.3	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	80%	0.797	S	S	*	*			trans	-121.5	113.6	142.7	11.5	9	0	0	0	110.4	L149	L149-P151 WeakPolarHBondContact O-CD 3.31Å
152	G	39.1	Very low	41.4	Very low	62 Å²	62	137 Å²	137	64%	0.639	80%	0.8	S	S	*	*			trans	48.7	91.6	149.6	0	0	0	0	0	118.4	V154	G152-V154 PolarHBondContact O-N 3.39Å
153	L	42.1	Very low	42.9	Very low	160 Å²	160	131.5 Å²	131.5	84%	0.838	79%	0.788	S	S	*	*			trans	-67.5	103.9	158.3	-170.4	75.8	0	0	0	108.9	L155	L153-L155 PolarHBondContact O-N 3.23Å
154	V	45.5	Very low	43.9	Very low	123 Å²	123	132.1 Å²	132.1	75%	0.745	78%	0.783	S	S	*	*			trans	-67.9	99.8	168.2	178.6	0	0	0	0	108.4	G152 G156	G152-V154 PolarHBondContact O-N 3.39Å; V154-G156 VanDerWaalsContact C-N 3.34Å; V154-G156 PolarHBondContact O-N 3.18Å
155	L	44.8	Very low	44.7	Very low	171 Å²	171	134.4 Å²	134.4	90%	0.895	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	92.9	163.7	-95.8	148.5	0	0	0	108.6	L153	L153-L155 PolarHBondContact O-N 3.23Å
156	G	47.2	Very low	45.3	Very low	45 Å²	45	134.7 Å²	134.7	46%	0.464	77%	0.773	S	S	.	*	T	Hydrogen-bonded Turn	trans	166.8	-2.9	-179.1	0	0	0	0	0	116.6	V154 F158	V154-G156 VanDerWaalsContact C-N 3.34Å; V154-G156 PolarHBondContact O-N 3.18Å; G156-F158 VanDerWaalsContact C-N 3.28Å; G156-F158 WeakPolarHBondContact O-CD2 3.22Å; G156-F158 PolarHBondContact O-N 2.95Å
157	G	44.2	Very low	46.5	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	76%	0.763	S	S	*	*			trans	-71	79.6	171.3	0	0	0	0	0	111.7	G159	G157-G159 PolarHBondContact O-N 2.74Å
158	F	51.4	Low	47.8	Very low	196 Å²	196	135.2 Å²	135.2	86%	0.86	76%	0.76	S	S	*	*			trans	-70.9	70.9	170.1	-66	-81.3	0	0	0	110.6	G156 R160	G156-F158 VanDerWaalsContact C-N 3.28Å; G156-F158 WeakPolarHBondContact O-CD2 3.22Å; G156-F158 PolarHBondContact O-N 2.95Å; F158-R160 PolarHBondContact O-N 2.92Å; F158-R160 VanDerWaalsContact O-N 3.16Å
159	G	52.3	Low	48.8	Very low	62 Å²	62	138.8 Å²	138.8	64%	0.639	76%	0.764	S	S	*	*			trans	-60.6	115.2	153.4	0	0	0	0	0	106.9	G157 R161	G157-G159 PolarHBondContact O-N 2.74Å; G159-R161 PolarHBondContact O-N 3.23Å
160	R	51.8	Low	50.6	Low	248 Å²	248	133 Å²	133	94%	0.936	73%	0.734	S	S	*	*			trans	-61.2	83.2	172.9	-76.7	-174.2	178.9	-165.1	0.6	108.9	F158 K162	F158-R160 PolarHBondContact O-N 2.92Å; F158-R160 VanDerWaalsContact O-N 3.16Å; R160-K162 PolarHBondContact O-N 3.47Å
161	R	52	Low	52.2	Low	240 Å²	240	128.4 Å²	128.4	91%	0.906	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.8	162.3	-77	-176.6	172.6	-179.9	-2.2	105.8	G159 A163	G159-R161 PolarHBondContact O-N 3.23Å; R161-A163 PolarHBondContact O-N 3.27Å
162	K	51.3	Low	53.9	Low	193 Å²	193	132.6 Å²	132.6	84%	0.839	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-53	118.8	168.9	-79.2	-177.5	177.9	178.2	0	106	R160	R160-K162 PolarHBondContact O-N 3.47Å
163	A	57.9	Low	55.8	Low	78 Å²	78	132.2 Å²	132.2	65%	0.645	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-52.1	137.8	177.5	0	0	0	0	0	108.7	R161 K165	R161-A163 PolarHBondContact O-N 3.27Å; A163-K165 PolarHBondContact O-N 3.06Å; A163-K165 VanDerWaalsContact O-N 3.09Å
164	P	48.5	Very low	57.5	Low	117 Å²	117	125 Å²	125	76%	0.76	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-54.3	122.6	176.9	21.5	-30.9	0	0	0	108.3	V166	P164-V166 PolarHBondContact O-N 3.48Å
165	K	47.2	Very low	58.8	Low	148 Å²	148	121.9 Å²	121.9	64%	0.643	64%	0.636	S	S	*	*			trans	-68.6	98.1	-179.5	-78.4	-177.7	168.7	-175.4	0	108.1	A163 Q167 D459	A163-K165 PolarHBondContact O-N 3.06Å; A163-K165 VanDerWaalsContact O-N 3.09Å; K165-Q167 PolarHBondContact O-N 3.29Å; K165-D459 IonicContact NZ-OD1 3.55Å; K165-D459 PolarHBondContact NZ-OD1 3.48Å; K165-D459 IonicContact NZ-OD2 2.77Å; K165-D459 PolarHBondContact NZ-OD2 3.34Å
166	V	49.9	Very low	60.3	Low	127 Å²	127	120.8 Å²	120.8	77%	0.77	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-66	117	170.5	-179.2	0	0	0	0	107.3	P164 P168	P164-V166 PolarHBondContact O-N 3.48Å; V166-P168 WeakPolarHBondContact O-CD 3.43Å
167	Q	55.1	Low	61.7	Low	156 Å²	156	119.7 Å²	119.7	73%	0.729	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-69.4	120.9	169.9	-69.1	-167.7	12.4	0	0	108.1	K165 F169	K165-Q167 PolarHBondContact O-N 3.29Å; Q167-F169 PolarHBondContact O-N 3.08Å
168	P	59.2	Low	63.2	Low	99 Å²	99	118.3 Å²	118.3	64%	0.643	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-65	129.6	178.3	25.4	-31.5	0	0	0	109.5	V166 L170	V166-P168 WeakPolarHBondContact O-CD 3.43Å; P168-L170 PolarHBondContact O-N 2.91Å; P168-L170 VanDerWaalsContact O-N 3.07Å
169	F	67.5	Low	63.9	Low	188 Å²	188	112.6 Å²	112.6	83%	0.825	57%	0.573	S	S	*	*			trans	-66.5	105.7	168.8	176.4	-97.7	0	0	0	108.5	Q167	Q167-F169 PolarHBondContact O-N 3.08Å
170	L	71.5	Confident	64.8	Low	50 Å²	50	109.9 Å²	109.9	26%	0.262	54%	0.543	S	S	.	.			trans	-93.8	135.3	174.4	-65.4	174.1	0	0	0	109.4	P168 L174 Q428	P168-L170 PolarHBondContact O-N 2.91Å; P168-L170 VanDerWaalsContact O-N 3.07Å; L170-L174 HydrophobicContact CD2-CD2 3.79Å; L170-Q428 HydrophobicContact CD2-CB 4.29Å
171	P	75.8	Confident	65.3	Low	36 Å²	36	106.1 Å²	106.1	23%	0.234	53%	0.529	C	S	.	.			trans	-54.6	144.4	171.2	-25.6	34.4	0	0	0	111.7	W173 L174 A175	P171-W173 VanDerWaalsContact C-N 3.28Å; P171-W173 HydrophobicContact CB-CG 4.49Å; P171-W173 PolarHBondContact O-N 3.36Å; P171-W173 VanDerWaalsContact O-N 3.16Å; P171-L174 WeakPolarHBondContact O-CA 3.25Å; P171-L174 WeakPolarHBondContact O-CB 3.43Å; P171-L174 PolarHBondContact O-N 3.35Å; P171-A175 PolarHBondContact O-N 3.41Å
172	R	77.9	Confident	65.6	Low	210 Å²	210	100.1 Å²	100.1	79%	0.792	51%	0.51	S	S	*	.	H	α-helix	trans	-49.6	-45.3	-177	-72.7	-173.4	177.8	174.9	-1.6	113.6	L174 A175 E176	R172-L174 PolarHBondContact O-N 3.22Å; R172-A175 PolarHBondContact O-N 3.2Å; R172-A175 VanDerWaalsContact O-N 3.12Å; R172-E176 PolarHBondContact O-N 2.83Å
173	W	79.6	Confident	66	Low	53 Å²	53	93.3 Å²	93.3	20%	0.201	48%	0.483	C	S	.	.	H	α-helix	trans	-62.9	-23.7	-180	71.5	-94.5	0	0	0	114.4	P171 C245 L426 L433 P441 L443	P171-W173 VanDerWaalsContact C-N 3.28Å; P171-W173 HydrophobicContact CB-CG 4.49Å; P171-W173 PolarHBondContact O-N 3.36Å; P171-W173 VanDerWaalsContact O-N 3.16Å; W173-C245 HydrophobicContact CZ3-CB 4.33Å; W173-L426 HydrophobicContact CH2-CD2 4.5Å; W173-L426 HydrophobicContact CZ3-CD2 4.41Å; W173-L433 HydrophobicContact CH2-CD1 3.91Å; W173-L433 HydrophobicContact CH2-CD2 4.45Å; W173-L433 HydrophobicContact CZ2-CD1 3.91Å; W173-P441 VanDerWaalsContact CB-O 3.23Å; W173-P441 WeakPolarHBondContact CB-O 3.43Å; W173-P441 HydrophobicContact CD2-CB 4.06Å; W173-P441 HydrophobicContact CD2-CG 3.59Å; W173-P441 HydrophobicContact CE3-CB 4.15Å; W173-P441 HydrophobicContact CE3-CG 4.19Å; W173-P441 HydrophobicContact CG-CB 4.48Å; W173-P441 HydrophobicContact CG-CG 3.75Å; W173-P441 HydrophobicContact CZ2-CG 4.07Å; W173-P441 HydrophobicContact CZ3-CB 4.45Å; W173-L443 HydrophobicContact CE3-CB 3.82Å; W173-L443 HydrophobicContact CZ3-CB 3.99Å; W173-L443 HydrophobicContact CZ3-CD2 4.34Å
174	L	77.3	Confident	66.2	Low	8 Å²	8	91.2 Å²	91.2	4%	0.042	46%	0.461	C	S	.	.	H	α-helix	trans	-91	-31.4	176.8	-173.6	63.6	0	0	0	111.2	L170 P171 R172 Q428 L433 L443	L170-L174 HydrophobicContact CD2-CD2 3.79Å; P171-L174 WeakPolarHBondContact O-CA 3.25Å; P171-L174 WeakPolarHBondContact O-CB 3.43Å; P171-L174 PolarHBondContact O-N 3.35Å; R172-L174 PolarHBondContact O-N 3.22Å; L174-Q428 HydrophobicContact CD1-CG 4.41Å; L174-Q428 HydrophobicContact CD2-CB 4.12Å; L174-Q428 HydrophobicContact CD2-CG 4.24Å; L174-L433 HydrophobicContact CD2-CD1 3.98Å; L174-L443 HydrophobicContact CD1-CD2 3.7Å
175	A	72.6	Confident	66.7	Low	58 Å²	58	89.6 Å²	89.6	48%	0.479	45%	0.447	S	S	.	.	H	α-helix	trans	-72.6	-33.9	174.4	0	0	0	0	0	112.4	P171 R172 P177	P171-A175 PolarHBondContact O-N 3.41Å; R172-A175 PolarHBondContact O-N 3.2Å; R172-A175 VanDerWaalsContact O-N 3.12Å; A175-P177 VanDerWaalsContact C-CD 3.45Å; A175-P177 VanDerWaalsContact O-CD 3.3Å; A175-P177 WeakPolarHBondContact O-CD 3.26Å
176	E	75.4	Confident	67.4	Low	149 Å²	149	89.9 Å²	89.9	70%	0.696	45%	0.45	S	S	*	.	S	Bend	trans	-121.8	72.1	-175.9	-65.8	170.5	-163.4	0	0	110.8	R172	R172-E176 PolarHBondContact O-N 2.83Å
177	P	77.6	Confident	68.2	Low	22 Å²	22	85.6 Å²	85.6	14%	0.143	42%	0.423	C	S	.	.			trans	-69.9	144.7	176.2	30.8	-36.5	0	0	0	111.5	A175 C179 L443 L448	A175-P177 VanDerWaalsContact C-CD 3.45Å; A175-P177 VanDerWaalsContact O-CD 3.3Å; A175-P177 WeakPolarHBondContact O-CD 3.26Å; P177-C179 PolarHBondContact O-N 3.26Å; P177-C179 VanDerWaalsContact O-N 3.14Å; P177-L443 CarbonylContact C-O 3.44Å; P177-L443 WeakPolarHBondContact CA-O 3.28Å; P177-L443 HydrophobicContact CB-CB 4.26Å; P177-L443 HydrophobicContact CB-CD2 3.97Å; P177-L443 HydrophobicContact CB-CG 3.92Å; P177-L448 HydrophobicContact CB-CD1 4.31Å; P177-L448 HydrophobicContact CG-CB 3.49Å; P177-L448 VanDerWaalsContact CG-CB 3.49Å; P177-L448 HydrophobicContact CG-CD1 3.65Å; P177-L448 HydrophobicContact CG-CG 4.16Å
178	S	75	Confident	69.4	Low	47 Å²	47	81.1 Å²	81.1	33%	0.329	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	112.2	162.5	-57.8	0	0	0	0	108.8	V180 L443 F444 S445	S178-V180 PolarHBondContact O-N 3.09Å; S178-L443 PolarHBondContact N-O 2.91Å; S178-F444 WeakPolarHBondContact O-CA 3.46Å; S178-S445 PolarHBondContact O-N 3.18Å; S178-S445 VanDerWaalsContact O-N 3.1Å
179	C	66.9	Low	70.5	Confident	76 Å²	76	78 Å²	78	51%	0.514	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	127.5	-174.4	-163.2	0	0	0	0	110.5	P177	P177-C179 PolarHBondContact O-N 3.26Å; P177-C179 VanDerWaalsContact O-N 3.14Å
180	V	70.6	Confident	71.4	Confident	4 Å²	4	71.9 Å²	71.9	2%	0.024	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-101.1	135.3	169.3	-179.9	0	0	0	0	107.6	S178 P215 V216 A219 F444 S445 T446	S178-V180 PolarHBondContact O-N 3.09Å; V180-P215 VanDerWaalsContact CG1-C 3.44Å; V180-P215 HydrophobicContact CG1-CB 3.68Å; V180-P215 WeakPolarHBondContact CG1-O 3.39Å; V180-V216 HydrophobicContact CG1-CB 4.42Å; V180-V216 HydrophobicContact CG1-CG2 3.87Å; V180-A219 HydrophobicContact CG2-CB 3.87Å; V180-F444 HydrophobicContact CG2-CB 3.83Å; V180-F444 HydrophobicContact CG2-CD1 4.09Å; V180-F444 HydrophobicContact CG2-CG 4.47Å; V180-S445 PolarHBondContact N-O 3.04Å; V180-T446 HydrophobicContact CB-CG2 3.87Å; V180-T446 HydrophobicContact CG1-CG2 3.88Å
181	R	62.5	Low	72.1	Confident	169 Å²	169	69.5 Å²	69.5	64%	0.638	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-56.8	145.4	-179.4	-54.7	-170.7	-172.6	171.4	3.2	111.7	D187 P215	R181-D187 HydrophobicContact CB-CB 4.02Å; R181-D187 VanDerWaalsContact CB-OD2 3.27Å; R181-D187 WeakPolarHBondContact CB-OD2 3.46Å; R181-D187 VanDerWaalsContact CD-CG 3.42Å; R181-D187 WeakPolarHBondContact CD-OD1 3.47Å; R181-D187 IonicContact CZ-OD1 3.63Å; R181-D187 IonicContact NE-OD1 3.58Å; R181-D187 IonicContact NH1-OD1 3.28Å; R181-D187 PolarHBondContact NH1-OD1 3.3Å; R181-D187 VanDerWaalsContact NH1-OD1 3.09Å; R181-P215 HydrophobicContact CB-CB 4.27Å
182	K	59.5	Low	72.5	Confident	114 Å²	114	74.1 Å²	74.1	50%	0.496	37%	0.368	S	S	.	.	S	Bend	trans	-79.4	-32.1	-168.2	-69	-176.7	-179	175.1	0	113.2	V184 T446	K182-V184 PolarHBondContact O-N 3.44Å; K182-T446 WeakPolarHBondContact CG-O 3.09Å
183	N	59.4	Low	72.9	Confident	51 Å²	51	69.1 Å²	69.1	27%	0.273	36%	0.357	S	S	.	.			trans	-92.5	101.8	-167.8	-71.5	-9.3	0	0	0	111.7	N185 E186 D187	N183-N185 PolarHBondContact O-N 3.49Å; N183-N185 VanDerWaalsContact O-N 3.11Å; N183-E186 HydrophobicContact CB-CB 4.05Å; N183-E186 PolarHBondContact ND2-OE2 3.09Å; N183-D187 WeakPolarHBondContact CB-OD2 3.35Å; N183-D187 PolarHBondContact N-OD2 3.44Å; N183-D187 VanDerWaalsContact O-CB 3.31Å; N183-D187 WeakPolarHBondContact O-CB 3.39Å; N183-D187 PolarHBondContact O-N 3.1Å; N183-D187 VanDerWaalsContact O-N 3.1Å
184	V	61.3	Low	73.2	Confident	33 Å²	33	66.8 Å²	66.8	20%	0.2	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.6	-179.7	-177.8	0	0	0	0	113.1	K182 L188 F214	K182-V184 PolarHBondContact O-N 3.44Å; V184-L188 WeakPolarHBondContact O-CD2 3.06Å; V184-F214 HydrophobicContact CB-CD1 4.47Å; V184-F214 HydrophobicContact CG1-CD1 3.23Å; V184-F214 HydrophobicContact CG1-CE1 3.39Å; V184-F214 HydrophobicContact CG1-CG 4.13Å; V184-F214 HydrophobicContact CG1-CZ 4.39Å; V184-F214 WeakPolarHBondContact O-CD1 3.29Å
185	N	59.6	Low	73.4	Confident	84 Å²	84	71.1 Å²	71.1	45%	0.449	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-35.8	-177.8	-70.8	-8.6	0	0	0	114.8	N183 L188 A591 G592	N183-N185 PolarHBondContact O-N 3.49Å; N183-N185 VanDerWaalsContact O-N 3.11Å; N185-L188 WeakPolarHBondContact O-CD1 3.35Å; N185-L188 WeakPolarHBondContact O-CG 3.32Å; N185-A591 PolarHBondContact OD1-O 3.25Å; N185-G592 WeakPolarHBondContact ND2-CA 3.41Å; N185-G592 PolarHBondContact ND2-O 3.37Å; N185-G592 WeakPolarHBondContact OD1-CA 3.27Å
186	E	61	Low	74.1	Confident	154 Å²	154	72.9 Å²	72.9	72%	0.72	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-28.2	-173.8	-65.4	171.7	176.2	0	0	111.5	N183 L188	N183-E186 HydrophobicContact CB-CB 4.05Å; N183-E186 PolarHBondContact ND2-OE2 3.09Å; E186-L188 VanDerWaalsContact C-N 3.3Å; E186-L188 PolarHBondContact O-N 3Å
187	D	68.1	Low	74.8	Confident	36 Å²	36	65.8 Å²	65.8	19%	0.193	34%	0.342	C	S	.	.	S	Bend	trans	-95.9	30.5	178.5	-64.5	-62.3	0	0	0	112.3	R181 N183 V189 P215	R181-D187 HydrophobicContact CB-CB 4.02Å; R181-D187 VanDerWaalsContact CB-OD2 3.27Å; R181-D187 WeakPolarHBondContact CB-OD2 3.46Å; R181-D187 VanDerWaalsContact CD-CG 3.42Å; R181-D187 WeakPolarHBondContact CD-OD1 3.47Å; R181-D187 IonicContact CZ-OD1 3.63Å; R181-D187 IonicContact NE-OD1 3.58Å; R181-D187 IonicContact NH1-OD1 3.28Å; R181-D187 PolarHBondContact NH1-OD1 3.3Å; R181-D187 VanDerWaalsContact NH1-OD1 3.09Å; N183-D187 WeakPolarHBondContact CB-OD2 3.35Å; N183-D187 PolarHBondContact N-OD2 3.44Å; N183-D187 VanDerWaalsContact O-CB 3.31Å; N183-D187 WeakPolarHBondContact O-CB 3.39Å; N183-D187 PolarHBondContact O-N 3.1Å; N183-D187 VanDerWaalsContact O-N 3.1Å; D187-V189 PolarHBondContact O-N 3.11Å; D187-P215 HydrophobicContact CB-CG 3.61Å; D187-P215 WeakPolarHBondContact O-CG 3.47Å
188	L	79.4	Confident	75.3	Confident	63 Å²	63	68.9 Å²	68.9	33%	0.33	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-67.3	127.5	174.5	-72.1	175.9	0	0	0	109.5	V184 N185 E186 Y213 F214	V184-L188 WeakPolarHBondContact O-CD2 3.06Å; N185-L188 WeakPolarHBondContact O-CD1 3.35Å; N185-L188 WeakPolarHBondContact O-CG 3.32Å; E186-L188 VanDerWaalsContact C-N 3.3Å; E186-L188 PolarHBondContact O-N 3Å; L188-Y213 WeakPolarHBondContact CA-O 3.49Å; L188-F214 HydrophobicContact CD2-CD1 3.56Å; L188-F214 HydrophobicContact CD2-CE1 3.88Å; L188-F214 HydrophobicContact CD2-CG 4.45Å
189	V	81.5	Confident	76.1	Confident	33 Å²	33	70.8 Å²	70.8	20%	0.2	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.9	-179.8	177.7	0	0	0	0	108.1	D187 D193 I194 S212 Y213 A218	D187-V189 PolarHBondContact O-N 3.11Å; V189-D193 HydrophobicContact CG1-CB 3.6Å; V189-I194 HydrophobicContact CG1-CG1 4.31Å; V189-S212 CarbonylContact O-C 3.56Å; V189-S212 VanDerWaalsContact O-CA 3.25Å; V189-S212 WeakPolarHBondContact O-CA 3.37Å; V189-S212 WeakPolarHBondContact O-CB 3.46Å; V189-Y213 PolarHBondContact N-O 3.06Å; V189-Y213 PolarHBondContact O-N 3.33Å; V189-A218 HydrophobicContact CB-CB 3.91Å; V189-A218 HydrophobicContact CG1-CB 4.29Å; V189-A218 HydrophobicContact CG2-CB 3.62Å
190	P	86.2	Confident	77.1	Confident	59 Å²	59	72.2 Å²	72.2	38%	0.383	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-46.5	146.3	172.4	-28.4	32.4	0	0	0	112.7	E192 D193	P190-E192 PolarHBondContact O-N 3.01Å; P190-E192 VanDerWaalsContact O-N 3.15Å; P190-D193 VanDerWaalsContact CD-OD2 3.26Å; P190-D193 WeakPolarHBondContact CD-OD2 3.31Å; P190-D193 PolarHBondContact O-N 2.98Å; P190-D193 VanDerWaalsContact O-N 3.11Å
191	I	87	Confident	78	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-59.9	-29.2	-179.6	-74.5	169.5	0	0	0	112.6	D193 I194 Q202 L205 R206 I210 S211 Y213	I191-D193 VanDerWaalsContact C-N 3.27Å; I191-D193 PolarHBondContact O-N 3.5Å; I191-I194 PolarHBondContact O-N 2.86Å; I191-Q202 HydrophobicContact CG2-CB 3.67Å; I191-Q202 HydrophobicContact CG2-CG 3.6Å; I191-L205 HydrophobicContact CD1-CB 3.96Å; I191-R206 HydrophobicContact CD1-CG 4.26Å; I191-I210 HydrophobicContact CD1-CG2 4.19Å; I191-I210 WeakPolarHBondContact CD1-O 3.41Å; I191-S211 WeakPolarHBondContact CG1-O 3.35Å; I191-S211 PolarHBondContact N-O 3.15Å; I191-Y213 HydrophobicContact CB-CE2 4.03Å; I191-Y213 HydrophobicContact CG1-CD2 4.22Å; I191-Y213 HydrophobicContact CG1-CE1 4.38Å; I191-Y213 HydrophobicContact CG1-CE2 3.83Å; I191-Y213 HydrophobicContact CG2-CE2 4.16Å
192	E	84.9	Confident	79.3	Confident	133 Å²	133	65.4 Å²	65.4	62%	0.621	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-70.3	-23.6	-178.7	-69.4	158.8	-150.3	0	0	112.9	P190 I194 R206	P190-E192 PolarHBondContact O-N 3.01Å; P190-E192 VanDerWaalsContact O-N 3.15Å; E192-I194 PolarHBondContact O-N 3.16Å; E192-R206 VanDerWaalsContact CG-NH2 3.32Å; E192-R206 IonicContact OE1-CZ 3.11Å; E192-R206 IonicContact OE1-NH2 2.71Å; E192-R206 PolarHBondContact OE1-NH2 3.34Å
193	D	85.3	Confident	80.8	Confident	104 Å²	104	67.2 Å²	67.2	56%	0.556	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-78.9	-2.5	-177.3	-67.1	-4.2	0	0	0	112.7	V189 P190 I191 P195	V189-D193 HydrophobicContact CG1-CB 3.6Å; P190-D193 VanDerWaalsContact CD-OD2 3.26Å; P190-D193 WeakPolarHBondContact CD-OD2 3.31Å; P190-D193 PolarHBondContact O-N 2.98Å; P190-D193 VanDerWaalsContact O-N 3.11Å; I191-D193 VanDerWaalsContact C-N 3.27Å; I191-D193 PolarHBondContact O-N 3.5Å; D193-P195 VanDerWaalsContact C-CD 3.48Å; D193-P195 WeakPolarHBondContact O-CD 3.36Å
194	I	85.5	Confident	82.3	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	35%	0.348	C	S	.	.			trans	-115.8	78.9	171.7	-50.6	-172.1	0	0	0	109.1	V189 I191 E192 E196 V197 Q202 Y213 A218 I221 P222	V189-I194 HydrophobicContact CG1-CG1 4.31Å; I191-I194 PolarHBondContact O-N 2.86Å; E192-I194 PolarHBondContact O-N 3.16Å; I194-E196 VanDerWaalsContact CG2-OE2 3.26Å; I194-E196 WeakPolarHBondContact CG2-OE2 3.39Å; I194-E196 PolarHBondContact O-N 2.86Å; I194-V197 HydrophobicContact CB-CG2 4.45Å; I194-V197 HydrophobicContact CG2-CG2 3.84Å; I194-V197 PolarHBondContact O-N 3.32Å; I194-Q202 PolarHBondContact O-NE2 3.41Å; I194-Y213 HydrophobicContact CB-CD2 4.38Å; I194-Y213 HydrophobicContact CB-CE2 3.95Å; I194-Y213 HydrophobicContact CD1-CD2 3.26Å; I194-Y213 HydrophobicContact CD1-CE2 3.6Å; I194-Y213 HydrophobicContact CD1-CG 3.88Å; I194-Y213 HydrophobicContact CG1-CD2 3.77Å; I194-Y213 HydrophobicContact CG1-CE2 3.87Å; I194-A218 HydrophobicContact CD1-CB 4.04Å; I194-I221 HydrophobicContact CG2-CG2 4.38Å; I194-P222 HydrophobicContact CG2-CG 3.94Å
195	P	82.6	Confident	83.7	Confident	100 Å²	100	65.3 Å²	65.3	65%	0.649	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.8	-176.3	28.5	-36.3	0	0	0	113.1	D193 V197	D193-P195 VanDerWaalsContact C-CD 3.48Å; D193-P195 WeakPolarHBondContact O-CD 3.36Å; P195-V197 PolarHBondContact O-N 3.33Å
196	E	87.4	Confident	85.2	Confident	94 Å²	94	66.7 Å²	66.7	44%	0.439	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.4	177	-59.2	87.5	163.3	0	0	112.4	I194 L225 Q264	I194-E196 VanDerWaalsContact CG2-OE2 3.26Å; I194-E196 WeakPolarHBondContact CG2-OE2 3.39Å; I194-E196 PolarHBondContact O-N 2.86Å; E196-L225 HydrophobicContact CB-CB 4.26Å; E196-L225 HydrophobicContact CB-CD1 3.74Å; E196-L225 WeakPolarHBondContact O-CD1 3.15Å; E196-Q264 PolarHBondContact O-NE2 2.98Å
197	V	89.1	Confident	86.6	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	34%	0.336	C	S	.	.	S	Bend	trans	-80	128.1	178.3	-179	0	0	0	0	110.3	I194 P195 L201 Q202 I221 L225 I260	I194-V197 HydrophobicContact CB-CG2 4.45Å; I194-V197 HydrophobicContact CG2-CG2 3.84Å; I194-V197 PolarHBondContact O-N 3.32Å; P195-V197 PolarHBondContact O-N 3.33Å; V197-L201 HydrophobicContact CG1-CB 4.19Å; V197-L201 HydrophobicContact CG1-CD2 4.19Å; V197-L201 HydrophobicContact CG1-CG 4.29Å; V197-Q202 HydrophobicContact CB-CG 4.15Å; V197-Q202 HydrophobicContact CG1-CG 3.82Å; V197-Q202 PolarHBondContact O-NE2 3Å; V197-I221 HydrophobicContact CG2-CG2 3.63Å; V197-L225 HydrophobicContact CG2-CD1 4Å; V197-I260 HydrophobicContact CG1-CG2 4.1Å; V197-I260 HydrophobicContact CG2-CG2 4.07Å
198	H	89.5	Confident	87.6	Confident	87 Å²	87	66.6 Å²	66.6	40%	0.403	35%	0.35	S	S	.	.			trans	-58.9	138	-177.3	-167.7	-93.9	0	0	0	112.2	D200 L201 Q202	H198-D200 VanDerWaalsContact C-N 3.28Å; H198-D200 IonicContact CE1-OD2 3.77Å; H198-D200 PolarHBondContact CE1-OD2 3.28Å; H198-D200 PolarHBondContact ND1-N 3.49Å; H198-D200 IonicContact ND1-OD2 3.25Å; H198-D200 PolarHBondContact O-N 3.35Å; H198-D200 VanDerWaalsContact O-N 3.15Å; H198-L201 WeakPolarHBondContact O-CB 3.34Å; H198-L201 PolarHBondContact O-N 2.91Å; H198-Q202 PolarHBondContact O-N 2.89Å
199	P	89.8	Confident	88	Confident	86 Å²	86	66.8 Å²	66.8	56%	0.558	37%	0.367	S	S	*	.	H	α-helix	trans	-54.5	-37.1	-176.3	-29.2	35.5	0	0	0	114.9	L201 Q202 K203	P199-L201 VanDerWaalsContact C-N 3.33Å; P199-L201 PolarHBondContact O-N 3.28Å; P199-Q202 WeakPolarHBondContact O-CB 3.15Å; P199-Q202 PolarHBondContact O-N 3.34Å; P199-K203 WeakPolarHBondContact O-CB 3.37Å; P199-K203 PolarHBondContact O-N 3.27Å
200	D	89.2	Confident	88.3	Confident	107 Å²	107	66.9 Å²	66.9	57%	0.572	37%	0.366	S	S	*	.	H	α-helix	trans	-64.3	-38.4	177.4	-66.8	-29.1	0	0	0	112.4	H198 K203 Q204	H198-D200 VanDerWaalsContact C-N 3.28Å; H198-D200 IonicContact CE1-OD2 3.77Å; H198-D200 PolarHBondContact CE1-OD2 3.28Å; H198-D200 PolarHBondContact ND1-N 3.49Å; H198-D200 IonicContact ND1-OD2 3.25Å; H198-D200 PolarHBondContact O-N 3.35Å; H198-D200 VanDerWaalsContact O-N 3.15Å; D200-K203 WeakPolarHBondContact O-CB 3.28Å; D200-K203 PolarHBondContact O-N 2.98Å; D200-Q204 PolarHBondContact O-N 3.19Å
201	L	89.1	Confident	88.4	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-72.4	-37.4	177.6	-171.1	57.3	0	0	0	110.5	V197 H198 P199 K203 Q204 L205 I260 Q264 Y296	V197-L201 HydrophobicContact CG1-CB 4.19Å; V197-L201 HydrophobicContact CG1-CD2 4.19Å; V197-L201 HydrophobicContact CG1-CG 4.29Å; H198-L201 WeakPolarHBondContact O-CB 3.34Å; H198-L201 PolarHBondContact O-N 2.91Å; P199-L201 VanDerWaalsContact C-N 3.33Å; P199-L201 PolarHBondContact O-N 3.28Å; L201-K203 VanDerWaalsContact C-N 3.32Å; L201-K203 PolarHBondContact O-N 3.31Å; L201-Q204 PolarHBondContact O-N 3.35Å; L201-L205 VanDerWaalsContact O-CG 3.29Å; L201-L205 WeakPolarHBondContact O-CG 3.45Å; L201-L205 PolarHBondContact O-N 3.31Å; L201-I260 HydrophobicContact CD2-CB 4.45Å; L201-I260 HydrophobicContact CD2-CG2 3.76Å; L201-Q264 HydrophobicContact CD2-CB 4.22Å; L201-Y296 HydrophobicContact CD1-CD1 3.97Å; L201-Y296 HydrophobicContact CD1-CG 4.49Å
202	Q	90.8	Very high	88.5	Confident	22 Å²	22	69.7 Å²	69.7	10%	0.103	39%	0.387	C	S	.	.	H	α-helix	trans	-59.3	-42.1	170.2	-62	-173.4	8.4	0	0	111.9	I191 I194 V197 H198 P199 L205 R206	I191-Q202 HydrophobicContact CG2-CB 3.67Å; I191-Q202 HydrophobicContact CG2-CG 3.6Å; I194-Q202 PolarHBondContact O-NE2 3.41Å; V197-Q202 HydrophobicContact CB-CG 4.15Å; V197-Q202 HydrophobicContact CG1-CG 3.82Å; V197-Q202 PolarHBondContact O-NE2 3Å; H198-Q202 PolarHBondContact O-N 2.89Å; P199-Q202 WeakPolarHBondContact O-CB 3.15Å; P199-Q202 PolarHBondContact O-N 3.34Å; Q202-L205 PolarHBondContact O-N 3.46Å; Q202-R206 WeakPolarHBondContact O-CG 3.27Å; Q202-R206 PolarHBondContact O-N 3.12Å
203	K	90.1	Very high	88.8	Confident	152 Å²	152	63.4 Å²	63.4	66%	0.661	36%	0.358	S	S	*	.	H	α-helix	trans	-62.4	-41.9	175.5	-174	-180	179.2	-179.3	0	111.7	P199 D200 L201 R206 A207	P199-K203 WeakPolarHBondContact O-CB 3.37Å; P199-K203 PolarHBondContact O-N 3.27Å; D200-K203 WeakPolarHBondContact O-CB 3.28Å; D200-K203 PolarHBondContact O-N 2.98Å; L201-K203 VanDerWaalsContact C-N 3.32Å; L201-K203 PolarHBondContact O-N 3.31Å; K203-R206 PolarHBondContact O-N 3.26Å; K203-A207 PolarHBondContact O-N 3.49Å
204	Q	89.9	Confident	89	Confident	44 Å²	44	60.5 Å²	60.5	21%	0.206	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.1	-74.1	-166	-17.3	0	0	112.6	D200 L201 R206 A207 H208 Y296	D200-Q204 PolarHBondContact O-N 3.19Å; L201-Q204 PolarHBondContact O-N 3.35Å; Q204-R206 VanDerWaalsContact C-N 3.33Å; Q204-R206 PolarHBondContact O-N 3.3Å; Q204-A207 WeakPolarHBondContact O-CB 3.49Å; Q204-A207 PolarHBondContact O-N 2.83Å; Q204-H208 PolarHBondContact O-CD2 3.04Å; Q204-H208 VanDerWaalsContact O-CD2 3.27Å; Q204-H208 PolarHBondContact O-N 2.92Å; Q204-Y296 HydrophobicContact CB-CD1 4.49Å
205	L	91	Very high	89.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-57.3	-46.6	175.1	-71.2	167.4	0	0	0	111	I191 L201 Q202 A207 H208 G209 I210 Y213 I260 Y296	I191-L205 HydrophobicContact CD1-CB 3.96Å; L201-L205 VanDerWaalsContact O-CG 3.29Å; L201-L205 WeakPolarHBondContact O-CG 3.45Å; L201-L205 PolarHBondContact O-N 3.31Å; Q202-L205 PolarHBondContact O-N 3.46Å; L205-A207 PolarHBondContact O-N 2.8Å; L205-H208 CarbonylContact O-C 3.6Å; L205-H208 PolarHBondContact O-N 2.88Å; L205-G209 PolarHBondContact O-N 3.37Å; L205-I210 CarbonylContact C-O 3.54Å; L205-I210 HydrophobicContact CB-CB 4.3Å; L205-I210 HydrophobicContact CD2-CD1 3.79Å; L205-I210 WeakPolarHBondContact O-CB 3.44Å; L205-I210 PolarHBondContact O-N 3.34Å; L205-Y213 HydrophobicContact CD1-CE1 3.86Å; L205-Y213 WeakPolarHBondContact CD1-OH 3.35Å; L205-I260 HydrophobicContact CD1-CD1 3.98Å; L205-I260 HydrophobicContact CD2-CD1 3.93Å; L205-I260 HydrophobicContact CD2-CG1 4.33Å; L205-Y296 HydrophobicContact CD2-CD1 4.42Å; L205-Y296 HydrophobicContact CD2-CE1 3.52Å; L205-Y296 HydrophobicContact CG-CE1 4.16Å
206	R	91.1	Very high	89.4	Confident	113 Å²	113	56.1 Å²	56.1	43%	0.426	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-42.6	175	-69.4	-173	-173.6	114.7	-8.1	112.4	I191 E192 Q202 K203 Q204 H208 G209 I210	I191-R206 HydrophobicContact CD1-CG 4.26Å; E192-R206 VanDerWaalsContact CG-NH2 3.32Å; E192-R206 IonicContact OE1-CZ 3.11Å; E192-R206 IonicContact OE1-NH2 2.71Å; E192-R206 PolarHBondContact OE1-NH2 3.34Å; Q202-R206 WeakPolarHBondContact O-CG 3.27Å; Q202-R206 PolarHBondContact O-N 3.12Å; K203-R206 PolarHBondContact O-N 3.26Å; Q204-R206 VanDerWaalsContact C-N 3.33Å; Q204-R206 PolarHBondContact O-N 3.3Å; R206-H208 PolarHBondContact O-N 2.93Å; R206-G209 PolarHBondContact O-N 3.21Å; R206-I210 WeakPolarHBondContact CA-O 3.33Å; R206-I210 PolarHBondContact N-O 3.47Å
207	A	90.6	Very high	89.6	Confident	84 Å²	84	51.8 Å²	51.8	69%	0.694	29%	0.292	S	S	*	.	H	α-helix	trans	-61.3	-29.1	177.4	0	0	0	0	0	112.8	K203 Q204 L205 G209	K203-A207 PolarHBondContact O-N 3.49Å; Q204-A207 WeakPolarHBondContact O-CB 3.49Å; Q204-A207 PolarHBondContact O-N 2.83Å; L205-A207 PolarHBondContact O-N 2.8Å; A207-G209 VanDerWaalsContact C-N 3.33Å
208	H	89.3	Confident	89.7	Confident	105 Å²	105	52.7 Å²	52.7	49%	0.486	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	14.5	174.6	-73.2	-67	0	0	0	114.1	Q204 L205 R206 I295	Q204-H208 PolarHBondContact O-CD2 3.04Å; Q204-H208 VanDerWaalsContact O-CD2 3.27Å; Q204-H208 PolarHBondContact O-N 2.92Å; L205-H208 CarbonylContact O-C 3.6Å; L205-H208 PolarHBondContact O-N 2.88Å; R206-H208 PolarHBondContact O-N 2.93Å; H208-I295 VanDerWaalsContact NE2-CG2 3.31Å; H208-I295 WeakPolarHBondContact NE2-CG2 3.27Å
209	G	87.4	Confident	89.7	Confident	66 Å²	66	50 Å²	50	68%	0.68	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	17.4	173.8	0	0	0	0	0	114.5	L205 R206 A207	L205-G209 PolarHBondContact O-N 3.37Å; R206-G209 PolarHBondContact O-N 3.21Å; A207-G209 VanDerWaalsContact C-N 3.33Å
210	I	88.9	Confident	89.8	Confident	35 Å²	35	45.9 Å²	45.9	18%	0.179	27%	0.266	C	S	.	.			trans	-97.1	114.9	173.4	-54.3	173.9	0	0	0	106.8	I191 L205 R206 L256 Y296	I191-I210 HydrophobicContact CD1-CG2 4.19Å; I191-I210 WeakPolarHBondContact CD1-O 3.41Å; L205-I210 CarbonylContact C-O 3.54Å; L205-I210 HydrophobicContact CB-CB 4.3Å; L205-I210 HydrophobicContact CD2-CD1 3.79Å; L205-I210 WeakPolarHBondContact O-CB 3.44Å; L205-I210 PolarHBondContact O-N 3.34Å; R206-I210 WeakPolarHBondContact CA-O 3.33Å; R206-I210 PolarHBondContact N-O 3.47Å; I210-L256 HydrophobicContact CD1-CD1 3.47Å; I210-L256 VanDerWaalsContact CD1-CD1 3.47Å; I210-Y296 VanDerWaalsContact CD1-OH 3.22Å; I210-Y296 WeakPolarHBondContact CD1-OH 3.29Å
211	S	86.9	Confident	90	Very high	90 Å²	90	40.8 Å²	40.8	63%	0.629	24%	0.239	S	C	*	.			trans	-105.6	-21.2	176.7	51.5	0	0	0	0	113	I191	I191-S211 WeakPolarHBondContact CG1-O 3.35Å; I191-S211 PolarHBondContact N-O 3.15Å
212	S	90.3	Very high	90.1	Very high	29 Å²	29	41.9 Å²	41.9	20%	0.203	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	148	-176.8	58	0	0	0	0	111.6	V189	V189-S212 CarbonylContact O-C 3.56Å; V189-S212 VanDerWaalsContact O-CA 3.25Å; V189-S212 WeakPolarHBondContact O-CA 3.37Å; V189-S212 WeakPolarHBondContact O-CB 3.46Å
213	Y	90.3	Very high	90	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	144.2	172.7	-63.3	-62.9	0	0	0	111.9	L188 V189 I191 I194 L205 Q217 I221 I260	L188-Y213 WeakPolarHBondContact CA-O 3.49Å; V189-Y213 PolarHBondContact N-O 3.06Å; V189-Y213 PolarHBondContact O-N 3.33Å; I191-Y213 HydrophobicContact CB-CE2 4.03Å; I191-Y213 HydrophobicContact CG1-CD2 4.22Å; I191-Y213 HydrophobicContact CG1-CE1 4.38Å; I191-Y213 HydrophobicContact CG1-CE2 3.83Å; I191-Y213 HydrophobicContact CG2-CE2 4.16Å; I194-Y213 HydrophobicContact CB-CD2 4.38Å; I194-Y213 HydrophobicContact CB-CE2 3.95Å; I194-Y213 HydrophobicContact CD1-CD2 3.26Å; I194-Y213 HydrophobicContact CD1-CE2 3.6Å; I194-Y213 HydrophobicContact CD1-CG 3.88Å; I194-Y213 HydrophobicContact CG1-CD2 3.77Å; I194-Y213 HydrophobicContact CG1-CE2 3.87Å; L205-Y213 HydrophobicContact CD1-CE1 3.86Å; L205-Y213 WeakPolarHBondContact CD1-OH 3.35Å; Y213-Q217 HydrophobicContact CD1-CB 4.17Å; Y213-Q217 HydrophobicContact CG-CB 4.47Å; Y213-I221 HydrophobicContact CD1-CD1 4.03Å; Y213-I221 HydrophobicContact CE1-CD1 3.98Å; Y213-I260 HydrophobicContact CE1-CD1 3.79Å
214	F	89.4	Confident	89.9	Confident	43 Å²	43	34.4 Å²	34.4	19%	0.189	22%	0.216	C	C	.	.			trans	-70.8	156.5	166.1	-66.4	-61.1	0	0	0	111	V184 L188 V216 Q217 A218 S252 A591	V184-F214 HydrophobicContact CB-CD1 4.47Å; V184-F214 HydrophobicContact CG1-CD1 3.23Å; V184-F214 HydrophobicContact CG1-CE1 3.39Å; V184-F214 HydrophobicContact CG1-CG 4.13Å; V184-F214 HydrophobicContact CG1-CZ 4.39Å; V184-F214 WeakPolarHBondContact O-CD1 3.29Å; L188-F214 HydrophobicContact CD2-CD1 3.56Å; L188-F214 HydrophobicContact CD2-CE1 3.88Å; L188-F214 HydrophobicContact CD2-CG 4.45Å; F214-V216 PolarHBondContact O-N 3.26Å; F214-V216 VanDerWaalsContact O-N 3.08Å; F214-Q217 HydrophobicContact CB-CG 4.35Å; F214-Q217 WeakPolarHBondContact O-CA 3.49Å; F214-Q217 VanDerWaalsContact O-CB 3.32Å; F214-Q217 WeakPolarHBondContact O-CB 3.5Å; F214-Q217 PolarHBondContact O-N 2.83Å; F214-A218 PolarHBondContact O-N 2.79Å; F214-S252 WeakPolarHBondContact CB-O 3.47Å; F214-A591 HydrophobicContact CZ-CB 4.01Å
215	P	87.8	Confident	89.9	Confident	10 Å²	10	32.9 Å²	32.9	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-51.9	-38.8	-179.6	-31.1	36.6	0	0	0	114.3	V180 R181 D187 A218 A219	V180-P215 VanDerWaalsContact CG1-C 3.44Å; V180-P215 HydrophobicContact CG1-CB 3.68Å; V180-P215 WeakPolarHBondContact CG1-O 3.39Å; R181-P215 HydrophobicContact CB-CB 4.27Å; D187-P215 HydrophobicContact CB-CG 3.61Å; D187-P215 WeakPolarHBondContact O-CG 3.47Å; P215-A218 PolarHBondContact O-N 3.27Å; P215-A219 WeakPolarHBondContact O-CB 3.4Å; P215-A219 PolarHBondContact O-N 2.98Å
216	V	89.1	Confident	89.5	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-39.5	177.6	176.8	0	0	0	0	111.5	V180 F214 V220 V246 A248 K254 T446	V180-V216 HydrophobicContact CG1-CB 4.42Å; V180-V216 HydrophobicContact CG1-CG2 3.87Å; F214-V216 PolarHBondContact O-N 3.26Å; F214-V216 VanDerWaalsContact O-N 3.08Å; V216-V220 HydrophobicContact CG1-CG2 4.33Å; V216-V220 VanDerWaalsContact O-CB 3.26Å; V216-V220 WeakPolarHBondContact O-CB 3.42Å; V216-V220 WeakPolarHBondContact O-CG2 3.5Å; V216-V220 PolarHBondContact O-N 2.93Å; V216-V220 VanDerWaalsContact O-N 3.09Å; V216-V246 HydrophobicContact CG1-CG1 3.6Å; V216-A248 HydrophobicContact CB-CB 4.48Å; V216-A248 HydrophobicContact CG1-CB 4.26Å; V216-A248 HydrophobicContact CG2-CB 3.43Å; V216-A248 VanDerWaalsContact CG2-CB 3.43Å; V216-K254 HydrophobicContact CG1-CG 4.49Å; V216-T446 HydrophobicContact CG2-CG2 3.95Å
217	Q	92.7	Very high	88.7	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-45.7	176.7	-66.3	167.8	-11.5	0	0	109.8	Y213 F214 A219 V220 I221 G253 A257	Y213-Q217 HydrophobicContact CD1-CB 4.17Å; Y213-Q217 HydrophobicContact CG-CB 4.47Å; F214-Q217 HydrophobicContact CB-CG 4.35Å; F214-Q217 WeakPolarHBondContact O-CA 3.49Å; F214-Q217 VanDerWaalsContact O-CB 3.32Å; F214-Q217 WeakPolarHBondContact O-CB 3.5Å; F214-Q217 PolarHBondContact O-N 2.83Å; Q217-A219 VanDerWaalsContact C-N 3.29Å; Q217-A219 PolarHBondContact O-N 3.33Å; Q217-V220 PolarHBondContact O-N 2.77Å; Q217-I221 HydrophobicContact CB-CD1 3.81Å; Q217-I221 HydrophobicContact CB-CG1 4.49Å; Q217-I221 VanDerWaalsContact O-CB 3.28Å; Q217-I221 WeakPolarHBondContact O-CB 3.43Å; Q217-I221 WeakPolarHBondContact O-CG1 3.45Å; Q217-I221 PolarHBondContact O-N 3.08Å; Q217-G253 PolarHBondContact NE2-O 2.73Å; Q217-A257 HydrophobicContact CG-CB 3.99Å
218	A	90.1	Very high	87.8	Confident	21 Å²	21	29.3 Å²	29.3	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-33.1	179.4	0	0	0	0	0	113.8	V189 I194 F214 P215 P222	V189-A218 HydrophobicContact CB-CB 3.91Å; V189-A218 HydrophobicContact CG1-CB 4.29Å; V189-A218 HydrophobicContact CG2-CB 3.62Å; I194-A218 HydrophobicContact CD1-CB 4.04Å; F214-A218 PolarHBondContact O-N 2.79Å; P215-A218 PolarHBondContact O-N 3.27Å; A218-P222 WeakPolarHBondContact O-CD 3.45Å; A218-P222 VanDerWaalsContact O-CG 3.29Å; A218-P222 WeakPolarHBondContact O-CG 3.38Å
219	A	89.9	Confident	86.8	Confident	30 Å²	30	28.2 Å²	28.2	25%	0.248	20%	0.197	C	C	.	.	H	α-helix	trans	-79.2	-37.1	175.9	0	0	0	0	0	113.4	V180 P215 Q217 F444	V180-A219 HydrophobicContact CG2-CB 3.87Å; P215-A219 WeakPolarHBondContact O-CB 3.4Å; P215-A219 PolarHBondContact O-N 2.98Å; Q217-A219 VanDerWaalsContact C-N 3.29Å; Q217-A219 PolarHBondContact O-N 3.33Å; A219-F444 HydrophobicContact CB-CD1 3.98Å; A219-F444 HydrophobicContact CB-CE1 4.17Å
220	V	92.3	Very high	85.7	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-90	-37.6	-169.8	174.1	0	0	0	0	112.7	V216 Q217 A223 L224 V246 A257 F422 F444	V216-V220 HydrophobicContact CG1-CG2 4.33Å; V216-V220 VanDerWaalsContact O-CB 3.26Å; V216-V220 WeakPolarHBondContact O-CB 3.42Å; V216-V220 WeakPolarHBondContact O-CG2 3.5Å; V216-V220 PolarHBondContact O-N 2.93Å; V216-V220 VanDerWaalsContact O-N 3.09Å; Q217-V220 PolarHBondContact O-N 2.77Å; V220-A223 PolarHBondContact O-N 3.16Å; V220-L224 HydrophobicContact CG1-CD1 3.74Å; V220-L224 HydrophobicContact CG1-CG 4.2Å; V220-L224 PolarHBondContact O-N 3.46Å; V220-V246 HydrophobicContact CG1-CG2 4.33Å; V220-V246 HydrophobicContact CG2-CG1 4.37Å; V220-V246 HydrophobicContact CG2-CG2 3.69Å; V220-A257 HydrophobicContact CB-CB 4.31Å; V220-A257 HydrophobicContact CG1-CB 4.3Å; V220-F422 HydrophobicContact CG1-CE1 4.43Å; V220-F422 HydrophobicContact CG1-CZ 4.26Å; V220-F444 HydrophobicContact CG2-CB 4.3Å; V220-F444 HydrophobicContact CG2-CD1 4.43Å; V220-F444 HydrophobicContact CG2-CD2 4.15Å; V220-F444 HydrophobicContact CG2-CG 4.04Å
221	I	93.4	Very high	84.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-51.5	-176.1	-67	169	0	0	0	111.3	I194 V197 Y213 Q217 A223 L224 L225 I260	I194-I221 HydrophobicContact CG2-CG2 4.38Å; V197-I221 HydrophobicContact CG2-CG2 3.63Å; Y213-I221 HydrophobicContact CD1-CD1 4.03Å; Y213-I221 HydrophobicContact CE1-CD1 3.98Å; Q217-I221 HydrophobicContact CB-CD1 3.81Å; Q217-I221 HydrophobicContact CB-CG1 4.49Å; Q217-I221 VanDerWaalsContact O-CB 3.28Å; Q217-I221 WeakPolarHBondContact O-CB 3.43Å; Q217-I221 WeakPolarHBondContact O-CG1 3.45Å; Q217-I221 PolarHBondContact O-N 3.08Å; I221-A223 PolarHBondContact O-N 3.39Å; I221-L224 PolarHBondContact O-N 3.37Å; I221-L225 HydrophobicContact CG2-CD1 3.74Å; I221-L225 HydrophobicContact CG2-CG 4.32Å; I221-L225 WeakPolarHBondContact O-CG 3.43Å; I221-L225 PolarHBondContact O-N 3.41Å; I221-I260 HydrophobicContact CD1-CB 4.29Å; I221-I260 HydrophobicContact CD1-CD1 3.73Å; I221-I260 HydrophobicContact CD1-CG2 4.28Å; I221-I260 HydrophobicContact CG2-CG2 4.19Å
222	P	89.9	Confident	83.4	Confident	29 Å²	29	26.8 Å²	26.8	19%	0.188	18%	0.179	C	C	.	.	H	α-helix	trans	-62.1	-43.1	178.4	-20.5	32.5	0	0	0	111.9	I194 A218 L224 L225 E226	I194-P222 HydrophobicContact CG2-CG 3.94Å; A218-P222 WeakPolarHBondContact O-CD 3.45Å; A218-P222 VanDerWaalsContact O-CG 3.29Å; A218-P222 WeakPolarHBondContact O-CG 3.38Å; P222-L224 PolarHBondContact O-N 2.95Å; P222-L225 PolarHBondContact O-N 3.39Å; P222-L225 VanDerWaalsContact O-N 3.17Å; P222-E226 WeakPolarHBondContact O-CB 3.48Å; P222-E226 PolarHBondContact O-N 3.12Å
223	A	88.8	Confident	81.9	Confident	14 Å²	14	28.8 Å²	28.8	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-32.9	179.4	0	0	0	0	0	112.9	V220 I221 F444	V220-A223 PolarHBondContact O-N 3.16Å; I221-A223 PolarHBondContact O-N 3.39Å; A223-F444 HydrophobicContact CB-CE2 4.49Å; A223-F444 HydrophobicContact CB-CZ 3.87Å
224	L	89.8	Confident	80.7	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-77.2	-43.4	173.7	-78.1	176	0	0	0	112.6	V220 I221 P222 S227 A228 L244 P261 L420	V220-L224 HydrophobicContact CG1-CD1 3.74Å; V220-L224 HydrophobicContact CG1-CG 4.2Å; V220-L224 PolarHBondContact O-N 3.46Å; I221-L224 PolarHBondContact O-N 3.37Å; P222-L224 PolarHBondContact O-N 2.95Å; L224-S227 WeakPolarHBondContact O-CB 3.08Å; L224-S227 PolarHBondContact O-N 3.36Å; L224-S227 PolarHBondContact O-OG 3.45Å; L224-A228 PolarHBondContact O-N 3.16Å; L224-L244 HydrophobicContact CD1-CD1 4.44Å; L224-L244 HydrophobicContact CD2-CD1 3.4Å; L224-L244 VanDerWaalsContact CD2-CD1 3.4Å; L224-L244 HydrophobicContact CD2-CG 4.19Å; L224-L244 HydrophobicContact CG-CD1 3.6Å; L224-P261 HydrophobicContact CB-CB 3.68Å; L224-P261 HydrophobicContact CB-CG 3.88Å; L224-P261 HydrophobicContact CD1-CB 4.23Å; L224-P261 HydrophobicContact CD1-CG 3.51Å; L224-P261 HydrophobicContact CG-CG 4.33Å; L224-L420 HydrophobicContact CD1-CD1 3.95Å; L224-L420 HydrophobicContact CD2-CD1 3.76Å; L224-L420 HydrophobicContact CD2-CD2 3.5Å; L224-L420 VanDerWaalsContact CD2-CD2 3.5Å; L224-L420 HydrophobicContact CD2-CG 4.31Å
225	L	88.3	Confident	79.6	Confident	11 Å²	11	28.7 Å²	28.7	6%	0.058	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-38.5	-179.5	-71.1	177	0	0	0	112.4	E196 V197 I221 P222 S227 A228 A229 P261 Q264	E196-L225 HydrophobicContact CB-CB 4.26Å; E196-L225 HydrophobicContact CB-CD1 3.74Å; E196-L225 WeakPolarHBondContact O-CD1 3.15Å; V197-L225 HydrophobicContact CG2-CD1 4Å; I221-L225 HydrophobicContact CG2-CD1 3.74Å; I221-L225 HydrophobicContact CG2-CG 4.32Å; I221-L225 WeakPolarHBondContact O-CG 3.43Å; I221-L225 PolarHBondContact O-N 3.41Å; P222-L225 PolarHBondContact O-N 3.39Å; P222-L225 VanDerWaalsContact O-N 3.17Å; L225-S227 PolarHBondContact O-N 3.13Å; L225-A228 CarbonylContact O-C 3.5Å; L225-A228 WeakPolarHBondContact O-CA 3.47Å; L225-A228 PolarHBondContact O-N 3.13Å; L225-A229 PolarHBondContact O-N 3.34Å; L225-P261 HydrophobicContact CD2-CB 3.77Å; L225-P261 HydrophobicContact CG-CB 3.93Å; L225-Q264 HydrophobicContact CD2-CB 4.18Å; L225-Q264 HydrophobicContact CD2-CG 4.11Å
226	E	82.6	Confident	78.4	Confident	85 Å²	85	36.7 Å²	36.7	40%	0.397	22%	0.22	S	C	.	.	H	α-helix	trans	-55.6	-38.4	172.5	-171.2	-172.2	179.6	0	0	110.8	P222 A228 A229 R236	P222-E226 WeakPolarHBondContact O-CB 3.48Å; P222-E226 PolarHBondContact O-N 3.12Å; E226-A228 PolarHBondContact O-N 2.68Å; E226-A229 PolarHBondContact O-N 3.4Å; E226-R236 VanDerWaalsContact OE1-CD 3.29Å; E226-R236 WeakPolarHBondContact OE1-CD 3.5Å; E226-R236 IonicContact OE1-CZ 3.91Å; E226-R236 IonicContact OE1-NE 3.42Å; E226-R236 IonicContact OE1-NH1 3.83Å; E226-R236 PolarHBondContact OE1-NH1 3.01Å
227	S	74.1	Confident	77.2	Confident	14 Å²	14	39.6 Å²	39.6	10%	0.098	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.4	177.5	82.2	0	0	0	0	114.7	L224 L225 R358 Q418	L224-S227 WeakPolarHBondContact O-CB 3.08Å; L224-S227 PolarHBondContact O-N 3.36Å; L224-S227 PolarHBondContact O-OG 3.45Å; L225-S227 PolarHBondContact O-N 3.13Å; S227-R358 PolarHBondContact O-NH2 3.11Å; S227-R358 VanDerWaalsContact O-NH2 3.11Å; S227-Q418 PolarHBondContact OG-OE1 2.82Å
228	A	72.9	Confident	76	Confident	23 Å²	23	41.5 Å²	41.5	19%	0.19	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-10.9	178.1	0	0	0	0	0	113.1	L224 L225 E226 C230 G231 A265	L224-A228 PolarHBondContact O-N 3.16Å; L225-A228 CarbonylContact O-C 3.5Å; L225-A228 WeakPolarHBondContact O-CA 3.47Å; L225-A228 PolarHBondContact O-N 3.13Å; E226-A228 PolarHBondContact O-N 2.68Å; A228-C230 VanDerWaalsContact C-N 3.27Å; A228-C230 PolarHBondContact O-N 3.21Å; A228-G231 PolarHBondContact O-N 2.94Å; A228-G231 VanDerWaalsContact O-N 3.11Å; A228-A265 HydrophobicContact CB-CB 3.94Å
229	A	68.4	Low	75.1	Confident	82 Å²	82	48 Å²	48	68%	0.678	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.8	-175.6	0	0	0	0	0	113.4	L225 E226 G231	L225-A229 PolarHBondContact O-N 3.34Å; E226-A229 PolarHBondContact O-N 3.4Å; A229-G231 PolarHBondContact O-N 3Å
230	C	63.8	Low	74.5	Confident	79 Å²	79	49.8 Å²	49.8	53%	0.534	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	17.9	177.4	-57.6	0	0	0	0	113.8	A228 V234	A228-C230 VanDerWaalsContact C-N 3.27Å; A228-C230 PolarHBondContact O-N 3.21Å; C230-V234 WeakPolarHBondContact CB-O 3.4Å
231	G	64.8	Low	74.1	Confident	36 Å²	36	50.3 Å²	50.3	37%	0.371	30%	0.296	S	S	.	.			trans	84	-174.6	-178.6	0	0	0	0	0	114.1	A228 A229 L233	A228-G231 PolarHBondContact O-N 2.94Å; A228-G231 VanDerWaalsContact O-N 3.11Å; A229-G231 PolarHBondContact O-N 3Å; G231-L233 VanDerWaalsContact C-N 3.33Å; G231-L233 PolarHBondContact O-N 3.11Å
232	F	63.1	Low	73.8	Confident	46 Å²	46	51.8 Å²	51.8	20%	0.202	31%	0.306	C	S	.	.	S	Bend	trans	-73.5	-23.1	-173.9	-69.5	-73.9	0	0	0	114.3	A265 L266 S268 R269 M415 P416	F232-A265 WeakPolarHBondContact CE1-O 3.44Å; F232-A265 WeakPolarHBondContact CZ-O 3.26Å; F232-L266 HydrophobicContact CE1-CD2 3.99Å; F232-S268 VanDerWaalsContact CE2-OG 3.24Å; F232-S268 WeakPolarHBondContact CE2-OG 3.38Å; F232-R269 HydrophobicContact CZ-CB 4.37Å; F232-M415 WeakPolarHBondContact O-CG 3.39Å; F232-P416 WeakPolarHBondContact O-CD 3.26Å
233	L	58.2	Low	73.9	Confident	71 Å²	71	50.4 Å²	50.4	37%	0.372	30%	0.297	S	S	.	.	S	Bend	trans	-86.2	-28.1	-166.4	-63.5	179.2	0	0	0	113.1	G231 L397 P413 Q414 M415	G231-L233 VanDerWaalsContact C-N 3.33Å; G231-L233 PolarHBondContact O-N 3.11Å; L233-L397 HydrophobicContact CD1-CD2 4.4Å; L233-L397 HydrophobicContact CD2-CD2 3.95Å; L233-P413 HydrophobicContact CB-CB 4.42Å; L233-Q414 CarbonylContact O-C 3.59Å; L233-M415 HydrophobicContact CD2-CB 4.44Å
234	V	66.1	Low	74.1	Confident	40 Å²	40	49.9 Å²	49.9	24%	0.242	29%	0.292	C	S	.	.			trans	-153.9	149.5	-176.2	-130.8	0	0	0	0	112.7	C230 G238	C230-V234 WeakPolarHBondContact CB-O 3.4Å; V234-G238 WeakPolarHBondContact CG1-O 3.48Å
235	G	64.9	Low	74.2	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.031	29%	0.291	C	S	.	.			trans	-77	-176.5	169.7	0	0	0	0	0	112	G237 G238 Y239	G235-G237 PolarHBondContact O-N 2.87Å; G235-G238 PolarHBondContact O-N 2.82Å; G235-Y239 VanDerWaalsContact CA-O 3.25Å; G235-Y239 WeakPolarHBondContact CA-O 3.19Å; G235-Y239 PolarHBondContact N-O 2.83Å
236	R	64.1	Low	74.4	Confident	177 Å²	177	49.3 Å²	49.3	67%	0.668	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-51.7	132.2	176.8	-169.4	174.6	178.6	-163	-4.2	111	E226 G238	E226-R236 VanDerWaalsContact OE1-CD 3.29Å; E226-R236 WeakPolarHBondContact OE1-CD 3.5Å; E226-R236 IonicContact OE1-CZ 3.91Å; E226-R236 IonicContact OE1-NE 3.42Å; E226-R236 IonicContact OE1-NH1 3.83Å; E226-R236 PolarHBondContact OE1-NH1 3.01Å; R236-G238 PolarHBondContact O-N 2.91Å
237	G	62.5	Low	74.7	Confident	64 Å²	64	46.2 Å²	46.2	66%	0.66	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	69.7	12.9	-179.9	0	0	0	0	0	115.3	G235 Y239	G235-G237 PolarHBondContact O-N 2.87Å; G237-Y239 WeakPolarHBondContact O-CD2 3.48Å; G237-Y239 VanDerWaalsContact O-CE2 3.29Å; G237-Y239 WeakPolarHBondContact O-CE2 3.2Å
238	G	67.8	Low	75.2	Confident	43 Å²	43	45.6 Å²	45.6	44%	0.443	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	82.8	12.6	179.5	0	0	0	0	0	114.2	V234 G235 R236	V234-G238 WeakPolarHBondContact CG1-O 3.48Å; G235-G238 PolarHBondContact O-N 2.82Å; R236-G238 PolarHBondContact O-N 2.91Å
239	Y	70.8	Confident	75.5	Confident	156 Å²	156	45.3 Å²	45.3	61%	0.612	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-99.5	160.4	-178.8	-61.6	-75.4	0	0	0	113.4	G235 G237 P241	G235-Y239 VanDerWaalsContact CA-O 3.25Å; G235-Y239 WeakPolarHBondContact CA-O 3.19Å; G235-Y239 PolarHBondContact N-O 2.83Å; G237-Y239 WeakPolarHBondContact O-CD2 3.48Å; G237-Y239 VanDerWaalsContact O-CE2 3.29Å; G237-Y239 WeakPolarHBondContact O-CE2 3.2Å; Y239-P241 WeakPolarHBondContact O-CD 3.36Å
240	R	78.6	Confident	76	Confident	68 Å²	68	42.1 Å²	42.1	26%	0.257	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-65.7	126.4	168.7	179.6	178.8	178.6	-173	0.6	109.5	P416 L417	R240-P416 HydrophobicContact CG-CB 3.97Å; R240-L417 PolarHBondContact NE-O 3.45Å; R240-L417 PolarHBondContact NH2-O 2.9Å
241	P	83.3	Confident	76.6	Confident	11 Å²	11	39.8 Å²	39.8	7%	0.071	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-56.5	148.3	174.8	-26.9	35.2	0	0	0	113.6	Y239 P416 Q418 H439	Y239-P241 WeakPolarHBondContact O-CD 3.36Å; P241-P416 HydrophobicContact CG-CG 4.11Å; P241-Q418 HydrophobicContact CB-CG 4.25Å; P241-H439 PolarHBondContact O-ND1 3.3Å
242	S	86.8	Confident	77.2	Confident	31 Å²	31	38.1 Å²	38.1	22%	0.217	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-62.7	138.6	167.6	-62.9	0	0	0	0	111.3	Q418 Q440	S242-Q418 PolarHBondContact O-NE2 3.27Å; S242-Q440 WeakPolarHBondContact CB-O 3.45Å; S242-Q440 PolarHBondContact OG-O 3.23Å
243	D	92.4	Very high	78.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-67.8	144.3	166.6	-72	-16.3	0	0	0	109.1	K419 L438 H439 P441 R442	D243-K419 WeakPolarHBondContact CA-O 3.46Å; D243-K419 HydrophobicContact CB-CB 4.34Å; D243-K419 WeakPolarHBondContact CB-O 3.46Å; D243-K419 PolarHBondContact OD1-N 3.05Å; D243-K419 IonicContact OD2-NZ 3.18Å; D243-L438 HydrophobicContact CB-CB 4.35Å; D243-L438 HydrophobicContact CB-CD2 4.31Å; D243-L438 VanDerWaalsContact OD2-CA 3.27Å; D243-L438 WeakPolarHBondContact OD2-CA 3.42Å; D243-H439 PolarHBondContact N-O 3.35Å; D243-H439 PolarHBondContact OD2-N 3.15Å; D243-P441 CarbonylContact O-C 3.37Å; D243-P441 VanDerWaalsContact O-CA 3.23Å; D243-P441 WeakPolarHBondContact O-CA 3.49Å; D243-R442 PolarHBondContact O-N 3.39Å
244	L	92.9	Very high	79.8	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	138.6	-178.9	-56.7	-168.9	0	0	0	110.7	L224 K419 L420 L421 R442 F444	L224-L244 HydrophobicContact CD1-CD1 4.44Å; L224-L244 HydrophobicContact CD2-CD1 3.4Å; L224-L244 VanDerWaalsContact CD2-CD1 3.4Å; L224-L244 HydrophobicContact CD2-CG 4.19Å; L224-L244 HydrophobicContact CG-CD1 3.6Å; L244-K419 PolarHBondContact N-O 2.99Å; L244-L420 HydrophobicContact CB-CD2 3.9Å; L244-L420 HydrophobicContact CD1-CD2 4.36Å; L244-L420 HydrophobicContact CG-CD2 4.02Å; L244-L420 CarbonylContact O-C 3.5Å; L244-L420 WeakPolarHBondContact O-CA 3.32Å; L244-L421 PolarHBondContact O-N 3.05Å; L244-R442 HydrophobicContact CD2-CB 3.91Å; L244-F444 HydrophobicContact CD1-CE2 4.2Å; L244-F444 HydrophobicContact CD2-CE2 4.08Å
245	C	92.4	Very high	81.1	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.9	172.4	-68.3	0	0	0	0	108.7	W173 L421 L426 R442 L443 F444	W173-C245 HydrophobicContact CZ3-CB 4.33Å; C245-L421 CarbonylContact C-O 3.58Å; C245-L421 WeakPolarHBondContact CA-O 3.49Å; C245-L426 HydrophobicContact CB-CD2 4.07Å; C245-R442 PolarHBondContact N-O 2.63Å; C245-L443 HydrophobicContact CB-CB 4.46Å; C245-L443 HydrophobicContact CB-CD1 3.81Å; C245-L443 CarbonylContact O-C 3.58Å; C245-L443 WeakPolarHBondContact O-CA 3.48Å; C245-F444 PolarHBondContact O-N 3.3Å
246	V	91.3	Very high	82.5	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.6	-177.9	-177.7	0	0	0	0	108.4	V216 V220 A248 L421 F422 S423 F444	V216-V246 HydrophobicContact CG1-CG1 3.6Å; V220-V246 HydrophobicContact CG1-CG2 4.33Å; V220-V246 HydrophobicContact CG2-CG1 4.37Å; V220-V246 HydrophobicContact CG2-CG2 3.69Å; V246-A248 HydrophobicContact CG1-CB 4.49Å; V246-L421 PolarHBondContact N-O 2.96Å; V246-F422 HydrophobicContact CB-CD1 3.63Å; V246-F422 HydrophobicContact CB-CE1 3.8Å; V246-F422 HydrophobicContact CB-CG 4.38Å; V246-F422 HydrophobicContact CG1-CD1 3.96Å; V246-F422 HydrophobicContact CG1-CE1 4.09Å; V246-F422 HydrophobicContact CG2-CD1 3.92Å; V246-F422 HydrophobicContact CG2-CE1 3.54Å; V246-F422 HydrophobicContact CG2-CZ 4.03Å; V246-S423 PolarHBondContact O-N 3.37Å; V246-F444 WeakPolarHBondContact CA-O 3.29Å; V246-F444 HydrophobicContact CG2-CB 4.38Å; V246-F444 HydrophobicContact CG2-CD2 4.47Å
247	S	88.7	Confident	83.9	Confident	20 Å²	20	26.7 Å²	26.7	14%	0.14	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	99.6	176.5	-171.1	0	0	0	0	109.7	S423 F444 S445 T446	S247-S423 WeakPolarHBondContact CA-O 3.5Å; S247-F444 PolarHBondContact N-O 3.11Å; S247-S445 WeakPolarHBondContact O-CA 3.42Å; S247-T446 PolarHBondContact O-N 3.39Å; S247-T446 PolarHBondContact O-OG1 2.86Å
248	A	84.7	Confident	85.5	Confident	2 Å²	2	23.6 Å²	23.6	2%	0.017	14%	0.139	C	C	.	.			trans	-147.1	145.1	-177.9	0	0	0	0	0	111.8	V216 V246 S252 K254 S423 A424 T446	V216-A248 HydrophobicContact CB-CB 4.48Å; V216-A248 HydrophobicContact CG1-CB 4.26Å; V216-A248 HydrophobicContact CG2-CB 3.43Å; V216-A248 VanDerWaalsContact CG2-CB 3.43Å; V246-A248 HydrophobicContact CG1-CB 4.49Å; A248-S252 WeakPolarHBondContact CB-OG 3.45Å; A248-K254 HydrophobicContact CB-CD 4.35Å; A248-K254 HydrophobicContact CB-CG 4.34Å; A248-K254 PolarHBondContact O-NZ 2.94Å; A248-S423 PolarHBondContact N-O 2.94Å; A248-S423 VanDerWaalsContact N-O 3.12Å; A248-A424 VanDerWaalsContact O-CA 3.3Å; A248-A424 WeakPolarHBondContact O-CA 3.24Å; A248-T446 HydrophobicContact CB-CG2 4.1Å
249	P	80	Confident	86.9	Confident	16 Å²	16	21.6 Å²	21.6	10%	0.104	12%	0.118	C	C	.	.			trans	-57.6	157.9	-173.4	23	-33.3	0	0	0	112.7	S252 K254 T446 A466	P249-S252 WeakPolarHBondContact O-CB 3.41Å; P249-S252 PolarHBondContact O-N 3.44Å; P249-S252 PolarHBondContact O-OG 3.08Å; P249-K254 PolarHBondContact O-NZ 3.43Å; P249-T446 VanDerWaalsContact CD-OG1 3.3Å; P249-T446 WeakPolarHBondContact CD-OG1 3.45Å; P249-A466 HydrophobicContact CG-CB 4.37Å
250	T	79.8	Confident	88	Confident	15 Å²	15	14.1 Å²	14.1	9%	0.092	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	139.7	173.1	46.6	0	0	0	0	110.4	A424 G586	T250-A424 HydrophobicContact CG2-CB 4.09Å; T250-G586 VanDerWaalsContact OG1-CA 3.25Å; T250-G586 WeakPolarHBondContact OG1-CA 3.34Å; T250-G586 PolarHBondContact OG1-O 3.09Å
251	G	74.9	Confident	88.8	Confident	30 Å²	30	11 Å²	11	31%	0.309	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	4.1	-175.6	0	0	0	0	0	115.6	G253	G251-G253 VanDerWaalsContact C-N 3.25Å; G251-G253 PolarHBondContact O-N 3.29Å
252	S	78.4	Confident	89.3	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.014	7%	0.074	C	C	.	.	S	Bend	trans	-82.7	9.3	173	56.5	0	0	0	0	114.7	F214 A248 P249 K254	F214-S252 WeakPolarHBondContact CB-O 3.47Å; A248-S252 WeakPolarHBondContact CB-OG 3.45Å; P249-S252 WeakPolarHBondContact O-CB 3.41Å; P249-S252 PolarHBondContact O-N 3.44Å; P249-S252 PolarHBondContact O-OG 3.08Å; S252-K254 PolarHBondContact O-N 3.08Å
253	G	85.9	Confident	89.7	Confident	18 Å²	18	9.1 Å²	9.1	19%	0.186	6%	0.064	C	C	.	.			trans	75.6	19.8	177.7	0	0	0	0	0	116.5	Q217 G251 T255 L256 A257	Q217-G253 PolarHBondContact NE2-O 2.73Å; G251-G253 VanDerWaalsContact C-N 3.25Å; G251-G253 PolarHBondContact O-N 3.29Å; G253-T255 PolarHBondContact O-N 3.4Å; G253-T255 VanDerWaalsContact O-N 3.09Å; G253-L256 PolarHBondContact O-N 2.87Å; G253-L256 VanDerWaalsContact O-N 3.16Å; G253-A257 PolarHBondContact O-N 2.96Å
254	K	90.4	Very high	89.7	Confident	20 Å²	20	11 Å²	11	9%	0.087	7%	0.073	C	C	.	.	H	α-helix	trans	-46.7	-38.9	178.1	-70.2	-170.2	-65.5	-72.7	0	114.4	V216 A248 P249 S252 L256 A257 F258 F422	V216-K254 HydrophobicContact CG1-CG 4.49Å; A248-K254 HydrophobicContact CB-CD 4.35Å; A248-K254 HydrophobicContact CB-CG 4.34Å; A248-K254 PolarHBondContact O-NZ 2.94Å; P249-K254 PolarHBondContact O-NZ 3.43Å; S252-K254 PolarHBondContact O-N 3.08Å; K254-L256 PolarHBondContact O-N 3.37Å; K254-A257 VanDerWaalsContact O-CB 3.3Å; K254-A257 WeakPolarHBondContact O-CB 3.48Å; K254-A257 PolarHBondContact O-N 2.77Å; K254-A257 VanDerWaalsContact O-N 3.17Å; K254-F258 VanDerWaalsContact O-CD1 3.29Å; K254-F258 WeakPolarHBondContact O-CD1 3.24Å; K254-F422 HydrophobicContact CB-CD1 4.03Å; K254-F422 HydrophobicContact CD-CB 4.44Å; K254-F422 HydrophobicContact CD-CD1 4.41Å; K254-F422 HydrophobicContact CG-CD1 4.36Å
255	T	93.3	Very high	89.6	Confident	31 Å²	31	11.5 Å²	11.5	19%	0.19	8%	0.077	C	C	.	.	H	α-helix	trans	-59.5	-48.7	-178.1	-51.1	0	0	0	0	112	G253 A257 F258 V259 V289 V292	G253-T255 PolarHBondContact O-N 3.4Å; G253-T255 VanDerWaalsContact O-N 3.09Å; T255-A257 VanDerWaalsContact C-N 3.26Å; T255-A257 PolarHBondContact O-N 3.29Å; T255-F258 HydrophobicContact CG2-CZ 4.03Å; T255-F258 WeakPolarHBondContact O-CD1 3.36Å; T255-F258 PolarHBondContact O-N 3Å; T255-V259 HydrophobicContact CG2-CG2 4.14Å; T255-V259 WeakPolarHBondContact O-CG2 3.41Å; T255-V259 PolarHBondContact O-N 3.48Å; T255-V289 HydrophobicContact CG2-CG1 4.33Å; T255-V289 HydrophobicContact CG2-CG2 3.95Å; T255-V292 HydrophobicContact CG2-CB 4.3Å; T255-V292 HydrophobicContact CG2-CG1 4.13Å; T255-V292 HydrophobicContact CG2-CG2 4.3Å
256	L	93.7	Very high	89.5	Confident	27 Å²	27	11.5 Å²	11.5	14%	0.141	8%	0.077	C	C	.	.	H	α-helix	trans	-69.6	-26.2	178.7	-66.2	175	0	0	0	112.6	I210 G253 K254 F258 V259 I260 V292 Y296	I210-L256 HydrophobicContact CD1-CD1 3.47Å; I210-L256 VanDerWaalsContact CD1-CD1 3.47Å; G253-L256 PolarHBondContact O-N 2.87Å; G253-L256 VanDerWaalsContact O-N 3.16Å; K254-L256 PolarHBondContact O-N 3.37Å; L256-F258 PolarHBondContact O-N 2.86Å; L256-V259 PolarHBondContact O-N 3.37Å; L256-I260 HydrophobicContact CB-CD1 4.04Å; L256-I260 HydrophobicContact CB-CG1 4.47Å; L256-I260 WeakPolarHBondContact O-CB 3.45Å; L256-I260 WeakPolarHBondContact O-CG1 3.35Å; L256-I260 PolarHBondContact O-N 2.77Å; L256-I260 VanDerWaalsContact O-N 3.1Å; L256-V292 HydrophobicContact CD2-CG1 3.74Å; L256-Y296 HydrophobicContact CD2-CD2 4.19Å; L256-Y296 HydrophobicContact CD2-CE2 3.37Å
257	A	94.3	Very high	89.5	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.6	-27.2	178.2	0	0	0	0	0	113.1	Q217 V220 G253 K254 T255 P261 F422	Q217-A257 HydrophobicContact CG-CB 3.99Å; V220-A257 HydrophobicContact CB-CB 4.31Å; V220-A257 HydrophobicContact CG1-CB 4.3Å; G253-A257 PolarHBondContact O-N 2.96Å; K254-A257 VanDerWaalsContact O-CB 3.3Å; K254-A257 WeakPolarHBondContact O-CB 3.48Å; K254-A257 PolarHBondContact O-N 2.77Å; K254-A257 VanDerWaalsContact O-N 3.17Å; T255-A257 VanDerWaalsContact C-N 3.26Å; T255-A257 PolarHBondContact O-N 3.29Å; A257-P261 WeakPolarHBondContact O-CD 3.25Å; A257-P261 VanDerWaalsContact O-CG 3.23Å; A257-P261 WeakPolarHBondContact O-CG 3.3Å; A257-F422 HydrophobicContact CB-CE1 4.15Å
258	F	95.6	Very high	89.2	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-103.8	-29.8	170	63.9	-101.1	0	0	0	114.2	K254 T255 L256 P261 V262 V278 V289 F293 V361 F422	K254-F258 VanDerWaalsContact O-CD1 3.29Å; K254-F258 WeakPolarHBondContact O-CD1 3.24Å; T255-F258 HydrophobicContact CG2-CZ 4.03Å; T255-F258 WeakPolarHBondContact O-CD1 3.36Å; T255-F258 PolarHBondContact O-N 3Å; L256-F258 PolarHBondContact O-N 2.86Å; F258-P261 WeakPolarHBondContact O-CD 3.48Å; F258-V262 VanDerWaalsContact O-CB 3.23Å; F258-V262 WeakPolarHBondContact O-CB 3.38Å; F258-V262 WeakPolarHBondContact O-CG2 2.92Å; F258-V262 PolarHBondContact O-N 3.25Å; F258-V262 VanDerWaalsContact O-N 3.13Å; F258-V278 HydrophobicContact CE2-CG1 4.14Å; F258-V278 HydrophobicContact CZ-CG1 4.37Å; F258-V289 HydrophobicContact CE2-CG1 4.03Å; F258-V289 HydrophobicContact CZ-CG1 4Å; F258-F293 HydrophobicContact CD2-CE2 4.44Å; F258-F293 HydrophobicContact CD2-CZ 4.08Å; F258-F293 AromaticContact CE2-CE2 3.87Å; F258-F293 HydrophobicContact CE2-CE2 3.87Å; F258-F293 AromaticContact CE2-CZ 3.98Å; F258-F293 HydrophobicContact CE2-CZ 3.98Å; F258-V361 HydrophobicContact CD1-CG1 4.05Å; F258-V361 HydrophobicContact CD2-CG1 4.01Å; F258-V361 HydrophobicContact CD2-CG2 4.31Å; F258-V361 HydrophobicContact CE1-CG1 4.16Å; F258-V361 HydrophobicContact CE2-CG1 4.17Å; F258-V361 HydrophobicContact CG-CG1 3.96Å; F258-V361 HydrophobicContact CZ-CG1 4.24Å; F258-F422 HydrophobicContact CB-CE2 3.59Å; F258-F422 HydrophobicContact CB-CZ 3.61Å; F258-F422 HydrophobicContact CD1-CD1 4.17Å; F258-F422 AromaticContact CD1-CD2 3.66Å; F258-F422 HydrophobicContact CD1-CD2 3.66Å; F258-F422 HydrophobicContact CD1-CE1 4.06Å; F258-F422 AromaticContact CD1-CE2 3.54Å; F258-F422 HydrophobicContact CD1-CE2 3.54Å; F258-F422 AromaticContact CD1-CG 3.99Å; F258-F422 HydrophobicContact CD1-CG 3.99Å; F258-F422 AromaticContact CD1-CZ 3.78Å; F258-F422 HydrophobicContact CD1-CZ 3.78Å; F258-F422 HydrophobicContact CE1-CD2 4.26Å; F258-F422 HydrophobicContact CE1-CG 4.39Å; F258-F422 HydrophobicContact CG-CD2 4.4Å; F258-F422 AromaticContact CG-CE2 3.92Å; F258-F422 HydrophobicContact CG-CE2 3.92Å; F258-F422 HydrophobicContact CG-CZ 4.17Å
259	V	96.4	Very high	89.3	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-48.2	-179.4	169.4	0	0	0	0	111	T255 L256 V262 V263 V292 F293 Y296	T255-V259 HydrophobicContact CG2-CG2 4.14Å; T255-V259 WeakPolarHBondContact O-CG2 3.41Å; T255-V259 PolarHBondContact O-N 3.48Å; L256-V259 PolarHBondContact O-N 3.37Å; V259-V262 PolarHBondContact O-N 3.14Å; V259-V263 HydrophobicContact CG1-CG2 4.11Å; V259-V263 WeakPolarHBondContact O-CB 3.29Å; V259-V263 VanDerWaalsContact O-CG2 3.29Å; V259-V263 WeakPolarHBondContact O-CG2 3.42Å; V259-V263 PolarHBondContact O-N 2.98Å; V259-V292 HydrophobicContact CG1-CG1 4.34Å; V259-V292 HydrophobicContact CG2-CG1 4.08Å; V259-F293 HydrophobicContact CB-CE1 4.22Å; V259-F293 HydrophobicContact CB-CZ 4.4Å; V259-F293 HydrophobicContact CG1-CD1 3.95Å; V259-F293 HydrophobicContact CG1-CE1 4.06Å; V259-F293 HydrophobicContact CG1-CG 4.46Å; V259-F293 HydrophobicContact CG2-CD1 4.23Å; V259-F293 HydrophobicContact CG2-CD2 4.1Å; V259-F293 HydrophobicContact CG2-CE1 3.95Å; V259-F293 HydrophobicContact CG2-CE2 3.8Å; V259-F293 HydrophobicContact CG2-CG 4.31Å; V259-F293 HydrophobicContact CG2-CZ 3.72Å; V259-Y296 HydrophobicContact CG1-CD2 3.91Å
260	I	94.6	Very high	89.5	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.6	-58.5	-177.5	-67.5	167.3	0	0	0	111.4	V197 L201 L205 Y213 I221 L256 V262 V263 Q264	V197-I260 HydrophobicContact CG1-CG2 4.1Å; V197-I260 HydrophobicContact CG2-CG2 4.07Å; L201-I260 HydrophobicContact CD2-CB 4.45Å; L201-I260 HydrophobicContact CD2-CG2 3.76Å; L205-I260 HydrophobicContact CD1-CD1 3.98Å; L205-I260 HydrophobicContact CD2-CD1 3.93Å; L205-I260 HydrophobicContact CD2-CG1 4.33Å; Y213-I260 HydrophobicContact CE1-CD1 3.79Å; I221-I260 HydrophobicContact CD1-CB 4.29Å; I221-I260 HydrophobicContact CD1-CD1 3.73Å; I221-I260 HydrophobicContact CD1-CG2 4.28Å; I221-I260 HydrophobicContact CG2-CG2 4.19Å; L256-I260 HydrophobicContact CB-CD1 4.04Å; L256-I260 HydrophobicContact CB-CG1 4.47Å; L256-I260 WeakPolarHBondContact O-CB 3.45Å; L256-I260 WeakPolarHBondContact O-CG1 3.35Å; L256-I260 PolarHBondContact O-N 2.77Å; L256-I260 VanDerWaalsContact O-N 3.1Å; I260-V262 VanDerWaalsContact C-N 3.35Å; I260-V262 PolarHBondContact O-N 3.46Å; I260-V263 PolarHBondContact O-N 3.43Å; I260-Q264 WeakPolarHBondContact O-CB 3.42Å; I260-Q264 PolarHBondContact O-N 3.22Å
261	P	93.9	Very high	89.9	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.019	17%	0.173	C	C	.	.	H	α-helix	trans	-67.9	-32.7	-177.5	24.3	-34.1	0	0	0	113.1	L224 L225 A257 F258 A265	L224-P261 HydrophobicContact CB-CB 3.68Å; L224-P261 HydrophobicContact CB-CG 3.88Å; L224-P261 HydrophobicContact CD1-CB 4.23Å; L224-P261 HydrophobicContact CD1-CG 3.51Å; L224-P261 HydrophobicContact CG-CG 4.33Å; L225-P261 HydrophobicContact CD2-CB 3.77Å; L225-P261 HydrophobicContact CG-CB 3.93Å; A257-P261 WeakPolarHBondContact O-CD 3.25Å; A257-P261 VanDerWaalsContact O-CG 3.23Å; A257-P261 WeakPolarHBondContact O-CG 3.3Å; F258-P261 WeakPolarHBondContact O-CD 3.48Å; P261-A265 WeakPolarHBondContact O-CB 3.3Å; P261-A265 PolarHBondContact O-N 3.25Å
262	V	94.8	Very high	90.6	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-48.1	176.3	169.2	0	0	0	0	110.9	F258 V259 I260 A265 L266 A276 F293 I334 F359	F258-V262 VanDerWaalsContact O-CB 3.23Å; F258-V262 WeakPolarHBondContact O-CB 3.38Å; F258-V262 WeakPolarHBondContact O-CG2 2.92Å; F258-V262 PolarHBondContact O-N 3.25Å; F258-V262 VanDerWaalsContact O-N 3.13Å; V259-V262 PolarHBondContact O-N 3.14Å; I260-V262 VanDerWaalsContact C-N 3.35Å; I260-V262 PolarHBondContact O-N 3.46Å; V262-A265 PolarHBondContact O-N 3.25Å; V262-L266 HydrophobicContact CG1-CD1 3.98Å; V262-L266 WeakPolarHBondContact O-CG 3.4Å; V262-L266 PolarHBondContact O-N 2.72Å; V262-L266 VanDerWaalsContact O-N 3.11Å; V262-A276 HydrophobicContact CG1-CB 3.54Å; V262-F293 HydrophobicContact CB-CE1 4.43Å; V262-F293 HydrophobicContact CG1-CE1 4.11Å; V262-I334 HydrophobicContact CG1-CD1 4.45Å; V262-F359 HydrophobicContact CG1-CD2 4.36Å; V262-F359 HydrophobicContact CG2-CB 4.35Å; V262-F359 HydrophobicContact CG2-CD2 4.12Å; V262-F359 HydrophobicContact CG2-CG 4.09Å
263	V	94.4	Very high	91.3	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-52.2	178.2	168.5	0	0	0	0	109.6	V259 I260 A265 L266 L267 F293 T297 L302 I334	V259-V263 HydrophobicContact CG1-CG2 4.11Å; V259-V263 WeakPolarHBondContact O-CB 3.29Å; V259-V263 VanDerWaalsContact O-CG2 3.29Å; V259-V263 WeakPolarHBondContact O-CG2 3.42Å; V259-V263 PolarHBondContact O-N 2.98Å; I260-V263 PolarHBondContact O-N 3.43Å; V263-A265 PolarHBondContact O-N 2.74Å; V263-L266 PolarHBondContact O-N 3.1Å; V263-L267 WeakPolarHBondContact O-CG 3.42Å; V263-L267 PolarHBondContact O-N 3.28Å; V263-L267 VanDerWaalsContact O-N 3.14Å; V263-F293 HydrophobicContact CG2-CD1 3.93Å; V263-F293 HydrophobicContact CG2-CE1 4.17Å; V263-T297 HydrophobicContact CG1-CG2 4.34Å; V263-T297 HydrophobicContact CG2-CG2 3.86Å; V263-L302 HydrophobicContact CG1-CD1 4.06Å; V263-I334 HydrophobicContact CG2-CD1 4.43Å
264	Q	92.8	Very high	91.7	Very high	38 Å²	38	29.3 Å²	29.3	18%	0.178	17%	0.167	C	C	.	.	H	α-helix	trans	-58.2	-46	180	179.3	168	-48.8	0	0	112.7	E196 L201 L225 I260 L266 L267	E196-Q264 PolarHBondContact O-NE2 2.98Å; L201-Q264 HydrophobicContact CD2-CB 4.22Å; L225-Q264 HydrophobicContact CD2-CB 4.18Å; L225-Q264 HydrophobicContact CD2-CG 4.11Å; I260-Q264 WeakPolarHBondContact O-CB 3.42Å; I260-Q264 PolarHBondContact O-N 3.22Å; Q264-L266 PolarHBondContact O-N 2.9Å; Q264-L267 PolarHBondContact O-N 3.28Å
265	A	90.3	Very high	91.8	Very high	14 Å²	14	29.4 Å²	29.4	12%	0.116	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-29.3	178.4	0	0	0	0	0	112.4	A228 F232 P261 V262 V263 F359	A228-A265 HydrophobicContact CB-CB 3.94Å; F232-A265 WeakPolarHBondContact CE1-O 3.44Å; F232-A265 WeakPolarHBondContact CZ-O 3.26Å; P261-A265 WeakPolarHBondContact O-CB 3.3Å; P261-A265 PolarHBondContact O-N 3.25Å; V262-A265 PolarHBondContact O-N 3.25Å; V263-A265 PolarHBondContact O-N 2.74Å; A265-F359 HydrophobicContact CB-CE2 3.83Å; A265-F359 HydrophobicContact CB-CZ 3.91Å
266	L	91.8	Very high	92	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-87.8	-14.4	-179.7	-63.4	-178.9	0	0	0	113.9	F232 V262 V263 Q264 S268 R269 R275 A276 L302 I334	F232-L266 HydrophobicContact CE1-CD2 3.99Å; V262-L266 HydrophobicContact CG1-CD1 3.98Å; V262-L266 WeakPolarHBondContact O-CG 3.4Å; V262-L266 PolarHBondContact O-N 2.72Å; V262-L266 VanDerWaalsContact O-N 3.11Å; V263-L266 PolarHBondContact O-N 3.1Å; Q264-L266 PolarHBondContact O-N 2.9Å; L266-S268 PolarHBondContact O-N 2.83Å; L266-S268 VanDerWaalsContact O-N 3.16Å; L266-R269 WeakPolarHBondContact O-CB 3.4Å; L266-R269 WeakPolarHBondContact O-CG 3.48Å; L266-R269 PolarHBondContact O-N 3.33Å; L266-R275 HydrophobicContact CD1-CB 4.42Å; L266-R275 HydrophobicContact CD2-CB 3.34Å; L266-R275 HydrophobicContact CD2-CG 4.12Å; L266-A276 HydrophobicContact CD1-CB 4.02Å; L266-L302 HydrophobicContact CB-CD1 3.91Å; L266-L302 HydrophobicContact CB-CD2 3.73Å; L266-I334 HydrophobicContact CD1-CD1 3.96Å; L266-I334 HydrophobicContact CD1-CG1 3.65Å
267	L	89.7	Confident	92.2	Very high	66 Å²	66	26.7 Å²	26.7	35%	0.346	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-30.6	-176.3	-73.4	176.2	0	0	0	113.5	V263 Q264 R269 T300 L302	V263-L267 WeakPolarHBondContact O-CG 3.42Å; V263-L267 PolarHBondContact O-N 3.28Å; V263-L267 VanDerWaalsContact O-N 3.14Å; Q264-L267 PolarHBondContact O-N 3.28Å; L267-R269 PolarHBondContact O-N 3.06Å; L267-T300 HydrophobicContact CD2-CG2 3.68Å; L267-L302 HydrophobicContact CD2-CD1 4Å; L267-L302 HydrophobicContact CD2-CG 4.44Å
268	S	84.2	Confident	92.4	Very high	85 Å²	85	26.7 Å²	26.7	59%	0.594	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	5.7	178.7	57.5	0	0	0	0	114.1	F232 L266 V270	F232-S268 VanDerWaalsContact CE2-OG 3.24Å; F232-S268 WeakPolarHBondContact CE2-OG 3.38Å; L266-S268 PolarHBondContact O-N 2.83Å; L266-S268 VanDerWaalsContact O-N 3.16Å; S268-V270 PolarHBondContact O-N 3.42Å
269	R	86.6	Confident	92.4	Very high	41 Å²	41	26.7 Å²	26.7	16%	0.155	15%	0.151	C	C	.	.			trans	-70.1	130.3	-177	73.1	96.2	-177.6	112.1	-7.4	112.3	F232 L266 L267 V271 P301 L302 D333	F232-R269 HydrophobicContact CZ-CB 4.37Å; L266-R269 WeakPolarHBondContact O-CB 3.4Å; L266-R269 WeakPolarHBondContact O-CG 3.48Å; L266-R269 PolarHBondContact O-N 3.33Å; L267-R269 PolarHBondContact O-N 3.06Å; R269-V271 WeakPolarHBondContact CD-O 3.34Å; R269-P301 PolarHBondContact NH2-O 3.12Å; R269-L302 HydrophobicContact CG-CD2 3.85Å; R269-D333 WeakPolarHBondContact CD-OD1 3.25Å; R269-D333 IonicContact CZ-OD2 2.82Å; R269-D333 IonicContact NE-OD1 3.6Å; R269-D333 PolarHBondContact NE-OD1 2.82Å; R269-D333 IonicContact NE-OD2 3.96Å; R269-D333 PolarHBondContact NE-OD2 3.17Å; R269-D333 IonicContact NH2-OD2 2.71Å; R269-D333 PolarHBondContact NH2-OD2 3Å
270	V	84.4	Confident	92.3	Very high	133 Å²	133	26.7 Å²	26.7	81%	0.806	15%	0.151	S	C	*	.	S	Bend	trans	-80.6	-50.8	177.8	-176.6	0	0	0	0	111.8	S268	S268-V270 PolarHBondContact O-N 3.42Å
271	V	87.3	Confident	92	Very high	80 Å²	80	28.5 Å²	28.5	49%	0.485	16%	0.163	S	C	.	.	S	Bend	trans	-112.1	142	-176.6	-176.9	0	0	0	0	110.3	R269 H273 R275	R269-V271 WeakPolarHBondContact CD-O 3.34Å; V271-H273 PolarHBondContact O-N 2.89Å; V271-R275 PolarHBondContact O-NH1 3.42Å; V271-R275 PolarHBondContact O-NH2 3.16Å; V271-R275 VanDerWaalsContact O-NH2 3.09Å
272	C	90.6	Very high	91.7	Very high	15 Å²	15	29.2 Å²	29.2	10%	0.101	17%	0.167	C	C	.	.			trans	-72.6	119.4	176.6	-170.6	0	0	0	0	111.7	R303 C330 D333	C272-R303 PolarHBondContact SG-NH2 3.03Å; C272-C330 WeakPolarHBondContact O-CB 3.33Å; C272-D333 WeakPolarHBondContact CA-OD1 3.42Å; C272-D333 PolarHBondContact SG-OD1 3.28Å; C272-D333 VanDerWaalsContact SG-OD1 3.33Å
273	H	91.9	Very high	91.4	Very high	59 Å²	59	33.3 Å²	33.3	27%	0.273	19%	0.185	S	C	.	.			trans	-150.2	153.5	172.6	-75.2	-74	0	0	0	108.9	V271 R275 A332 D333 Q356	V271-H273 PolarHBondContact O-N 2.89Å; H273-R275 PolarHBondContact O-N 2.73Å; H273-R275 PolarHBondContact O-NH1 3.11Å; H273-A332 CarbonylContact C-O 3.53Å; H273-A332 VanDerWaalsContact C-O 3.26Å; H273-D333 PolarHBondContact N-OD1 2.96Å; H273-D333 WeakPolarHBondContact O-CA 3.48Å; H273-Q356 HydrophobicContact CB-CB 3.76Å; H273-Q356 HydrophobicContact CB-CG 4.05Å
274	I	94.5	Very high	90.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.193	C	C	.	.			trans	-66.3	100.9	178.1	-56.3	171	0	0	0	108.7	A332 V335 F352 L354 Q356 L357	I274-A332 PolarHBondContact N-O 3.4Å; I274-V335 HydrophobicContact CD1-CG2 3.92Å; I274-V335 HydrophobicContact CG1-CG2 3.91Å; I274-V335 HydrophobicContact CG2-CB 4.33Å; I274-V335 HydrophobicContact CG2-CG2 3.87Å; I274-F352 HydrophobicContact CD1-CD2 3.91Å; I274-F352 HydrophobicContact CD1-CE2 3.48Å; I274-F352 VanDerWaalsContact CD1-CE2 3.48Å; I274-F352 HydrophobicContact CD1-CZ 3.96Å; I274-L354 HydrophobicContact CB-CD2 4.21Å; I274-L354 HydrophobicContact CD1-CD2 4.17Å; I274-L354 HydrophobicContact CG2-CD2 3.73Å; I274-Q356 CarbonylContact O-C 3.51Å; I274-Q356 VanDerWaalsContact O-C 3.3Å; I274-L357 HydrophobicContact CG2-CD1 4.37Å; I274-L357 WeakPolarHBondContact O-CA 3.44Å; I274-L357 PolarHBondContact O-N 3.07Å
275	R	93.6	Very high	90.6	Very high	23 Å²	23	33.8 Å²	33.8	9%	0.087	19%	0.188	C	C	.	.			trans	-107.5	-19.8	179.6	-72	-178.1	-178.3	81.8	-1.8	112.7	L266 V271 H273 D333 Q356 R358 F359	L266-R275 HydrophobicContact CD1-CB 4.42Å; L266-R275 HydrophobicContact CD2-CB 3.34Å; L266-R275 HydrophobicContact CD2-CG 4.12Å; V271-R275 PolarHBondContact O-NH1 3.42Å; V271-R275 PolarHBondContact O-NH2 3.16Å; V271-R275 VanDerWaalsContact O-NH2 3.09Å; H273-R275 PolarHBondContact O-N 2.73Å; H273-R275 PolarHBondContact O-NH1 3.11Å; R275-D333 PolarHBondContact N-O 3.26Å; R275-D333 IonicContact NH1-OD1 3.77Å; R275-Q356 WeakPolarHBondContact CA-O 3.49Å; R275-Q356 WeakPolarHBondContact CG-O 3.4Å; R275-R358 WeakPolarHBondContact O-CA 3.41Å; R275-R358 WeakPolarHBondContact O-CB 3.29Å; R275-R358 PolarHBondContact O-N 3.25Å; R275-F359 PolarHBondContact O-N 3.27Å
276	A	96.4	Very high	90.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.5	172.1	0	0	0	0	0	111.1	V262 L266 D333 I334 V335 F359	V262-A276 HydrophobicContact CG1-CB 3.54Å; L266-A276 HydrophobicContact CD1-CB 4.02Å; A276-D333 PolarHBondContact N-O 3.47Å; A276-I334 HydrophobicContact CB-CG1 4.24Å; A276-I334 HydrophobicContact CB-CG2 4.21Å; A276-I334 WeakPolarHBondContact O-CA 3.38Å; A276-V335 PolarHBondContact O-N 3.06Å; A276-F359 WeakPolarHBondContact CA-O 3.46Å; A276-F359 HydrophobicContact CB-CB 4.31Å
277	L	98	Very high	90.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120	174.6	-178	62.2	0	0	0	108.6	V279 V335 A337 L342 L354 L357 F359 L360 V361 V380	L277-V279 HydrophobicContact CD2-CG2 4.27Å; L277-V279 HydrophobicContact CG-CG2 3.91Å; L277-V335 WeakPolarHBondContact CA-O 3.17Å; L277-V335 HydrophobicContact CD1-CB 3.86Å; L277-V335 HydrophobicContact CD1-CG1 3.81Å; L277-A337 HydrophobicContact CD1-CB 4.32Å; L277-L342 HydrophobicContact CD1-CD1 3.92Å; L277-L342 HydrophobicContact CD1-CD2 4.22Å; L277-L342 HydrophobicContact CD2-CD1 4.15Å; L277-L342 HydrophobicContact CD2-CD2 3.76Å; L277-L342 HydrophobicContact CG-CD2 4.31Å; L277-L354 HydrophobicContact CD2-CD1 4.28Å; L277-L357 HydrophobicContact CB-CD1 3.49Å; L277-L357 VanDerWaalsContact CB-CD1 3.49Å; L277-L357 HydrophobicContact CB-CD2 4.2Å; L277-L357 HydrophobicContact CB-CG 4.49Å; L277-L357 HydrophobicContact CD2-CD2 4.25Å; L277-F359 PolarHBondContact N-O 3.15Å; L277-L360 HydrophobicContact CB-CD1 4.17Å; L277-L360 HydrophobicContact CD2-CD1 3.93Å; L277-L360 HydrophobicContact CG-CD1 4.1Å; L277-L360 CarbonylContact O-C 3.47Å; L277-L360 WeakPolarHBondContact O-CA 3.31Å; L277-V361 PolarHBondContact O-N 3.01Å; L277-V380 HydrophobicContact CD2-CG1 3.74Å
278	V	98.1	Very high	90.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.4	179.7	-170.5	0	0	0	0	108.1	F258 L280 V289 F293 V335 V336 A337 V361	F258-V278 HydrophobicContact CE2-CG1 4.14Å; F258-V278 HydrophobicContact CZ-CG1 4.37Å; V278-L280 HydrophobicContact CB-CD1 4.35Å; V278-L280 HydrophobicContact CG1-CD1 3.71Å; V278-L280 HydrophobicContact CG1-CG 4.3Å; V278-V289 HydrophobicContact CG1-CG1 4.17Å; V278-F293 HydrophobicContact CG2-CE2 3.7Å; V278-F293 HydrophobicContact CG2-CZ 3.85Å; V278-V335 PolarHBondContact N-O 3.49Å; V278-V336 HydrophobicContact CB-CG2 4.37Å; V278-V336 CarbonylContact O-C 3.59Å; V278-V336 WeakPolarHBondContact O-CA 3.29Å; V278-A337 PolarHBondContact O-N 2.7Å; V278-V361 WeakPolarHBondContact CA-O 3.08Å; V278-V361 HydrophobicContact CB-CB 4.27Å; V278-V361 HydrophobicContact CG1-CB 3.98Å; V278-V361 HydrophobicContact CG1-CG1 4.04Å; V278-V361 HydrophobicContact CG2-CB 4.04Å; V278-V361 HydrophobicContact CG2-CG2 4.16Å
279	V	96.2	Very high	91.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125	-175.4	-160.8	0	0	0	0	109.6	L277 A337 P339 L342 L360 V361 D363 M368 W376	L277-V279 HydrophobicContact CD2-CG2 4.27Å; L277-V279 HydrophobicContact CG-CG2 3.91Å; V279-A337 WeakPolarHBondContact CA-O 3.18Å; V279-P339 HydrophobicContact CG1-CG 3.76Å; V279-L342 HydrophobicContact CG1-CD2 4.36Å; V279-L342 HydrophobicContact CG2-CD2 3.86Å; V279-L360 HydrophobicContact CG2-CD1 3.94Å; V279-V361 PolarHBondContact N-O 2.96Å; V279-D363 PolarHBondContact O-N 3.38Å; V279-M368 HydrophobicContact CB-CE 4.25Å; V279-M368 HydrophobicContact CG1-CE 3.66Å; V279-W376 HydrophobicContact CB-CH2 4.08Å; V279-W376 HydrophobicContact CB-CZ3 4.18Å; V279-W376 HydrophobicContact CG1-CE3 4.38Å; V279-W376 HydrophobicContact CG1-CH2 4.03Å; V279-W376 HydrophobicContact CG1-CZ3 3.95Å; V279-W376 HydrophobicContact CG2-CH2 4.2Å; V279-W376 HydrophobicContact CG2-CZ3 3.9Å
280	L	93.8	Very high	91.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.			trans	-129.5	149.4	-175.3	-53.1	98.7	0	0	0	110.8	V278 T282 L285 A286 V289 V336 A337 P339 D363	V278-L280 HydrophobicContact CB-CD1 4.35Å; V278-L280 HydrophobicContact CG1-CD1 3.71Å; V278-L280 HydrophobicContact CG1-CG 4.3Å; L280-T282 PolarHBondContact O-N 3Å; L280-L285 HydrophobicContact CB-CD2 4.37Å; L280-L285 HydrophobicContact CD2-CB 4.36Å; L280-L285 HydrophobicContact CD2-CD2 3.83Å; L280-L285 HydrophobicContact CD2-CG 3.57Å; L280-A286 HydrophobicContact CB-CB 4.37Å; L280-A286 HydrophobicContact CD1-CB 4.04Å; L280-V289 HydrophobicContact CD2-CB 4.02Å; L280-V289 HydrophobicContact CD2-CG2 3.55Å; L280-V336 HydrophobicContact CD1-CG1 3.45Å; L280-V336 VanDerWaalsContact CD1-CG1 3.45Å; L280-A337 PolarHBondContact N-O 3.48Å; L280-P339 WeakPolarHBondContact O-CD 3.37Å; L280-D363 HydrophobicContact CD2-CB 3.94Å; L280-D363 HydrophobicContact CG-CB 4.24Å
281	P	89.6	Confident	92.1	Very high	38 Å²	38	27.2 Å²	27.2	25%	0.247	14%	0.136	C	C	.	.	S	Bend	trans	-72.5	-25.3	-172.8	26.5	-35.9	0	0	0	114.2	D363 E364 R367 M368	P281-D363 WeakPolarHBondContact CD-O 3.43Å; P281-E364 HydrophobicContact CG-CB 3.69Å; P281-E364 HydrophobicContact CG-CG 4.34Å; P281-R367 HydrophobicContact CB-CB 4.28Å; P281-R367 HydrophobicContact CG-CB 4.4Å; P281-M368 VanDerWaalsContact CA-SD 3.58Å; P281-M368 HydrophobicContact CB-CG 4.43Å; P281-M368 HydrophobicContact CB-SD 3.72Å; P281-M368 HydrophobicContact CG-SD 4.35Å
282	T	87.4	Confident	92.4	Very high	18 Å²	18	24.8 Å²	24.8	11%	0.11	12%	0.121	C	C	.	.	S	Bend	trans	-125.2	149.8	-174.9	67.5	0	0	0	0	111.9	L280 E284 L285 A286	L280-T282 PolarHBondContact O-N 3Å; T282-E284 VanDerWaalsContact C-N 3.26Å; T282-E284 PolarHBondContact O-N 3.18Å; T282-L285 PolarHBondContact O-N 3Å; T282-L285 VanDerWaalsContact OG1-CB 3.31Å; T282-L285 WeakPolarHBondContact OG1-CB 3.28Å; T282-L285 PolarHBondContact OG1-N 2.84Å; T282-A286 WeakPolarHBondContact O-CB 3.32Å; T282-A286 PolarHBondContact O-N 2.77Å; T282-A286 VanDerWaalsContact O-N 3.13Å
283	K	87.6	Confident	92.7	Very high	87 Å²	87	24 Å²	24	38%	0.378	12%	0.116	S	C	.	.	H	α-helix	trans	-65.6	-33.8	-179.3	-56.7	-173.3	179.8	-166.3	0	111.4	Q287 T308 G309 Q310 T338	K283-Q287 WeakPolarHBondContact O-CG 3.45Å; K283-Q287 PolarHBondContact O-N 2.85Å; K283-T308 VanDerWaalsContact CD-O 3.26Å; K283-T308 WeakPolarHBondContact CD-O 3.39Å; K283-T308 WeakPolarHBondContact CE-O 3.45Å; K283-T308 PolarHBondContact NZ-O 3.29Å; K283-G309 PolarHBondContact NZ-O 3.31Å; K283-G309 VanDerWaalsContact NZ-O 3.12Å; K283-Q310 HydrophobicContact CD-CG 4.2Å; K283-T338 HydrophobicContact CG-CG2 4.19Å
284	E	84.4	Confident	92.9	Very high	39 Å²	39	24.5 Å²	24.5	18%	0.182	12%	0.121	C	C	.	.	H	α-helix	trans	-70.1	-44.8	-177.8	-63.6	66.1	-146.1	0	0	110.8	T282 A286 Q287 Q288 R536	T282-E284 VanDerWaalsContact C-N 3.26Å; T282-E284 PolarHBondContact O-N 3.18Å; E284-A286 VanDerWaalsContact C-N 3.35Å; E284-Q287 WeakPolarHBondContact O-CB 3.16Å; E284-Q287 PolarHBondContact O-N 3.06Å; E284-Q288 PolarHBondContact O-N 3.13Å; E284-R536 VanDerWaalsContact CD-NH1 3.3Å; E284-R536 IonicContact OE1-CZ 3.17Å; E284-R536 IonicContact OE1-NH1 2.67Å; E284-R536 PolarHBondContact OE1-NH1 3.29Å; E284-R536 IonicContact OE1-NH2 2.74Å; E284-R536 PolarHBondContact OE1-NH2 3.49Å
285	L	87.3	Confident	92.9	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.058	14%	0.137	C	C	.	.	H	α-helix	trans	-66.3	-40.3	176.4	-171.9	59.3	0	0	0	111.1	L280 T282 Q287 Q288 V289 E364	L280-L285 HydrophobicContact CB-CD2 4.37Å; L280-L285 HydrophobicContact CD2-CB 4.36Å; L280-L285 HydrophobicContact CD2-CD2 3.83Å; L280-L285 HydrophobicContact CD2-CG 3.57Å; T282-L285 PolarHBondContact O-N 3Å; T282-L285 VanDerWaalsContact OG1-CB 3.31Å; T282-L285 WeakPolarHBondContact OG1-CB 3.28Å; T282-L285 PolarHBondContact OG1-N 2.84Å; L285-Q287 VanDerWaalsContact C-N 3.35Å; L285-Q287 PolarHBondContact O-N 3.07Å; L285-Q288 WeakPolarHBondContact O-CB 3.33Å; L285-Q288 PolarHBondContact O-N 3.43Å; L285-Q288 VanDerWaalsContact O-N 3.13Å; L285-V289 HydrophobicContact CD1-CG2 4.43Å; L285-V289 WeakPolarHBondContact O-CG2 3.25Å; L285-V289 PolarHBondContact O-N 2.97Å; L285-E364 HydrophobicContact CD2-CG 3.61Å
286	A	92.4	Very high	92.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-42.3	174.6	0	0	0	0	0	112.6	L280 T282 E284 Q288 S290 L306 T308 V336	L280-A286 HydrophobicContact CB-CB 4.37Å; L280-A286 HydrophobicContact CD1-CB 4.04Å; T282-A286 WeakPolarHBondContact O-CB 3.32Å; T282-A286 PolarHBondContact O-N 2.77Å; T282-A286 VanDerWaalsContact O-N 3.13Å; E284-A286 VanDerWaalsContact C-N 3.35Å; A286-Q288 VanDerWaalsContact C-N 3.33Å; A286-Q288 PolarHBondContact O-N 3.42Å; A286-S290 VanDerWaalsContact O-CB 3.23Å; A286-S290 WeakPolarHBondContact O-CB 3.42Å; A286-S290 PolarHBondContact O-N 3.27Å; A286-L306 HydrophobicContact CB-CD1 3.95Å; A286-T308 HydrophobicContact CB-CG2 3.54Å; A286-V336 HydrophobicContact CB-CG1 4.04Å; A286-V336 WeakPolarHBondContact O-CG1 3.26Å
287	Q	90.9	Very high	92.8	Very high	33 Å²	33	27.5 Å²	27.5	15%	0.154	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-42.7	172.2	-79.3	-179.3	-21	0	0	112.3	K283 E284 L285 K291 L306 Q310	K283-Q287 WeakPolarHBondContact O-CG 3.45Å; K283-Q287 PolarHBondContact O-N 2.85Å; E284-Q287 WeakPolarHBondContact O-CB 3.16Å; E284-Q287 PolarHBondContact O-N 3.06Å; L285-Q287 VanDerWaalsContact C-N 3.35Å; L285-Q287 PolarHBondContact O-N 3.07Å; Q287-K291 WeakPolarHBondContact O-CG 3.31Å; Q287-K291 PolarHBondContact O-N 3.33Å; Q287-L306 HydrophobicContact CB-CD2 4.45Å; Q287-L306 HydrophobicContact CG-CD2 3.68Å; Q287-Q310 VanDerWaalsContact CD-NE2 3.34Å
288	Q	89.3	Confident	92.4	Very high	44 Å²	44	34.4 Å²	34.4	21%	0.206	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-51.8	179.3	-176.9	-169.9	-18.2	0	0	110.9	E284 L285 A286 S290 K291 V292 D562	E284-Q288 PolarHBondContact O-N 3.13Å; L285-Q288 WeakPolarHBondContact O-CB 3.33Å; L285-Q288 PolarHBondContact O-N 3.43Å; L285-Q288 VanDerWaalsContact O-N 3.13Å; A286-Q288 VanDerWaalsContact C-N 3.33Å; A286-Q288 PolarHBondContact O-N 3.42Å; Q288-S290 VanDerWaalsContact C-N 3.31Å; Q288-S290 PolarHBondContact O-N 3.45Å; Q288-K291 WeakPolarHBondContact O-CB 3.2Å; Q288-K291 PolarHBondContact O-N 2.93Å; Q288-K291 VanDerWaalsContact O-N 3.11Å; Q288-V292 WeakPolarHBondContact O-CG2 3.29Å; Q288-V292 PolarHBondContact O-N 2.86Å; Q288-D562 PolarHBondContact NE2-OD2 2.9Å; Q288-D562 VanDerWaalsContact NE2-OD2 3.08Å
289	V	94.4	Very high	91.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-37.9	-179.7	174.2	0	0	0	0	111.3	T255 F258 V278 L280 L285 K291 V292 F293	T255-V289 HydrophobicContact CG2-CG1 4.33Å; T255-V289 HydrophobicContact CG2-CG2 3.95Å; F258-V289 HydrophobicContact CE2-CG1 4.03Å; F258-V289 HydrophobicContact CZ-CG1 4Å; V278-V289 HydrophobicContact CG1-CG1 4.17Å; L280-V289 HydrophobicContact CD2-CB 4.02Å; L280-V289 HydrophobicContact CD2-CG2 3.55Å; L285-V289 HydrophobicContact CD1-CG2 4.43Å; L285-V289 WeakPolarHBondContact O-CG2 3.25Å; L285-V289 PolarHBondContact O-N 2.97Å; V289-K291 VanDerWaalsContact C-N 3.34Å; V289-K291 PolarHBondContact O-N 2.9Å; V289-V292 WeakPolarHBondContact O-CB 3.29Å; V289-V292 PolarHBondContact O-N 3.08Å; V289-V292 VanDerWaalsContact O-N 3.14Å; V289-F293 HydrophobicContact CG1-CD2 3.85Å; V289-F293 HydrophobicContact CG1-CE2 3.73Å; V289-F293 WeakPolarHBondContact O-CD2 3.46Å; V289-F293 PolarHBondContact O-N 3.49Å
290	S	95.8	Very high	91.6	Very high	10 Å²	10	39.8 Å²	39.8	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-39.3	172.7	175.9	0	0	0	0	112.7	A286 Q288 V292 F293 N294	A286-S290 VanDerWaalsContact O-CB 3.23Å; A286-S290 WeakPolarHBondContact O-CB 3.42Å; A286-S290 PolarHBondContact O-N 3.27Å; Q288-S290 VanDerWaalsContact C-N 3.31Å; Q288-S290 PolarHBondContact O-N 3.45Å; S290-V292 VanDerWaalsContact C-N 3.35Å; S290-F293 PolarHBondContact O-N 3.43Å; S290-N294 PolarHBondContact O-N 3.31Å; S290-N294 PolarHBondContact O-ND2 3.09Å
291	K	93.9	Very high	91.5	Very high	113 Å²	113	43.6 Å²	43.6	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-42	172.6	-71	170.5	-177.9	179.4	0	111.8	Q287 Q288 V289 N294 I295	Q287-K291 WeakPolarHBondContact O-CG 3.31Å; Q287-K291 PolarHBondContact O-N 3.33Å; Q288-K291 WeakPolarHBondContact O-CB 3.2Å; Q288-K291 PolarHBondContact O-N 2.93Å; Q288-K291 VanDerWaalsContact O-N 3.11Å; V289-K291 VanDerWaalsContact C-N 3.34Å; V289-K291 PolarHBondContact O-N 2.9Å; K291-N294 PolarHBondContact O-N 3.35Å; K291-I295 WeakPolarHBondContact O-CG1 3.4Å; K291-I295 PolarHBondContact O-N 3.45Å
292	V	95	Very high	91.8	Very high	29 Å²	29	42.2 Å²	42.2	18%	0.176	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-45.9	177.5	-179.4	0	0	0	0	110.4	T255 L256 V259 Q288 V289 S290 N294 I295 Y296	T255-V292 HydrophobicContact CG2-CB 4.3Å; T255-V292 HydrophobicContact CG2-CG1 4.13Å; T255-V292 HydrophobicContact CG2-CG2 4.3Å; L256-V292 HydrophobicContact CD2-CG1 3.74Å; V259-V292 HydrophobicContact CG1-CG1 4.34Å; V259-V292 HydrophobicContact CG2-CG1 4.08Å; Q288-V292 WeakPolarHBondContact O-CG2 3.29Å; Q288-V292 PolarHBondContact O-N 2.86Å; V289-V292 WeakPolarHBondContact O-CB 3.29Å; V289-V292 PolarHBondContact O-N 3.08Å; V289-V292 VanDerWaalsContact O-N 3.14Å; S290-V292 VanDerWaalsContact C-N 3.35Å; V292-N294 PolarHBondContact O-N 2.99Å; V292-I295 PolarHBondContact O-N 2.88Å; V292-Y296 HydrophobicContact CG1-CD2 4.17Å; V292-Y296 HydrophobicContact CG1-CE2 3.93Å; V292-Y296 WeakPolarHBondContact O-CD2 3.3Å; V292-Y296 PolarHBondContact O-N 2.81Å
293	F	96.6	Very high	92.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-49.8	172.8	-86.2	-72.8	0	0	0	112.1	F258 V259 V262 V263 V278 V289 S290 I295 Y296 T297 V304 I334 V336	F258-F293 HydrophobicContact CD2-CE2 4.44Å; F258-F293 HydrophobicContact CD2-CZ 4.08Å; F258-F293 AromaticContact CE2-CE2 3.87Å; F258-F293 HydrophobicContact CE2-CE2 3.87Å; F258-F293 AromaticContact CE2-CZ 3.98Å; F258-F293 HydrophobicContact CE2-CZ 3.98Å; V259-F293 HydrophobicContact CB-CE1 4.22Å; V259-F293 HydrophobicContact CB-CZ 4.4Å; V259-F293 HydrophobicContact CG1-CD1 3.95Å; V259-F293 HydrophobicContact CG1-CE1 4.06Å; V259-F293 HydrophobicContact CG1-CG 4.46Å; V259-F293 HydrophobicContact CG2-CD1 4.23Å; V259-F293 HydrophobicContact CG2-CD2 4.1Å; V259-F293 HydrophobicContact CG2-CE1 3.95Å; V259-F293 HydrophobicContact CG2-CE2 3.8Å; V259-F293 HydrophobicContact CG2-CG 4.31Å; V259-F293 HydrophobicContact CG2-CZ 3.72Å; V262-F293 HydrophobicContact CB-CE1 4.43Å; V262-F293 HydrophobicContact CG1-CE1 4.11Å; V263-F293 HydrophobicContact CG2-CD1 3.93Å; V263-F293 HydrophobicContact CG2-CE1 4.17Å; V278-F293 HydrophobicContact CG2-CE2 3.7Å; V278-F293 HydrophobicContact CG2-CZ 3.85Å; V289-F293 HydrophobicContact CG1-CD2 3.85Å; V289-F293 HydrophobicContact CG1-CE2 3.73Å; V289-F293 WeakPolarHBondContact O-CD2 3.46Å; V289-F293 PolarHBondContact O-N 3.49Å; S290-F293 PolarHBondContact O-N 3.43Å; F293-I295 PolarHBondContact O-N 3.06Å; F293-Y296 CarbonylContact O-C 3.3Å; F293-Y296 PolarHBondContact O-N 3.37Å; F293-T297 WeakPolarHBondContact O-CG2 3.32Å; F293-T297 PolarHBondContact O-N 3.35Å; F293-T297 PolarHBondContact O-OG1 2.59Å; F293-T297 VanDerWaalsContact O-OG1 3.07Å; F293-V304 HydrophobicContact CB-CG1 3.96Å; F293-V304 HydrophobicContact CB-CG2 3.92Å; F293-I334 HydrophobicContact CD1-CD1 3.64Å; F293-I334 HydrophobicContact CD1-CG2 4.12Å; F293-I334 HydrophobicContact CD2-CG2 4.38Å; F293-I334 HydrophobicContact CE1-CD1 3.83Å; F293-I334 HydrophobicContact CE1-CG2 4.06Å; F293-I334 HydrophobicContact CE2-CG2 4.33Å; F293-I334 HydrophobicContact CG-CG2 4.28Å; F293-I334 HydrophobicContact CZ-CG2 4.17Å; F293-V336 HydrophobicContact CD2-CG2 4.03Å; F293-V336 HydrophobicContact CE2-CG2 4.39Å
294	N	95.9	Very high	92.6	Very high	69 Å²	69	43.1 Å²	43.1	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-56.9	-37.4	-179.2	-76.4	-56.4	0	0	0	112.8	S290 K291 V292 Y296 T297 D298	S290-N294 PolarHBondContact O-N 3.31Å; S290-N294 PolarHBondContact O-ND2 3.09Å; K291-N294 PolarHBondContact O-N 3.35Å; V292-N294 PolarHBondContact O-N 2.99Å; N294-Y296 VanDerWaalsContact C-N 3.32Å; N294-Y296 PolarHBondContact O-N 3Å; N294-T297 WeakPolarHBondContact CA-OG1 3.34Å; N294-T297 PolarHBondContact O-N 3.25Å; N294-D298 WeakPolarHBondContact O-CB 3.37Å; N294-D298 PolarHBondContact O-N 2.92Å
295	I	94.4	Very high	93.2	Very high	69 Å²	69	41.8 Å²	41.8	35%	0.354	23%	0.228	S	C	.	.	H	α-helix	trans	-57.7	-45.4	175.9	-71.2	165.2	0	0	0	111.2	H208 K291 V292 F293	H208-I295 VanDerWaalsContact NE2-CG2 3.31Å; H208-I295 WeakPolarHBondContact NE2-CG2 3.27Å; K291-I295 WeakPolarHBondContact O-CG1 3.4Å; K291-I295 PolarHBondContact O-N 3.45Å; V292-I295 PolarHBondContact O-N 2.88Å; F293-I295 PolarHBondContact O-N 3.06Å
296	Y	93.6	Very high	93.7	Very high	11 Å²	11	43.3 Å²	43.3	4%	0.043	24%	0.236	C	C	.	.	H	α-helix	trans	-90.1	-3	-177.6	-61.1	-72.4	0	0	0	114	L201 Q204 L205 I210 L256 V259 V292 F293 N294	L201-Y296 HydrophobicContact CD1-CD1 3.97Å; L201-Y296 HydrophobicContact CD1-CG 4.49Å; Q204-Y296 HydrophobicContact CB-CD1 4.49Å; L205-Y296 HydrophobicContact CD2-CD1 4.42Å; L205-Y296 HydrophobicContact CD2-CE1 3.52Å; L205-Y296 HydrophobicContact CG-CE1 4.16Å; I210-Y296 VanDerWaalsContact CD1-OH 3.22Å; I210-Y296 WeakPolarHBondContact CD1-OH 3.29Å; L256-Y296 HydrophobicContact CD2-CD2 4.19Å; L256-Y296 HydrophobicContact CD2-CE2 3.37Å; V259-Y296 HydrophobicContact CG1-CD2 3.91Å; V292-Y296 HydrophobicContact CG1-CD2 4.17Å; V292-Y296 HydrophobicContact CG1-CE2 3.93Å; V292-Y296 WeakPolarHBondContact O-CD2 3.3Å; V292-Y296 PolarHBondContact O-N 2.81Å; F293-Y296 CarbonylContact O-C 3.3Å; F293-Y296 PolarHBondContact O-N 3.37Å; N294-Y296 VanDerWaalsContact C-N 3.32Å; N294-Y296 PolarHBondContact O-N 3Å
297	T	94.1	Very high	93.9	Very high	6 Å²	6	43.3 Å²	43.3	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-109.6	-7.1	174.8	62	0	0	0	0	113.6	V263 F293 N294 A299 T300 L302 V304 I334	V263-T297 HydrophobicContact CG1-CG2 4.34Å; V263-T297 HydrophobicContact CG2-CG2 3.86Å; F293-T297 WeakPolarHBondContact O-CG2 3.32Å; F293-T297 PolarHBondContact O-N 3.35Å; F293-T297 PolarHBondContact O-OG1 2.59Å; F293-T297 VanDerWaalsContact O-OG1 3.07Å; N294-T297 WeakPolarHBondContact CA-OG1 3.34Å; N294-T297 PolarHBondContact O-N 3.25Å; T297-A299 VanDerWaalsContact C-N 3.32Å; T297-A299 PolarHBondContact O-N 2.9Å; T297-T300 VanDerWaalsContact CA-OG1 3.3Å; T297-T300 WeakPolarHBondContact CA-OG1 3.48Å; T297-T300 WeakPolarHBondContact O-CB 3.31Å; T297-T300 PolarHBondContact O-N 3.3Å; T297-T300 PolarHBondContact O-OG1 3.13Å; T297-L302 HydrophobicContact CG2-CB 3.97Å; T297-L302 HydrophobicContact CG2-CD1 4.2Å; T297-V304 HydrophobicContact CG2-CG2 4.02Å; T297-V304 WeakPolarHBondContact OG1-CG2 3.35Å; T297-I334 HydrophobicContact CG2-CD1 4.32Å
298	D	90.1	Very high	94	Very high	145 Å²	145	41.9 Å²	41.9	78%	0.775	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-41.4	-172.8	-164.7	50.8	0	0	0	113.2	N294 T300	N294-D298 WeakPolarHBondContact O-CB 3.37Å; N294-D298 PolarHBondContact O-N 2.92Å; D298-T300 VanDerWaalsContact C-N 3.3Å; D298-T300 PolarHBondContact O-N 3.12Å
299	A	86.6	Confident	94	Very high	82 Å²	82	41 Å²	41	68%	0.678	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	19.4	177.5	0	0	0	0	0	113.5	T297	T297-A299 VanDerWaalsContact C-N 3.32Å; T297-A299 PolarHBondContact O-N 2.9Å
300	T	90.1	Very high	93.6	Very high	32 Å²	32	44.4 Å²	44.4	20%	0.196	25%	0.248	C	C	.	.	S	Bend	trans	-126.7	159.9	-174.2	79.3	0	0	0	0	110.2	L267 T297 D298 L302	L267-T300 HydrophobicContact CD2-CG2 3.68Å; T297-T300 VanDerWaalsContact CA-OG1 3.3Å; T297-T300 WeakPolarHBondContact CA-OG1 3.48Å; T297-T300 WeakPolarHBondContact O-CB 3.31Å; T297-T300 PolarHBondContact O-N 3.3Å; T297-T300 PolarHBondContact O-OG1 3.13Å; D298-T300 VanDerWaalsContact C-N 3.3Å; D298-T300 PolarHBondContact O-N 3.12Å; T300-L302 PolarHBondContact O-N 3.19Å; T300-L302 WeakPolarHBondContact OG1-CB 3.4Å; T300-L302 PolarHBondContact OG1-N 3.41Å
301	P	92	Very high	93.3	Very high	80 Å²	80	50.3 Å²	50.3	52%	0.519	27%	0.272	S	S	.	.	S	Bend	trans	-72.9	-3.1	174.9	31.9	-37	0	0	0	113.1	R269	R269-P301 PolarHBondContact NH2-O 3.12Å
302	L	95.1	Very high	93.4	Very high	9 Å²	9	48 Å²	48	5%	0.047	27%	0.27	C	S	.	.			trans	-71.4	134.6	-174.9	-62.3	177.1	0	0	0	111.8	V263 L266 L267 R269 T297 T300 D333	V263-L302 HydrophobicContact CG1-CD1 4.06Å; L266-L302 HydrophobicContact CB-CD1 3.91Å; L266-L302 HydrophobicContact CB-CD2 3.73Å; L267-L302 HydrophobicContact CD2-CD1 4Å; L267-L302 HydrophobicContact CD2-CG 4.44Å; R269-L302 HydrophobicContact CG-CD2 3.85Å; T297-L302 HydrophobicContact CG2-CB 3.97Å; T297-L302 HydrophobicContact CG2-CD1 4.2Å; T300-L302 PolarHBondContact O-N 3.19Å; T300-L302 WeakPolarHBondContact OG1-CB 3.4Å; T300-L302 PolarHBondContact OG1-N 3.41Å; L302-D333 HydrophobicContact CD2-CB 4.15Å
303	R	95.9	Very high	93.3	Very high	95 Å²	95	48.3 Å²	48.3	36%	0.358	27%	0.271	S	S	.	.			trans	-108.4	125.9	-179.2	-64.3	-174.1	-69.2	171.7	-2.2	111.7	C272 C330 L331 D333 I334	C272-R303 PolarHBondContact SG-NH2 3.03Å; R303-C330 PolarHBondContact NH2-O 3.17Å; R303-L331 WeakPolarHBondContact CB-O 3.33Å; R303-L331 VanDerWaalsContact CD-O 3.31Å; R303-L331 WeakPolarHBondContact CD-O 3.42Å; R303-L331 VanDerWaalsContact CZ-C 3.41Å; R303-L331 VanDerWaalsContact CZ-CA 3.42Å; R303-L331 PolarHBondContact NE-O 2.96Å; R303-L331 PolarHBondContact NH1-O 2.76Å; R303-L331 VanDerWaalsContact NH2-CA 3.32Å; R303-D333 PolarHBondContact N-OD2 3.12Å; R303-D333 PolarHBondContact O-N 2.88Å; R303-I334 PolarHBondContact O-N 3.31Å
304	V	97.4	Very high	93.2	Very high	28 Å²	28	50.6 Å²	50.6	17%	0.17	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.9	179.8	-172.9	0	0	0	0	109.6	F293 T297 I334 V336	F293-V304 HydrophobicContact CB-CG1 3.96Å; F293-V304 HydrophobicContact CB-CG2 3.92Å; T297-V304 HydrophobicContact CG2-CG2 4.02Å; T297-V304 WeakPolarHBondContact OG1-CG2 3.35Å; V304-I334 CarbonylContact C-O 3.52Å; V304-I334 WeakPolarHBondContact CA-O 3.44Å; V304-I334 HydrophobicContact CG1-CB 4.48Å; V304-I334 HydrophobicContact CG1-CG2 4.48Å; V304-I334 HydrophobicContact CG2-CB 4.28Å; V304-I334 HydrophobicContact CG2-CD1 4.38Å; V304-V336 HydrophobicContact CG1-CG2 4.27Å
305	S	97	Very high	93.2	Very high	11 Å²	11	53.6 Å²	53.6	8%	0.077	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.5	174.4	-172.6	0	0	0	0	111.8	S319 I334 V335 V336	S305-S319 PolarHBondContact OG-OG 3.25Å; S305-I334 PolarHBondContact N-O 3.36Å; S305-V335 WeakPolarHBondContact O-CA 3.43Å; S305-V336 PolarHBondContact O-N 3.15Å
306	L	97.2	Very high	93.2	Very high	43 Å²	43	50.4 Å²	50.4	23%	0.225	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.8	-179.7	177.6	71.5	0	0	0	110.1	A286 Q287 T308 V336	A286-L306 HydrophobicContact CB-CD1 3.95Å; Q287-L306 HydrophobicContact CB-CD2 4.45Å; Q287-L306 HydrophobicContact CG-CD2 3.68Å; L306-T308 HydrophobicContact CD1-CG2 3.49Å; L306-T308 VanDerWaalsContact CD1-CG2 3.49Å; L306-T308 HydrophobicContact CG-CG2 3.93Å; L306-V336 WeakPolarHBondContact CA-O 3.47Å; L306-V336 HydrophobicContact CD1-CB 4.13Å; L306-V336 HydrophobicContact CD1-CG1 4.14Å
307	I	96.2	Very high	93.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	94.5	178.9	56.3	169.9	0	0	0	111.8	E316 L320 V335 V336 A337 T338 R341 L342 H345	I307-E316 HydrophobicContact CG2-CB 4.11Å; I307-E316 HydrophobicContact CG2-CG 4.45Å; I307-L320 HydrophobicContact CD1-CD1 4.46Å; I307-L320 HydrophobicContact CG2-CD1 3.72Å; I307-L320 HydrophobicContact CG2-CD2 4.31Å; I307-L320 HydrophobicContact CG2-CG 4.16Å; I307-V335 HydrophobicContact CD1-CG1 3.53Å; I307-V335 HydrophobicContact CG1-CG1 3.65Å; I307-V336 PolarHBondContact N-O 3.42Å; I307-A337 HydrophobicContact CD1-CB 3.83Å; I307-A337 HydrophobicContact CG1-CB 3.48Å; I307-A337 VanDerWaalsContact CG1-CB 3.48Å; I307-A337 WeakPolarHBondContact O-CA 3.29Å; I307-T338 PolarHBondContact O-N 2.94Å; I307-R341 HydrophobicContact CB-CG 4.4Å; I307-L342 HydrophobicContact CD1-CD1 4.08Å; I307-H345 HydrophobicContact CD1-CB 4.46Å
308	T	93.2	Very high	93.3	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	32%	0.32	C	S	.	.	S	Bend	trans	-127.9	5	-173.7	56.8	0	0	0	0	112.9	K283 A286 L306 Q310 T338	K283-T308 VanDerWaalsContact CD-O 3.26Å; K283-T308 WeakPolarHBondContact CD-O 3.39Å; K283-T308 WeakPolarHBondContact CE-O 3.45Å; K283-T308 PolarHBondContact NZ-O 3.29Å; A286-T308 HydrophobicContact CB-CG2 3.54Å; L306-T308 HydrophobicContact CD1-CG2 3.49Å; L306-T308 VanDerWaalsContact CD1-CG2 3.49Å; L306-T308 HydrophobicContact CG-CG2 3.93Å; T308-Q310 VanDerWaalsContact C-N 3.28Å; T308-Q310 PolarHBondContact O-N 2.84Å; T308-Q310 WeakPolarHBondContact OG1-CG 3.5Å; T308-T338 HydrophobicContact CG2-CG2 4.11Å
309	G	89.2	Confident	93.5	Very high	26 Å²	26	53.4 Å²	53.4	27%	0.268	30%	0.297	S	S	.	.	S	Bend	trans	66.7	35.9	-177.2	0	0	0	0	0	111	K283 E316	K283-G309 PolarHBondContact NZ-O 3.31Å; K283-G309 VanDerWaalsContact NZ-O 3.12Å; G309-E316 PolarHBondContact N-OE1 3.29Å
310	Q	86.4	Confident	93.8	Very high	72 Å²	72	49.5 Å²	49.5	34%	0.336	27%	0.265	S	S	.	.	S	Bend	trans	-94.3	-30.6	170.4	-72.2	-177.4	-2.8	0	0	111.3	K283 Q287 T308	K283-Q310 HydrophobicContact CD-CG 4.2Å; Q287-Q310 VanDerWaalsContact CD-NE2 3.34Å; T308-Q310 VanDerWaalsContact C-N 3.28Å; T308-Q310 PolarHBondContact O-N 2.84Å; T308-Q310 WeakPolarHBondContact OG1-CG 3.5Å
311	K	89.9	Confident	94	Very high	134 Å²	134	48.7 Å²	48.7	58%	0.583	26%	0.26	S	S	*	.	S	Bend	trans	-99.8	165.2	170.5	-61.9	175.6	-175	175.4	0	108.4	K315 E316 R341	K311-K315 HydrophobicContact CB-CB 4.25Å; K311-E316 HydrophobicContact CB-CG 3.89Å; K311-E316 PolarHBondContact N-OE1 3.15Å; K311-R341 PolarHBondContact O-NH2 2.83Å
312	S	94.6	Very high	94.1	Very high	64 Å²	64	49.9 Å²	49.9	45%	0.448	26%	0.258	S	S	.	.			trans	-61	153.1	170.7	57.6	0	0	0	0	110.3	A314 K315 E316	S312-A314 VanDerWaalsContact C-N 3.32Å; S312-A314 PolarHBondContact O-N 2.76Å; S312-K315 PolarHBondContact O-N 2.83Å; S312-K315 VanDerWaalsContact O-N 3.17Å; S312-K315 WeakPolarHBondContact OG-CG 3.21Å; S312-E316 PolarHBondContact O-N 3.08Å; S312-E316 VanDerWaalsContact O-N 3.15Å
313	L	94.6	Very high	93.9	Very high	35 Å²	35	57.2 Å²	57.2	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-54.8	-47.8	178.3	-173.1	69	0	0	0	111.7	K315 E316 Q317 R341 H345 Q348	L313-K315 VanDerWaalsContact C-N 3.31Å; L313-K315 PolarHBondContact O-N 2.95Å; L313-E316 CarbonylContact O-C 3.55Å; L313-E316 PolarHBondContact O-N 3.22Å; L313-Q317 HydrophobicContact CG-CG 4.19Å; L313-Q317 VanDerWaalsContact O-CG 3.23Å; L313-Q317 WeakPolarHBondContact O-CG 3.23Å; L313-Q317 PolarHBondContact O-N 2.78Å; L313-R341 VanDerWaalsContact N-NH2 3.14Å; L313-H345 WeakPolarHBondContact CD1-CE1 3.34Å; L313-Q348 HydrophobicContact CD2-CB 4.12Å; L313-Q348 VanDerWaalsContact CD2-OE1 3.29Å
314	A	94.6	Very high	93.6	Very high	48 Å²	48	54.2 Å²	54.2	40%	0.397	28%	0.282	S	S	.	.	H	α-helix	trans	-52.5	-44.7	176.9	0	0	0	0	0	113.6	S312 E316 Q317 E318	S312-A314 VanDerWaalsContact C-N 3.32Å; S312-A314 PolarHBondContact O-N 2.76Å; A314-E316 VanDerWaalsContact C-N 3.35Å; A314-E316 PolarHBondContact O-N 3.45Å; A314-Q317 WeakPolarHBondContact O-CB 3.31Å; A314-Q317 PolarHBondContact O-N 2.88Å; A314-E318 WeakPolarHBondContact O-CG 3.41Å; A314-E318 PolarHBondContact O-N 3.45Å
315	K	94.3	Very high	93.1	Very high	132 Å²	132	57.9 Å²	57.9	57%	0.574	32%	0.315	S	S	*	.	H	α-helix	trans	-68.2	-34.3	178.6	-75	-176.5	176.7	-174.8	0	112.9	K311 S312 L313 S319	K311-K315 HydrophobicContact CB-CB 4.25Å; S312-K315 PolarHBondContact O-N 2.83Å; S312-K315 VanDerWaalsContact O-N 3.17Å; S312-K315 WeakPolarHBondContact OG-CG 3.21Å; L313-K315 VanDerWaalsContact C-N 3.31Å; L313-K315 PolarHBondContact O-N 2.95Å; K315-S319 PolarHBondContact O-N 3.34Å
316	E	95.4	Very high	92.4	Very high	2 Å²	2	64 Å²	64	1%	0.009	35%	0.347	C	S	.	.	H	α-helix	trans	-72.5	-36.6	174.9	-67.7	179.8	170.5	0	0	110.4	I307 G309 K311 S312 L313 A314 S319 L320 R341 H345	I307-E316 HydrophobicContact CG2-CB 4.11Å; I307-E316 HydrophobicContact CG2-CG 4.45Å; G309-E316 PolarHBondContact N-OE1 3.29Å; K311-E316 HydrophobicContact CB-CG 3.89Å; K311-E316 PolarHBondContact N-OE1 3.15Å; S312-E316 PolarHBondContact O-N 3.08Å; S312-E316 VanDerWaalsContact O-N 3.15Å; L313-E316 CarbonylContact O-C 3.55Å; L313-E316 PolarHBondContact O-N 3.22Å; A314-E316 VanDerWaalsContact C-N 3.35Å; A314-E316 PolarHBondContact O-N 3.45Å; E316-S319 PolarHBondContact O-N 2.82Å; E316-S319 VanDerWaalsContact O-N 3.16Å; E316-S319 PolarHBondContact O-OG 3.41Å; E316-L320 WeakPolarHBondContact O-CG 3.28Å; E316-L320 PolarHBondContact O-N 3.39Å; E316-R341 IonicContact OE2-CZ 3.35Å; E316-R341 IonicContact OE2-NE 3.4Å; E316-R341 PolarHBondContact OE2-NE 2.7Å; E316-R341 IonicContact OE2-NH2 2.65Å; E316-R341 PolarHBondContact OE2-NH2 3.03Å; E316-H345 IonicContact OE2-NE2 3.58Å; E316-H345 PolarHBondContact OE2-NE2 3.32Å
317	Q	95.6	Very high	92	Very high	47 Å²	47	63.3 Å²	63.3	22%	0.22	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-48.6	174	-68.4	175.3	-36.2	0	0	112	L313 A314 S319 L320 V321 Q348 T349	L313-Q317 HydrophobicContact CG-CG 4.19Å; L313-Q317 VanDerWaalsContact O-CG 3.23Å; L313-Q317 WeakPolarHBondContact O-CG 3.23Å; L313-Q317 PolarHBondContact O-N 2.78Å; A314-Q317 WeakPolarHBondContact O-CB 3.31Å; A314-Q317 PolarHBondContact O-N 2.88Å; Q317-S319 PolarHBondContact O-N 3.17Å; Q317-L320 PolarHBondContact O-N 3.48Å; Q317-V321 PolarHBondContact O-N 2.95Å; Q317-Q348 PolarHBondContact NE2-O 3.21Å; Q317-T349 HydrophobicContact CB-CG2 4.1Å; Q317-T349 HydrophobicContact CG-CG2 3.67Å; Q317-T349 WeakPolarHBondContact CG-OG1 3.39Å; Q317-T349 PolarHBondContact NE2-OG1 3.17Å
318	E	94.1	Very high	91.6	Very high	137 Å²	137	68.6 Å²	68.6	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-57.9	-28.8	175.2	-72.4	166.1	-169	0	0	112.8	A314 L331	A314-E318 WeakPolarHBondContact O-CG 3.41Å; A314-E318 PolarHBondContact O-N 3.45Å; E318-L331 VanDerWaalsContact O-CD1 3.27Å; E318-L331 WeakPolarHBondContact O-CD1 2.93Å
319	S	93.8	Very high	91.4	Very high	41 Å²	41	75 Å²	75	29%	0.287	40%	0.395	S	S	.	.	H	α-helix	trans	-82.9	-17.5	177.2	77.6	0	0	0	0	114	S305 K315 E316 Q317	S305-S319 PolarHBondContact OG-OG 3.25Å; K315-S319 PolarHBondContact O-N 3.34Å; E316-S319 PolarHBondContact O-N 2.82Å; E316-S319 VanDerWaalsContact O-N 3.16Å; E316-S319 PolarHBondContact O-OG 3.41Å; Q317-S319 PolarHBondContact O-N 3.17Å
320	L	94.3	Very high	91.6	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-101.3	-36.9	-176.2	-74.5	173.2	0	0	0	112.4	I307 E316 Q317 L331 A332 V335 F352	I307-L320 HydrophobicContact CD1-CD1 4.46Å; I307-L320 HydrophobicContact CG2-CD1 3.72Å; I307-L320 HydrophobicContact CG2-CD2 4.31Å; I307-L320 HydrophobicContact CG2-CG 4.16Å; E316-L320 WeakPolarHBondContact O-CG 3.28Å; E316-L320 PolarHBondContact O-N 3.39Å; Q317-L320 PolarHBondContact O-N 3.48Å; L320-L331 PolarHBondContact O-N 3.48Å; L320-A332 HydrophobicContact CD2-CB 4.22Å; L320-V335 HydrophobicContact CD2-CG2 3.85Å; L320-F352 HydrophobicContact CD1-CD2 3.86Å; L320-F352 HydrophobicContact CD1-CE2 3.81Å; L320-F352 HydrophobicContact CD2-CE2 4.29Å
321	V	94.3	Very high	91.9	Very high	16 Å²	16	72.6 Å²	72.6	10%	0.097	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138.7	-169.9	-169.6	0	0	0	0	110.2	Q317 Y328 R329 T349 F352	Q317-V321 PolarHBondContact O-N 2.95Å; V321-Y328 HydrophobicContact CG1-CD1 3.6Å; V321-Y328 HydrophobicContact CG1-CG 4Å; V321-R329 WeakPolarHBondContact CA-O 3.34Å; V321-T349 HydrophobicContact CG2-CG2 4.15Å; V321-F352 HydrophobicContact CG2-CB 4.47Å
322	Q	93.5	Very high	92.2	Very high	105 Å²	105	66.2 Å²	66.2	49%	0.491	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.5	170.2	-171.2	175.6	13.8	0	0	110.1	T324 R329 L331	Q322-T324 HydrophobicContact CG-CG2 4.44Å; Q322-R329 PolarHBondContact N-O 3.42Å; Q322-R329 PolarHBondContact O-N 2.98Å; Q322-L331 HydrophobicContact CB-CD1 4.02Å; Q322-L331 HydrophobicContact CB-CD2 4Å; Q322-L331 HydrophobicContact CB-CG 4.1Å
323	K	91.3	Very high	92.3	Very high	163 Å²	163	63.1 Å²	63.1	71%	0.709	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.6	170.3	-168	174.6	-177.5	177.7	0	109.7	Y328	K323-Y328 HydrophobicContact CB-CD1 4.23Å; K323-Y328 HydrophobicContact CB-CE1 4.02Å; K323-Y328 HydrophobicContact CD-CE1 4.32Å; K323-Y328 HydrophobicContact CG-CD1 4.43Å; K323-Y328 HydrophobicContact CG-CE1 4.02Å
324	T	89.8	Confident	92.4	Very high	32 Å²	32	61.5 Å²	61.5	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	171.5	177.7	57.3	0	0	0	0	110.6	Q322 D326 G327 R329	Q322-T324 HydrophobicContact CG-CG2 4.44Å; T324-D326 PolarHBondContact O-N 3.01Å; T324-G327 CarbonylContact C-O 3.48Å; T324-G327 WeakPolarHBondContact CA-O 3.4Å; T324-G327 PolarHBondContact N-O 3.3Å; T324-G327 PolarHBondContact O-N 3.41Å; T324-G327 PolarHBondContact OG1-O 2.98Å; T324-R329 HydrophobicContact CG2-CB 4.43Å; T324-R329 HydrophobicContact CG2-CG 3.8Å; T324-R329 PolarHBondContact OG1-NE 3.37Å
325	A	86.6	Confident	92.6	Very high	105 Å²	105	59.2 Å²	59.2	87%	0.868	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-34.7	179	0	0	0	0	0	112.2	G327	A325-G327 VanDerWaalsContact C-N 3.35Å; A325-G327 PolarHBondContact O-N 3.43Å
326	D	82.4	Confident	92.8	Very high	139 Å²	139	52.9 Å²	52.9	74%	0.743	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	10.1	-175.8	-39.9	-51.9	0	0	0	113.4	T324 R329	T324-D326 PolarHBondContact O-N 3.01Å; D326-R329 IonicContact OD2-NH2 3.4Å; D326-R329 PolarHBondContact OD2-NH2 3.26Å
327	G	87.1	Confident	92.8	Very high	29 Å²	29	52.8 Å²	52.8	30%	0.299	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	117.9	-139.2	-176	0	0	0	0	0	112.9	T324 A325	T324-G327 CarbonylContact C-O 3.48Å; T324-G327 WeakPolarHBondContact CA-O 3.4Å; T324-G327 PolarHBondContact N-O 3.3Å; T324-G327 PolarHBondContact O-N 3.41Å; T324-G327 PolarHBondContact OG1-O 2.98Å; A325-G327 VanDerWaalsContact C-N 3.35Å; A325-G327 PolarHBondContact O-N 3.43Å
328	Y	88.3	Confident	92.8	Very high	111 Å²	111	51.2 Å²	51.2	44%	0.435	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.1	-175.6	-68	-79.3	0	0	0	112.1	V321 K323 P350	V321-Y328 HydrophobicContact CG1-CD1 3.6Å; V321-Y328 HydrophobicContact CG1-CG 4Å; K323-Y328 HydrophobicContact CB-CD1 4.23Å; K323-Y328 HydrophobicContact CB-CE1 4.02Å; K323-Y328 HydrophobicContact CD-CE1 4.32Å; K323-Y328 HydrophobicContact CG-CD1 4.43Å; K323-Y328 HydrophobicContact CG-CE1 4.02Å; Y328-P350 HydrophobicContact CE1-CB 3.96Å; Y328-P350 HydrophobicContact CE2-CB 3.92Å; Y328-P350 VanDerWaalsContact CZ-CB 3.47Å; Y328-P350 WeakPolarHBondContact OH-CB 3.37Å
329	R	89.5	Confident	92.7	Very high	137 Å²	137	45.3 Å²	45.3	52%	0.517	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.5	174.6	-64.5	-172.6	-171.9	-176.9	-1.4	110.7	V321 Q322 T324 D326	V321-R329 WeakPolarHBondContact CA-O 3.34Å; Q322-R329 PolarHBondContact N-O 3.42Å; Q322-R329 PolarHBondContact O-N 2.98Å; T324-R329 HydrophobicContact CG2-CB 4.43Å; T324-R329 HydrophobicContact CG2-CG 3.8Å; T324-R329 PolarHBondContact OG1-NE 3.37Å; D326-R329 IonicContact OD2-NH2 3.4Å; D326-R329 PolarHBondContact OD2-NH2 3.26Å
330	C	92.4	Very high	92.6	Very high	12 Å²	12	45.1 Å²	45.1	8%	0.081	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	135	175	-72.3	0	0	0	0	110.9	C272 R303	C272-C330 WeakPolarHBondContact O-CB 3.33Å; R303-C330 PolarHBondContact NH2-O 3.17Å
331	L	94.3	Very high	92.6	Very high	35 Å²	35	46.8 Å²	46.8	18%	0.183	25%	0.252	C	S	.	.			trans	-104.9	-2.4	178.6	-62.2	-178.3	0	0	0	114.3	R303 E318 L320 Q322	R303-L331 WeakPolarHBondContact CB-O 3.33Å; R303-L331 VanDerWaalsContact CD-O 3.31Å; R303-L331 WeakPolarHBondContact CD-O 3.42Å; R303-L331 VanDerWaalsContact CZ-C 3.41Å; R303-L331 VanDerWaalsContact CZ-CA 3.42Å; R303-L331 PolarHBondContact NE-O 2.96Å; R303-L331 PolarHBondContact NH1-O 2.76Å; R303-L331 VanDerWaalsContact NH2-CA 3.32Å; E318-L331 VanDerWaalsContact O-CD1 3.27Å; E318-L331 WeakPolarHBondContact O-CD1 2.93Å; L320-L331 PolarHBondContact O-N 3.48Å; Q322-L331 HydrophobicContact CB-CD1 4.02Å; Q322-L331 HydrophobicContact CB-CD2 4Å; Q322-L331 HydrophobicContact CB-CG 4.1Å
332	A	95.6	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.			trans	-130.1	140.7	-178.6	0	0	0	0	0	111.5	H273 I274 L320 V335	H273-A332 CarbonylContact C-O 3.53Å; H273-A332 VanDerWaalsContact C-O 3.26Å; I274-A332 PolarHBondContact N-O 3.4Å; L320-A332 HydrophobicContact CD2-CB 4.22Å; A332-V335 HydrophobicContact CB-CG2 3.94Å
333	D	96	Very high	92.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-95.1	-36.8	169.3	-69.9	-60.2	0	0	0	110.9	R269 C272 H273 R275 A276 L302 R303	R269-D333 WeakPolarHBondContact CD-OD1 3.25Å; R269-D333 IonicContact CZ-OD2 2.82Å; R269-D333 IonicContact NE-OD1 3.6Å; R269-D333 PolarHBondContact NE-OD1 2.82Å; R269-D333 IonicContact NE-OD2 3.96Å; R269-D333 PolarHBondContact NE-OD2 3.17Å; R269-D333 IonicContact NH2-OD2 2.71Å; R269-D333 PolarHBondContact NH2-OD2 3Å; C272-D333 WeakPolarHBondContact CA-OD1 3.42Å; C272-D333 PolarHBondContact SG-OD1 3.28Å; C272-D333 VanDerWaalsContact SG-OD1 3.33Å; H273-D333 PolarHBondContact N-OD1 2.96Å; H273-D333 WeakPolarHBondContact O-CA 3.48Å; R275-D333 PolarHBondContact N-O 3.26Å; R275-D333 IonicContact NH1-OD1 3.77Å; A276-D333 PolarHBondContact N-O 3.47Å; L302-D333 HydrophobicContact CD2-CB 4.15Å; R303-D333 PolarHBondContact N-OD2 3.12Å; R303-D333 PolarHBondContact O-N 2.88Å
334	I	97.9	Very high	92.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125	-178.4	-51.5	-179.1	0	0	0	108.5	V262 V263 L266 A276 F293 T297 R303 V304 S305	V262-I334 HydrophobicContact CG1-CD1 4.45Å; V263-I334 HydrophobicContact CG2-CD1 4.43Å; L266-I334 HydrophobicContact CD1-CD1 3.96Å; L266-I334 HydrophobicContact CD1-CG1 3.65Å; A276-I334 HydrophobicContact CB-CG1 4.24Å; A276-I334 HydrophobicContact CB-CG2 4.21Å; A276-I334 WeakPolarHBondContact O-CA 3.38Å; F293-I334 HydrophobicContact CD1-CD1 3.64Å; F293-I334 HydrophobicContact CD1-CG2 4.12Å; F293-I334 HydrophobicContact CD2-CG2 4.38Å; F293-I334 HydrophobicContact CE1-CD1 3.83Å; F293-I334 HydrophobicContact CE1-CG2 4.06Å; F293-I334 HydrophobicContact CE2-CG2 4.33Å; F293-I334 HydrophobicContact CG-CG2 4.28Å; F293-I334 HydrophobicContact CZ-CG2 4.17Å; T297-I334 HydrophobicContact CG2-CD1 4.32Å; R303-I334 PolarHBondContact O-N 3.31Å; V304-I334 CarbonylContact C-O 3.52Å; V304-I334 WeakPolarHBondContact CA-O 3.44Å; V304-I334 HydrophobicContact CG1-CB 4.48Å; V304-I334 HydrophobicContact CG1-CG2 4.48Å; V304-I334 HydrophobicContact CG2-CB 4.28Å; V304-I334 HydrophobicContact CG2-CD1 4.38Å; S305-I334 PolarHBondContact N-O 3.36Å
335	V	98.1	Very high	93.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.6	176.3	177.1	0	0	0	0	109.4	I274 A276 L277 V278 S305 I307 L320 A332 A337	I274-V335 HydrophobicContact CD1-CG2 3.92Å; I274-V335 HydrophobicContact CG1-CG2 3.91Å; I274-V335 HydrophobicContact CG2-CB 4.33Å; I274-V335 HydrophobicContact CG2-CG2 3.87Å; A276-V335 PolarHBondContact O-N 3.06Å; L277-V335 WeakPolarHBondContact CA-O 3.17Å; L277-V335 HydrophobicContact CD1-CB 3.86Å; L277-V335 HydrophobicContact CD1-CG1 3.81Å; V278-V335 PolarHBondContact N-O 3.49Å; S305-V335 WeakPolarHBondContact O-CA 3.43Å; I307-V335 HydrophobicContact CD1-CG1 3.53Å; I307-V335 HydrophobicContact CG1-CG1 3.65Å; L320-V335 HydrophobicContact CD2-CG2 3.85Å; A332-V335 HydrophobicContact CB-CG2 3.94Å; V335-A337 HydrophobicContact CG1-CB 4.37Å
336	V	98.1	Very high	93.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.1	174.3	-172.7	0	0	0	0	108.5	V278 L280 A286 F293 V304 S305 L306 I307	V278-V336 HydrophobicContact CB-CG2 4.37Å; V278-V336 CarbonylContact O-C 3.59Å; V278-V336 WeakPolarHBondContact O-CA 3.29Å; L280-V336 HydrophobicContact CD1-CG1 3.45Å; L280-V336 VanDerWaalsContact CD1-CG1 3.45Å; A286-V336 HydrophobicContact CB-CG1 4.04Å; A286-V336 WeakPolarHBondContact O-CG1 3.26Å; F293-V336 HydrophobicContact CD2-CG2 4.03Å; F293-V336 HydrophobicContact CE2-CG2 4.39Å; V304-V336 HydrophobicContact CG1-CG2 4.27Å; S305-V336 PolarHBondContact O-N 3.15Å; L306-V336 WeakPolarHBondContact CA-O 3.47Å; L306-V336 HydrophobicContact CD1-CB 4.13Å; L306-V336 HydrophobicContact CD1-CG1 4.14Å; I307-V336 PolarHBondContact N-O 3.42Å
337	A	96.4	Very high	94	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.1	-163.6	0	0	0	0	0	114.4	L277 V278 V279 L280 I307 V335 L342	L277-A337 HydrophobicContact CD1-CB 4.32Å; V278-A337 PolarHBondContact O-N 2.7Å; V279-A337 WeakPolarHBondContact CA-O 3.18Å; L280-A337 PolarHBondContact N-O 3.48Å; I307-A337 HydrophobicContact CD1-CB 3.83Å; I307-A337 HydrophobicContact CG1-CB 3.48Å; I307-A337 VanDerWaalsContact CG1-CB 3.48Å; I307-A337 WeakPolarHBondContact O-CA 3.29Å; V335-A337 HydrophobicContact CG1-CB 4.37Å; A337-L342 HydrophobicContact CB-CB 4.06Å; A337-L342 HydrophobicContact CB-CD1 4.41Å; A337-L342 HydrophobicContact CB-CD2 4.44Å
338	T	94.4	Very high	94.3	Very high	14 Å²	14	33.3 Å²	33.3	9%	0.086	17%	0.165	C	C	.	.			trans	-100.1	145.6	161.2	51.6	0	0	0	0	110.6	K283 I307 T308 G340 R341 L342	K283-T338 HydrophobicContact CG-CG2 4.19Å; I307-T338 PolarHBondContact O-N 2.94Å; T308-T338 HydrophobicContact CG2-CG2 4.11Å; T338-G340 PolarHBondContact O-N 2.88Å; T338-R341 PolarHBondContact O-N 3.49Å; T338-L342 WeakPolarHBondContact O-CB 3.22Å; T338-L342 PolarHBondContact O-N 2.94Å
339	P	93	Very high	94.6	Very high	12 Å²	12	28.5 Å²	28.5	8%	0.078	15%	0.147	C	C	.	.	H	α-helix	trans	-50.6	-56.3	-171.8	-32.9	37.7	0	0	0	116	V279 L280 R341 L342 V343 M368 W376	V279-P339 HydrophobicContact CG1-CG 3.76Å; L280-P339 WeakPolarHBondContact O-CD 3.37Å; P339-R341 VanDerWaalsContact C-N 3.3Å; P339-R341 PolarHBondContact O-N 3.24Å; P339-L342 WeakPolarHBondContact O-CB 3.26Å; P339-L342 PolarHBondContact O-N 3.08Å; P339-V343 WeakPolarHBondContact O-CG2 3.22Å; P339-V343 PolarHBondContact O-N 2.89Å; P339-M368 HydrophobicContact CB-CE 4.48Å; P339-M368 HydrophobicContact CG-CE 3.23Å; P339-M368 HydrophobicContact CG-SD 3.87Å; P339-W376 HydrophobicContact CB-CB 4.05Å; P339-W376 HydrophobicContact CB-CD2 3.94Å; P339-W376 HydrophobicContact CB-CG 3.66Å; P339-W376 HydrophobicContact CG-CD2 4.29Å; P339-W376 HydrophobicContact CG-CG 4.4Å
340	G	91.9	Very high	94.7	Very high	37 Å²	37	25.5 Å²	25.5	38%	0.381	15%	0.146	S	C	.	.	H	α-helix	trans	-59.9	-43.2	-176.7	0	0	0	0	0	111.7	T338 L342 V343 D344	T338-G340 PolarHBondContact O-N 2.88Å; G340-L342 PolarHBondContact O-N 2.71Å; G340-V343 PolarHBondContact O-N 2.93Å; G340-D344 PolarHBondContact O-N 3.4Å; G340-D344 VanDerWaalsContact O-N 3.09Å
341	R	94	Very high	94.4	Very high	35 Å²	35	26.4 Å²	26.4	13%	0.132	16%	0.157	C	C	.	.	H	α-helix	trans	-67.8	-35.9	178.7	-173.5	52.3	164.3	-158.2	-12.7	113.4	I307 K311 L313 E316 T338 P339 V343 D344 H345	I307-R341 HydrophobicContact CB-CG 4.4Å; K311-R341 PolarHBondContact O-NH2 2.83Å; L313-R341 VanDerWaalsContact N-NH2 3.14Å; E316-R341 IonicContact OE2-CZ 3.35Å; E316-R341 IonicContact OE2-NE 3.4Å; E316-R341 PolarHBondContact OE2-NE 2.7Å; E316-R341 IonicContact OE2-NH2 2.65Å; E316-R341 PolarHBondContact OE2-NH2 3.03Å; T338-R341 PolarHBondContact O-N 3.49Å; P339-R341 VanDerWaalsContact C-N 3.3Å; P339-R341 PolarHBondContact O-N 3.24Å; R341-V343 VanDerWaalsContact C-N 3.32Å; R341-D344 IonicContact NH1-OD2 3.08Å; R341-D344 WeakPolarHBondContact O-CB 3.39Å; R341-D344 PolarHBondContact O-N 3.22Å; R341-H345 PolarHBondContact NE-NE2 2.95Å; R341-H345 PolarHBondContact O-CD2 3.23Å; R341-H345 VanDerWaalsContact O-CD2 3.28Å; R341-H345 PolarHBondContact O-N 3.18Å; R341-H345 VanDerWaalsContact O-N 3.13Å
342	L	95.5	Very high	94.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-42.7	175.1	174.3	60.3	0	0	0	111.1	L277 V279 I307 A337 T338 P339 G340 H345 I346 F352 V380	L277-L342 HydrophobicContact CD1-CD1 3.92Å; L277-L342 HydrophobicContact CD1-CD2 4.22Å; L277-L342 HydrophobicContact CD2-CD1 4.15Å; L277-L342 HydrophobicContact CD2-CD2 3.76Å; L277-L342 HydrophobicContact CG-CD2 4.31Å; V279-L342 HydrophobicContact CG1-CD2 4.36Å; V279-L342 HydrophobicContact CG2-CD2 3.86Å; I307-L342 HydrophobicContact CD1-CD1 4.08Å; A337-L342 HydrophobicContact CB-CB 4.06Å; A337-L342 HydrophobicContact CB-CD1 4.41Å; A337-L342 HydrophobicContact CB-CD2 4.44Å; T338-L342 WeakPolarHBondContact O-CB 3.22Å; T338-L342 PolarHBondContact O-N 2.94Å; P339-L342 WeakPolarHBondContact O-CB 3.26Å; P339-L342 PolarHBondContact O-N 3.08Å; G340-L342 PolarHBondContact O-N 2.71Å; L342-H345 PolarHBondContact O-N 2.84Å; L342-I346 HydrophobicContact CD1-CD1 4.33Å; L342-I346 HydrophobicContact CG-CD1 4.12Å; L342-I346 WeakPolarHBondContact O-CG1 3.31Å; L342-I346 PolarHBondContact O-N 2.95Å; L342-F352 HydrophobicContact CD1-CE1 4.37Å; L342-F352 HydrophobicContact CD1-CZ 4.04Å; L342-V380 HydrophobicContact CD2-CG2 3.52Å; L342-V380 HydrophobicContact CG-CG2 4.06Å
343	V	94.3	Very high	94	Very high	26 Å²	26	28 Å²	28	16%	0.158	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-42.7	176	177.6	0	0	0	0	111	P339 G340 R341 H345 I346 D347 W376	P339-V343 WeakPolarHBondContact O-CG2 3.22Å; P339-V343 PolarHBondContact O-N 2.89Å; G340-V343 PolarHBondContact O-N 2.93Å; R341-V343 VanDerWaalsContact C-N 3.32Å; V343-H345 PolarHBondContact O-N 3.17Å; V343-I346 PolarHBondContact O-N 3.36Å; V343-I346 VanDerWaalsContact O-N 3.17Å; V343-D347 PolarHBondContact O-N 2.88Å; V343-W376 HydrophobicContact CG2-CB 3.8Å
344	D	94.6	Very high	93.8	Very high	57 Å²	57	28.1 Å²	28.1	31%	0.305	17%	0.165	S	C	.	.	H	α-helix	trans	-54.9	-40.5	173.5	-62.1	-24.8	0	0	0	111.8	G340 R341 D347 Q348	G340-D344 PolarHBondContact O-N 3.4Å; G340-D344 VanDerWaalsContact O-N 3.09Å; R341-D344 IonicContact NH1-OD2 3.08Å; R341-D344 WeakPolarHBondContact O-CB 3.39Å; R341-D344 PolarHBondContact O-N 3.22Å; D344-D347 PolarHBondContact O-N 3.43Å; D344-Q348 WeakPolarHBondContact O-CA 3.45Å; D344-Q348 WeakPolarHBondContact O-CB 3.32Å; D344-Q348 WeakPolarHBondContact O-CG 3.45Å; D344-Q348 PolarHBondContact O-N 3.33Å
345	H	95.6	Very high	93.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-71.1	-39.8	179.1	-82.9	-69.5	0	0	0	113	I307 L313 E316 R341 L342 V343 D347 T349 F352	I307-H345 HydrophobicContact CD1-CB 4.46Å; L313-H345 WeakPolarHBondContact CD1-CE1 3.34Å; E316-H345 IonicContact OE2-NE2 3.58Å; E316-H345 PolarHBondContact OE2-NE2 3.32Å; R341-H345 PolarHBondContact NE-NE2 2.95Å; R341-H345 PolarHBondContact O-CD2 3.23Å; R341-H345 VanDerWaalsContact O-CD2 3.28Å; R341-H345 PolarHBondContact O-N 3.18Å; R341-H345 VanDerWaalsContact O-N 3.13Å; L342-H345 PolarHBondContact O-N 2.84Å; V343-H345 PolarHBondContact O-N 3.17Å; H345-D347 PolarHBondContact O-N 3.24Å; H345-T349 WeakPolarHBondContact CA-OG1 3.39Å; H345-T349 PolarHBondContact ND1-OG1 3.37Å; H345-T349 WeakPolarHBondContact O-CB 3.4Å; H345-T349 PolarHBondContact O-N 2.95Å; H345-T349 VanDerWaalsContact O-N 3.08Å; H345-T349 PolarHBondContact O-OG1 3.36Å; H345-F352 HydrophobicContact CB-CD2 4.49Å; H345-F352 HydrophobicContact CB-CE2 4.44Å; H345-F352 HydrophobicContact CB-CZ 4.49Å
346	I	94.1	Very high	92.8	Very high	30 Å²	30	31.2 Å²	31.2	15%	0.154	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-40.9	173.1	-69.4	163	0	0	0	110.5	L342 V343 F352 L354 V380 A383	L342-I346 HydrophobicContact CD1-CD1 4.33Å; L342-I346 HydrophobicContact CG-CD1 4.12Å; L342-I346 WeakPolarHBondContact O-CG1 3.31Å; L342-I346 PolarHBondContact O-N 2.95Å; V343-I346 PolarHBondContact O-N 3.36Å; V343-I346 VanDerWaalsContact O-N 3.17Å; I346-F352 HydrophobicContact CG1-CD1 4.12Å; I346-F352 HydrophobicContact CG1-CE1 3.73Å; I346-L354 HydrophobicContact CD1-CD1 4.17Å; I346-L354 HydrophobicContact CG1-CD1 4.24Å; I346-V380 HydrophobicContact CD1-CG2 3.8Å; I346-A383 HydrophobicContact CD1-CB 4.43Å; I346-A383 HydrophobicContact CG1-CB 4.46Å; I346-A383 HydrophobicContact CG2-CB 3.99Å
347	D	92.6	Very high	92.5	Very high	82 Å²	82	31.2 Å²	31.2	44%	0.439	18%	0.18	S	C	.	.	H	α-helix	trans	-87	-34.6	-172.8	-66.4	-13.1	0	0	0	113.5	V343 D344 H345 R379	V343-D347 PolarHBondContact O-N 2.88Å; D344-D347 PolarHBondContact O-N 3.43Å; H345-D347 PolarHBondContact O-N 3.24Å; D347-R379 VanDerWaalsContact CG-NH2 3.33Å; D347-R379 IonicContact OD1-CZ 2.8Å; D347-R379 IonicContact OD1-NE 2.65Å; D347-R379 IonicContact OD1-NH2 2.63Å; D347-R379 PolarHBondContact OD1-NH2 2.98Å; D347-R379 IonicContact OD2-NH2 3.58Å; D347-R379 PolarHBondContact OD2-NH2 2.99Å
348	Q	94.6	Very high	92.1	Very high	112 Å²	112	31.4 Å²	31.4	52%	0.523	18%	0.18	S	C	.	.	H	α-helix	trans	-117.3	-1.5	-166.6	-55.3	174.6	29.7	0	0	114.2	L313 Q317 D344 P350	L313-Q348 HydrophobicContact CD2-CB 4.12Å; L313-Q348 VanDerWaalsContact CD2-OE1 3.29Å; Q317-Q348 PolarHBondContact NE2-O 3.21Å; D344-Q348 WeakPolarHBondContact O-CA 3.45Å; D344-Q348 WeakPolarHBondContact O-CB 3.32Å; D344-Q348 WeakPolarHBondContact O-CG 3.45Å; D344-Q348 PolarHBondContact O-N 3.33Å; Q348-P350 WeakPolarHBondContact O-CD 3.23Å
349	T	94.1	Very high	92.1	Very high	9 Å²	9	30.9 Å²	30.9	6%	0.055	18%	0.177	C	C	.	.			trans	-106.6	104.5	-179.5	-52.1	0	0	0	0	111.3	Q317 V321 H345 G351 F352	Q317-T349 HydrophobicContact CB-CG2 4.1Å; Q317-T349 HydrophobicContact CG-CG2 3.67Å; Q317-T349 WeakPolarHBondContact CG-OG1 3.39Å; Q317-T349 PolarHBondContact NE2-OG1 3.17Å; V321-T349 HydrophobicContact CG2-CG2 4.15Å; H345-T349 WeakPolarHBondContact CA-OG1 3.39Å; H345-T349 PolarHBondContact ND1-OG1 3.37Å; H345-T349 WeakPolarHBondContact O-CB 3.4Å; H345-T349 PolarHBondContact O-N 2.95Å; H345-T349 VanDerWaalsContact O-N 3.08Å; H345-T349 PolarHBondContact O-OG1 3.36Å; T349-G351 PolarHBondContact O-N 3.47Å; T349-F352 HydrophobicContact CG2-CB 3.9Å; T349-F352 WeakPolarHBondContact O-CB 3.3Å; T349-F352 PolarHBondContact O-N 3.16Å; T349-F352 VanDerWaalsContact O-N 3.17Å
350	P	90.3	Very high	92.3	Very high	75 Å²	75	30.3 Å²	30.3	49%	0.487	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	131.9	174.4	-22.4	33.7	0	0	0	111.1	Y328 Q348 F352	Y328-P350 HydrophobicContact CE1-CB 3.96Å; Y328-P350 HydrophobicContact CE2-CB 3.92Å; Y328-P350 VanDerWaalsContact CZ-CB 3.47Å; Y328-P350 WeakPolarHBondContact OH-CB 3.37Å; Q348-P350 WeakPolarHBondContact O-CD 3.23Å; P350-F352 VanDerWaalsContact C-N 3.29Å; P350-F352 PolarHBondContact O-N 3.09Å
351	G	87.2	Confident	92.6	Very high	30 Å²	30	28.6 Å²	28.6	31%	0.309	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	4.8	179.8	0	0	0	0	0	115.5	T349 N353	T349-G351 PolarHBondContact O-N 3.47Å; G351-N353 PolarHBondContact O-N 2.74Å
352	F	92.6	Very high	92.6	Very high	23 Å²	23	27 Å²	27	10%	0.101	15%	0.149	C	C	.	.			trans	-75.5	109.5	169.3	-175.7	-94.5	0	0	0	109.7	I274 L320 V321 L342 H345 I346 T349 P350 L354	I274-F352 HydrophobicContact CD1-CD2 3.91Å; I274-F352 HydrophobicContact CD1-CE2 3.48Å; I274-F352 VanDerWaalsContact CD1-CE2 3.48Å; I274-F352 HydrophobicContact CD1-CZ 3.96Å; L320-F352 HydrophobicContact CD1-CD2 3.86Å; L320-F352 HydrophobicContact CD1-CE2 3.81Å; L320-F352 HydrophobicContact CD2-CE2 4.29Å; V321-F352 HydrophobicContact CG2-CB 4.47Å; L342-F352 HydrophobicContact CD1-CE1 4.37Å; L342-F352 HydrophobicContact CD1-CZ 4.04Å; H345-F352 HydrophobicContact CB-CD2 4.49Å; H345-F352 HydrophobicContact CB-CE2 4.44Å; H345-F352 HydrophobicContact CB-CZ 4.49Å; I346-F352 HydrophobicContact CG1-CD1 4.12Å; I346-F352 HydrophobicContact CG1-CE1 3.73Å; T349-F352 HydrophobicContact CG2-CB 3.9Å; T349-F352 WeakPolarHBondContact O-CB 3.3Å; T349-F352 PolarHBondContact O-N 3.16Å; T349-F352 VanDerWaalsContact O-N 3.17Å; P350-F352 VanDerWaalsContact C-N 3.29Å; P350-F352 PolarHBondContact O-N 3.09Å; F352-L354 HydrophobicContact CD1-CG 4.48Å; F352-L354 HydrophobicContact CE1-CD1 3.98Å; F352-L354 HydrophobicContact CE1-CD2 3.89Å; F352-L354 HydrophobicContact CE1-CG 3.79Å; F352-L354 HydrophobicContact CZ-CD2 3.93Å; F352-L354 HydrophobicContact CZ-CG 4.35Å
353	N	89.1	Confident	92.5	Very high	46 Å²	46	27.3 Å²	27.3	25%	0.246	15%	0.151	C	C	.	.			trans	-124.8	130.9	-171.6	-174.3	-21.8	0	0	0	111.3	G351 Q355	G351-N353 PolarHBondContact O-N 2.74Å; N353-Q355 PolarHBondContact ND2-OE1 2.78Å; N353-Q355 WeakPolarHBondContact OD1-CB 3.29Å; N353-Q355 WeakPolarHBondContact OD1-CG 3.47Å; N353-Q355 PolarHBondContact OD1-N 3.48Å; N353-Q355 PolarHBondContact OD1-OE1 2.9Å
354	L	92	Very high	92.3	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.147	C	C	.	.			trans	-112.3	7.9	178.8	-63.2	-178.5	0	0	0	114	I274 L277 I346 F352 Q356 L357 V380 A383 A384	I274-L354 HydrophobicContact CB-CD2 4.21Å; I274-L354 HydrophobicContact CD1-CD2 4.17Å; I274-L354 HydrophobicContact CG2-CD2 3.73Å; L277-L354 HydrophobicContact CD2-CD1 4.28Å; I346-L354 HydrophobicContact CD1-CD1 4.17Å; I346-L354 HydrophobicContact CG1-CD1 4.24Å; F352-L354 HydrophobicContact CD1-CG 4.48Å; F352-L354 HydrophobicContact CE1-CD1 3.98Å; F352-L354 HydrophobicContact CE1-CD2 3.89Å; F352-L354 HydrophobicContact CE1-CG 3.79Å; F352-L354 HydrophobicContact CZ-CD2 3.93Å; F352-L354 HydrophobicContact CZ-CG 4.35Å; L354-Q356 PolarHBondContact O-N 2.99Å; L354-L357 HydrophobicContact CB-CB 4.45Å; L354-L357 WeakPolarHBondContact O-CB 3.4Å; L354-L357 PolarHBondContact O-N 3.38Å; L354-V380 HydrophobicContact CD1-CG1 4.32Å; L354-A383 HydrophobicContact CD1-CB 4.12Å; L354-A384 HydrophobicContact CB-CB 4.34Å; L354-A384 WeakPolarHBondContact O-CA 3.45Å
355	Q	87.1	Confident	91.9	Very high	21 Å²	21	24.2 Å²	24.2	10%	0.098	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-35.1	177.6	-70	166.4	-13.2	0	0	111.8	N353 L357 Q386 M415	N353-Q355 PolarHBondContact ND2-OE1 2.78Å; N353-Q355 WeakPolarHBondContact OD1-CB 3.29Å; N353-Q355 WeakPolarHBondContact OD1-CG 3.47Å; N353-Q355 PolarHBondContact OD1-N 3.48Å; N353-Q355 PolarHBondContact OD1-OE1 2.9Å; Q355-L357 VanDerWaalsContact C-N 3.26Å; Q355-L357 PolarHBondContact O-N 3.24Å; Q355-Q386 WeakPolarHBondContact CG-O 3.31Å; Q355-Q386 PolarHBondContact NE2-O 3.21Å; Q355-M415 WeakPolarHBondContact O-CE 3.36Å
356	Q	87.4	Confident	91.3	Very high	45 Å²	45	24.3 Å²	24.3	21%	0.21	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	8.7	178.5	-60.5	-59.5	-39.4	0	0	113.9	H273 I274 R275 L354 R358 M415	H273-Q356 HydrophobicContact CB-CB 3.76Å; H273-Q356 HydrophobicContact CB-CG 4.05Å; I274-Q356 CarbonylContact O-C 3.51Å; I274-Q356 VanDerWaalsContact O-C 3.3Å; R275-Q356 WeakPolarHBondContact CA-O 3.49Å; R275-Q356 WeakPolarHBondContact CG-O 3.4Å; L354-Q356 PolarHBondContact O-N 2.99Å; Q356-R358 PolarHBondContact O-N 3.43Å; Q356-M415 HydrophobicContact CB-CE 4.4Å; Q356-M415 WeakPolarHBondContact O-CE 3.49Å; Q356-M415 VanDerWaalsContact O-SD 3.37Å
357	L	91.3	Very high	90.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.			trans	-69.9	110.7	-177.5	-175.3	66.4	0	0	0	112.8	I274 L277 L354 Q355 F359 L360 A384 R399 L417	I274-L357 HydrophobicContact CG2-CD1 4.37Å; I274-L357 WeakPolarHBondContact O-CA 3.44Å; I274-L357 PolarHBondContact O-N 3.07Å; L277-L357 HydrophobicContact CB-CD1 3.49Å; L277-L357 VanDerWaalsContact CB-CD1 3.49Å; L277-L357 HydrophobicContact CB-CD2 4.2Å; L277-L357 HydrophobicContact CB-CG 4.49Å; L277-L357 HydrophobicContact CD2-CD2 4.25Å; L354-L357 HydrophobicContact CB-CB 4.45Å; L354-L357 WeakPolarHBondContact O-CB 3.4Å; L354-L357 PolarHBondContact O-N 3.38Å; Q355-L357 VanDerWaalsContact C-N 3.26Å; Q355-L357 PolarHBondContact O-N 3.24Å; L357-F359 WeakPolarHBondContact CD1-O 3.38Å; L357-L360 HydrophobicContact CD2-CB 4.49Å; L357-A384 HydrophobicContact CD2-CB 4.27Å; L357-R399 PolarHBondContact O-NH1 2.95Å; L357-R399 PolarHBondContact O-NH2 2.81Å; L357-L417 HydrophobicContact CB-CD1 4.34Å; L357-L417 HydrophobicContact CD2-CD1 3.75Å; L357-L417 HydrophobicContact CG-CD1 3.75Å; L357-L417 WeakPolarHBondContact O-CD1 3.36Å
358	R	89.3	Confident	90.2	Very high	3 Å²	3	21.5 Å²	21.5	1%	0.011	12%	0.115	C	C	.	.			trans	-87.2	-42.8	176.3	178.5	69.6	-176.5	81	12.3	112.8	S227 R275 Q356 P416 Q418	S227-R358 PolarHBondContact O-NH2 3.11Å; S227-R358 VanDerWaalsContact O-NH2 3.11Å; R275-R358 WeakPolarHBondContact O-CA 3.41Å; R275-R358 WeakPolarHBondContact O-CB 3.29Å; R275-R358 PolarHBondContact O-N 3.25Å; Q356-R358 PolarHBondContact O-N 3.43Å; R358-P416 WeakPolarHBondContact CD-O 3.4Å; R358-P416 PolarHBondContact NH1-O 3.31Å; R358-Q418 VanDerWaalsContact NH1-CB 3.28Å; R358-Q418 PolarHBondContact O-N 3.25Å
359	F	94.4	Very high	89.7	Confident	4 Å²	4	16.3 Å²	16.3	2%	0.018	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125	-174.4	-58.3	-72.5	0	0	0	111.5	V262 A265 R275 A276 L277 L357 L420	V262-F359 HydrophobicContact CG1-CD2 4.36Å; V262-F359 HydrophobicContact CG2-CB 4.35Å; V262-F359 HydrophobicContact CG2-CD2 4.12Å; V262-F359 HydrophobicContact CG2-CG 4.09Å; A265-F359 HydrophobicContact CB-CE2 3.83Å; A265-F359 HydrophobicContact CB-CZ 3.91Å; R275-F359 PolarHBondContact O-N 3.27Å; A276-F359 WeakPolarHBondContact CA-O 3.46Å; A276-F359 HydrophobicContact CB-CB 4.31Å; L277-F359 PolarHBondContact N-O 3.15Å; L357-F359 WeakPolarHBondContact CD1-O 3.38Å; F359-L420 HydrophobicContact CD1-CD1 4.21Å
360	L	96.5	Very high	88.9	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	103	168	176.2	60.2	0	0	0	109.3	L277 V279 L357 I362 L377 V380 L417 Q418 K419 L420	L277-L360 HydrophobicContact CB-CD1 4.17Å; L277-L360 HydrophobicContact CD2-CD1 3.93Å; L277-L360 HydrophobicContact CG-CD1 4.1Å; L277-L360 CarbonylContact O-C 3.47Å; L277-L360 WeakPolarHBondContact O-CA 3.31Å; V279-L360 HydrophobicContact CG2-CD1 3.94Å; L357-L360 HydrophobicContact CD2-CB 4.49Å; L360-I362 HydrophobicContact CG-CG1 4.4Å; L360-L377 HydrophobicContact CD2-CD1 3.64Å; L360-V380 HydrophobicContact CD1-CG1 4.31Å; L360-V380 HydrophobicContact CD2-CG1 4.35Å; L360-L417 HydrophobicContact CB-CD1 4.06Å; L360-Q418 PolarHBondContact N-O 2.97Å; L360-K419 HydrophobicContact CB-CG 4.48Å; L360-K419 HydrophobicContact CD2-CD 4.32Å; L360-K419 HydrophobicContact CD2-CG 4.32Å; L360-K419 CarbonylContact O-C 3.26Å; L360-K419 WeakPolarHBondContact O-CA 3.37Å; L360-L420 PolarHBondContact O-N 3.19Å
361	V	97.4	Very high	87.9	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.3	178.3	-174.2	0	0	0	0	109.3	F258 L277 V278 V279 L420 F422	F258-V361 HydrophobicContact CD1-CG1 4.05Å; F258-V361 HydrophobicContact CD2-CG1 4.01Å; F258-V361 HydrophobicContact CD2-CG2 4.31Å; F258-V361 HydrophobicContact CE1-CG1 4.16Å; F258-V361 HydrophobicContact CE2-CG1 4.17Å; F258-V361 HydrophobicContact CG-CG1 3.96Å; F258-V361 HydrophobicContact CZ-CG1 4.24Å; L277-V361 PolarHBondContact O-N 3.01Å; V278-V361 WeakPolarHBondContact CA-O 3.08Å; V278-V361 HydrophobicContact CB-CB 4.27Å; V278-V361 HydrophobicContact CG1-CB 3.98Å; V278-V361 HydrophobicContact CG1-CG1 4.04Å; V278-V361 HydrophobicContact CG2-CB 4.04Å; V278-V361 HydrophobicContact CG2-CG2 4.16Å; V279-V361 PolarHBondContact N-O 2.96Å; V361-L420 CarbonylContact C-O 3.41Å; V361-L420 WeakPolarHBondContact CA-O 3.17Å; V361-L420 HydrophobicContact CG2-CB 4.28Å; V361-L420 HydrophobicContact CG2-CD1 4.11Å; V361-F422 HydrophobicContact CG1-CD2 3.92Å; V361-F422 HydrophobicContact CG1-CE2 4.15Å
362	I	95.5	Very high	87	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	102.5	173.3	-51.9	178.9	0	0	0	107	L360 A365 M368 W376 L377 L420 F422 L436	L360-I362 HydrophobicContact CG-CG1 4.4Å; I362-A365 HydrophobicContact CG2-CB 3.96Å; I362-M368 HydrophobicContact CG2-CB 3.83Å; I362-M368 HydrophobicContact CG2-CE 4.37Å; I362-M368 HydrophobicContact CG2-CG 3.84Å; I362-W376 HydrophobicContact CD1-CH2 3.99Å; I362-W376 HydrophobicContact CD1-CZ2 4.4Å; I362-W376 HydrophobicContact CG1-CH2 4.16Å; I362-L377 HydrophobicContact CD1-CD1 4.29Å; I362-L420 PolarHBondContact N-O 3.04Å; I362-F422 PolarHBondContact O-N 3.42Å; I362-L436 HydrophobicContact CD1-CD2 4.22Å
363	D	93.1	Very high	85.4	Confident	7 Å²	7	23.3 Å²	23.3	4%	0.037	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	150.2	177.2	-164.5	14.4	0	0	0	110.7	V279 L280 P281 A365 F422	V279-D363 PolarHBondContact O-N 3.38Å; L280-D363 HydrophobicContact CD2-CB 3.94Å; L280-D363 HydrophobicContact CG-CB 4.24Å; P281-D363 WeakPolarHBondContact CD-O 3.43Å; D363-A365 PolarHBondContact O-N 2.99Å; D363-F422 CarbonylContact C-O 3.43Å; D363-F422 WeakPolarHBondContact OD1-CB 3.46Å
364	E	88.7	Confident	84.2	Confident	18 Å²	18	27.8 Å²	27.8	8%	0.084	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	44.8	-165.3	-63.7	-97.7	-179.6	0	0	111.2	P281 L285 D366 R367 M368 F422	P281-E364 HydrophobicContact CG-CB 3.69Å; P281-E364 HydrophobicContact CG-CG 4.34Å; L285-E364 HydrophobicContact CD2-CG 3.61Å; E364-D366 PolarHBondContact O-N 3.49Å; E364-D366 VanDerWaalsContact O-N 3.08Å; E364-R367 PolarHBondContact O-N 3.22Å; E364-M368 PolarHBondContact O-N 2.8Å; E364-F422 PolarHBondContact N-O 3.2Å
365	A	87	Confident	83.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55.3	-31.9	-171	0	0	0	0	0	113.4	I362 D363 R367 M368 I369 L421 F422	I362-A365 HydrophobicContact CG2-CB 3.96Å; D363-A365 PolarHBondContact O-N 2.99Å; A365-R367 VanDerWaalsContact C-N 3.3Å; A365-R367 PolarHBondContact O-N 3.48Å; A365-M368 WeakPolarHBondContact O-CB 3.41Å; A365-M368 PolarHBondContact O-N 3.38Å; A365-M368 VanDerWaalsContact O-N 3.15Å; A365-I369 WeakPolarHBondContact O-CB 3.45Å; A365-I369 WeakPolarHBondContact O-CD1 3.44Å; A365-I369 WeakPolarHBondContact O-CG1 3.47Å; A365-I369 PolarHBondContact O-N 3.4Å; A365-L421 HydrophobicContact CB-CB 4.27Å; A365-L421 HydrophobicContact CB-CD2 4.42Å; A365-F422 PolarHBondContact N-O 2.91Å
366	D	82.6	Confident	83.8	Confident	2 Å²	2	30 Å²	30	1%	0.011	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-36.2	175.5	61.5	-54.3	0	0	0	112.9	E364 S423 T425 R579 H583	E364-D366 PolarHBondContact O-N 3.49Å; E364-D366 VanDerWaalsContact O-N 3.08Å; D366-S423 VanDerWaalsContact CB-OG 3.28Å; D366-S423 WeakPolarHBondContact CB-OG 3.5Å; D366-S423 PolarHBondContact OD1-OG 3.07Å; D366-T425 WeakPolarHBondContact CB-O 3.32Å; D366-R579 PolarHBondContact O-NH2 3.46Å; D366-R579 IonicContact OD2-CZ 2.73Å; D366-R579 IonicContact OD2-NE 2.79Å; D366-R579 PolarHBondContact OD2-NE 3.49Å; D366-R579 IonicContact OD2-NH2 3.22Å; D366-R579 PolarHBondContact OD2-NH2 3.18Å; D366-H583 IonicContact OD2-CE1 3.77Å; D366-H583 PolarHBondContact OD2-CE1 3.35Å; D366-H583 VanDerWaalsContact OD2-CE1 3.22Å; D366-H583 IonicContact OD2-NE2 2.93Å
367	R	80.7	Confident	83.9	Confident	50 Å²	50	28.1 Å²	28.1	19%	0.189	14%	0.143	C	C	.	.	H	α-helix	trans	-77.3	-37.3	173.7	-56.6	-166.1	89.3	-175.8	15.7	111.1	P281 E364 A365 I369 D370 S371 R559	P281-R367 HydrophobicContact CB-CB 4.28Å; P281-R367 HydrophobicContact CG-CB 4.4Å; E364-R367 PolarHBondContact O-N 3.22Å; A365-R367 VanDerWaalsContact C-N 3.3Å; A365-R367 PolarHBondContact O-N 3.48Å; R367-I369 VanDerWaalsContact C-N 3.28Å; R367-I369 PolarHBondContact O-N 2.88Å; R367-D370 PolarHBondContact O-N 3.05Å; R367-S371 PolarHBondContact O-N 2.92Å; R367-S371 VanDerWaalsContact O-N 3.13Å; R367-S371 PolarHBondContact O-OG 3.46Å; R367-R559 VanDerWaalsContact CZ-NH1 3.26Å
368	M	84.3	Confident	83.9	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.015	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-40.1	179.7	-63.8	-68.2	-67.7	0	0	111	V279 P281 P339 I362 E364 A365 S371 M372 W376	V279-M368 HydrophobicContact CB-CE 4.25Å; V279-M368 HydrophobicContact CG1-CE 3.66Å; P281-M368 VanDerWaalsContact CA-SD 3.58Å; P281-M368 HydrophobicContact CB-CG 4.43Å; P281-M368 HydrophobicContact CB-SD 3.72Å; P281-M368 HydrophobicContact CG-SD 4.35Å; P339-M368 HydrophobicContact CB-CE 4.48Å; P339-M368 HydrophobicContact CG-CE 3.23Å; P339-M368 HydrophobicContact CG-SD 3.87Å; I362-M368 HydrophobicContact CG2-CB 3.83Å; I362-M368 HydrophobicContact CG2-CE 4.37Å; I362-M368 HydrophobicContact CG2-CG 3.84Å; E364-M368 PolarHBondContact O-N 2.8Å; A365-M368 WeakPolarHBondContact O-CB 3.41Å; A365-M368 PolarHBondContact O-N 3.38Å; A365-M368 VanDerWaalsContact O-N 3.15Å; M368-S371 WeakPolarHBondContact CA-OG 3.27Å; M368-S371 CarbonylContact O-C 3.53Å; M368-S371 PolarHBondContact O-N 3.15Å; M368-S371 VanDerWaalsContact O-N 3.14Å; M368-S371 PolarHBondContact O-OG 3.11Å; M368-M372 WeakPolarHBondContact O-CG 3.46Å; M368-M372 PolarHBondContact O-N 3.19Å; M368-M372 VanDerWaalsContact O-N 3.09Å; M368-W376 HydrophobicContact CE-CH2 3.91Å; M368-W376 HydrophobicContact CE-CZ2 3.25Å
369	I	83.7	Confident	84	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-44.8	174.4	-69	161.5	0	0	0	111.3	A365 R367 S371 M372 T427 K432 L436	A365-I369 WeakPolarHBondContact O-CB 3.45Å; A365-I369 WeakPolarHBondContact O-CD1 3.44Å; A365-I369 WeakPolarHBondContact O-CG1 3.47Å; A365-I369 PolarHBondContact O-N 3.4Å; R367-I369 VanDerWaalsContact C-N 3.28Å; R367-I369 PolarHBondContact O-N 2.88Å; I369-S371 PolarHBondContact O-N 3.41Å; I369-M372 HydrophobicContact CB-SD 4.22Å; I369-M372 HydrophobicContact CG1-SD 4.06Å; I369-M372 HydrophobicContact CG2-SD 4.33Å; I369-M372 VanDerWaalsContact O-CB 3.3Å; I369-M372 WeakPolarHBondContact O-CB 3.47Å; I369-M372 PolarHBondContact O-N 2.99Å; I369-T427 HydrophobicContact CD1-CG2 3.94Å; I369-T427 HydrophobicContact CG2-CG2 4.49Å; I369-K432 HydrophobicContact CG2-CB 3.7Å; I369-K432 HydrophobicContact CG2-CD 3.95Å; I369-K432 HydrophobicContact CG2-CG 4.08Å; I369-L436 HydrophobicContact CD1-CD1 3.81Å; I369-L436 HydrophobicContact CG1-CD1 4.08Å; I369-L436 HydrophobicContact CG1-CD2 4.11Å; I369-L436 HydrophobicContact CG1-CG 4.32Å
370	D	76.1	Confident	83.9	Confident	64 Å²	64	37.1 Å²	37.1	34%	0.342	19%	0.187	S	C	.	.	H	α-helix	trans	-64.7	-24.8	177.1	-66.2	-35	0	0	0	112	R367 H373 K432 R579	R367-D370 PolarHBondContact O-N 3.05Å; D370-H373 PolarHBondContact O-CD2 2.87Å; D370-K432 IonicContact OD1-NZ 2.7Å; D370-K432 PolarHBondContact OD1-NZ 2.91Å; D370-R579 IonicContact OD2-CZ 3.76Å; D370-R579 IonicContact OD2-NH1 3.65Å; D370-R579 PolarHBondContact OD2-NH1 3.39Å; D370-R579 IonicContact OD2-NH2 3.41Å; D370-R579 PolarHBondContact OD2-NH2 3.43Å
371	S	69.4	Low	83.6	Confident	38 Å²	38	39 Å²	39	27%	0.266	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1	174.5	70.3	0	0	0	0	115	R367 M368 I369 H373 Q374	R367-S371 PolarHBondContact O-N 2.92Å; R367-S371 VanDerWaalsContact O-N 3.13Å; R367-S371 PolarHBondContact O-OG 3.46Å; M368-S371 WeakPolarHBondContact CA-OG 3.27Å; M368-S371 CarbonylContact O-C 3.53Å; M368-S371 PolarHBondContact O-N 3.15Å; M368-S371 VanDerWaalsContact O-N 3.14Å; M368-S371 PolarHBondContact O-OG 3.11Å; I369-S371 PolarHBondContact O-N 3.41Å; S371-H373 PolarHBondContact O-N 2.62Å; S371-Q374 PolarHBondContact O-N 3.46Å; S371-Q374 VanDerWaalsContact O-N 3.13Å
372	M	68.9	Low	83.2	Confident	16 Å²	16	41.2 Å²	41.2	8%	0.079	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-62.4	-13.9	-176.4	-85.4	173.2	127.1	0	0	114.2	M368 I369 Q374 S375 L377 Q435 L436	M368-M372 WeakPolarHBondContact O-CG 3.46Å; M368-M372 PolarHBondContact O-N 3.19Å; M368-M372 VanDerWaalsContact O-N 3.09Å; I369-M372 HydrophobicContact CB-SD 4.22Å; I369-M372 HydrophobicContact CG1-SD 4.06Å; I369-M372 HydrophobicContact CG2-SD 4.33Å; I369-M372 VanDerWaalsContact O-CB 3.3Å; I369-M372 WeakPolarHBondContact O-CB 3.47Å; I369-M372 PolarHBondContact O-N 2.99Å; M372-Q374 PolarHBondContact O-N 3.42Å; M372-S375 PolarHBondContact O-N 3.25Å; M372-L377 HydrophobicContact CE-CB 4.18Å; M372-L377 HydrophobicContact CE-CD2 3.33Å; M372-L377 HydrophobicContact CE-CG 4.38Å; M372-Q435 HydrophobicContact CE-CB 4Å; M372-Q435 WeakPolarHBondContact CE-O 3.5Å; M372-Q435 HydrophobicContact SD-CB 3.82Å; M372-L436 HydrophobicContact CE-CB 4.47Å; M372-L436 HydrophobicContact CE-CD2 3.38Å; M372-L436 HydrophobicContact CE-CG 3.86Å; M372-L436 HydrophobicContact SD-CD2 4.09Å; M372-L436 HydrophobicContact SD-CG 4.38Å
373	H	58.4	Low	82.9	Confident	166 Å²	166	41.5 Å²	41.5	77%	0.769	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-54.9	-19.4	170.3	-62.4	-67.8	0	0	0	113.9	D370 S371 S375	D370-H373 PolarHBondContact O-CD2 2.87Å; S371-H373 PolarHBondContact O-N 2.62Å; H373-S375 VanDerWaalsContact C-N 3.27Å; H373-S375 PolarHBondContact O-N 2.97Å
374	Q	64.3	Low	82.7	Confident	139 Å²	139	41.2 Å²	41.2	65%	0.65	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-83	3.6	174.5	-63.2	-179.1	0.4	0	0	113.8	S371 M372 W376	S371-Q374 PolarHBondContact O-N 3.46Å; S371-Q374 VanDerWaalsContact O-N 3.13Å; M372-Q374 PolarHBondContact O-N 3.42Å; Q374-W376 PolarHBondContact O-N 3.48Å
375	S	80.3	Confident	82.6	Confident	68 Å²	68	42.4 Å²	42.4	48%	0.476	22%	0.223	S	C	.	.			trans	52.1	26.2	174.1	-61.2	0	0	0	0	115.6	M372 H373 P378 R379	M372-S375 PolarHBondContact O-N 3.25Å; H373-S375 VanDerWaalsContact C-N 3.27Å; H373-S375 PolarHBondContact O-N 2.97Å; S375-P378 WeakPolarHBondContact O-CD 3.26Å; S375-R379 WeakPolarHBondContact O-CG 3.28Å; S375-R379 PolarHBondContact O-N 3.45Å
376	W	89.6	Confident	81.9	Confident	3 Å²	3	47.1 Å²	47.1	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-40.1	-177.7	73.3	-94.3	0	0	0	112.3	V279 P339 V343 I362 M368 Q374 R379 V380	V279-W376 HydrophobicContact CB-CH2 4.08Å; V279-W376 HydrophobicContact CB-CZ3 4.18Å; V279-W376 HydrophobicContact CG1-CE3 4.38Å; V279-W376 HydrophobicContact CG1-CH2 4.03Å; V279-W376 HydrophobicContact CG1-CZ3 3.95Å; V279-W376 HydrophobicContact CG2-CH2 4.2Å; V279-W376 HydrophobicContact CG2-CZ3 3.9Å; P339-W376 HydrophobicContact CB-CB 4.05Å; P339-W376 HydrophobicContact CB-CD2 3.94Å; P339-W376 HydrophobicContact CB-CG 3.66Å; P339-W376 HydrophobicContact CG-CD2 4.29Å; P339-W376 HydrophobicContact CG-CG 4.4Å; V343-W376 HydrophobicContact CG2-CB 3.8Å; I362-W376 HydrophobicContact CD1-CH2 3.99Å; I362-W376 HydrophobicContact CD1-CZ2 4.4Å; I362-W376 HydrophobicContact CG1-CH2 4.16Å; M368-W376 HydrophobicContact CE-CH2 3.91Å; M368-W376 HydrophobicContact CE-CZ2 3.25Å; Q374-W376 PolarHBondContact O-N 3.48Å; W376-R379 WeakPolarHBondContact O-CB 2.87Å; W376-R379 PolarHBondContact O-N 2.94Å; W376-V380 HydrophobicContact CE3-CG2 3.81Å; W376-V380 HydrophobicContact CZ3-CG2 4.08Å; W376-V380 WeakPolarHBondContact O-CG2 3.26Å; W376-V380 PolarHBondContact O-N 3.41Å
377	L	90.9	Very high	81	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-47	-177.4	177.3	67.2	0	0	0	111.8	L360 I362 M372 R379 V380 V381 L436	L360-L377 HydrophobicContact CD2-CD1 3.64Å; I362-L377 HydrophobicContact CD1-CD1 4.29Å; M372-L377 HydrophobicContact CE-CB 4.18Å; M372-L377 HydrophobicContact CE-CD2 3.33Å; M372-L377 HydrophobicContact CE-CG 4.38Å; L377-R379 VanDerWaalsContact C-N 3.25Å; L377-R379 PolarHBondContact O-N 3.22Å; L377-V380 PolarHBondContact O-N 3.44Å; L377-V381 HydrophobicContact CD1-CG2 3.99Å; L377-V381 HydrophobicContact CG-CG2 4.24Å; L377-V381 WeakPolarHBondContact O-CG2 3.21Å; L377-V381 PolarHBondContact O-N 3.32Å; L377-L436 HydrophobicContact CD2-CD2 4.12Å
378	P	90.3	Very high	79.8	Confident	77 Å²	77	55.6 Å²	55.6	50%	0.5	30%	0.295	S	S	.	.	H	α-helix	trans	-53	-39.6	170.6	-29.6	34.4	0	0	0	113.9	S375 A382	S375-P378 WeakPolarHBondContact O-CD 3.26Å; P378-A382 VanDerWaalsContact O-CB 3.27Å; P378-A382 WeakPolarHBondContact O-CB 3.48Å; P378-A382 PolarHBondContact O-N 2.8Å
379	R	91.4	Very high	78.4	Confident	119 Å²	119	59.7 Å²	59.7	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-44.3	177.1	-63.5	-71.4	-74.8	175.1	-5.2	111.9	D347 S375 W376 L377 A382 A383	D347-R379 VanDerWaalsContact CG-NH2 3.33Å; D347-R379 IonicContact OD1-CZ 2.8Å; D347-R379 IonicContact OD1-NE 2.65Å; D347-R379 IonicContact OD1-NH2 2.63Å; D347-R379 PolarHBondContact OD1-NH2 2.98Å; D347-R379 IonicContact OD2-NH2 3.58Å; D347-R379 PolarHBondContact OD2-NH2 2.99Å; S375-R379 WeakPolarHBondContact O-CG 3.28Å; S375-R379 PolarHBondContact O-N 3.45Å; W376-R379 WeakPolarHBondContact O-CB 2.87Å; W376-R379 PolarHBondContact O-N 2.94Å; L377-R379 VanDerWaalsContact C-N 3.25Å; L377-R379 PolarHBondContact O-N 3.22Å; R379-A382 PolarHBondContact O-N 3.02Å; R379-A383 WeakPolarHBondContact O-CB 3.23Å; R379-A383 PolarHBondContact O-N 2.87Å
380	V	91.9	Very high	77.1	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-63.2	-45.5	176.2	172.9	0	0	0	0	111.3	L277 L342 I346 L354 L360 W376 L377 A383 A384	L277-V380 HydrophobicContact CD2-CG1 3.74Å; L342-V380 HydrophobicContact CD2-CG2 3.52Å; L342-V380 HydrophobicContact CG-CG2 4.06Å; I346-V380 HydrophobicContact CD1-CG2 3.8Å; L354-V380 HydrophobicContact CD1-CG1 4.32Å; L360-V380 HydrophobicContact CD1-CG1 4.31Å; L360-V380 HydrophobicContact CD2-CG1 4.35Å; W376-V380 HydrophobicContact CE3-CG2 3.81Å; W376-V380 HydrophobicContact CZ3-CG2 4.08Å; W376-V380 WeakPolarHBondContact O-CG2 3.26Å; W376-V380 PolarHBondContact O-N 3.41Å; L377-V380 PolarHBondContact O-N 3.44Å; V380-A383 PolarHBondContact O-N 2.89Å; V380-A384 WeakPolarHBondContact O-CB 3.38Å; V380-A384 PolarHBondContact O-N 3.44Å
381	V	90.4	Very high	76	Confident	39 Å²	39	66 Å²	66	24%	0.236	37%	0.369	C	S	.	.	H	α-helix	trans	-63.6	-44.8	176.9	174	0	0	0	0	109.8	L377 A383 A384 F385	L377-V381 HydrophobicContact CD1-CG2 3.99Å; L377-V381 HydrophobicContact CG-CG2 4.24Å; L377-V381 WeakPolarHBondContact O-CG2 3.21Å; L377-V381 PolarHBondContact O-N 3.32Å; V381-A383 PolarHBondContact O-N 3.18Å; V381-A384 PolarHBondContact O-N 2.75Å; V381-A384 VanDerWaalsContact O-N 3.16Å; V381-F385 HydrophobicContact CG1-CD2 3.93Å; V381-F385 HydrophobicContact CG1-CE2 3.88Å; V381-F385 WeakPolarHBondContact O-CD2 3.39Å; V381-F385 PolarHBondContact O-N 3.27Å
382	A	89.4	Confident	75.6	Confident	47 Å²	47	66.8 Å²	66.8	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-57.4	-48.5	175.4	0	0	0	0	0	111.6	P378 R379 A384 F385 Q386	P378-A382 VanDerWaalsContact O-CB 3.27Å; P378-A382 WeakPolarHBondContact O-CB 3.48Å; P378-A382 PolarHBondContact O-N 2.8Å; R379-A382 PolarHBondContact O-N 3.02Å; A382-A384 VanDerWaalsContact C-N 3.26Å; A382-A384 PolarHBondContact O-N 2.65Å; A382-F385 CarbonylContact O-C 3.59Å; A382-F385 PolarHBondContact O-N 2.97Å; A382-Q386 WeakPolarHBondContact O-CG 3.15Å; A382-Q386 PolarHBondContact O-N 3.48Å
383	A	90.1	Very high	75	Confident	7 Å²	7	72 Å²	72	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-60.9	-32.3	177.4	0	0	0	0	0	113.5	I346 L354 R379 V380 V381 F385	I346-A383 HydrophobicContact CD1-CB 4.43Å; I346-A383 HydrophobicContact CG1-CB 4.46Å; I346-A383 HydrophobicContact CG2-CB 3.99Å; L354-A383 HydrophobicContact CD1-CB 4.12Å; R379-A383 WeakPolarHBondContact O-CB 3.23Å; R379-A383 PolarHBondContact O-N 2.87Å; V380-A383 PolarHBondContact O-N 2.89Å; V381-A383 PolarHBondContact O-N 3.18Å; A383-F385 VanDerWaalsContact C-N 3.28Å; A383-F385 PolarHBondContact O-N 2.93Å
384	A	89.2	Confident	74.7	Confident	0 Å²	0	67 Å²	67	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-78.6	-8.8	177.4	0	0	0	0	0	114.2	L354 L357 V380 V381 A382 R399 L417	L354-A384 HydrophobicContact CB-CB 4.34Å; L354-A384 WeakPolarHBondContact O-CA 3.45Å; L357-A384 HydrophobicContact CD2-CB 4.27Å; V380-A384 WeakPolarHBondContact O-CB 3.38Å; V380-A384 PolarHBondContact O-N 3.44Å; V381-A384 PolarHBondContact O-N 2.75Å; V381-A384 VanDerWaalsContact O-N 3.16Å; A382-A384 VanDerWaalsContact C-N 3.26Å; A382-A384 PolarHBondContact O-N 2.65Å; A384-R399 PolarHBondContact O-NH1 3.4Å; A384-L417 HydrophobicContact CB-CD2 4.37Å
385	F	84.9	Confident	74.6	Confident	44 Å²	44	61.4 Å²	61.4	19%	0.193	37%	0.366	C	S	.	.	H	α-helix	trans	-122.9	4.5	179.6	-75.3	-103.6	0	0	0	112.4	V381 A382 A383 S387 R399 R400 Q401 L417	V381-F385 HydrophobicContact CG1-CD2 3.93Å; V381-F385 HydrophobicContact CG1-CE2 3.88Å; V381-F385 WeakPolarHBondContact O-CD2 3.39Å; V381-F385 PolarHBondContact O-N 3.27Å; A382-F385 CarbonylContact O-C 3.59Å; A382-F385 PolarHBondContact O-N 2.97Å; A383-F385 VanDerWaalsContact C-N 3.28Å; A383-F385 PolarHBondContact O-N 2.93Å; F385-S387 PolarHBondContact O-N 3.38Å; F385-R399 HydrophobicContact CD1-CB 4.45Å; F385-R399 HydrophobicContact CD1-CG 3.56Å; F385-R399 HydrophobicContact CE1-CG 3.46Å; F385-R399 VanDerWaalsContact CE1-CG 3.46Å; F385-R399 HydrophobicContact CG-CG 4.22Å; F385-R399 HydrophobicContact CZ-CG 4.05Å; F385-R400 WeakPolarHBondContact CE1-O 3.45Å; F385-Q401 HydrophobicContact CD1-CB 4.27Å; F385-L417 HydrophobicContact CE2-CB 4.49Å; F385-L417 HydrophobicContact CE2-CD2 3.87Å
386	Q	73.8	Confident	73.5	Confident	98 Å²	98	64.9 Å²	64.9	46%	0.458	38%	0.378	S	S	.	.			trans	-67.3	126.6	177	-91.7	166.8	-1.4	0	0	110.5	Q355 A382	Q355-Q386 WeakPolarHBondContact CG-O 3.31Å; Q355-Q386 PolarHBondContact NE2-O 3.21Å; A382-Q386 WeakPolarHBondContact O-CG 3.15Å; A382-Q386 PolarHBondContact O-N 3.48Å
387	S	62.4	Low	72	Confident	78 Å²	78	68.1 Å²	68.1	55%	0.545	40%	0.395	S	S	.	.			trans	-96.6	113	169.5	168	0	0	0	0	107.7	F385	F385-S387 PolarHBondContact O-N 3.38Å
388	E	55.3	Low	70.8	Confident	152 Å²	152	68.9 Å²	68.9	71%	0.71	40%	0.398	S	S	*	.			trans	-88.7	-20.4	-178.7	-71.1	-156.8	145.6	0	0	113.7
389	D	55.9	Low	70.1	Confident	89 Å²	89	66 Å²	66	48%	0.476	38%	0.378	S	S	.	.			trans	-163.8	126.2	175.8	-144.5	-34.5	0	0	0	112.6	A391 D392	D389-A391 PolarHBondContact O-N 3.01Å; D389-A391 PolarHBondContact OD1-N 3.44Å; D389-D392 HydrophobicContact CB-CB 4.48Å; D389-D392 WeakPolarHBondContact O-CB 3.33Å; D389-D392 PolarHBondContact O-N 3.37Å
390	P	55.3	Low	68.9	Low	120 Å²	120	68.3 Å²	68.3	78%	0.779	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.3	170.3	-19	30.7	0	0	0	113.5
391	A	54.1	Low	67.6	Low	81 Å²	81	75.9 Å²	75.9	67%	0.669	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.8	177.6	0	0	0	0	0	114	D389 P393	D389-A391 PolarHBondContact O-N 3.01Å; D389-A391 PolarHBondContact OD1-N 3.44Å; A391-P393 WeakPolarHBondContact O-CD 3.47Å
392	D	61.7	Low	66.1	Low	54 Å²	54	77.6 Å²	77.6	29%	0.289	44%	0.44	S	S	.	.			trans	-65.9	123.3	176.5	178.6	5.6	0	0	0	110.3	D389 C394 A395 Q398	D389-D392 HydrophobicContact CB-CB 4.48Å; D389-D392 WeakPolarHBondContact O-CB 3.33Å; D389-D392 PolarHBondContact O-N 3.37Å; D392-C394 PolarHBondContact O-N 3.06Å; D392-C394 PolarHBondContact OD1-N 3.33Å; D392-A395 WeakPolarHBondContact O-CB 3.5Å; D392-A395 PolarHBondContact O-N 3.32Å; D392-Q398 PolarHBondContact OD2-NE2 2.87Å
393	P	54.5	Low	64.6	Low	125 Å²	125	83 Å²	83	81%	0.812	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-17.5	175.2	20.9	-31.1	0	0	0	113.6	A391	A391-P393 WeakPolarHBondContact O-CD 3.47Å
394	C	53.6	Low	63.4	Low	63 Å²	63	86.2 Å²	86.2	43%	0.426	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.9	172.4	-69.6	0	0	0	0	114.7	D392 L396 L397 Q398	D392-C394 PolarHBondContact O-N 3.06Å; D392-C394 PolarHBondContact OD1-N 3.33Å; C394-L396 PolarHBondContact O-N 3.15Å; C394-L397 PolarHBondContact O-N 3.49Å; C394-Q398 PolarHBondContact O-N 3.29Å
395	A	60.5	Low	62.3	Low	21 Å²	21	92.4 Å²	92.4	17%	0.174	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-26	-179.7	0	0	0	0	0	114.1	D392 L397 Q398	D392-A395 WeakPolarHBondContact O-CB 3.5Å; D392-A395 PolarHBondContact O-N 3.32Å; A395-L397 VanDerWaalsContact C-N 3.32Å; A395-L397 PolarHBondContact O-N 2.65Å; A395-Q398 PolarHBondContact O-N 2.88Å
396	L	57.8	Low	61.6	Low	140 Å²	140	93.6 Å²	93.6	73%	0.733	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.5	175.2	-66.3	176.4	0	0	0	113.7	C394	C394-L396 PolarHBondContact O-N 3.15Å
397	L	59.4	Low	61.3	Low	71 Å²	71	92.9 Å²	92.9	37%	0.372	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-2.1	178.6	-59.8	177.1	0	0	0	112.4	L233 C394 A395	L233-L397 HydrophobicContact CD1-CD2 4.4Å; L233-L397 HydrophobicContact CD2-CD2 3.95Å; C394-L397 PolarHBondContact O-N 3.49Å; A395-L397 VanDerWaalsContact C-N 3.32Å; A395-L397 PolarHBondContact O-N 2.65Å
398	Q	65.8	Low	61.5	Low	20 Å²	20	92.6 Å²	92.6	9%	0.093	55%	0.546	C	S	.	.	S	Bend	trans	-69.9	142.3	178.5	-73.7	175.8	6.2	0	0	111.1	D392 C394 A395 R400	D392-Q398 PolarHBondContact OD2-NE2 2.87Å; C394-Q398 PolarHBondContact O-N 3.29Å; A395-Q398 PolarHBondContact O-N 2.88Å; Q398-R400 PolarHBondContact O-N 2.63Å
399	R	74.1	Confident	61.8	Low	17 Å²	17	87.4 Å²	87.4	6%	0.064	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-74.3	124.2	176.7	-173.5	177.9	-62.2	129.1	0.4	110.1	L357 A384 F385 M415	L357-R399 PolarHBondContact O-NH1 2.95Å; L357-R399 PolarHBondContact O-NH2 2.81Å; A384-R399 PolarHBondContact O-NH1 3.4Å; F385-R399 HydrophobicContact CD1-CB 4.45Å; F385-R399 HydrophobicContact CD1-CG 3.56Å; F385-R399 HydrophobicContact CE1-CG 3.46Å; F385-R399 VanDerWaalsContact CE1-CG 3.46Å; F385-R399 HydrophobicContact CG-CG 4.22Å; F385-R399 HydrophobicContact CZ-CG 4.05Å; R399-M415 PolarHBondContact NE-O 3.15Å; R399-M415 VanDerWaalsContact NH2-CE 3.31Å; R399-M415 PolarHBondContact NH2-O 3.33Å
400	R	66	Low	62.2	Low	167 Å²	167	86.7 Å²	86.7	63%	0.63	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-97.1	149.1	169.8	-61.4	-173.9	178.5	-171	-0.7	109.8	F385 Q398 A402 Q414	F385-R400 WeakPolarHBondContact CE1-O 3.45Å; Q398-R400 PolarHBondContact O-N 2.63Å; R400-A402 PolarHBondContact O-N 3.36Å; R400-Q414 VanDerWaalsContact N-OE1 3.14Å
401	Q	65.5	Low	62.6	Low	161 Å²	161	85.2 Å²	85.2	75%	0.752	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-61.5	139	174.6	-163.3	169.6	14.5	0	0	109.1	F385 Q403	F385-Q401 HydrophobicContact CD1-CB 4.27Å; Q401-Q403 PolarHBondContact O-N 3.07Å
402	A	58.6	Low	63	Low	75 Å²	75	84 Å²	84	62%	0.62	50%	0.503	S	S	*	.			trans	-59.2	111.2	-177.7	0	0	0	0	0	110.1	R400	R400-A402 PolarHBondContact O-N 3.36Å
403	Q	58.5	Low	63.1	Low	159 Å²	159	84.7 Å²	84.7	74%	0.743	51%	0.51	S	S	*	.			trans	-89	179.5	167.2	-66.2	-173.7	-12.3	0	0	109.2	Q401 V405	Q401-Q403 PolarHBondContact O-N 3.07Å; Q403-V405 PolarHBondContact O-N 3.32Å
404	A	65.1	Low	63.8	Low	76 Å²	76	81 Å²	81	63%	0.628	48%	0.482	S	S	*	.	S	Bend	trans	-51.8	136.5	170.6	0	0	0	0	0	109.9	T406	A404-T406 PolarHBondContact O-N 3.48Å
405	V	65.9	Low	64.7	Low	129 Å²	129	78.2 Å²	78.2	78%	0.782	46%	0.463	S	S	*	.			trans	-65.4	100.1	179.5	-177.4	0	0	0	0	108	Q403 T410	Q403-V405 PolarHBondContact O-N 3.32Å; V405-T410 HydrophobicContact CG1-CG2 4.01Å
406	T	69.6	Low	65.7	Low	70 Å²	70	77.7 Å²	77.7	43%	0.429	46%	0.458	S	S	.	.			trans	-119.4	158.3	176.3	57.3	0	0	0	0	108.7	A404 A408 S409 T410	A404-T406 PolarHBondContact O-N 3.48Å; T406-A408 PolarHBondContact O-N 3.25Å; T406-A408 VanDerWaalsContact O-N 3.16Å; T406-S409 WeakPolarHBondContact O-CA 3.31Å; T406-S409 WeakPolarHBondContact O-CB 3.49Å; T406-S409 PolarHBondContact O-N 3.13Å; T406-S409 WeakPolarHBondContact OG1-CB 3.15Å; T406-S409 PolarHBondContact OG1-N 3.36Å; T406-T410 PolarHBondContact O-N 2.75Å; T406-T410 VanDerWaalsContact O-N 3.11Å; T406-T410 PolarHBondContact O-OG1 3.4Å
407	A	67.8	Low	67.1	Low	82 Å²	82	71.1 Å²	71.1	68%	0.678	42%	0.423	S	S	*	.	H	α-helix	trans	-53.3	-36.5	175.5	0	0	0	0	0	112.3	T410 C411	A407-T410 WeakPolarHBondContact CA-OG1 3.5Å; A407-T410 PolarHBondContact O-N 2.81Å; A407-T410 PolarHBondContact O-OG1 3.29Å; A407-C411 WeakPolarHBondContact O-CB 3.47Å; A407-C411 PolarHBondContact O-N 3.34Å
408	A	65.8	Low	68.7	Low	73 Å²	73	67.9 Å²	67.9	60%	0.603	41%	0.406	S	S	*	.	H	α-helix	trans	-70.6	-32.3	175.5	0	0	0	0	0	113.5	T406 T410 C411	T406-A408 PolarHBondContact O-N 3.25Å; T406-A408 VanDerWaalsContact O-N 3.16Å; A408-T410 VanDerWaalsContact C-N 3.3Å; A408-C411 PolarHBondContact O-SG 2.88Å
409	S	63.1	Low	70	Confident	42 Å²	42	67.4 Å²	67.4	29%	0.294	40%	0.404	S	S	.	.	H	α-helix	trans	-73	-24.2	174.8	-177.4	0	0	0	0	112.6	T406	T406-S409 WeakPolarHBondContact O-CA 3.31Å; T406-S409 WeakPolarHBondContact O-CB 3.49Å; T406-S409 PolarHBondContact O-N 3.13Å; T406-S409 WeakPolarHBondContact OG1-CB 3.15Å; T406-S409 PolarHBondContact OG1-N 3.36Å
410	T	64.1	Low	71.1	Confident	74 Å²	74	66.6 Å²	66.6	45%	0.454	40%	0.401	S	S	.	.	H	α-helix	trans	-98	-15.4	-178.2	52.4	0	0	0	0	113.7	V405 T406 A407 A408 C412	V405-T410 HydrophobicContact CG1-CG2 4.01Å; T406-T410 PolarHBondContact O-N 2.75Å; T406-T410 VanDerWaalsContact O-N 3.11Å; T406-T410 PolarHBondContact O-OG1 3.4Å; A407-T410 WeakPolarHBondContact CA-OG1 3.5Å; A407-T410 PolarHBondContact O-N 2.81Å; A407-T410 PolarHBondContact O-OG1 3.29Å; A408-T410 VanDerWaalsContact C-N 3.3Å; T410-C412 VanDerWaalsContact C-N 3.31Å; T410-C412 PolarHBondContact O-N 3.46Å
411	C	63.4	Low	72.4	Confident	90 Å²	90	58.7 Å²	58.7	61%	0.608	37%	0.371	S	S	*	.	S	Bend	trans	-76.1	-15.9	-176.5	69.9	0	0	0	0	114	A407 A408	A407-C411 WeakPolarHBondContact O-CB 3.47Å; A407-C411 PolarHBondContact O-N 3.34Å; A408-C411 PolarHBondContact O-SG 2.88Å
412	C	61.2	Low	73.8	Confident	55 Å²	55	51.1 Å²	51.1	37%	0.372	34%	0.335	S	S	.	.	S	Bend	trans	-99.9	120.1	178.6	-56.5	0	0	0	0	109.7	T410 Q414	T410-C412 VanDerWaalsContact C-N 3.31Å; T410-C412 PolarHBondContact O-N 3.46Å; C412-Q414 PolarHBondContact O-N 3.01Å; C412-Q414 VanDerWaalsContact O-N 3.1Å
413	P	63.8	Low	75.2	Confident	68 Å²	68	47.6 Å²	47.6	44%	0.442	31%	0.306	S	S	.	.			trans	-64.7	113.1	176.2	24.7	-31.2	0	0	0	110	L233	L233-P413 HydrophobicContact CB-CB 4.42Å
414	Q	69.4	Low	76.4	Confident	47 Å²	47	40.5 Å²	40.5	22%	0.22	28%	0.275	C	S	.	.			trans	-117.6	127.9	179.1	-68.8	-176.8	21.1	0	0	110.4	L233 R400 C412 P416	L233-Q414 CarbonylContact O-C 3.59Å; R400-Q414 VanDerWaalsContact N-OE1 3.14Å; C412-Q414 PolarHBondContact O-N 3.01Å; C412-Q414 VanDerWaalsContact O-N 3.1Å; Q414-P416 VanDerWaalsContact O-CD 3.22Å; Q414-P416 WeakPolarHBondContact O-CD 3.49Å; Q414-P416 VanDerWaalsContact O-N 3.11Å
415	M	73.9	Confident	77.1	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.03	25%	0.248	C	C	.	.			trans	-63.2	115.7	176.6	-179.7	-163.7	58.6	0	0	110.7	F232 L233 Q355 Q356 R399	F232-M415 WeakPolarHBondContact O-CG 3.39Å; L233-M415 HydrophobicContact CD2-CB 4.44Å; Q355-M415 WeakPolarHBondContact O-CE 3.36Å; Q356-M415 HydrophobicContact CB-CE 4.4Å; Q356-M415 WeakPolarHBondContact O-CE 3.49Å; Q356-M415 VanDerWaalsContact O-SD 3.37Å; R399-M415 PolarHBondContact NE-O 3.15Å; R399-M415 VanDerWaalsContact NH2-CE 3.31Å; R399-M415 PolarHBondContact NH2-O 3.33Å
416	P	80.9	Confident	77.8	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.065	22%	0.217	C	C	.	.			trans	-81.4	139.4	-168.6	29.1	-31.7	0	0	0	112.3	F232 R240 P241 R358 Q414	F232-P416 WeakPolarHBondContact O-CD 3.26Å; R240-P416 HydrophobicContact CG-CB 3.97Å; P241-P416 HydrophobicContact CG-CG 4.11Å; R358-P416 WeakPolarHBondContact CD-O 3.4Å; R358-P416 PolarHBondContact NH1-O 3.31Å; Q414-P416 VanDerWaalsContact O-CD 3.22Å; Q414-P416 WeakPolarHBondContact O-CD 3.49Å; Q414-P416 VanDerWaalsContact O-N 3.11Å
417	L	88.1	Confident	78.3	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	21%	0.207	C	C	.	.			trans	-85	114.8	167.1	-176.3	64.3	0	0	0	109.5	R240 L357 L360 A384 F385	R240-L417 PolarHBondContact NE-O 3.45Å; R240-L417 PolarHBondContact NH2-O 2.9Å; L357-L417 HydrophobicContact CB-CD1 4.34Å; L357-L417 HydrophobicContact CD2-CD1 3.75Å; L357-L417 HydrophobicContact CG-CD1 3.75Å; L357-L417 WeakPolarHBondContact O-CD1 3.36Å; L360-L417 HydrophobicContact CB-CD1 4.06Å; A384-L417 HydrophobicContact CB-CD2 4.37Å; F385-L417 HydrophobicContact CE2-CB 4.49Å; F385-L417 HydrophobicContact CE2-CD2 3.87Å
418	Q	91.5	Very high	78.7	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.6	174.2	-172	177.4	13.3	0	0	109.9	S227 P241 S242 R358 L360 L420	S227-Q418 PolarHBondContact OG-OE1 2.82Å; P241-Q418 HydrophobicContact CB-CG 4.25Å; S242-Q418 PolarHBondContact O-NE2 3.27Å; R358-Q418 VanDerWaalsContact NH1-CB 3.28Å; R358-Q418 PolarHBondContact O-N 3.25Å; L360-Q418 PolarHBondContact N-O 2.97Å; Q418-L420 HydrophobicContact CG-CD2 3.88Å
419	K	94.3	Very high	79.4	Confident	10 Å²	10	28.9 Å²	28.9	4%	0.043	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	130.9	177.3	-52.4	-168.3	-163.1	76.8	0	109.8	D243 L244 L360 L421 G437 L438	D243-K419 WeakPolarHBondContact CA-O 3.46Å; D243-K419 HydrophobicContact CB-CB 4.34Å; D243-K419 WeakPolarHBondContact CB-O 3.46Å; D243-K419 PolarHBondContact OD1-N 3.05Å; D243-K419 IonicContact OD2-NZ 3.18Å; L244-K419 PolarHBondContact N-O 2.99Å; L360-K419 HydrophobicContact CB-CG 4.48Å; L360-K419 HydrophobicContact CD2-CD 4.32Å; L360-K419 HydrophobicContact CD2-CG 4.32Å; L360-K419 CarbonylContact O-C 3.26Å; L360-K419 WeakPolarHBondContact O-CA 3.37Å; K419-L421 HydrophobicContact CB-CD1 4.03Å; K419-G437 PolarHBondContact NZ-O 3.39Å; K419-L438 HydrophobicContact CB-CD2 4.26Å; K419-L438 HydrophobicContact CD-CD2 4.2Å
420	L	95.7	Very high	80	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.7	-179.7	-49.9	-177.1	0	0	0	108.8	L224 L244 F359 L360 V361 I362 Q418 F422	L224-L420 HydrophobicContact CD1-CD1 3.95Å; L224-L420 HydrophobicContact CD2-CD1 3.76Å; L224-L420 HydrophobicContact CD2-CD2 3.5Å; L224-L420 VanDerWaalsContact CD2-CD2 3.5Å; L224-L420 HydrophobicContact CD2-CG 4.31Å; L244-L420 HydrophobicContact CB-CD2 3.9Å; L244-L420 HydrophobicContact CD1-CD2 4.36Å; L244-L420 HydrophobicContact CG-CD2 4.02Å; L244-L420 CarbonylContact O-C 3.5Å; L244-L420 WeakPolarHBondContact O-CA 3.32Å; F359-L420 HydrophobicContact CD1-CD1 4.21Å; L360-L420 PolarHBondContact O-N 3.19Å; V361-L420 CarbonylContact C-O 3.41Å; V361-L420 WeakPolarHBondContact CA-O 3.17Å; V361-L420 HydrophobicContact CG2-CB 4.28Å; V361-L420 HydrophobicContact CG2-CD1 4.11Å; I362-L420 PolarHBondContact N-O 3.04Å; Q418-L420 HydrophobicContact CG-CD2 3.88Å; L420-F422 HydrophobicContact CB-CD2 4.4Å; L420-F422 HydrophobicContact CB-CE2 3.74Å
421	L	94.8	Very high	80.8	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.3	-174.7	-71.2	81.5	0	0	0	109	L244 C245 V246 A365 K419 L436 L438	L244-L421 PolarHBondContact O-N 3.05Å; C245-L421 CarbonylContact C-O 3.58Å; C245-L421 WeakPolarHBondContact CA-O 3.49Å; V246-L421 PolarHBondContact N-O 2.96Å; A365-L421 HydrophobicContact CB-CB 4.27Å; A365-L421 HydrophobicContact CB-CD2 4.42Å; K419-L421 HydrophobicContact CB-CD1 4.03Å; L421-L436 HydrophobicContact CD2-CD1 3.31Å; L421-L436 HydrophobicContact CD2-CD2 3.93Å; L421-L436 HydrophobicContact CD2-CG 4.12Å; L421-L438 HydrophobicContact CD1-CD1 4.38Å; L421-L438 HydrophobicContact CD1-CD2 3.41Å; L421-L438 VanDerWaalsContact CD1-CD2 3.41Å; L421-L438 HydrophobicContact CD2-CD1 4.28Å; L421-L438 HydrophobicContact CD2-CD2 4.18Å; L421-L438 HydrophobicContact CG-CD2 4.47Å
422	F	93.5	Very high	81.7	Confident	1 Å²	1	31.9 Å²	31.9	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.3	176.8	-68.8	-93.4	0	0	0	109.2	V220 V246 K254 A257 F258 V361 I362 D363 E364 A365 L420	V220-F422 HydrophobicContact CG1-CE1 4.43Å; V220-F422 HydrophobicContact CG1-CZ 4.26Å; V246-F422 HydrophobicContact CB-CD1 3.63Å; V246-F422 HydrophobicContact CB-CE1 3.8Å; V246-F422 HydrophobicContact CB-CG 4.38Å; V246-F422 HydrophobicContact CG1-CD1 3.96Å; V246-F422 HydrophobicContact CG1-CE1 4.09Å; V246-F422 HydrophobicContact CG2-CD1 3.92Å; V246-F422 HydrophobicContact CG2-CE1 3.54Å; V246-F422 HydrophobicContact CG2-CZ 4.03Å; K254-F422 HydrophobicContact CB-CD1 4.03Å; K254-F422 HydrophobicContact CD-CB 4.44Å; K254-F422 HydrophobicContact CD-CD1 4.41Å; K254-F422 HydrophobicContact CG-CD1 4.36Å; A257-F422 HydrophobicContact CB-CE1 4.15Å; F258-F422 HydrophobicContact CB-CE2 3.59Å; F258-F422 HydrophobicContact CB-CZ 3.61Å; F258-F422 HydrophobicContact CD1-CD1 4.17Å; F258-F422 AromaticContact CD1-CD2 3.66Å; F258-F422 HydrophobicContact CD1-CD2 3.66Å; F258-F422 HydrophobicContact CD1-CE1 4.06Å; F258-F422 AromaticContact CD1-CE2 3.54Å; F258-F422 HydrophobicContact CD1-CE2 3.54Å; F258-F422 AromaticContact CD1-CG 3.99Å; F258-F422 HydrophobicContact CD1-CG 3.99Å; F258-F422 AromaticContact CD1-CZ 3.78Å; F258-F422 HydrophobicContact CD1-CZ 3.78Å; F258-F422 HydrophobicContact CE1-CD2 4.26Å; F258-F422 HydrophobicContact CE1-CG 4.39Å; F258-F422 HydrophobicContact CG-CD2 4.4Å; F258-F422 AromaticContact CG-CE2 3.92Å; F258-F422 HydrophobicContact CG-CE2 3.92Å; F258-F422 HydrophobicContact CG-CZ 4.17Å; V361-F422 HydrophobicContact CG1-CD2 3.92Å; V361-F422 HydrophobicContact CG1-CE2 4.15Å; I362-F422 PolarHBondContact O-N 3.42Å; D363-F422 CarbonylContact C-O 3.43Å; D363-F422 WeakPolarHBondContact OD1-CB 3.46Å; E364-F422 PolarHBondContact N-O 3.2Å; A365-F422 PolarHBondContact N-O 2.91Å; L420-F422 HydrophobicContact CB-CD2 4.4Å; L420-F422 HydrophobicContact CB-CE2 3.74Å
423	S	89.2	Confident	82.7	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.007	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	153.7	175.6	-177.9	0	0	0	0	111.2	V246 S247 A248 D366 T425	V246-S423 PolarHBondContact O-N 3.37Å; S247-S423 WeakPolarHBondContact CA-O 3.5Å; A248-S423 PolarHBondContact N-O 2.94Å; A248-S423 VanDerWaalsContact N-O 3.12Å; D366-S423 VanDerWaalsContact CB-OG 3.28Å; D366-S423 WeakPolarHBondContact CB-OG 3.5Å; D366-S423 PolarHBondContact OD1-OG 3.07Å; S423-T425 PolarHBondContact OG-N 3.32Å; S423-T425 VanDerWaalsContact OG-N 3.08Å; S423-T425 PolarHBondContact OG-O 3.42Å
424	A	83.1	Confident	83.7	Confident	11 Å²	11	34 Å²	34	9%	0.091	17%	0.172	C	C	.	.	S	Bend	trans	-72	-35.9	166.7	0	0	0	0	0	112	A248 T250	A248-A424 VanDerWaalsContact O-CA 3.3Å; A248-A424 WeakPolarHBondContact O-CA 3.24Å; T250-A424 HydrophobicContact CG2-CB 4.09Å
425	T	80	Confident	84.4	Confident	10 Å²	10	36.7 Å²	36.7	6%	0.061	19%	0.185	C	C	.	.	S	Bend	trans	-142.1	94.8	-175.1	65.6	0	0	0	0	109.5	D366 S423 Y465 R579 V582	D366-T425 WeakPolarHBondContact CB-O 3.32Å; S423-T425 PolarHBondContact OG-N 3.32Å; S423-T425 VanDerWaalsContact OG-N 3.08Å; S423-T425 PolarHBondContact OG-O 3.42Å; T425-Y465 HydrophobicContact CG2-CD1 3.49Å; T425-Y465 VanDerWaalsContact CG2-CD1 3.49Å; T425-Y465 HydrophobicContact CG2-CE1 3.63Å; T425-R579 VanDerWaalsContact OG1-CD 3.31Å; T425-R579 WeakPolarHBondContact OG1-CD 3.02Å; T425-R579 WeakPolarHBondContact OG1-CG 3.26Å; T425-R579 PolarHBondContact OG1-NE 3.13Å; T425-V582 HydrophobicContact CG2-CG1 4.11Å
426	L	80.9	Confident	85	Confident	26 Å²	26	36.7 Å²	36.7	14%	0.136	19%	0.185	C	C	.	.			trans	-74.6	134.2	178.4	-168.5	65.9	0	0	0	110.8	W173 C245 L433 L443	W173-L426 HydrophobicContact CH2-CD2 4.5Å; W173-L426 HydrophobicContact CZ3-CD2 4.41Å; C245-L426 HydrophobicContact CB-CD2 4.07Å; L426-L433 HydrophobicContact CD1-CD2 4.27Å; L426-L433 HydrophobicContact CG-CD2 4.41Å; L426-L443 HydrophobicContact CD2-CD1 3.8Å
427	T	80.1	Confident	85.4	Confident	34 Å²	34	38.6 Å²	38.6	21%	0.209	21%	0.206	C	C	.	.			trans	-67.9	141.8	175.7	179	0	0	0	0	111	I369 N429 K432 L433	I369-T427 HydrophobicContact CD1-CG2 3.94Å; I369-T427 HydrophobicContact CG2-CG2 4.49Å; T427-N429 PolarHBondContact OG1-N 2.76Å; T427-K432 HydrophobicContact CG2-CB 4.18Å; T427-L433 HydrophobicContact CG2-CD2 3.97Å; T427-L433 HydrophobicContact CG2-CG 4.21Å; T427-L433 WeakPolarHBondContact O-CD1 3.12Å
428	Q	76	Confident	85.4	Confident	54 Å²	54	40.1 Å²	40.1	25%	0.252	21%	0.214	S	C	.	.			trans	-93.8	-1.3	172	-66.6	-177.4	-9.1	0	0	113.2	L170 L174 P430 K464	L170-Q428 HydrophobicContact CD2-CB 4.29Å; L174-Q428 HydrophobicContact CD1-CG 4.41Å; L174-Q428 HydrophobicContact CD2-CB 4.12Å; L174-Q428 HydrophobicContact CD2-CG 4.24Å; Q428-P430 VanDerWaalsContact O-CD 3.28Å; Q428-P430 WeakPolarHBondContact O-CD 3.45Å; Q428-K464 VanDerWaalsContact OE1-CE 3.25Å
429	N	79.5	Confident	85.2	Confident	61 Å²	61	42.5 Å²	42.5	33%	0.326	23%	0.225	S	C	.	.			trans	-67.5	115.5	177.7	-178.3	-29.2	0	0	0	109.9	T427 E431 K432 L433	T427-N429 PolarHBondContact OG1-N 2.76Å; N429-E431 VanDerWaalsContact C-N 3.34Å; N429-E431 PolarHBondContact O-N 3.42Å; N429-E431 WeakPolarHBondContact OD1-CB 3.39Å; N429-E431 PolarHBondContact OD1-N 3.05Å; N429-K432 HydrophobicContact CB-CB 4.24Å; N429-K432 HydrophobicContact CB-CD 4.37Å; N429-K432 HydrophobicContact CB-CG 4.34Å; N429-K432 PolarHBondContact O-N 3.41Å; N429-K432 PolarHBondContact OD1-N 3.1Å; N429-L433 WeakPolarHBondContact O-CG 3.23Å; N429-L433 PolarHBondContact O-N 3.41Å; N429-L433 VanDerWaalsContact O-N 3.13Å
430	P	76	Confident	84.9	Confident	63 Å²	63	48.2 Å²	48.2	41%	0.409	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-33.3	-175.6	27	-34.6	0	0	0	112.9	Q428 L433 Q434	Q428-P430 VanDerWaalsContact O-CD 3.28Å; Q428-P430 WeakPolarHBondContact O-CD 3.45Å; P430-L433 PolarHBondContact O-N 2.89Å; P430-Q434 WeakPolarHBondContact O-CB 3.21Å; P430-Q434 PolarHBondContact O-N 3.41Å
431	E	81.5	Confident	84.6	Confident	138 Å²	138	49.1 Å²	49.1	65%	0.645	26%	0.258	S	S	*	.	H	α-helix	trans	-64	-45.2	179.2	-60.3	177.7	169.8	0	0	111	N429 L433 Q434 Q435	N429-E431 VanDerWaalsContact C-N 3.34Å; N429-E431 PolarHBondContact O-N 3.42Å; N429-E431 WeakPolarHBondContact OD1-CB 3.39Å; N429-E431 PolarHBondContact OD1-N 3.05Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.45Å; E431-Q434 PolarHBondContact O-N 3.13Å; E431-Q435 PolarHBondContact O-N 3.04Å
432	K	81.9	Confident	84.4	Confident	69 Å²	69	53.9 Å²	53.9	30%	0.3	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-37.8	176	-76.2	-169.9	173.7	-167.9	0	111.8	I369 D370 T427 N429	I369-K432 HydrophobicContact CG2-CB 3.7Å; I369-K432 HydrophobicContact CG2-CD 3.95Å; I369-K432 HydrophobicContact CG2-CG 4.08Å; D370-K432 IonicContact OD1-NZ 2.7Å; D370-K432 PolarHBondContact OD1-NZ 2.91Å; T427-K432 HydrophobicContact CG2-CB 4.18Å; N429-K432 HydrophobicContact CB-CB 4.24Å; N429-K432 HydrophobicContact CB-CD 4.37Å; N429-K432 HydrophobicContact CB-CG 4.34Å; N429-K432 PolarHBondContact O-N 3.41Å; N429-K432 PolarHBondContact OD1-N 3.1Å
433	L	82.6	Confident	84.2	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-72.2	-35.1	177.8	-68.9	174.5	0	0	0	112.4	W173 L174 L426 T427 N429 P430 E431 Q435 L436	W173-L433 HydrophobicContact CH2-CD1 3.91Å; W173-L433 HydrophobicContact CH2-CD2 4.45Å; W173-L433 HydrophobicContact CZ2-CD1 3.91Å; L174-L433 HydrophobicContact CD2-CD1 3.98Å; L426-L433 HydrophobicContact CD1-CD2 4.27Å; L426-L433 HydrophobicContact CG-CD2 4.41Å; T427-L433 HydrophobicContact CG2-CD2 3.97Å; T427-L433 HydrophobicContact CG2-CG 4.21Å; T427-L433 WeakPolarHBondContact O-CD1 3.12Å; N429-L433 WeakPolarHBondContact O-CG 3.23Å; N429-L433 PolarHBondContact O-N 3.41Å; N429-L433 VanDerWaalsContact O-N 3.13Å; P430-L433 PolarHBondContact O-N 2.89Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.45Å; L433-Q435 PolarHBondContact O-N 2.91Å; L433-L436 HydrophobicContact CD2-CD1 4Å; L433-L436 VanDerWaalsContact O-CB 3.31Å; L433-L436 WeakPolarHBondContact O-CB 3.48Å; L433-L436 PolarHBondContact O-N 3.23Å; L433-L436 VanDerWaalsContact O-N 3.07Å
434	Q	84.3	Confident	84.2	Confident	156 Å²	156	54.6 Å²	54.6	73%	0.729	28%	0.279	S	S	*	.	H	α-helix	trans	-61.9	-33.6	178.3	-175.7	176.5	-14.9	0	0	111.9	P430 E431 L436 G437	P430-Q434 WeakPolarHBondContact O-CB 3.21Å; P430-Q434 PolarHBondContact O-N 3.41Å; E431-Q434 PolarHBondContact O-N 3.13Å; Q434-L436 PolarHBondContact O-N 2.9Å; Q434-L436 VanDerWaalsContact O-N 3.1Å; Q434-G437 PolarHBondContact O-N 3.05Å
435	Q	85.2	Confident	84.3	Confident	105 Å²	105	54.4 Å²	54.4	49%	0.491	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.5	175.4	-67.2	177.7	3.6	0	0	113.6	M372 E431 L433 G437	M372-Q435 HydrophobicContact CE-CB 4Å; M372-Q435 WeakPolarHBondContact CE-O 3.5Å; M372-Q435 HydrophobicContact SD-CB 3.82Å; E431-Q435 PolarHBondContact O-N 3.04Å; L433-Q435 PolarHBondContact O-N 2.91Å; Q435-G437 VanDerWaalsContact C-N 3.32Å
436	L	86.9	Confident	84	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-16.5	177.6	-64.2	160.9	0	0	0	113	I362 I369 M372 L377 L421 L433 Q434 L438	I362-L436 HydrophobicContact CD1-CD2 4.22Å; I369-L436 HydrophobicContact CD1-CD1 3.81Å; I369-L436 HydrophobicContact CG1-CD1 4.08Å; I369-L436 HydrophobicContact CG1-CD2 4.11Å; I369-L436 HydrophobicContact CG1-CG 4.32Å; M372-L436 HydrophobicContact CE-CB 4.47Å; M372-L436 HydrophobicContact CE-CD2 3.38Å; M372-L436 HydrophobicContact CE-CG 3.86Å; M372-L436 HydrophobicContact SD-CD2 4.09Å; M372-L436 HydrophobicContact SD-CG 4.38Å; L377-L436 HydrophobicContact CD2-CD2 4.12Å; L421-L436 HydrophobicContact CD2-CD1 3.31Å; L421-L436 HydrophobicContact CD2-CD2 3.93Å; L421-L436 HydrophobicContact CD2-CG 4.12Å; L433-L436 HydrophobicContact CD2-CD1 4Å; L433-L436 VanDerWaalsContact O-CB 3.31Å; L433-L436 WeakPolarHBondContact O-CB 3.48Å; L433-L436 PolarHBondContact O-N 3.23Å; L433-L436 VanDerWaalsContact O-N 3.07Å; Q434-L436 PolarHBondContact O-N 2.9Å; Q434-L436 VanDerWaalsContact O-N 3.1Å; L436-L438 VanDerWaalsContact C-N 3.34Å; L436-L438 HydrophobicContact CB-CD1 4.42Å; L436-L438 HydrophobicContact CB-CD2 3.8Å; L436-L438 HydrophobicContact CB-CG 3.82Å; L436-L438 HydrophobicContact CD1-CD1 4.47Å; L436-L438 PolarHBondContact O-N 3.37Å
437	G	87.9	Confident	82.9	Confident	49 Å²	49	54 Å²	54	51%	0.505	28%	0.279	S	S	.	.			trans	54.5	46.8	179	0	0	0	0	0	112.8	K419 Q434 Q435	K419-G437 PolarHBondContact NZ-O 3.39Å; Q434-G437 PolarHBondContact O-N 3.05Å; Q435-G437 VanDerWaalsContact C-N 3.32Å
438	L	89.5	Confident	81.7	Confident	34 Å²	34	55.7 Å²	55.7	18%	0.178	29%	0.286	C	S	.	.			trans	-72.7	141.2	-175.2	-56.4	-179.6	0	0	0	112	D243 K419 L421 L436 P441	D243-L438 HydrophobicContact CB-CB 4.35Å; D243-L438 HydrophobicContact CB-CD2 4.31Å; D243-L438 VanDerWaalsContact OD2-CA 3.27Å; D243-L438 WeakPolarHBondContact OD2-CA 3.42Å; K419-L438 HydrophobicContact CB-CD2 4.26Å; K419-L438 HydrophobicContact CD-CD2 4.2Å; L421-L438 HydrophobicContact CD1-CD1 4.38Å; L421-L438 HydrophobicContact CD1-CD2 3.41Å; L421-L438 VanDerWaalsContact CD1-CD2 3.41Å; L421-L438 HydrophobicContact CD2-CD1 4.28Å; L421-L438 HydrophobicContact CD2-CD2 4.18Å; L421-L438 HydrophobicContact CG-CD2 4.47Å; L436-L438 VanDerWaalsContact C-N 3.34Å; L436-L438 HydrophobicContact CB-CD1 4.42Å; L436-L438 HydrophobicContact CB-CD2 3.8Å; L436-L438 HydrophobicContact CB-CG 3.82Å; L436-L438 HydrophobicContact CD1-CD1 4.47Å; L436-L438 PolarHBondContact O-N 3.37Å; L438-P441 HydrophobicContact CB-CB 4Å; L438-P441 HydrophobicContact CB-CG 4.01Å; L438-P441 HydrophobicContact CD1-CB 3.88Å; L438-P441 HydrophobicContact CD1-CG 4.29Å
439	H	87.4	Confident	79.9	Confident	52 Å²	52	55.3 Å²	55.3	24%	0.241	29%	0.293	C	S	.	.	S	Bend	trans	-99.3	113.9	174.8	176.8	-103.9	0	0	0	110.5	P241 D243	P241-H439 PolarHBondContact O-ND1 3.3Å; D243-H439 PolarHBondContact N-O 3.35Å; D243-H439 PolarHBondContact OD2-N 3.15Å
440	Q	87.2	Confident	77.9	Confident	130 Å²	130	61 Å²	61	61%	0.607	32%	0.317	S	S	*	.	S	Bend	trans	40.6	58.5	-179.9	-65.9	-174.6	-37.1	0	0	113.1	S242	S242-Q440 WeakPolarHBondContact CB-O 3.45Å; S242-Q440 PolarHBondContact OG-O 3.23Å
441	P	90.1	Very high	75.9	Confident	20 Å²	20	69.4 Å²	69.4	13%	0.13	34%	0.34	C	S	.	.			trans	-63.2	140	-171.8	25.4	-34.3	0	0	0	112.4	W173 D243 L438	W173-P441 VanDerWaalsContact CB-O 3.23Å; W173-P441 WeakPolarHBondContact CB-O 3.43Å; W173-P441 HydrophobicContact CD2-CB 4.06Å; W173-P441 HydrophobicContact CD2-CG 3.59Å; W173-P441 HydrophobicContact CE3-CB 4.15Å; W173-P441 HydrophobicContact CE3-CG 4.19Å; W173-P441 HydrophobicContact CG-CB 4.48Å; W173-P441 HydrophobicContact CG-CG 3.75Å; W173-P441 HydrophobicContact CZ2-CG 4.07Å; W173-P441 HydrophobicContact CZ3-CB 4.45Å; D243-P441 CarbonylContact O-C 3.37Å; D243-P441 VanDerWaalsContact O-CA 3.23Å; D243-P441 WeakPolarHBondContact O-CA 3.49Å; L438-P441 HydrophobicContact CB-CB 4Å; L438-P441 HydrophobicContact CB-CG 4.01Å; L438-P441 HydrophobicContact CD1-CB 3.88Å; L438-P441 HydrophobicContact CD1-CG 4.29Å
442	R	90.1	Very high	73.5	Confident	101 Å²	101	65.4 Å²	65.4	38%	0.381	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.7	170.2	-67.9	172.7	63.5	-172.1	-0.1	109.4	D243 L244 C245	D243-R442 PolarHBondContact O-N 3.39Å; L244-R442 HydrophobicContact CD2-CB 3.91Å; C245-R442 PolarHBondContact N-O 2.63Å
443	L	89.5	Confident	71.3	Confident	6 Å²	6	70.6 Å²	70.6	3%	0.031	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.6	-179.6	176.6	60.2	0	0	0	111.5	W173 L174 P177 S178 C245 L426	W173-L443 HydrophobicContact CE3-CB 3.82Å; W173-L443 HydrophobicContact CZ3-CB 3.99Å; W173-L443 HydrophobicContact CZ3-CD2 4.34Å; L174-L443 HydrophobicContact CD1-CD2 3.7Å; P177-L443 CarbonylContact C-O 3.44Å; P177-L443 WeakPolarHBondContact CA-O 3.28Å; P177-L443 HydrophobicContact CB-CB 4.26Å; P177-L443 HydrophobicContact CB-CD2 3.97Å; P177-L443 HydrophobicContact CB-CG 3.92Å; S178-L443 PolarHBondContact N-O 2.91Å; C245-L443 HydrophobicContact CB-CB 4.46Å; C245-L443 HydrophobicContact CB-CD1 3.81Å; C245-L443 CarbonylContact O-C 3.58Å; C245-L443 WeakPolarHBondContact O-CA 3.48Å; L426-L443 HydrophobicContact CD2-CD1 3.8Å
444	F	88.4	Confident	68.8	Low	11 Å²	11	78.9 Å²	78.9	5%	0.048	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.7	166.3	-66.3	-89	0	0	0	109.1	S178 V180 A219 V220 A223 L244 C245 V246 S247	S178-F444 WeakPolarHBondContact O-CA 3.46Å; V180-F444 HydrophobicContact CG2-CB 3.83Å; V180-F444 HydrophobicContact CG2-CD1 4.09Å; V180-F444 HydrophobicContact CG2-CG 4.47Å; A219-F444 HydrophobicContact CB-CD1 3.98Å; A219-F444 HydrophobicContact CB-CE1 4.17Å; V220-F444 HydrophobicContact CG2-CB 4.3Å; V220-F444 HydrophobicContact CG2-CD1 4.43Å; V220-F444 HydrophobicContact CG2-CD2 4.15Å; V220-F444 HydrophobicContact CG2-CG 4.04Å; A223-F444 HydrophobicContact CB-CE2 4.49Å; A223-F444 HydrophobicContact CB-CZ 3.87Å; L244-F444 HydrophobicContact CD1-CE2 4.2Å; L244-F444 HydrophobicContact CD2-CE2 4.08Å; C245-F444 PolarHBondContact O-N 3.3Å; V246-F444 WeakPolarHBondContact CA-O 3.29Å; V246-F444 HydrophobicContact CG2-CB 4.38Å; V246-F444 HydrophobicContact CG2-CD2 4.47Å; S247-F444 PolarHBondContact N-O 3.11Å
445	S	84.4	Confident	66.5	Low	7 Å²	7	79.5 Å²	79.5	5%	0.049	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.1	-178.2	-172.9	0	0	0	0	112.1	S178 V180 S247 G447	S178-S445 PolarHBondContact O-N 3.18Å; S178-S445 VanDerWaalsContact O-N 3.1Å; V180-S445 PolarHBondContact N-O 3.04Å; S247-S445 WeakPolarHBondContact O-CA 3.42Å; S445-G447 PolarHBondContact OG-N 3.2Å
446	T	75.1	Confident	64	Low	11 Å²	11	80.4 Å²	80.4	7%	0.067	43%	0.426	C	S	.	.	S	Bend	trans	-84.4	-17.4	172.2	48.1	0	0	0	0	112.6	V180 K182 V216 S247 A248 P249	V180-T446 HydrophobicContact CB-CG2 3.87Å; V180-T446 HydrophobicContact CG1-CG2 3.88Å; K182-T446 WeakPolarHBondContact CG-O 3.09Å; V216-T446 HydrophobicContact CG2-CG2 3.95Å; S247-T446 PolarHBondContact O-N 3.39Å; S247-T446 PolarHBondContact O-OG1 2.86Å; A248-T446 HydrophobicContact CB-CG2 4.1Å; P249-T446 VanDerWaalsContact CD-OG1 3.3Å; P249-T446 WeakPolarHBondContact CD-OG1 3.45Å
447	G	58.4	Low	61.5	Low	17 Å²	17	88.9 Å²	88.9	18%	0.175	47%	0.471	C	S	.	.	S	Bend	trans	-96.3	-5.7	-169.8	0	0	0	0	0	116.6	S445	S445-G447 PolarHBondContact OG-N 3.2Å
448	L	53.1	Low	58.7	Low	70 Å²	70	89.5 Å²	89.5	37%	0.366	48%	0.477	S	S	.	.			trans	-119.1	54.5	-164.6	-73.3	161.6	0	0	0	112.9	P177	P177-L448 HydrophobicContact CB-CD1 4.31Å; P177-L448 HydrophobicContact CG-CB 3.49Å; P177-L448 VanDerWaalsContact CG-CB 3.49Å; P177-L448 HydrophobicContact CG-CD1 3.65Å; P177-L448 HydrophobicContact CG-CG 4.16Å
449	A	39	Very low	56.3	Low	46 Å²	46	94 Å²	94	38%	0.38	50%	0.501	S	S	.	.			trans	-104.9	85.8	168.1	0	0	0	0	0	109.6
450	H	36.7	Very low	53.7	Low	181 Å²	181	93.8 Å²	93.8	84%	0.838	51%	0.513	S	S	*	.			trans	155.9	94.1	140.9	-93.9	-15.1	0	0	0	111.3
451	R	35	Very low	51.5	Low	239 Å²	239	92.6 Å²	92.6	90%	0.902	51%	0.511	S	S	*	.			trans	-127.6	51.6	145.5	-120.9	-173.1	-177.4	-166.3	-0.3	107.7
452	G	31.2	Very low	49	Very low	53 Å²	53	95.5 Å²	95.5	55%	0.546	53%	0.532	S	S	.	.	S	Bend	trans	-86.8	140	158.7	0	0	0	0	0	107.2	E454	G452-E454 PolarHBondContact O-N 2.61Å; G452-E454 VanDerWaalsContact O-N 3.12Å
453	L	34.7	Very low	47	Very low	178 Å²	178	92.3 Å²	92.3	93%	0.932	53%	0.531	S	S	*	.	S	Bend	trans	-41.8	111.9	-175.8	-70.1	79.9	0	0	0	112.6
454	E	30.8	Very low	45.6	Very low	184 Å²	184	96.1 Å²	96.1	86%	0.86	55%	0.547	S	S	*	.			trans	-158.9	117.7	148.6	-110.5	167.5	-150.6	0	0	108.6	G452 T456	G452-E454 PolarHBondContact O-N 2.61Å; G452-E454 VanDerWaalsContact O-N 3.12Å; E454-T456 PolarHBondContact O-N 3.38Å
455	N	35.5	Very low	44.5	Very low	170 Å²	170	98.8 Å²	98.8	91%	0.909	56%	0.557	S	S	*	*			trans	-68.9	106.4	176.2	-73	-33.7	0	0	0	108.9
456	T	33.2	Very low	43.7	Very low	124 Å²	124	99.9 Å²	99.9	76%	0.761	57%	0.567	S	S	*	*			trans	-128.9	112.2	152.5	49.9	0	0	0	0	108.2	E454 G458	E454-T456 PolarHBondContact O-N 3.38Å; T456-G458 PolarHBondContact O-N 2.77Å
457	D	33.5	Very low	43.5	Very low	183 Å²	183	101 Å²	101	98%	0.979	57%	0.571	S	S	*	*			trans	-61.5	83.4	168.2	-73.9	-48.5	0	0	0	109.4
458	G	30.7	Very low	44.2	Very low	62 Å²	62	101.3 Å²	101.3	64%	0.639	57%	0.57	S	S	*	*			trans	-149.3	79.2	-177.6	0	0	0	0	0	108.7	T456 G460	T456-G458 PolarHBondContact O-N 2.77Å; G458-G460 PolarHBondContact O-N 3.08Å
459	D	38.5	Very low	45.1	Very low	128 Å²	128	103.7 Å²	103.7	68%	0.684	59%	0.587	S	S	*	*			trans	-54.9	105.7	179.3	-174.2	27.2	0	0	0	112.5	K165	K165-D459 IonicContact NZ-OD1 3.55Å; K165-D459 PolarHBondContact NZ-OD1 3.48Å; K165-D459 IonicContact NZ-OD2 2.77Å; K165-D459 PolarHBondContact NZ-OD2 3.34Å
460	G	31.9	Very low	46.9	Very low	48 Å²	48	102.7 Å²	102.7	50%	0.495	58%	0.581	S	S	.	*			trans	-160.5	124.9	169.1	0	0	0	0	0	111.2	G458 S462	G458-G460 PolarHBondContact O-N 3.08Å; G460-S462 PolarHBondContact O-N 3.44Å; G460-S462 PolarHBondContact O-OG 3.36Å
461	D	41.7	Very low	49.2	Very low	105 Å²	105	94.6 Å²	94.6	56%	0.561	54%	0.544	S	S	*	.			trans	-67.4	31.2	168.6	-167.7	33.4	0	0	0	112.2	K464	D461-K464 WeakPolarHBondContact OD1-CE 3.46Å; D461-K464 IonicContact OD1-NZ 2.68Å; D461-K464 PolarHBondContact OD1-NZ 2.98Å; D461-K464 IonicContact OD2-NZ 2.6Å; D461-K464 PolarHBondContact OD2-NZ 3.42Å
462	S	37.5	Very low	51.8	Low	82 Å²	82	85.6 Å²	85.6	57%	0.573	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	118.4	-169.9	45.2	0	0	0	0	110.6	G460	G460-S462 PolarHBondContact O-N 3.44Å; G460-S462 PolarHBondContact O-OG 3.36Å
463	G	47.7	Very low	54.7	Low	34 Å²	34	83.3 Å²	83.3	35%	0.351	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	124.2	10	172.7	0	0	0	0	0	116.8	Y465	G463-Y465 VanDerWaalsContact C-N 3.28Å; G463-Y465 PolarHBondContact O-N 2.91Å
464	K	59.9	Low	57.4	Low	85 Å²	85	75.9 Å²	75.9	37%	0.37	45%	0.451	S	S	.	.	S	Bend	trans	-67.4	-20.5	-178.6	-88.6	175.1	176.9	158.2	0	115.7	Q428 D461	Q428-K464 VanDerWaalsContact OE1-CE 3.25Å; D461-K464 WeakPolarHBondContact OD1-CE 3.46Å; D461-K464 IonicContact OD1-NZ 2.68Å; D461-K464 PolarHBondContact OD1-NZ 2.98Å; D461-K464 IonicContact OD2-NZ 2.6Å; D461-K464 PolarHBondContact OD2-NZ 3.42Å
465	Y	66.3	Low	60.4	Low	68 Å²	68	67.9 Å²	67.9	27%	0.267	41%	0.413	S	S	.	.	S	Bend	trans	-127.8	130.1	-170.5	-62.2	-87.4	0	0	0	111.2	T425 G463 L578 V582	T425-Y465 HydrophobicContact CG2-CD1 3.49Å; T425-Y465 VanDerWaalsContact CG2-CD1 3.49Å; T425-Y465 HydrophobicContact CG2-CE1 3.63Å; G463-Y465 VanDerWaalsContact C-N 3.28Å; G463-Y465 PolarHBondContact O-N 2.91Å; Y465-L578 HydrophobicContact CD2-CD2 3.36Å; Y465-L578 HydrophobicContact CD2-CG 4.13Å; Y465-L578 HydrophobicContact CE2-CD2 3.35Å; Y465-L578 HydrophobicContact CE2-CG 4.16Å; Y465-L578 HydrophobicContact CG-CD2 4.22Å; Y465-V582 HydrophobicContact CD1-CG2 4.11Å; Y465-V582 HydrophobicContact CG-CG2 4.25Å
466	A	66.3	Low	63.1	Low	30 Å²	30	59.8 Å²	59.8	25%	0.248	37%	0.37	C	S	.	.			trans	-88.2	126.3	175	0	0	0	0	0	110.3	P249	P249-A466 HydrophobicContact CG-CB 4.37Å
467	F	72.9	Confident	65.9	Low	34 Å²	34	55.6 Å²	55.6	15%	0.149	34%	0.344	C	S	.	.			trans	-104.4	147.4	172.5	-64.3	-87.8	0	0	0	110.1	V469 H473 L578 Y581 V582 V618	F467-V469 PolarHBondContact O-N 3.12Å; F467-H473 AromaticContact CD1-CE1 3.91Å; F467-L578 HydrophobicContact CZ-CD1 4.4Å; F467-Y581 HydrophobicContact CE1-CD1 4.12Å; F467-Y581 HydrophobicContact CE1-CE1 4.08Å; F467-V582 HydrophobicContact CE1-CB 4.39Å; F467-V582 HydrophobicContact CE1-CG2 3.59Å; F467-V582 HydrophobicContact CZ-CG2 3.6Å; F467-V618 HydrophobicContact CD2-CG2 4.2Å; F467-V618 HydrophobicContact CE1-CG2 4.07Å; F467-V618 HydrophobicContact CE2-CB 4.29Å; F467-V618 HydrophobicContact CE2-CG2 3.37Å; F467-V618 HydrophobicContact CZ-CB 4.47Å; F467-V618 HydrophobicContact CZ-CG2 3.29Å
468	P	72	Confident	68.5	Low	24 Å²	24	47.5 Å²	47.5	16%	0.156	30%	0.302	C	S	.	.			trans	-61.3	135	170.7	-16.9	29.5	0	0	0	110.7	G470 L471 A589	P468-G470 VanDerWaalsContact C-N 3.27Å; P468-G470 PolarHBondContact O-N 3.31Å; P468-L471 HydrophobicContact CB-CB 4.34Å; P468-L471 HydrophobicContact CG-CD2 4.43Å; P468-L471 VanDerWaalsContact O-CB 3.27Å; P468-L471 WeakPolarHBondContact O-CB 3.46Å; P468-L471 PolarHBondContact O-N 3.04Å; P468-A589 HydrophobicContact CB-CB 3.98Å; P468-A589 WeakPolarHBondContact CB-O 3.34Å; P468-A589 HydrophobicContact CG-CB 4.43Å
469	V	71.4	Confident	71.3	Confident	120 Å²	120	47.3 Å²	47.3	73%	0.727	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.3	-176	-175.5	0	0	0	0	112.7	F467 L471	F467-V469 PolarHBondContact O-N 3.12Å; V469-L471 VanDerWaalsContact C-N 3.25Å; V469-L471 PolarHBondContact O-N 3.06Å
470	G	77.4	Confident	73.7	Confident	24 Å²	24	47 Å²	47	25%	0.247	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	8.4	179.8	0	0	0	0	0	115.5	P468 T594 G595	P468-G470 VanDerWaalsContact C-N 3.27Å; P468-G470 PolarHBondContact O-N 3.31Å; G470-T594 WeakPolarHBondContact O-CA 3.42Å; G470-G595 PolarHBondContact O-N 3.45Å
471	L	85.8	Confident	76.2	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.058	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.2	-175.6	-177.3	58.2	0	0	0	111.3	P468 V469 H473 A585 T588 A589 G595 A597	P468-L471 HydrophobicContact CB-CB 4.34Å; P468-L471 HydrophobicContact CG-CD2 4.43Å; P468-L471 VanDerWaalsContact O-CB 3.27Å; P468-L471 WeakPolarHBondContact O-CB 3.46Å; P468-L471 PolarHBondContact O-N 3.04Å; V469-L471 VanDerWaalsContact C-N 3.25Å; V469-L471 PolarHBondContact O-N 3.06Å; L471-H473 WeakPolarHBondContact CD2-CE1 3.06Å; L471-A585 HydrophobicContact CD2-CB 3.79Å; L471-T588 HydrophobicContact CD1-CG2 3.5Å; L471-A589 HydrophobicContact CB-CB 3.9Å; L471-A589 HydrophobicContact CD1-CB 4.18Å; L471-G595 WeakPolarHBondContact CA-O 3.41Å; L471-A597 HydrophobicContact CD1-CB 4.16Å
472	T	89.3	Confident	78.5	Confident	50 Å²	50	44.5 Å²	44.5	31%	0.307	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	137.7	171	66	0	0	0	0	111.1	H474 G595 Q596 A597	T472-H474 PolarHBondContact OG1-NE2 2.96Å; T472-G595 PolarHBondContact N-O 3.37Å; T472-Q596 WeakPolarHBondContact OG1-CG 3.42Å; T472-A597 PolarHBondContact O-N 3.35Å
473	H	90.6	Very high	81	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.023	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124	-176.8	-57.2	-75.8	0	0	0	110.3	F467 L471 Y581 V618 L621 R622	F467-H473 AromaticContact CD1-CE1 3.91Å; L471-H473 WeakPolarHBondContact CD2-CE1 3.06Å; H473-Y581 AromaticContact ND1-CE1 3.91Å; H473-Y581 AromaticContact ND1-CZ 3.68Å; H473-Y581 PolarHBondContact ND1-OH 3.48Å; H473-V618 WeakPolarHBondContact CD2-CG1 3.31Å; H473-V618 WeakPolarHBondContact NE2-CG1 3.46Å; H473-L621 HydrophobicContact CB-CD1 3.52Å; H473-R622 PolarHBondContact O-N 3.19Å
474	H	92.3	Very high	83.2	Confident	22 Å²	22	39.4 Å²	39.4	10%	0.102	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.6	179.8	-63.2	-96	0	0	0	110.7	T472 A597 F598 T599 R622	T472-H474 PolarHBondContact OG1-NE2 2.96Å; H474-A597 PolarHBondContact N-O 2.94Å; H474-F598 HydrophobicContact CB-CD1 3.95Å; H474-F598 HydrophobicContact CB-CD2 3.76Å; H474-F598 HydrophobicContact CB-CE1 3.91Å; H474-F598 HydrophobicContact CB-CE2 3.74Å; H474-F598 HydrophobicContact CB-CG 3.89Å; H474-F598 HydrophobicContact CB-CZ 3.82Å; H474-F598 AromaticContact CD2-CE2 3.62Å; H474-F598 AromaticContact CG-CE2 3.63Å; H474-F598 AromaticContact CG-CZ 3.74Å; H474-F598 CarbonylContact O-C 3.57Å; H474-F598 WeakPolarHBondContact O-CA 3.39Å; H474-T599 PolarHBondContact O-N 2.83Å; H474-R622 VanDerWaalsContact CA-O 3.27Å; H474-R622 WeakPolarHBondContact CA-O 3.33Å
475	Y	93.2	Very high	84.6	Confident	16 Å²	16	36 Å²	36	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.5	168.2	82.2	-83.2	0	0	0	111.7	T599 L601 E606 L610 L621 R622 R623 H624	Y475-T599 CarbonylContact C-O 3.56Å; Y475-T599 VanDerWaalsContact CA-O 3.31Å; Y475-T599 WeakPolarHBondContact CA-O 3.33Å; Y475-L601 HydrophobicContact CD2-CD1 3.74Å; Y475-L601 HydrophobicContact CG-CD1 4.06Å; Y475-E606 HydrophobicContact CE2-CG 4Å; Y475-E606 WeakPolarHBondContact CE2-OE1 3.45Å; Y475-E606 PolarHBondContact OH-OE1 2.77Å; Y475-L610 HydrophobicContact CE1-CD2 4.27Å; Y475-L621 HydrophobicContact CD1-CD2 3.37Å; Y475-L621 HydrophobicContact CD1-CG 3.69Å; Y475-L621 HydrophobicContact CE1-CD2 3.99Å; Y475-L621 HydrophobicContact CE1-CG 4.4Å; Y475-L621 HydrophobicContact CG-CD2 3.97Å; Y475-R622 PolarHBondContact N-O 3.11Å; Y475-R623 HydrophobicContact CD1-CB 4.2Å; Y475-R623 VanDerWaalsContact CE1-CA 3.46Å; Y475-R623 HydrophobicContact CE1-CB 3.45Å; Y475-R623 VanDerWaalsContact CE1-CB 3.45Å; Y475-R623 HydrophobicContact CE1-CG 3.91Å; Y475-R623 HydrophobicContact CE2-CB 4.46Å; Y475-R623 HydrophobicContact CE2-CG 4.01Å; Y475-R623 WeakPolarHBondContact OH-CD 3.41Å; Y475-H624 PolarHBondContact O-N 3.47Å
476	V	92.8	Very high	85.9	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	113	-179.8	-176.1	0	0	0	0	108.5	C478 V486 F598 T599 L600 L601 H624 L626	V476-C478 PolarHBondContact O-N 3.08Å; V476-V486 HydrophobicContact CG1-CG1 4.12Å; V476-V486 HydrophobicContact CG1-CG2 4.38Å; V476-F598 HydrophobicContact CG2-CD1 3.78Å; V476-F598 HydrophobicContact CG2-CE1 4.27Å; V476-T599 PolarHBondContact N-O 2.8Å; V476-L600 HydrophobicContact CB-CD2 3.89Å; V476-L600 HydrophobicContact CG2-CD2 4.2Å; V476-L601 PolarHBondContact O-N 2.77Å; V476-H624 HydrophobicContact CG2-CB 4.09Å; V476-L626 HydrophobicContact CG1-CD1 3.63Å; V476-L626 HydrophobicContact CG1-CG 4.08Å
477	P	91.3	Very high	87.1	Confident	35 Å²	35	31.4 Å²	31.4	23%	0.227	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	119.6	172.1	28.8	-30.9	0	0	0	109.7	L601	P477-L601 WeakPolarHBondContact CA-O 3.25Å
478	C	89.9	Confident	88	Confident	14 Å²	14	29.9 Å²	29.9	10%	0.095	19%	0.186	C	C	.	.			trans	-143.6	161	-175.4	67	0	0	0	0	112.4	V476 S482 K483 V486 L601 L602	V476-C478 PolarHBondContact O-N 3.08Å; C478-S482 WeakPolarHBondContact CB-OG 3.25Å; C478-K483 WeakPolarHBondContact SG-CG 3.29Å; C478-V486 HydrophobicContact CB-CG2 4.26Å; C478-L601 PolarHBondContact N-O 3.27Å; C478-L602 WeakPolarHBondContact O-CD2 3.46Å
479	S	89.3	Confident	88.9	Confident	58 Å²	58	29.2 Å²	29.2	41%	0.406	18%	0.18	S	C	.	.			trans	-87.1	164.3	168.3	72.1	0	0	0	0	110.7	S481 S482 K483	S479-S481 VanDerWaalsContact C-N 3.32Å; S479-S481 PolarHBondContact O-N 2.9Å; S479-S481 PolarHBondContact OG-OG 3.14Å; S479-S482 PolarHBondContact N-OG 2.78Å; S479-S482 PolarHBondContact O-N 3.22Å; S479-S482 PolarHBondContact O-OG 2.81Å; S479-S482 WeakPolarHBondContact OG-CB 3.33Å; S479-S482 PolarHBondContact OG-N 2.97Å; S479-S482 PolarHBondContact OG-OG 3.45Å; S479-S482 VanDerWaalsContact OG-OG 3.04Å; S479-K483 PolarHBondContact O-N 2.73Å
480	L	87.5	Confident	89.8	Confident	121 Å²	121	23.5 Å²	23.5	63%	0.634	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-42	177.9	-73.3	171.1	0	0	0	113	S482 K483 L602	L480-S482 VanDerWaalsContact C-N 3.31Å; L480-S482 PolarHBondContact O-N 3.25Å; L480-K483 PolarHBondContact O-N 3.09Å; L480-L602 HydrophobicContact CD2-CD1 4Å; L480-L602 HydrophobicContact CD2-CD2 3.9Å; L480-L602 HydrophobicContact CG-CD1 4.31Å; L480-L602 HydrophobicContact CG-CD2 3.91Å
481	S	85.9	Confident	90.5	Very high	82 Å²	82	22.6 Å²	22.6	57%	0.573	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-30.9	179.8	51	0	0	0	0	112.8	S479 Y638	S479-S481 VanDerWaalsContact C-N 3.32Å; S479-S481 PolarHBondContact O-N 2.9Å; S479-S481 PolarHBondContact OG-OG 3.14Å; S481-Y638 PolarHBondContact O-OH 3.39Å
482	S	88.4	Confident	90.7	Very high	19 Å²	19	25.3 Å²	25.3	13%	0.133	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-15.4	179.6	65.4	0	0	0	0	114.3	C478 S479 L480 L485 V486	C478-S482 WeakPolarHBondContact CB-OG 3.25Å; S479-S482 PolarHBondContact N-OG 2.78Å; S479-S482 PolarHBondContact O-N 3.22Å; S479-S482 PolarHBondContact O-OG 2.81Å; S479-S482 WeakPolarHBondContact OG-CB 3.33Å; S479-S482 PolarHBondContact OG-N 2.97Å; S479-S482 PolarHBondContact OG-OG 3.45Å; S479-S482 VanDerWaalsContact OG-OG 3.04Å; L480-S482 VanDerWaalsContact C-N 3.31Å; L480-S482 PolarHBondContact O-N 3.25Å; S482-L485 WeakPolarHBondContact O-CB 3.35Å; S482-L485 PolarHBondContact O-N 2.89Å; S482-L485 VanDerWaalsContact O-N 3.12Å; S482-V486 WeakPolarHBondContact O-CG2 3.33Å; S482-V486 PolarHBondContact O-N 3.23Å
483	K	91.4	Very high	90.5	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-55	-47.9	-175.3	-79.4	-173.9	174.2	-157.5	0	113.5	C478 S479 L480 L485 V486 V487 Y572 D573 L600	C478-K483 WeakPolarHBondContact SG-CG 3.29Å; S479-K483 PolarHBondContact O-N 2.73Å; L480-K483 PolarHBondContact O-N 3.09Å; K483-L485 VanDerWaalsContact C-N 3.32Å; K483-L485 PolarHBondContact O-N 3.15Å; K483-V486 PolarHBondContact O-N 3.37Å; K483-V487 PolarHBondContact O-N 3.1Å; K483-Y572 HydrophobicContact CB-CD2 4.28Å; K483-Y572 HydrophobicContact CB-CE2 3.51Å; K483-Y572 HydrophobicContact CD-CE1 4.18Å; K483-Y572 HydrophobicContact CD-CE2 4.35Å; K483-Y572 PolarHBondContact NZ-O 2.96Å; K483-D573 IonicContact NZ-OD1 2.91Å; K483-D573 PolarHBondContact NZ-OD1 3.14Å; K483-L600 HydrophobicContact CB-CD1 4.21Å; K483-L600 HydrophobicContact CG-CD1 4.25Å
484	P	92.3	Very high	90.3	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.032	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-37.9	178.4	-25.3	38.1	0	0	0	112.5	V486 V487 L488 L512 L515 Y572 Y638	P484-V486 VanDerWaalsContact C-N 3.3Å; P484-V486 PolarHBondContact O-N 2.73Å; P484-V487 PolarHBondContact O-N 3.07Å; P484-V487 VanDerWaalsContact O-N 3.15Å; P484-L488 WeakPolarHBondContact O-CG 3.36Å; P484-L488 PolarHBondContact O-N 3.23Å; P484-L512 HydrophobicContact CB-CD1 4.17Å; P484-L512 HydrophobicContact CG-CD1 4.41Å; P484-L515 HydrophobicContact CB-CD2 3.68Å; P484-L515 HydrophobicContact CG-CD2 3.78Å; P484-Y572 HydrophobicContact CG-CE2 4.28Å; P484-Y572 WeakPolarHBondContact CG-OH 3.45Å; P484-Y638 HydrophobicContact CB-CE2 3.71Å; P484-Y638 HydrophobicContact CG-CE2 4.25Å; P484-Y638 WeakPolarHBondContact CG-OH 3.37Å
485	L	91.3	Very high	90.1	Very high	12 Å²	12	31.8 Å²	31.8	6%	0.063	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-40.4	176	-67.7	173	0	0	0	111.7	S482 K483 V487 L488 H489 L631 L634 V635 Y638	S482-L485 WeakPolarHBondContact O-CB 3.35Å; S482-L485 PolarHBondContact O-N 2.89Å; S482-L485 VanDerWaalsContact O-N 3.12Å; K483-L485 VanDerWaalsContact C-N 3.32Å; K483-L485 PolarHBondContact O-N 3.15Å; L485-V487 PolarHBondContact O-N 3.47Å; L485-L488 PolarHBondContact O-N 3.13Å; L485-H489 WeakPolarHBondContact O-CB 3.43Å; L485-H489 PolarHBondContact O-N 3.47Å; L485-L631 HydrophobicContact CB-CD2 4.15Å; L485-L634 HydrophobicContact CD2-CB 3.95Å; L485-V635 HydrophobicContact CD1-CG2 4.14Å; L485-Y638 HydrophobicContact CD1-CD1 4.09Å; L485-Y638 HydrophobicContact CD1-CE1 4.32Å; L485-Y638 VanDerWaalsContact CD2-CB 3.49Å; L485-Y638 HydrophobicContact CD2-CD1 3.85Å; L485-Y638 HydrophobicContact CD2-CD2 3.75Å; L485-Y638 HydrophobicContact CD2-CE1 4.5Å; L485-Y638 HydrophobicContact CD2-CE2 4.42Å; L485-Y638 HydrophobicContact CD2-CG 3.41Å; L485-Y638 VanDerWaalsContact CD2-CG 3.41Å; L485-Y638 HydrophobicContact CG-CD1 3.97Å; L485-Y638 HydrophobicContact CG-CD2 4.2Å; L485-Y638 HydrophobicContact CG-CE1 4.18Å; L485-Y638 HydrophobicContact CG-CE2 4.41Å; L485-Y638 HydrophobicContact CG-CG 3.97Å
486	V	91.8	Very high	90	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-44.5	174.9	175.2	0	0	0	0	111.2	V476 C478 S482 K483 P484 L488 H489 L490 L600 L626	V476-V486 HydrophobicContact CG1-CG1 4.12Å; V476-V486 HydrophobicContact CG1-CG2 4.38Å; C478-V486 HydrophobicContact CB-CG2 4.26Å; S482-V486 WeakPolarHBondContact O-CG2 3.33Å; S482-V486 PolarHBondContact O-N 3.23Å; K483-V486 PolarHBondContact O-N 3.37Å; P484-V486 VanDerWaalsContact C-N 3.3Å; P484-V486 PolarHBondContact O-N 2.73Å; V486-L488 VanDerWaalsContact C-N 3.33Å; V486-L488 PolarHBondContact O-N 3.02Å; V486-H489 PolarHBondContact O-N 3.44Å; V486-L490 HydrophobicContact CG1-CD1 4.25Å; V486-L490 HydrophobicContact CG1-CG 4.39Å; V486-L490 VanDerWaalsContact O-CG 3.29Å; V486-L490 WeakPolarHBondContact O-CG 3.27Å; V486-L490 PolarHBondContact O-N 2.93Å; V486-L600 HydrophobicContact CB-CD1 4.42Å; V486-L600 HydrophobicContact CB-CD2 4.27Å; V486-L600 HydrophobicContact CG1-CD1 4.41Å; V486-L600 HydrophobicContact CG1-CD2 3.49Å; V486-L600 VanDerWaalsContact CG1-CD2 3.49Å; V486-L626 HydrophobicContact CB-CD1 4.03Å; V486-L626 HydrophobicContact CG1-CD1 3.57Å; V486-L626 HydrophobicContact CG2-CD1 3.52Å
487	V	92.4	Very high	89.8	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-44.2	177.5	179.6	0	0	0	0	111.1	K483 P484 L485 L490 V491 L550 V570 Y572 L600	K483-V487 PolarHBondContact O-N 3.1Å; P484-V487 PolarHBondContact O-N 3.07Å; P484-V487 VanDerWaalsContact O-N 3.15Å; L485-V487 PolarHBondContact O-N 3.47Å; V487-L490 PolarHBondContact O-N 3.43Å; V487-V491 WeakPolarHBondContact O-CG2 3.49Å; V487-V491 PolarHBondContact O-N 3.46Å; V487-V491 VanDerWaalsContact O-N 3.16Å; V487-L550 HydrophobicContact CG1-CD1 4.24Å; V487-L550 HydrophobicContact CG1-CD2 3.9Å; V487-V570 HydrophobicContact CG2-CG1 4.23Å; V487-Y572 HydrophobicContact CG2-CD2 3.74Å; V487-Y572 HydrophobicContact CG2-CE2 4.29Å; V487-L600 HydrophobicContact CG2-CD1 4Å
488	L	91.4	Very high	89.8	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-42.9	177.5	-70.4	169.2	0	0	0	111.7	P484 L485 V486 L490 V491 L492 V516 F519 V522 L634	P484-L488 WeakPolarHBondContact O-CG 3.36Å; P484-L488 PolarHBondContact O-N 3.23Å; L485-L488 PolarHBondContact O-N 3.13Å; V486-L488 VanDerWaalsContact C-N 3.33Å; V486-L488 PolarHBondContact O-N 3.02Å; L488-L490 PolarHBondContact O-N 3.03Å; L488-V491 PolarHBondContact O-N 3.22Å; L488-L492 HydrophobicContact CB-CD1 4.49Å; L488-L492 VanDerWaalsContact O-CB 3.32Å; L488-L492 WeakPolarHBondContact O-CB 3.43Å; L488-L492 PolarHBondContact O-N 3.32Å; L488-V516 HydrophobicContact CD2-CG1 4.06Å; L488-V516 HydrophobicContact CD2-CG2 4.16Å; L488-F519 HydrophobicContact CD1-CB 4.37Å; L488-F519 HydrophobicContact CD1-CD1 3.93Å; L488-F519 HydrophobicContact CD1-CD2 3.82Å; L488-F519 HydrophobicContact CD1-CE1 4.17Å; L488-F519 HydrophobicContact CD1-CE2 4.03Å; L488-F519 HydrophobicContact CD1-CG 3.77Å; L488-F519 HydrophobicContact CD1-CZ 4.22Å; L488-F519 HydrophobicContact CD2-CD1 3.89Å; L488-F519 HydrophobicContact CD2-CE1 4.39Å; L488-F519 HydrophobicContact CD2-CG 4.3Å; L488-F519 HydrophobicContact CG-CD1 4.5Å; L488-V522 HydrophobicContact CD2-CG2 4.29Å; L488-L634 HydrophobicContact CB-CD1 4.49Å
489	H	90.7	Very high	90	Very high	10 Å²	10	35.2 Å²	35.2	5%	0.046	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-44.9	175.7	177	81.1	0	0	0	112.1	L485 V486 V491 E493 M494 L626 L631 L634	L485-H489 WeakPolarHBondContact O-CB 3.43Å; L485-H489 PolarHBondContact O-N 3.47Å; V486-H489 PolarHBondContact O-N 3.44Å; H489-V491 VanDerWaalsContact C-N 3.27Å; H489-V491 PolarHBondContact O-N 3.17Å; H489-E493 VanDerWaalsContact CE1-CD 3.42Å; H489-E493 IonicContact CE1-OE1 2.69Å; H489-E493 IonicContact CE1-OE2 3.34Å; H489-E493 PolarHBondContact CE1-OE2 3.24Å; H489-E493 IonicContact CG-OE1 3.17Å; H489-E493 IonicContact ND1-OE1 2.76Å; H489-E493 PolarHBondContact ND1-OE1 3.31Å; H489-E493 IonicContact ND1-OE2 3.08Å; H489-E493 PolarHBondContact ND1-OE2 3.22Å; H489-E493 WeakPolarHBondContact O-CB 3.5Å; H489-E493 PolarHBondContact O-N 3.01Å; H489-M494 PolarHBondContact O-N 3.14Å; H489-M494 VanDerWaalsContact O-N 3.16Å; H489-L626 VanDerWaalsContact CD2-CD2 3.5Å; H489-L626 WeakPolarHBondContact CD2-CD2 3.44Å; H489-L626 WeakPolarHBondContact NE2-CD2 3.49Å; H489-L631 HydrophobicContact CB-CD2 4.12Å; H489-L634 HydrophobicContact CB-CD1 4.24Å
490	L	90.6	Very high	90.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-36.7	176.7	-67.6	175	0	0	0	112	V486 V487 L488 M494 F496 L568 V570 F598	V486-L490 HydrophobicContact CG1-CD1 4.25Å; V486-L490 HydrophobicContact CG1-CG 4.39Å; V486-L490 VanDerWaalsContact O-CG 3.29Å; V486-L490 WeakPolarHBondContact O-CG 3.27Å; V486-L490 PolarHBondContact O-N 2.93Å; V487-L490 PolarHBondContact O-N 3.43Å; L488-L490 PolarHBondContact O-N 3.03Å; L490-M494 HydrophobicContact CD2-SD 3.49Å; L490-M494 WeakPolarHBondContact CD2-SD 3.44Å; L490-M494 WeakPolarHBondContact O-CB 3.42Å; L490-F496 HydrophobicContact CB-CD2 4.49Å; L490-F496 VanDerWaalsContact O-CD2 3.28Å; L490-F496 WeakPolarHBondContact O-CD2 3.3Å; L490-F496 PolarHBondContact O-N 3.47Å; L490-L568 HydrophobicContact CB-CD2 4.36Å; L490-L568 HydrophobicContact CD1-CD2 4.46Å; L490-V570 HydrophobicContact CD1-CG2 4.01Å; L490-F598 HydrophobicContact CD1-CB 4.29Å; L490-F598 HydrophobicContact CD1-CD1 4.09Å; L490-F598 HydrophobicContact CD1-CG 4.31Å; L490-F598 HydrophobicContact CD2-CD1 3.84Å; L490-F598 HydrophobicContact CD2-CE1 3.75Å; L490-F598 HydrophobicContact CD2-CZ 4.35Å
491	V	92.1	Very high	90.6	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.03	16%	0.156	C	C	.	.	H	α-helix	trans	-82.9	-48.3	-178.4	-179.3	0	0	0	0	111.7	V487 L488 H489 G495 V499 V522 Q549 L550	V487-V491 WeakPolarHBondContact O-CG2 3.49Å; V487-V491 PolarHBondContact O-N 3.46Å; V487-V491 VanDerWaalsContact O-N 3.16Å; L488-V491 PolarHBondContact O-N 3.22Å; H489-V491 VanDerWaalsContact C-N 3.27Å; H489-V491 PolarHBondContact O-N 3.17Å; V491-G495 WeakPolarHBondContact O-CA 3.37Å; V491-G495 PolarHBondContact O-N 3.05Å; V491-V499 HydrophobicContact CG2-CB 4.48Å; V491-V499 HydrophobicContact CG2-CG2 4.06Å; V491-V522 HydrophobicContact CB-CG2 4.37Å; V491-V522 HydrophobicContact CG1-CB 4.47Å; V491-V522 HydrophobicContact CG1-CG1 3.78Å; V491-V522 HydrophobicContact CG1-CG2 3.87Å; V491-Q549 HydrophobicContact CG1-CB 4.35Å; V491-L550 HydrophobicContact CG2-CD1 4.49Å
492	L	89.7	Confident	91.1	Very high	68 Å²	68	23.1 Å²	23.1	36%	0.356	13%	0.129	S	C	.	.	H	α-helix	trans	-83.4	-44.2	-170.6	-68.2	172.5	0	0	0	113.5	L488 F519 G521 V522	L488-L492 HydrophobicContact CB-CD1 4.49Å; L488-L492 VanDerWaalsContact O-CB 3.32Å; L488-L492 WeakPolarHBondContact O-CB 3.43Å; L488-L492 PolarHBondContact O-N 3.32Å; L492-F519 HydrophobicContact CD1-CD1 4.34Å; L492-F519 HydrophobicContact CD1-CE1 3.7Å; L492-G521 WeakPolarHBondContact CD2-O 3.12Å; L492-V522 HydrophobicContact CD1-CG2 4.18Å; L492-V522 HydrophobicContact CD2-CG2 3.54Å; L492-V522 HydrophobicContact CG-CG2 3.72Å
493	E	85.9	Confident	91.4	Very high	83 Å²	83	22.2 Å²	22.2	39%	0.388	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-42.7	-174.3	-70.7	178.9	-124.9	0	0	111.9	H489 G495	H489-E493 VanDerWaalsContact CE1-CD 3.42Å; H489-E493 IonicContact CE1-OE1 2.69Å; H489-E493 IonicContact CE1-OE2 3.34Å; H489-E493 PolarHBondContact CE1-OE2 3.24Å; H489-E493 IonicContact CG-OE1 3.17Å; H489-E493 IonicContact ND1-OE1 2.76Å; H489-E493 PolarHBondContact ND1-OE1 3.31Å; H489-E493 IonicContact ND1-OE2 3.08Å; H489-E493 PolarHBondContact ND1-OE2 3.22Å; H489-E493 WeakPolarHBondContact O-CB 3.5Å; H489-E493 PolarHBondContact O-N 3.01Å; E493-G495 VanDerWaalsContact C-N 3.25Å; E493-G495 PolarHBondContact O-N 3.39Å
494	M	87.1	Confident	91.3	Very high	74 Å²	74	25.7 Å²	25.7	37%	0.365	14%	0.142	S	C	.	.	S	Bend	trans	-79.7	-9.8	175	-60.7	-170.3	70.3	0	0	112.9	H489 L490 F496	H489-M494 PolarHBondContact O-N 3.14Å; H489-M494 VanDerWaalsContact O-N 3.16Å; L490-M494 HydrophobicContact CD2-SD 3.49Å; L490-M494 WeakPolarHBondContact CD2-SD 3.44Å; L490-M494 WeakPolarHBondContact O-CB 3.42Å; M494-F496 VanDerWaalsContact C-N 3.27Å; M494-F496 HydrophobicContact CB-CD2 3.71Å; M494-F496 HydrophobicContact CB-CE2 3.76Å; M494-F496 HydrophobicContact CE-CE2 3.57Å; M494-F496 HydrophobicContact CE-CZ 4.01Å; M494-F496 HydrophobicContact CG-CE2 4.45Å; M494-F496 PolarHBondContact O-N 3.24Å; M494-F496 HydrophobicContact SD-CD2 4.5Å; M494-F496 HydrophobicContact SD-CE2 3.86Å
495	G	87.6	Confident	91.3	Very high	55 Å²	55	27.1 Å²	27.1	57%	0.567	15%	0.152	S	C	*	.			trans	68.4	20.2	173.4	0	0	0	0	0	114.6	V491 E493 S497	V491-G495 WeakPolarHBondContact O-CA 3.37Å; V491-G495 PolarHBondContact O-N 3.05Å; E493-G495 VanDerWaalsContact C-N 3.25Å; E493-G495 PolarHBondContact O-N 3.39Å; G495-S497 PolarHBondContact O-N 2.97Å
496	F	89.6	Confident	91.2	Very high	15 Å²	15	31 Å²	31	7%	0.066	17%	0.166	C	C	.	.			trans	-66.2	131.8	-180	-74.9	-63.6	0	0	0	111.3	L490 M494 V499 E567 L568	L490-F496 HydrophobicContact CB-CD2 4.49Å; L490-F496 VanDerWaalsContact O-CD2 3.28Å; L490-F496 WeakPolarHBondContact O-CD2 3.3Å; L490-F496 PolarHBondContact O-N 3.47Å; M494-F496 VanDerWaalsContact C-N 3.27Å; M494-F496 HydrophobicContact CB-CD2 3.71Å; M494-F496 HydrophobicContact CB-CE2 3.76Å; M494-F496 HydrophobicContact CE-CE2 3.57Å; M494-F496 HydrophobicContact CE-CZ 4.01Å; M494-F496 HydrophobicContact CG-CE2 4.45Å; M494-F496 PolarHBondContact O-N 3.24Å; M494-F496 HydrophobicContact SD-CD2 4.5Å; M494-F496 HydrophobicContact SD-CE2 3.86Å; F496-V499 HydrophobicContact CB-CG2 3.83Å; F496-E567 HydrophobicContact CD1-CG 4.41Å; F496-E567 WeakPolarHBondContact CD1-OE1 3.5Å; F496-L568 HydrophobicContact CB-CB 4.44Å; F496-L568 HydrophobicContact CB-CD2 3.93Å; F496-L568 HydrophobicContact CD1-CB 4.37Å; F496-L568 HydrophobicContact CD1-CD2 4.47Å; F496-L568 HydrophobicContact CD2-CD2 3.6Å; F496-L568 HydrophobicContact CE2-CD2 4.18Å; F496-L568 HydrophobicContact CG-CB 4.35Å; F496-L568 HydrophobicContact CG-CD2 3.77Å
497	S	88.9	Confident	91.2	Very high	39 Å²	39	34.8 Å²	34.8	27%	0.273	18%	0.183	S	C	.	.			trans	-106.4	156.2	177.9	76.3	0	0	0	0	111.1	G495 V499 E567	G495-S497 PolarHBondContact O-N 2.97Å; S497-V499 PolarHBondContact O-N 3.07Å; S497-E567 PolarHBondContact N-OE2 3.08Å; S497-E567 VanDerWaalsContact O-CB 3.26Å; S497-E567 WeakPolarHBondContact O-CB 3.33Å; S497-E567 PolarHBondContact OG-OE2 3.05Å
498	R	92	Very high	91.2	Very high	84 Å²	84	37.4 Å²	37.4	32%	0.317	20%	0.197	S	C	.	.	S	Bend	trans	51.7	54	177.9	-60.9	172	-68	-107	-14	112.3	F543 Q549 G565 E567	R498-F543 HydrophobicContact CB-CE1 4.1Å; R498-F543 HydrophobicContact CB-CE2 4.29Å; R498-F543 HydrophobicContact CB-CZ 3.82Å; R498-F543 WeakPolarHBondContact O-CZ 3.4Å; R498-Q549 PolarHBondContact N-O 2.93Å; R498-G565 WeakPolarHBondContact CD-O 3.41Å; R498-G565 PolarHBondContact NE-O 3.37Å; R498-E567 IonicContact NH2-OE2 3.53Å; R498-E567 PolarHBondContact O-N 3Å
499	V	94.5	Very high	91.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	126	179.1	-174.8	0	0	0	0	110.1	V491 F496 S497 Q549 L550 L551 L568 V570	V491-V499 HydrophobicContact CG2-CB 4.48Å; V491-V499 HydrophobicContact CG2-CG2 4.06Å; F496-V499 HydrophobicContact CB-CG2 3.83Å; S497-V499 PolarHBondContact O-N 3.07Å; V499-Q549 PolarHBondContact N-O 2.91Å; V499-L550 HydrophobicContact CB-CD1 3.86Å; V499-L550 HydrophobicContact CG1-CD1 3.74Å; V499-L551 PolarHBondContact O-N 3.42Å; V499-L568 WeakPolarHBondContact CA-O 3.42Å; V499-L568 HydrophobicContact CG1-CB 4.35Å; V499-L568 HydrophobicContact CG1-CD2 3.92Å; V499-L568 HydrophobicContact CG1-CG 4.09Å; V499-L568 HydrophobicContact CG2-CB 4.22Å; V499-L568 HydrophobicContact CG2-CD2 4.08Å; V499-V570 HydrophobicContact CG1-CB 4.41Å; V499-V570 HydrophobicContact CG1-CG2 3.56Å
500	L	94.4	Very high	91.4	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.4	173.9	-178.7	63.1	0	0	0	110.2	F502 L551 V566 L568 V569 V570 R587	L500-F502 HydrophobicContact CD2-CE2 3.61Å; L500-F502 HydrophobicContact CD2-CZ 3.72Å; L500-F502 HydrophobicContact CG-CD2 4.37Å; L500-F502 HydrophobicContact CG-CE2 3.74Å; L500-F502 HydrophobicContact CG-CZ 4.15Å; L500-L551 HydrophobicContact CD1-CB 4.14Å; L500-L551 HydrophobicContact CD1-CD2 3.99Å; L500-L551 HydrophobicContact CD1-CG 4.14Å; L500-V566 HydrophobicContact CB-CG1 3.84Å; L500-L568 PolarHBondContact N-O 3.39Å; L500-V569 CarbonylContact O-C 3.54Å; L500-V569 WeakPolarHBondContact O-CA 3.45Å; L500-V570 PolarHBondContact O-N 3.47Å; L500-R587 HydrophobicContact CD2-CB 3.73Å; L500-R587 HydrophobicContact CD2-CG 3.85Å
501	C	95.4	Very high	91.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.1	-175.2	-179.7	0	0	0	0	112.2	L550 L551 I552 S553 V570	C501-L550 HydrophobicContact CB-CD1 3.75Å; C501-L551 PolarHBondContact N-O 3.06Å; C501-I552 HydrophobicContact CB-CG1 4.26Å; C501-I552 WeakPolarHBondContact O-CA 2.91Å; C501-S553 PolarHBondContact O-N 3.14Å; C501-V570 CarbonylContact C-O 3.58Å; C501-V570 VanDerWaalsContact CA-O 3.31Å; C501-V570 WeakPolarHBondContact CA-O 3.44Å; C501-V570 HydrophobicContact CB-CB 4.35Å
502	F	95.6	Very high	91.6	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.5	-178.4	-75	-87.1	0	0	0	112.9	L500 S553 A558 V569 V570 Y572 D573 R584 R587	L500-F502 HydrophobicContact CD2-CE2 3.61Å; L500-F502 HydrophobicContact CD2-CZ 3.72Å; L500-F502 HydrophobicContact CG-CD2 4.37Å; L500-F502 HydrophobicContact CG-CE2 3.74Å; L500-F502 HydrophobicContact CG-CZ 4.15Å; F502-S553 WeakPolarHBondContact CA-O 3.29Å; F502-A558 HydrophobicContact CD1-CB 4.23Å; F502-A558 HydrophobicContact CE1-CB 3.31Å; F502-A558 HydrophobicContact CZ-CB 3.8Å; F502-V569 HydrophobicContact CD2-CG1 3.81Å; F502-V569 HydrophobicContact CE2-CG1 3.79Å; F502-V570 PolarHBondContact N-O 3.37Å; F502-Y572 WeakPolarHBondContact O-CB 3.41Å; F502-Y572 PolarHBondContact O-N 3.18Å; F502-D573 PolarHBondContact O-N 3.11Å; F502-R584 HydrophobicContact CD1-CG 3.82Å; F502-R584 HydrophobicContact CD2-CB 3.99Å; F502-R584 HydrophobicContact CD2-CG 3.93Å; F502-R584 HydrophobicContact CE1-CG 3.86Å; F502-R584 HydrophobicContact CE2-CB 3.88Å; F502-R584 HydrophobicContact CE2-CG 4.01Å; F502-R584 HydrophobicContact CG-CB 4.41Å; F502-R584 HydrophobicContact CG-CG 3.84Å; F502-R584 HydrophobicContact CZ-CB 4.2Å; F502-R584 HydrophobicContact CZ-CG 3.99Å; F502-R587 HydrophobicContact CE2-CG 4.25Å; F502-R587 HydrophobicContact CZ-CG 3.91Å
503	T	94.6	Very high	91.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.6	171.8	67.2	0	0	0	0	111	S505 S509 L512 I552 S553 Y572	T503-S505 PolarHBondContact OG1-O 2.82Å; T503-S509 PolarHBondContact OG1-N 3.05Å; T503-S509 PolarHBondContact OG1-OG 3.11Å; T503-L512 HydrophobicContact CG2-CD2 4.17Å; T503-I552 HydrophobicContact CG2-CG2 4.15Å; T503-S553 PolarHBondContact N-O 3.42Å; T503-Y572 HydrophobicContact CG2-CD1 3.95Å; T503-Y572 HydrophobicContact CG2-CG 4.27Å
504	N	90.5	Very high	92.2	Very high	77 Å²	77	38.3 Å²	38.3	41%	0.412	20%	0.195	S	C	.	.	S	Bend	trans	-82.7	-21.7	-177.6	-76.1	-6.6	0	0	0	113.9	D573 R584	N504-D573 HydrophobicContact CB-CB 4.04Å; N504-D573 PolarHBondContact N-OD2 3.03Å; N504-D573 WeakPolarHBondContact ND2-CB 3.45Å; N504-D573 WeakPolarHBondContact OD1-CB 3.34Å; N504-R584 PolarHBondContact OD1-NH2 2.73Å
505	S	90.8	Very high	92.5	Very high	35 Å²	35	35.2 Å²	35.2	25%	0.245	18%	0.18	C	C	.	.	S	Bend	trans	-133.3	154.8	-179.3	75.7	0	0	0	0	112.2	T503 E507 N508 S509 T554	T503-S505 PolarHBondContact OG1-O 2.82Å; S505-E507 VanDerWaalsContact C-N 3.29Å; S505-E507 PolarHBondContact O-N 3.4Å; S505-N508 PolarHBondContact O-N 3.1Å; S505-N508 VanDerWaalsContact OG-CB 3.26Å; S505-N508 WeakPolarHBondContact OG-CB 3.38Å; S505-N508 PolarHBondContact OG-N 3.06Å; S505-N508 PolarHBondContact OG-ND2 3.35Å; S505-N508 PolarHBondContact OG-OD1 3.49Å; S505-S509 PolarHBondContact O-N 3.29Å; S505-S509 PolarHBondContact O-OG 3.42Å; S505-T554 VanDerWaalsContact C-CG2 3.49Å; S505-T554 WeakPolarHBondContact O-CG2 3.09Å
506	R	90.4	Very high	92.8	Very high	94 Å²	94	32.7 Å²	32.7	36%	0.355	15%	0.153	S	C	.	.	H	α-helix	trans	-67.5	-35	178.5	-173.3	178.2	67.7	158.6	-0.8	111.2	N508 S509 H510	R506-N508 VanDerWaalsContact C-N 3.34Å; R506-S509 WeakPolarHBondContact O-CB 3.39Å; R506-S509 PolarHBondContact O-N 3.11Å; R506-H510 WeakPolarHBondContact O-CB 3.14Å; R506-H510 PolarHBondContact O-N 2.91Å
507	E	90.6	Very high	93	Very high	81 Å²	81	37.3 Å²	37.3	38%	0.379	18%	0.175	S	C	.	.	H	α-helix	trans	-66.3	-39	177.2	-64.4	64.2	-136.5	0	0	110.5	S505 H510 R511	S505-E507 VanDerWaalsContact C-N 3.29Å; S505-E507 PolarHBondContact O-N 3.4Å; E507-H510 PolarHBondContact O-N 2.9Å; E507-R511 WeakPolarHBondContact O-CB 3.21Å; E507-R511 VanDerWaalsContact O-CG 3.26Å; E507-R511 WeakPolarHBondContact O-CG 3.39Å; E507-R511 PolarHBondContact O-N 3.31Å
508	N	92	Very high	93.1	Very high	56 Å²	56	37 Å²	37	30%	0.299	18%	0.175	S	C	.	.	H	α-helix	trans	-69.4	-40	174.6	-70.8	0.9	0	0	0	111.8	S505 R506 H510 R511 L512	S505-N508 PolarHBondContact O-N 3.1Å; S505-N508 VanDerWaalsContact OG-CB 3.26Å; S505-N508 WeakPolarHBondContact OG-CB 3.38Å; S505-N508 PolarHBondContact OG-N 3.06Å; S505-N508 PolarHBondContact OG-ND2 3.35Å; S505-N508 PolarHBondContact OG-OD1 3.49Å; R506-N508 VanDerWaalsContact C-N 3.34Å; N508-H510 VanDerWaalsContact C-N 3.28Å; N508-H510 PolarHBondContact O-N 2.89Å; N508-R511 PolarHBondContact O-N 3.37Å; N508-L512 VanDerWaalsContact O-CB 3.31Å; N508-L512 WeakPolarHBondContact O-CB 3.45Å; N508-L512 PolarHBondContact O-N 3.12Å
509	S	93.3	Very high	93.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55	-47.9	172.5	-64	0	0	0	0	111.1	T503 S505 R506 L512 F513 T554	T503-S509 PolarHBondContact OG1-N 3.05Å; T503-S509 PolarHBondContact OG1-OG 3.11Å; S505-S509 PolarHBondContact O-N 3.29Å; S505-S509 PolarHBondContact O-OG 3.42Å; R506-S509 WeakPolarHBondContact O-CB 3.39Å; R506-S509 PolarHBondContact O-N 3.11Å; S509-L512 PolarHBondContact O-N 3.28Å; S509-F513 WeakPolarHBondContact O-CB 3.23Å; S509-F513 PolarHBondContact O-N 3.44Å; S509-T554 VanDerWaalsContact OG-CG2 3.31Å; S509-T554 WeakPolarHBondContact OG-CG2 3.34Å
510	H	93.6	Very high	92.7	Very high	18 Å²	18	34.1 Å²	34.1	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-68.6	-44.4	-176.5	-174	62.5	0	0	0	112.4	R506 E507 N508 L512 F513 L514 E526 R530 E652	R506-H510 WeakPolarHBondContact O-CB 3.14Å; R506-H510 PolarHBondContact O-N 2.91Å; E507-H510 PolarHBondContact O-N 2.9Å; N508-H510 VanDerWaalsContact C-N 3.28Å; N508-H510 PolarHBondContact O-N 2.89Å; H510-L512 VanDerWaalsContact C-N 3.34Å; H510-L512 PolarHBondContact O-N 3.01Å; H510-F513 WeakPolarHBondContact O-CB 3.38Å; H510-F513 PolarHBondContact O-N 2.84Å; H510-L514 WeakPolarHBondContact O-CG 3.49Å; H510-L514 PolarHBondContact O-N 3.13Å; H510-E526 IonicContact CE1-OE2 3.63Å; H510-E526 IonicContact CG-OE2 3.01Å; H510-E526 IonicContact ND1-OE2 3.35Å; H510-E526 PolarHBondContact ND1-OE2 2.94Å; H510-R530 PolarHBondContact CD2-NH1 3.47Å; H510-R530 PolarHBondContact NE2-NH1 3.13Å; H510-E652 IonicContact CE1-OE1 2.78Å; H510-E652 IonicContact NE2-OE1 3.32Å; H510-E652 PolarHBondContact NE2-OE1 3.02Å; H510-E652 VanDerWaalsContact NE2-OE1 3.08Å; H510-E652 IonicContact NE2-OE2 3.72Å; H510-E652 PolarHBondContact NE2-OE2 3.44Å
511	R	92.6	Very high	92.3	Very high	116 Å²	116	36.9 Å²	36.9	44%	0.438	20%	0.199	S	C	.	.	H	α-helix	trans	-59.8	-43.9	174.6	-73.8	173.1	176.8	148	-2.8	112.1	E507 N508 F513 L514 L515 I649	E507-R511 WeakPolarHBondContact O-CB 3.21Å; E507-R511 VanDerWaalsContact O-CG 3.26Å; E507-R511 WeakPolarHBondContact O-CG 3.39Å; E507-R511 PolarHBondContact O-N 3.31Å; N508-R511 PolarHBondContact O-N 3.37Å; R511-F513 VanDerWaalsContact C-N 3.34Å; R511-L514 PolarHBondContact O-N 3.5Å; R511-L515 VanDerWaalsContact O-CB 3.29Å; R511-L515 WeakPolarHBondContact O-CB 3.35Å; R511-L515 PolarHBondContact O-N 3.4Å; R511-I649 HydrophobicContact CG-CD1 3.94Å
512	L	94.2	Very high	92.1	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-38.9	177.8	-175.8	63.3	0	0	0	111.3	P484 T503 N508 S509 H510 L515 V516 I552 Y572	P484-L512 HydrophobicContact CB-CD1 4.17Å; P484-L512 HydrophobicContact CG-CD1 4.41Å; T503-L512 HydrophobicContact CG2-CD2 4.17Å; N508-L512 VanDerWaalsContact O-CB 3.31Å; N508-L512 WeakPolarHBondContact O-CB 3.45Å; N508-L512 PolarHBondContact O-N 3.12Å; S509-L512 PolarHBondContact O-N 3.28Å; H510-L512 VanDerWaalsContact C-N 3.34Å; H510-L512 PolarHBondContact O-N 3.01Å; L512-L515 PolarHBondContact O-N 3.29Å; L512-V516 HydrophobicContact CD1-CG2 4.26Å; L512-V516 HydrophobicContact CG-CG2 4.5Å; L512-V516 VanDerWaalsContact O-CG2 3.29Å; L512-V516 WeakPolarHBondContact O-CG2 3.47Å; L512-V516 PolarHBondContact O-N 2.71Å; L512-I552 HydrophobicContact CB-CD1 4.14Å; L512-I552 HydrophobicContact CD2-CD1 4Å; L512-I552 HydrophobicContact CD2-CG1 4.27Å; L512-I552 HydrophobicContact CD2-CG2 4.17Å; L512-I552 HydrophobicContact CG-CD1 3.74Å; L512-Y572 HydrophobicContact CD1-CE2 3.99Å; L512-Y572 HydrophobicContact CD2-CD2 3.9Å; L512-Y572 HydrophobicContact CD2-CE2 4.11Å; L512-Y572 HydrophobicContact CD2-CG 4.14Å
513	F	95.3	Very high	92	Very high	25 Å²	25	41.5 Å²	41.5	11%	0.11	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-52	174.8	165.1	-101.8	0	0	0	112	S509 H510 R511 L515 V516 Q517 V524 E526 I552	S509-F513 WeakPolarHBondContact O-CB 3.23Å; S509-F513 PolarHBondContact O-N 3.44Å; H510-F513 WeakPolarHBondContact O-CB 3.38Å; H510-F513 PolarHBondContact O-N 2.84Å; R511-F513 VanDerWaalsContact C-N 3.34Å; F513-L515 VanDerWaalsContact C-N 3.3Å; F513-L515 PolarHBondContact O-N 2.82Å; F513-V516 PolarHBondContact O-N 2.68Å; F513-Q517 VanDerWaalsContact O-CB 3.31Å; F513-Q517 WeakPolarHBondContact O-CB 3.42Å; F513-Q517 PolarHBondContact O-N 3.16Å; F513-V524 HydrophobicContact CD2-CB 4.46Å; F513-V524 HydrophobicContact CD2-CG1 3.86Å; F513-V524 HydrophobicContact CD2-CG2 4.03Å; F513-V524 HydrophobicContact CE2-CG1 3.9Å; F513-E526 HydrophobicContact CB-CB 3.97Å; F513-E526 HydrophobicContact CD1-CB 4.31Å; F513-E526 HydrophobicContact CD2-CB 4.04Å; F513-E526 HydrophobicContact CG-CB 3.83Å; F513-I552 HydrophobicContact CB-CD1 4.06Å
514	L	93.8	Very high	92.1	Very high	24 Å²	24	42.7 Å²	42.7	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-40.5	178.3	-68.8	177.3	0	0	0	111.9	H510 R511 Q517 A518 L645 I649	H510-L514 WeakPolarHBondContact O-CG 3.49Å; H510-L514 PolarHBondContact O-N 3.13Å; R511-L514 PolarHBondContact O-N 3.5Å; L514-Q517 PolarHBondContact O-N 2.85Å; L514-A518 WeakPolarHBondContact O-CB 3.49Å; L514-A518 PolarHBondContact O-N 3.38Å; L514-L645 HydrophobicContact CB-CD1 3.4Å; L514-L645 VanDerWaalsContact CB-CD1 3.4Å; L514-L645 HydrophobicContact CD1-CD1 4.11Å; L514-L645 HydrophobicContact CG-CD1 4.42Å; L514-I649 HydrophobicContact CD1-CG1 4.4Å
515	L	93.4	Very high	92.3	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-47	179.1	-175.9	57.4	0	0	0	112.5	P484 R511 L512 F513 Q517 A518 F519 Y638 A641 L642 L645	P484-L515 HydrophobicContact CB-CD2 3.68Å; P484-L515 HydrophobicContact CG-CD2 3.78Å; R511-L515 VanDerWaalsContact O-CB 3.29Å; R511-L515 WeakPolarHBondContact O-CB 3.35Å; R511-L515 PolarHBondContact O-N 3.4Å; L512-L515 PolarHBondContact O-N 3.29Å; F513-L515 VanDerWaalsContact C-N 3.3Å; F513-L515 PolarHBondContact O-N 2.82Å; L515-Q517 VanDerWaalsContact C-N 3.31Å; L515-A518 PolarHBondContact O-N 2.94Å; L515-F519 WeakPolarHBondContact O-CB 3.4Å; L515-F519 PolarHBondContact O-N 3.17Å; L515-Y638 HydrophobicContact CD1-CD2 4.46Å; L515-Y638 HydrophobicContact CD1-CE2 4.06Å; L515-Y638 HydrophobicContact CD2-CE2 3.85Å; L515-Y638 HydrophobicContact CG-CE2 4.2Å; L515-A641 HydrophobicContact CD1-CB 4.09Å; L515-L642 HydrophobicContact CD1-CD2 3.8Å; L515-L642 HydrophobicContact CD1-CG 4.15Å; L515-L642 HydrophobicContact CD2-CD2 4.4Å; L515-L645 HydrophobicContact CB-CD2 4.12Å; L515-L645 HydrophobicContact CD1-CB 4.45Å; L515-L645 HydrophobicContact CD1-CD2 4.12Å; L515-L645 HydrophobicContact CG-CD2 4.49Å
516	V	93.5	Very high	92.4	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-36.6	177.7	175.2	0	0	0	0	110.6	L488 L512 F513 F519 G520 V522 V524 L550	L488-V516 HydrophobicContact CD2-CG1 4.06Å; L488-V516 HydrophobicContact CD2-CG2 4.16Å; L512-V516 HydrophobicContact CD1-CG2 4.26Å; L512-V516 HydrophobicContact CG-CG2 4.5Å; L512-V516 VanDerWaalsContact O-CG2 3.29Å; L512-V516 WeakPolarHBondContact O-CG2 3.47Å; L512-V516 PolarHBondContact O-N 2.71Å; F513-V516 PolarHBondContact O-N 2.68Å; V516-F519 PolarHBondContact O-N 3.49Å; V516-G520 PolarHBondContact O-N 3.34Å; V516-G520 VanDerWaalsContact O-N 3.13Å; V516-V522 HydrophobicContact CG1-CB 3.93Å; V516-V522 HydrophobicContact CG1-CG1 4.13Å; V516-V524 HydrophobicContact CB-CB 4.35Å; V516-V524 HydrophobicContact CB-CG1 4.18Å; V516-V524 HydrophobicContact CB-CG2 4.21Å; V516-V524 HydrophobicContact CG1-CB 3.78Å; V516-V524 HydrophobicContact CG1-CG1 3.9Å; V516-V524 HydrophobicContact CG1-CG2 4Å; V516-L550 HydrophobicContact CG1-CD2 4.16Å; V516-L550 HydrophobicContact CG2-CD2 4.18Å
517	Q	93.4	Very high	92.4	Very high	112 Å²	112	33.4 Å²	33.4	52%	0.523	19%	0.188	S	C	.	.	H	α-helix	trans	-64.1	-42.8	175.9	-171.8	176.4	16.5	0	0	112	F513 L514 L515 G520 V524	F513-Q517 VanDerWaalsContact O-CB 3.31Å; F513-Q517 WeakPolarHBondContact O-CB 3.42Å; F513-Q517 PolarHBondContact O-N 3.16Å; L514-Q517 PolarHBondContact O-N 2.85Å; L515-Q517 VanDerWaalsContact C-N 3.31Å; Q517-G520 PolarHBondContact O-N 3.34Å; Q517-V524 HydrophobicContact CB-CG1 4.11Å
518	A	91.4	Very high	92.3	Very high	32 Å²	32	29.5 Å²	29.5	26%	0.264	17%	0.17	S	C	.	.	H	α-helix	trans	-67.1	-39.1	176.3	0	0	0	0	0	112.4	L514 L515 G520 A641 Q644	L514-A518 WeakPolarHBondContact O-CB 3.49Å; L514-A518 PolarHBondContact O-N 3.38Å; L515-A518 PolarHBondContact O-N 2.94Å; A518-G520 VanDerWaalsContact C-N 3.3Å; A518-G520 PolarHBondContact O-N 3.48Å; A518-A641 HydrophobicContact CB-CB 4.07Å; A518-Q644 HydrophobicContact CB-CB 4.26Å
519	F	91.8	Very high	91.8	Very high	5 Å²	5	30.5 Å²	30.5	2%	0.022	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-41.7	175.8	-170.4	-92.1	0	0	0	111.8	L488 L492 L515 V516 L634 R637 A641	L488-F519 HydrophobicContact CD1-CB 4.37Å; L488-F519 HydrophobicContact CD1-CD1 3.93Å; L488-F519 HydrophobicContact CD1-CD2 3.82Å; L488-F519 HydrophobicContact CD1-CE1 4.17Å; L488-F519 HydrophobicContact CD1-CE2 4.03Å; L488-F519 HydrophobicContact CD1-CG 3.77Å; L488-F519 HydrophobicContact CD1-CZ 4.22Å; L488-F519 HydrophobicContact CD2-CD1 3.89Å; L488-F519 HydrophobicContact CD2-CE1 4.39Å; L488-F519 HydrophobicContact CD2-CG 4.3Å; L488-F519 HydrophobicContact CG-CD1 4.5Å; L492-F519 HydrophobicContact CD1-CD1 4.34Å; L492-F519 HydrophobicContact CD1-CE1 3.7Å; L515-F519 WeakPolarHBondContact O-CB 3.4Å; L515-F519 PolarHBondContact O-N 3.17Å; V516-F519 PolarHBondContact O-N 3.49Å; F519-L634 HydrophobicContact CZ-CB 4.29Å; F519-L634 HydrophobicContact CZ-CD2 3.91Å; F519-R637 HydrophobicContact CD2-CB 4.32Å; F519-R637 HydrophobicContact CD2-CG 4.05Å; F519-R637 HydrophobicContact CE2-CB 3.68Å; F519-R637 HydrophobicContact CE2-CG 3.79Å; F519-R637 HydrophobicContact CZ-CB 4.14Å; F519-R637 HydrophobicContact CZ-CG 4.15Å; F519-R637 VanDerWaalsContact O-CZ 3.24Å; F519-R637 PolarHBondContact O-NE 3.18Å; F519-R637 PolarHBondContact O-NH2 2.66Å; F519-A641 HydrophobicContact CB-CB 4.11Å; F519-A641 HydrophobicContact CD2-CB 4.37Å
520	G	87	Confident	91.4	Very high	20 Å²	20	34.1 Å²	34.1	21%	0.206	20%	0.195	C	C	.	.			trans	77	167.3	178.5	0	0	0	0	0	113.9	V516 Q517 A518 V522	V516-G520 PolarHBondContact O-N 3.34Å; V516-G520 VanDerWaalsContact O-N 3.13Å; Q517-G520 PolarHBondContact O-N 3.34Å; A518-G520 VanDerWaalsContact C-N 3.3Å; A518-G520 PolarHBondContact O-N 3.48Å; G520-V522 VanDerWaalsContact C-N 3.32Å; G520-V522 PolarHBondContact O-N 3Å
521	G	85.6	Confident	91	Very high	61 Å²	61	35.6 Å²	35.6	63%	0.629	20%	0.2	S	C	*	.	S	Bend	trans	84.7	-3.1	-178.4	0	0	0	0	0	115.3	L492	L492-G521 WeakPolarHBondContact CD2-O 3.12Å
522	V	90.8	Very high	90.5	Very high	12 Å²	12	31.9 Å²	31.9	7%	0.073	20%	0.197	C	C	.	.	S	Bend	trans	-126.8	126.4	173.9	179.8	0	0	0	0	109.8	L488 V491 L492 V516 G520 V524 Q549 L550	L488-V522 HydrophobicContact CD2-CG2 4.29Å; V491-V522 HydrophobicContact CB-CG2 4.37Å; V491-V522 HydrophobicContact CG1-CB 4.47Å; V491-V522 HydrophobicContact CG1-CG1 3.78Å; V491-V522 HydrophobicContact CG1-CG2 3.87Å; L492-V522 HydrophobicContact CD1-CG2 4.18Å; L492-V522 HydrophobicContact CD2-CG2 3.54Å; L492-V522 HydrophobicContact CG-CG2 3.72Å; V516-V522 HydrophobicContact CG1-CB 3.93Å; V516-V522 HydrophobicContact CG1-CG1 4.13Å; G520-V522 VanDerWaalsContact C-N 3.32Å; G520-V522 PolarHBondContact O-N 3Å; V522-V524 PolarHBondContact O-N 3.18Å; V522-V524 VanDerWaalsContact O-N 3.07Å; V522-Q549 HydrophobicContact CG1-CB 4.27Å; V522-L550 HydrophobicContact CG1-CB 3.89Å
523	D	94.3	Very high	89.8	Confident	89 Å²	89	35 Å²	35	48%	0.476	22%	0.218	S	C	.	.			trans	-73.7	99.3	170.3	-62.9	-57.7	0	0	0	109.7	K547 I548 Q549 L550	D523-K547 VanDerWaalsContact CB-O 3.22Å; D523-K547 WeakPolarHBondContact CB-O 2.99Å; D523-I548 WeakPolarHBondContact O-CG2 3.43Å; D523-Q549 HydrophobicContact CB-CG 4.28Å; D523-Q549 PolarHBondContact O-N 2.93Å; D523-Q549 PolarHBondContact OD2-NE2 2.93Å; D523-L550 PolarHBondContact O-N 2.81Å
524	V	95.4	Very high	89.3	Confident	24 Å²	24	36.4 Å²	36.4	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.6	-175.7	69	0	0	0	0	111.9	F513 V516 Q517 V522 L550 I552	F513-V524 HydrophobicContact CD2-CB 4.46Å; F513-V524 HydrophobicContact CD2-CG1 3.86Å; F513-V524 HydrophobicContact CD2-CG2 4.03Å; F513-V524 HydrophobicContact CE2-CG1 3.9Å; V516-V524 HydrophobicContact CB-CB 4.35Å; V516-V524 HydrophobicContact CB-CG1 4.18Å; V516-V524 HydrophobicContact CB-CG2 4.21Å; V516-V524 HydrophobicContact CG1-CB 3.78Å; V516-V524 HydrophobicContact CG1-CG1 3.9Å; V516-V524 HydrophobicContact CG1-CG2 4Å; Q517-V524 HydrophobicContact CB-CG1 4.11Å; V522-V524 PolarHBondContact O-N 3.18Å; V522-V524 VanDerWaalsContact O-N 3.07Å; V524-L550 CarbonylContact C-O 3.51Å; V524-L550 WeakPolarHBondContact CA-O 3.24Å; V524-L550 HydrophobicContact CB-CB 4.46Å; V524-L550 HydrophobicContact CG2-CB 4.12Å; V524-L550 HydrophobicContact CG2-CD2 3.91Å; V524-L550 HydrophobicContact CG2-CG 4.04Å; V524-I552 HydrophobicContact CG2-CD1 3.59Å; V524-I552 HydrophobicContact CG2-CG1 4.18Å
525	A	94.5	Very high	89	Confident	10 Å²	10	40 Å²	40	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.2	168.8	0	0	0	0	0	111.8	I539 I548 L550 L551 I552	A525-I539 HydrophobicContact CB-CG2 3.89Å; A525-I548 HydrophobicContact CB-CD1 3.7Å; A525-I548 HydrophobicContact CB-CG1 4.31Å; A525-I548 HydrophobicContact CB-CG2 3.89Å; A525-L550 PolarHBondContact N-O 2.9Å; A525-L551 HydrophobicContact CB-CD1 4.06Å; A525-I552 PolarHBondContact O-N 2.89Å
526	E	94	Very high	88.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130	169.5	-177.7	-166.7	161.3	0	0	110	H510 F513 S528 Y531	H510-E526 IonicContact CE1-OE2 3.63Å; H510-E526 IonicContact CG-OE2 3.01Å; H510-E526 IonicContact ND1-OE2 3.35Å; H510-E526 PolarHBondContact ND1-OE2 2.94Å; F513-E526 HydrophobicContact CB-CB 3.97Å; F513-E526 HydrophobicContact CD1-CB 4.31Å; F513-E526 HydrophobicContact CD2-CB 4.04Å; F513-E526 HydrophobicContact CG-CB 3.83Å; E526-S528 WeakPolarHBondContact OE1-CB 3.49Å; E526-S528 PolarHBondContact OE1-OG 2.82Å; E526-Y531 HydrophobicContact CB-CE2 3.86Å; E526-Y531 HydrophobicContact CG-CE2 4.05Å; E526-Y531 WeakPolarHBondContact O-CD2 3.49Å; E526-Y531 WeakPolarHBondContact O-CE2 3.07Å
527	F	90.5	Very high	88.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	99.4	167.4	-168	-84.7	0	0	0	110.1	R536 L540 L551 I552 S553 T557 I561	F527-R536 HydrophobicContact CD2-CB 4.41Å; F527-R536 HydrophobicContact CD2-CG 4.36Å; F527-R536 HydrophobicContact CE2-CB 3.61Å; F527-R536 HydrophobicContact CE2-CG 3.86Å; F527-R536 HydrophobicContact CZ-CB 4.06Å; F527-R536 HydrophobicContact CZ-CG 4.15Å; F527-L540 HydrophobicContact CD2-CD2 4.09Å; F527-L540 HydrophobicContact CD2-CG 4.25Å; F527-L540 HydrophobicContact CE2-CD1 3.84Å; F527-L540 HydrophobicContact CE2-CD2 3.94Å; F527-L540 HydrophobicContact CE2-CG 3.77Å; F527-L540 HydrophobicContact CZ-CD1 4.32Å; F527-L551 HydrophobicContact CB-CD1 3.92Å; F527-L551 HydrophobicContact CB-CG 4.24Å; F527-I552 PolarHBondContact N-O 3.25Å; F527-S553 PolarHBondContact O-OG 3.3Å; F527-T557 WeakPolarHBondContact CE1-O 3.22Å; F527-T557 PolarHBondContact O-OG1 3.36Å; F527-I561 HydrophobicContact CD1-CD1 3.47Å; F527-I561 VanDerWaalsContact CD1-CD1 3.47Å; F527-I561 HydrophobicContact CD2-CD1 4.28Å; F527-I561 HydrophobicContact CE1-CD1 3.16Å; F527-I561 HydrophobicContact CE1-CG1 4.04Å; F527-I561 HydrophobicContact CE2-CD1 3.99Å; F527-I561 HydrophobicContact CG-CD1 4.04Å; F527-I561 HydrophobicContact CZ-CD1 3.43Å; F527-I561 VanDerWaalsContact CZ-CD1 3.43Å; F527-I561 HydrophobicContact CZ-CG1 4.13Å
528	S	87.3	Confident	88.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.29	C	S	.	.	S	Bend	trans	-140.6	170.9	178.4	77.3	0	0	0	0	112.8	E526 R530 Y531	E526-S528 WeakPolarHBondContact OE1-CB 3.49Å; E526-S528 PolarHBondContact OE1-OG 2.82Å; S528-R530 PolarHBondContact O-N 2.94Å; S528-R530 VanDerWaalsContact O-N 3.16Å; S528-R530 WeakPolarHBondContact OG-CB 3.36Å; S528-R530 PolarHBondContact OG-N 2.81Å; S528-Y531 PolarHBondContact O-N 3.41Å
529	S	82.8	Confident	88.1	Confident	76 Å²	76	49.6 Å²	49.6	53%	0.531	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-6.7	176	57.5	0	0	0	0	114.1	Y531	S529-Y531 VanDerWaalsContact C-N 3.25Å; S529-Y531 PolarHBondContact O-N 3.41Å
530	R	83.7	Confident	87.9	Confident	77 Å²	77	50.8 Å²	50.8	29%	0.291	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30	174.7	-63.5	179.4	174	-148	0.4	111.8	H510 S528	H510-R530 PolarHBondContact CD2-NH1 3.47Å; H510-R530 PolarHBondContact NE2-NH1 3.13Å; S528-R530 PolarHBondContact O-N 2.94Å; S528-R530 VanDerWaalsContact O-N 3.16Å; S528-R530 WeakPolarHBondContact OG-CB 3.36Å; S528-R530 PolarHBondContact OG-N 2.81Å
531	Y	85.3	Confident	88	Confident	48 Å²	48	55.9 Å²	55.9	19%	0.188	30%	0.303	C	S	.	.	S	Bend	trans	-90.3	139.2	-177.4	-59.1	-67.1	0	0	0	112	E526 S528 S529 Q535 R536 I539	E526-Y531 HydrophobicContact CB-CE2 3.86Å; E526-Y531 HydrophobicContact CG-CE2 4.05Å; E526-Y531 WeakPolarHBondContact O-CD2 3.49Å; E526-Y531 WeakPolarHBondContact O-CE2 3.07Å; S528-Y531 PolarHBondContact O-N 3.41Å; S529-Y531 VanDerWaalsContact C-N 3.25Å; S529-Y531 PolarHBondContact O-N 3.41Å; Y531-Q535 HydrophobicContact CD1-CG 4.21Å; Y531-Q535 HydrophobicContact CG-CG 4.48Å; Y531-R536 PolarHBondContact O-NE 2.96Å; Y531-I539 HydrophobicContact CD2-CD1 4.44Å
532	G	83.6	Confident	88.3	Confident	38 Å²	38	55.7 Å²	55.7	39%	0.392	29%	0.286	S	S	.	.			trans	-62.7	160.1	175.1	0	0	0	0	0	112.8	G534 Q535 R536	G532-G534 VanDerWaalsContact C-N 3.27Å; G532-G534 PolarHBondContact O-N 2.97Å; G532-Q535 PolarHBondContact O-N 3.35Å; G532-R536 PolarHBondContact O-N 3.04Å
533	P	78.9	Confident	88.4	Confident	70 Å²	70	55.1 Å²	55.1	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-56.1	-36.2	-178.5	-24.9	33.3	0	0	0	114.5	R537	P533-R537 PolarHBondContact O-N 3.4Å; P533-R537 VanDerWaalsContact O-N 3.12Å
534	G	84.1	Confident	88.1	Confident	55 Å²	55	55.3 Å²	55.3	57%	0.567	28%	0.28	S	S	*	.	H	α-helix	trans	-66.6	-43.6	178.4	0	0	0	0	0	112.9	G532 R537 R538	G532-G534 VanDerWaalsContact C-N 3.27Å; G532-G534 PolarHBondContact O-N 2.97Å; G534-R537 PolarHBondContact O-N 3.22Å; G534-R538 PolarHBondContact O-N 3.11Å; G534-R538 VanDerWaalsContact O-N 3.1Å
535	Q	88.4	Confident	87.8	Confident	99 Å²	99	59 Å²	59	46%	0.463	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-42.2	178	-173.3	171.2	10	0	0	111.6	Y531 G532 R537 R538 I539	Y531-Q535 HydrophobicContact CD1-CG 4.21Å; Y531-Q535 HydrophobicContact CG-CG 4.48Å; G532-Q535 PolarHBondContact O-N 3.35Å; Q535-R537 VanDerWaalsContact C-N 3.29Å; Q535-R537 PolarHBondContact O-N 3.02Å; Q535-R538 WeakPolarHBondContact O-CB 3.38Å; Q535-R538 PolarHBondContact O-N 2.91Å; Q535-I539 HydrophobicContact CG-CD1 4.11Å; Q535-I539 WeakPolarHBondContact O-CG1 3.35Å; Q535-I539 PolarHBondContact O-N 2.89Å
536	R	86.6	Confident	87.5	Confident	32 Å²	32	60 Å²	60	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-57.3	-41.9	174	-72.2	-169.4	-64	150.3	6.7	112.1	E284 F527 Y531 G532 R538 I539 L540	E284-R536 VanDerWaalsContact CD-NH1 3.3Å; E284-R536 IonicContact OE1-CZ 3.17Å; E284-R536 IonicContact OE1-NH1 2.67Å; E284-R536 PolarHBondContact OE1-NH1 3.29Å; E284-R536 IonicContact OE1-NH2 2.74Å; E284-R536 PolarHBondContact OE1-NH2 3.49Å; F527-R536 HydrophobicContact CD2-CB 4.41Å; F527-R536 HydrophobicContact CD2-CG 4.36Å; F527-R536 HydrophobicContact CE2-CB 3.61Å; F527-R536 HydrophobicContact CE2-CG 3.86Å; F527-R536 HydrophobicContact CZ-CB 4.06Å; F527-R536 HydrophobicContact CZ-CG 4.15Å; Y531-R536 PolarHBondContact O-NE 2.96Å; G532-R536 PolarHBondContact O-N 3.04Å; R536-R538 PolarHBondContact O-N 3.16Å; R536-I539 PolarHBondContact O-N 3.02Å; R536-L540 WeakPolarHBondContact O-CG 3.46Å; R536-L540 PolarHBondContact O-N 3.13Å
537	R	84.1	Confident	87.4	Confident	139 Å²	139	65.9 Å²	65.9	53%	0.525	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-40.2	174.4	-169.3	-176.8	-59.6	-177.2	1.2	112.5	P533 G534 Q535 K541	P533-R537 PolarHBondContact O-N 3.4Å; P533-R537 VanDerWaalsContact O-N 3.12Å; G534-R537 PolarHBondContact O-N 3.22Å; Q535-R537 VanDerWaalsContact C-N 3.29Å; Q535-R537 PolarHBondContact O-N 3.02Å; R537-K541 WeakPolarHBondContact O-CB 3.37Å; R537-K541 PolarHBondContact O-N 3.02Å
538	R	89.6	Confident	87.5	Confident	172 Å²	172	66.4 Å²	66.4	65%	0.649	34%	0.336	S	S	*	.	H	α-helix	trans	-64.3	-45.4	176.8	-175.7	178.8	-179.8	165.6	1.2	111.6	G534 Q535 R536 K541 Q542	G534-R538 PolarHBondContact O-N 3.11Å; G534-R538 VanDerWaalsContact O-N 3.1Å; Q535-R538 WeakPolarHBondContact O-CB 3.38Å; Q535-R538 PolarHBondContact O-N 2.91Å; R536-R538 PolarHBondContact O-N 3.16Å; R538-K541 PolarHBondContact O-N 2.87Å; R538-Q542 WeakPolarHBondContact O-CB 3.48Å; R538-Q542 WeakPolarHBondContact O-CG 3.48Å; R538-Q542 PolarHBondContact O-N 2.72Å
539	I	91.5	Very high	87.8	Confident	13 Å²	13	69.2 Å²	69.2	7%	0.067	35%	0.35	C	S	.	.	H	α-helix	trans	-59.1	-48.6	177.4	-69.1	166.9	0	0	0	110.4	A525 Y531 Q535 R536 K541 Q542 F543 I548 L551	A525-I539 HydrophobicContact CB-CG2 3.89Å; Y531-I539 HydrophobicContact CD2-CD1 4.44Å; Q535-I539 HydrophobicContact CG-CD1 4.11Å; Q535-I539 WeakPolarHBondContact O-CG1 3.35Å; Q535-I539 PolarHBondContact O-N 2.89Å; R536-I539 PolarHBondContact O-N 3.02Å; I539-K541 PolarHBondContact O-N 3.36Å; I539-Q542 PolarHBondContact O-N 3.25Å; I539-F543 WeakPolarHBondContact O-CB 3.49Å; I539-F543 PolarHBondContact O-N 3.44Å; I539-I548 HydrophobicContact CG2-CD1 4.07Å; I539-L551 HydrophobicContact CG2-CD1 3.55Å
540	L	88.5	Confident	88.4	Confident	30 Å²	30	65.7 Å²	65.7	16%	0.157	33%	0.325	C	S	.	.	H	α-helix	trans	-60.5	-44.3	178.3	-67.7	174.7	0	0	0	112.2	F527 R536 Q542 F543 E544 L551 I561 V563	F527-L540 HydrophobicContact CD2-CD2 4.09Å; F527-L540 HydrophobicContact CD2-CG 4.25Å; F527-L540 HydrophobicContact CE2-CD1 3.84Å; F527-L540 HydrophobicContact CE2-CD2 3.94Å; F527-L540 HydrophobicContact CE2-CG 3.77Å; F527-L540 HydrophobicContact CZ-CD1 4.32Å; R536-L540 WeakPolarHBondContact O-CG 3.46Å; R536-L540 PolarHBondContact O-N 3.13Å; L540-Q542 VanDerWaalsContact C-N 3.33Å; L540-Q542 PolarHBondContact O-N 2.95Å; L540-F543 PolarHBondContact O-N 3.28Å; L540-E544 WeakPolarHBondContact O-CG 3.3Å; L540-E544 PolarHBondContact O-N 2.98Å; L540-L551 HydrophobicContact CD2-CD2 4.22Å; L540-I561 HydrophobicContact CD1-CG2 3.68Å; L540-I561 HydrophobicContact CD2-CD1 4.32Å; L540-I561 HydrophobicContact CD2-CG2 3.5Å; L540-I561 HydrophobicContact CG-CG2 4.24Å; L540-V563 HydrophobicContact CD2-CG2 4.04Å
541	K	89	Confident	89	Confident	127 Å²	127	62 Å²	62	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-63.1	-38.7	176.7	-171.6	176.4	-178.4	179.4	0	112.2	R537 R538 I539 Q545	R537-K541 WeakPolarHBondContact O-CB 3.37Å; R537-K541 PolarHBondContact O-N 3.02Å; R538-K541 PolarHBondContact O-N 2.87Å; I539-K541 PolarHBondContact O-N 3.36Å; K541-Q545 WeakPolarHBondContact O-CB 3.43Å; K541-Q545 WeakPolarHBondContact O-CG 3.46Å; K541-Q545 PolarHBondContact O-N 3.35Å
542	Q	92	Very high	89.4	Confident	57 Å²	57	59.7 Å²	59.7	27%	0.266	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-37.3	176.5	-75.8	173.9	-41.7	0	0	111.9	R538 I539 L540 Q545 G546 K547 I548	R538-Q542 WeakPolarHBondContact O-CB 3.48Å; R538-Q542 WeakPolarHBondContact O-CG 3.48Å; R538-Q542 PolarHBondContact O-N 2.72Å; I539-Q542 PolarHBondContact O-N 3.25Å; L540-Q542 VanDerWaalsContact C-N 3.33Å; L540-Q542 PolarHBondContact O-N 2.95Å; Q542-Q545 PolarHBondContact O-N 3.01Å; Q542-G546 PolarHBondContact O-N 3.19Å; Q542-K547 HydrophobicContact CB-CB 4.34Å; Q542-K547 HydrophobicContact CG-CD 4.44Å; Q542-K547 WeakPolarHBondContact O-CB 3.43Å; Q542-K547 PolarHBondContact O-N 2.86Å; Q542-I548 HydrophobicContact CB-CD1 3.54Å; Q542-I548 HydrophobicContact CB-CG1 4.01Å; Q542-I548 PolarHBondContact O-N 3.19Å
543	F	91.8	Very high	89.9	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-44.4	175.3	-175.6	-93	0	0	0	112.2	R498 I539 L540 Q545 G546 I548 L551 V563 V566	R498-F543 HydrophobicContact CB-CE1 4.1Å; R498-F543 HydrophobicContact CB-CE2 4.29Å; R498-F543 HydrophobicContact CB-CZ 3.82Å; R498-F543 WeakPolarHBondContact O-CZ 3.4Å; I539-F543 WeakPolarHBondContact O-CB 3.49Å; I539-F543 PolarHBondContact O-N 3.44Å; L540-F543 PolarHBondContact O-N 3.28Å; F543-Q545 VanDerWaalsContact C-N 3.27Å; F543-Q545 PolarHBondContact O-N 3.16Å; F543-G546 PolarHBondContact O-N 3.04Å; F543-I548 HydrophobicContact CB-CB 4.25Å; F543-I548 HydrophobicContact CB-CD1 4.45Å; F543-I548 HydrophobicContact CD2-CB 4.04Å; F543-I548 HydrophobicContact CD2-CG2 3.91Å; F543-I548 WeakPolarHBondContact CD2-O 3.19Å; F543-L551 HydrophobicContact CD1-CD2 4.39Å; F543-L551 HydrophobicContact CD2-CB 3.57Å; F543-L551 HydrophobicContact CD2-CD2 4.27Å; F543-L551 HydrophobicContact CD2-CG 4.42Å; F543-L551 HydrophobicContact CE2-CB 3.47Å; F543-L551 VanDerWaalsContact CE2-CB 3.47Å; F543-L551 HydrophobicContact CG-CB 4.29Å; F543-L551 HydrophobicContact CG-CD2 4.14Å; F543-L551 HydrophobicContact CZ-CB 4.13Å; F543-V563 HydrophobicContact CD1-CG1 3.25Å; F543-V563 HydrophobicContact CE1-CG1 3.29Å; F543-V566 HydrophobicContact CE1-CG2 4.09Å
544	E	88.5	Confident	90.5	Very high	93 Å²	93	55.2 Å²	55.2	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-59.7	-37.3	173.4	-74.1	168.6	-175	0	0	112.2	L540 G546	L540-E544 WeakPolarHBondContact O-CG 3.3Å; L540-E544 PolarHBondContact O-N 2.98Å; E544-G546 PolarHBondContact O-N 2.88Å
545	Q	89.8	Confident	90.6	Very high	101 Å²	101	53.9 Å²	53.9	47%	0.472	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-5.7	174.6	-73	174.5	3.5	0	0	113.8	K541 Q542 F543 K547	K541-Q545 WeakPolarHBondContact O-CB 3.43Å; K541-Q545 WeakPolarHBondContact O-CG 3.46Å; K541-Q545 PolarHBondContact O-N 3.35Å; Q542-Q545 PolarHBondContact O-N 3.01Å; F543-Q545 VanDerWaalsContact C-N 3.27Å; F543-Q545 PolarHBondContact O-N 3.16Å; Q545-K547 VanDerWaalsContact C-N 3.26Å; Q545-K547 HydrophobicContact CB-CG 4.27Å; Q545-K547 PolarHBondContact O-N 3.21Å
546	G	88	Confident	90	Very high	33 Å²	33	52.3 Å²	52.3	34%	0.34	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	9.1	-176.3	0	0	0	0	0	114.8	Q542 F543 E544 I548	Q542-G546 PolarHBondContact O-N 3.19Å; F543-G546 PolarHBondContact O-N 3.04Å; E544-G546 PolarHBondContact O-N 2.88Å; G546-I548 VanDerWaalsContact C-N 3.28Å
547	K	91.7	Very high	89.5	Confident	123 Å²	123	51.6 Å²	51.6	54%	0.535	25%	0.249	S	C	.	.	S	Bend	trans	-73.1	-22.9	175.8	-66.6	178.7	176.4	164.9	0	112.9	D523 Q542 Q545	D523-K547 VanDerWaalsContact CB-O 3.22Å; D523-K547 WeakPolarHBondContact CB-O 2.99Å; Q542-K547 HydrophobicContact CB-CB 4.34Å; Q542-K547 HydrophobicContact CG-CD 4.44Å; Q542-K547 WeakPolarHBondContact O-CB 3.43Å; Q542-K547 PolarHBondContact O-N 2.86Å; Q545-K547 VanDerWaalsContact C-N 3.26Å; Q545-K547 HydrophobicContact CB-CG 4.27Å; Q545-K547 PolarHBondContact O-N 3.21Å
548	I	92.9	Very high	89	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.062	22%	0.224	C	C	.	.			trans	-110.4	120.5	174	-62.6	164.5	0	0	0	106.1	D523 A525 I539 Q542 F543 G546 L550	D523-I548 WeakPolarHBondContact O-CG2 3.43Å; A525-I548 HydrophobicContact CB-CD1 3.7Å; A525-I548 HydrophobicContact CB-CG1 4.31Å; A525-I548 HydrophobicContact CB-CG2 3.89Å; I539-I548 HydrophobicContact CG2-CD1 4.07Å; Q542-I548 HydrophobicContact CB-CD1 3.54Å; Q542-I548 HydrophobicContact CB-CG1 4.01Å; Q542-I548 PolarHBondContact O-N 3.19Å; F543-I548 HydrophobicContact CB-CB 4.25Å; F543-I548 HydrophobicContact CB-CD1 4.45Å; F543-I548 HydrophobicContact CD2-CB 4.04Å; F543-I548 HydrophobicContact CD2-CG2 3.91Å; F543-I548 WeakPolarHBondContact CD2-O 3.19Å; G546-I548 VanDerWaalsContact C-N 3.28Å; I548-L550 WeakPolarHBondContact CG2-O 3.39Å
549	Q	93.5	Very high	88.3	Confident	59 Å²	59	38.4 Å²	38.4	28%	0.276	20%	0.199	S	C	.	.	S	Bend	trans	-83.4	-35.7	179.5	-62.5	175.6	24.3	0	0	111	V491 R498 V499 V522 D523	V491-Q549 HydrophobicContact CG1-CB 4.35Å; R498-Q549 PolarHBondContact N-O 2.93Å; V499-Q549 PolarHBondContact N-O 2.91Å; V522-Q549 HydrophobicContact CG1-CB 4.27Å; D523-Q549 HydrophobicContact CB-CG 4.28Å; D523-Q549 PolarHBondContact O-N 2.93Å; D523-Q549 PolarHBondContact OD2-NE2 2.93Å
550	L	95.2	Very high	87.1	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	117.6	-177.7	-179.5	64.6	0	0	0	111.8	V487 V491 V499 C501 V516 V522 D523 V524 A525 I548 I552	V487-L550 HydrophobicContact CG1-CD1 4.24Å; V487-L550 HydrophobicContact CG1-CD2 3.9Å; V491-L550 HydrophobicContact CG2-CD1 4.49Å; V499-L550 HydrophobicContact CB-CD1 3.86Å; V499-L550 HydrophobicContact CG1-CD1 3.74Å; C501-L550 HydrophobicContact CB-CD1 3.75Å; V516-L550 HydrophobicContact CG1-CD2 4.16Å; V516-L550 HydrophobicContact CG2-CD2 4.18Å; V522-L550 HydrophobicContact CG1-CB 3.89Å; D523-L550 PolarHBondContact O-N 2.81Å; V524-L550 CarbonylContact C-O 3.51Å; V524-L550 WeakPolarHBondContact CA-O 3.24Å; V524-L550 HydrophobicContact CB-CB 4.46Å; V524-L550 HydrophobicContact CG2-CB 4.12Å; V524-L550 HydrophobicContact CG2-CD2 3.91Å; V524-L550 HydrophobicContact CG2-CG 4.04Å; A525-L550 PolarHBondContact N-O 2.9Å; I548-L550 WeakPolarHBondContact CG2-O 3.39Å; L550-I552 HydrophobicContact CD2-CD1 4.24Å; L550-I552 HydrophobicContact CD2-CG1 4.23Å; L550-I552 HydrophobicContact CG-CG1 4.08Å
551	L	95.1	Very high	86.5	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.2	173.4	-171.7	64.7	0	0	0	110	V499 L500 C501 A525 F527 I539 L540 F543	V499-L551 PolarHBondContact O-N 3.42Å; L500-L551 HydrophobicContact CD1-CB 4.14Å; L500-L551 HydrophobicContact CD1-CD2 3.99Å; L500-L551 HydrophobicContact CD1-CG 4.14Å; C501-L551 PolarHBondContact N-O 3.06Å; A525-L551 HydrophobicContact CB-CD1 4.06Å; F527-L551 HydrophobicContact CB-CD1 3.92Å; F527-L551 HydrophobicContact CB-CG 4.24Å; I539-L551 HydrophobicContact CG2-CD1 3.55Å; L540-L551 HydrophobicContact CD2-CD2 4.22Å; F543-L551 HydrophobicContact CD1-CD2 4.39Å; F543-L551 HydrophobicContact CD2-CB 3.57Å; F543-L551 HydrophobicContact CD2-CD2 4.27Å; F543-L551 HydrophobicContact CD2-CG 4.42Å; F543-L551 HydrophobicContact CE2-CB 3.47Å; F543-L551 VanDerWaalsContact CE2-CB 3.47Å; F543-L551 HydrophobicContact CG-CB 4.29Å; F543-L551 HydrophobicContact CG-CD2 4.14Å; F543-L551 HydrophobicContact CZ-CB 4.13Å
552	I	95.3	Very high	85.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.1	-179.7	-58.3	164.2	0	0	0	109.3	C501 T503 L512 F513 V524 A525 F527 L550	C501-I552 HydrophobicContact CB-CG1 4.26Å; C501-I552 WeakPolarHBondContact O-CA 2.91Å; T503-I552 HydrophobicContact CG2-CG2 4.15Å; L512-I552 HydrophobicContact CB-CD1 4.14Å; L512-I552 HydrophobicContact CD2-CD1 4Å; L512-I552 HydrophobicContact CD2-CG1 4.27Å; L512-I552 HydrophobicContact CD2-CG2 4.17Å; L512-I552 HydrophobicContact CG-CD1 3.74Å; F513-I552 HydrophobicContact CB-CD1 4.06Å; V524-I552 HydrophobicContact CG2-CD1 3.59Å; V524-I552 HydrophobicContact CG2-CG1 4.18Å; A525-I552 PolarHBondContact O-N 2.89Å; F527-I552 PolarHBondContact N-O 3.25Å; L550-I552 HydrophobicContact CD2-CD1 4.24Å; L550-I552 HydrophobicContact CD2-CG1 4.23Å; L550-I552 HydrophobicContact CG-CG1 4.08Å
553	S	93.4	Very high	84.9	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.007	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	168.8	-178.2	-161.8	0	0	0	0	113	C501 F502 T503 F527 T557	C501-S553 PolarHBondContact O-N 3.14Å; F502-S553 WeakPolarHBondContact CA-O 3.29Å; T503-S553 PolarHBondContact N-O 3.42Å; F527-S553 PolarHBondContact O-OG 3.3Å; S553-T557 PolarHBondContact OG-OG1 3.49Å
554	T	91.9	Very high	84.2	Confident	13 Å²	13	37.2 Å²	37.2	8%	0.08	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	157.7	171.4	57.9	0	0	0	0	110.1	S505 S509 A556 T557 A558	S505-T554 VanDerWaalsContact C-CG2 3.49Å; S505-T554 WeakPolarHBondContact O-CG2 3.09Å; S509-T554 VanDerWaalsContact OG-CG2 3.31Å; S509-T554 WeakPolarHBondContact OG-CG2 3.34Å; T554-A556 VanDerWaalsContact C-N 3.25Å; T554-A556 PolarHBondContact O-N 3.01Å; T554-T557 PolarHBondContact N-OG1 3.12Å; T554-T557 PolarHBondContact O-N 2.87Å; T554-T557 VanDerWaalsContact O-N 3.11Å; T554-T557 PolarHBondContact O-OG1 2.64Å; T554-T557 PolarHBondContact OG1-OG1 3.22Å; T554-A558 WeakPolarHBondContact O-CB 3.36Å; T554-A558 PolarHBondContact O-N 3.37Å
555	D	85.2	Confident	83.8	Confident	27 Å²	27	34.4 Å²	34.4	14%	0.144	19%	0.194	C	C	.	.	H	α-helix	trans	-48.6	-48.4	174.4	-77	-56.7	0	0	0	112.4	T557 A558 R559 T580 R584	D555-T557 PolarHBondContact O-N 3.2Å; D555-A558 PolarHBondContact O-N 2.95Å; D555-R559 WeakPolarHBondContact O-CG 3.41Å; D555-R559 PolarHBondContact O-N 3.16Å; D555-T580 WeakPolarHBondContact OD1-CG2 3.03Å; D555-T580 WeakPolarHBondContact OD2-CG2 3.41Å; D555-R584 WeakPolarHBondContact OD1-CG 3.38Å; D555-R584 IonicContact OD1-CZ 3.09Å; D555-R584 IonicContact OD1-NE 2.73Å; D555-R584 PolarHBondContact OD1-NE 3.48Å; D555-R584 IonicContact OD1-NH2 3.95Å; D555-R584 IonicContact OD2-CZ 2.91Å; D555-R584 IonicContact OD2-NE 3.93Å; D555-R584 PolarHBondContact OD2-NE 3.35Å; D555-R584 IonicContact OD2-NH2 3.94Å; D555-R584 PolarHBondContact OD2-NH2 3.01Å
556	A	76.8	Confident	83.8	Confident	65 Å²	65	30 Å²	30	54%	0.537	17%	0.174	S	C	.	.	H	α-helix	trans	-57	-39.1	-175.7	0	0	0	0	0	112.9	T554	T554-A556 VanDerWaalsContact C-N 3.25Å; T554-A556 PolarHBondContact O-N 3.01Å
557	T	76.4	Confident	84	Confident	18 Å²	18	31.6 Å²	31.6	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-90.2	-34.1	-174.5	51.9	0	0	0	0	112.7	F527 S553 T554 D555 I561	F527-T557 WeakPolarHBondContact CE1-O 3.22Å; F527-T557 PolarHBondContact O-OG1 3.36Å; S553-T557 PolarHBondContact OG-OG1 3.49Å; T554-T557 PolarHBondContact N-OG1 3.12Å; T554-T557 PolarHBondContact O-N 2.87Å; T554-T557 VanDerWaalsContact O-N 3.11Å; T554-T557 PolarHBondContact O-OG1 2.64Å; T554-T557 PolarHBondContact OG1-OG1 3.22Å; D555-T557 PolarHBondContact O-N 3.2Å; T557-I561 VanDerWaalsContact O-CD1 3.29Å; T557-I561 WeakPolarHBondContact O-CD1 3.48Å; T557-I561 VanDerWaalsContact O-CG1 3.28Å; T557-I561 WeakPolarHBondContact O-CG1 3.41Å
558	A	74.1	Confident	84.1	Confident	2 Å²	2	25.8 Å²	25.8	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-77.9	-19.5	177.9	0	0	0	0	0	114.5	F502 T554 D555 G560 I561	F502-A558 HydrophobicContact CD1-CB 4.23Å; F502-A558 HydrophobicContact CE1-CB 3.31Å; F502-A558 HydrophobicContact CZ-CB 3.8Å; T554-A558 WeakPolarHBondContact O-CB 3.36Å; T554-A558 PolarHBondContact O-N 3.37Å; D555-A558 PolarHBondContact O-N 2.95Å; A558-G560 PolarHBondContact O-N 3.38Å; A558-I561 HydrophobicContact CB-CD1 4.47Å; A558-I561 PolarHBondContact O-N 3.44Å
559	R	74.3	Confident	84.1	Confident	31 Å²	31	25.2 Å²	25.2	12%	0.117	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	133.9	172.8	-58.5	-124	-172.9	127	0.4	109.9	R367 D555 I561 T580	R367-R559 VanDerWaalsContact CZ-NH1 3.26Å; D555-R559 WeakPolarHBondContact O-CG 3.41Å; D555-R559 PolarHBondContact O-N 3.16Å; R559-I561 PolarHBondContact O-N 3.04Å; R559-T580 PolarHBondContact NH2-OG1 3.17Å
560	G	65.5	Low	84.2	Confident	3 Å²	3	22.4 Å²	22.4	3%	0.031	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	2.5	-179.4	0	0	0	0	0	114.9	A558	A558-G560 PolarHBondContact O-N 3.38Å
561	I	75.9	Confident	84.3	Confident	8 Å²	8	22.3 Å²	22.3	4%	0.041	13%	0.131	C	C	.	.			trans	-81.3	122.7	163.2	-46.7	179.8	0	0	0	108.2	F527 L540 T557 A558 R559 V563 R587	F527-I561 HydrophobicContact CD1-CD1 3.47Å; F527-I561 VanDerWaalsContact CD1-CD1 3.47Å; F527-I561 HydrophobicContact CD2-CD1 4.28Å; F527-I561 HydrophobicContact CE1-CD1 3.16Å; F527-I561 HydrophobicContact CE1-CG1 4.04Å; F527-I561 HydrophobicContact CE2-CD1 3.99Å; F527-I561 HydrophobicContact CG-CD1 4.04Å; F527-I561 HydrophobicContact CZ-CD1 3.43Å; F527-I561 VanDerWaalsContact CZ-CD1 3.43Å; F527-I561 HydrophobicContact CZ-CG1 4.13Å; L540-I561 HydrophobicContact CD1-CG2 3.68Å; L540-I561 HydrophobicContact CD2-CD1 4.32Å; L540-I561 HydrophobicContact CD2-CG2 3.5Å; L540-I561 HydrophobicContact CG-CG2 4.24Å; T557-I561 VanDerWaalsContact O-CD1 3.29Å; T557-I561 WeakPolarHBondContact O-CD1 3.48Å; T557-I561 VanDerWaalsContact O-CG1 3.28Å; T557-I561 WeakPolarHBondContact O-CG1 3.41Å; A558-I561 HydrophobicContact CB-CD1 4.47Å; A558-I561 PolarHBondContact O-N 3.44Å; R559-I561 PolarHBondContact O-N 3.04Å; I561-V563 HydrophobicContact CB-CG2 4.07Å; I561-V563 HydrophobicContact CG2-CG2 3.28Å; I561-R587 PolarHBondContact O-NH1 3.44Å
562	D	71.8	Confident	84.3	Confident	54 Å²	54	23.8 Å²	23.8	29%	0.289	14%	0.136	S	C	.	.			trans	-89.6	102.8	164.1	-174	28.4	0	0	0	109.7	Q288 R590	Q288-D562 PolarHBondContact NE2-OD2 2.9Å; Q288-D562 VanDerWaalsContact NE2-OD2 3.08Å; D562-R590 IonicContact OD1-CZ 3.73Å; D562-R590 IonicContact OD1-NH1 2.68Å; D562-R590 PolarHBondContact OD1-NH1 3.1Å
563	V	76.3	Confident	84.2	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.024	14%	0.142	C	C	.	.			trans	-109.4	114.4	175.2	-167.7	0	0	0	0	106.5	L540 F543 I561 V566	L540-V563 HydrophobicContact CD2-CG2 4.04Å; F543-V563 HydrophobicContact CD1-CG1 3.25Å; F543-V563 HydrophobicContact CE1-CG1 3.29Å; I561-V563 HydrophobicContact CB-CG2 4.07Å; I561-V563 HydrophobicContact CG2-CG2 3.28Å; V563-V566 HydrophobicContact CB-CG2 3.85Å; V563-V566 HydrophobicContact CG1-CG2 3.78Å
564	Q	75.9	Confident	84.1	Confident	133 Å²	133	25.3 Å²	25.3	62%	0.621	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	145.4	178.8	-61.2	-173.1	2.1	0	0	110.2	V566	Q564-V566 PolarHBondContact O-N 2.97Å
565	G	81.2	Confident	84	Confident	35 Å²	35	25 Å²	25	36%	0.361	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	21.8	172.7	0	0	0	0	0	115.7	R498 E567	R498-G565 WeakPolarHBondContact CD-O 3.41Å; R498-G565 PolarHBondContact NE-O 3.37Å; G565-E567 PolarHBondContact O-N 3.19Å
566	V	89.9	Confident	84.1	Confident	8 Å²	8	29.3 Å²	29.3	5%	0.048	16%	0.163	C	C	.	.			trans	-64.2	114.3	169.6	-178.6	0	0	0	0	108.8	L500 F543 V563 Q564 L568 V569 T588	L500-V566 HydrophobicContact CB-CG1 3.84Å; F543-V566 HydrophobicContact CE1-CG2 4.09Å; V563-V566 HydrophobicContact CB-CG2 3.85Å; V563-V566 HydrophobicContact CG1-CG2 3.78Å; Q564-V566 PolarHBondContact O-N 2.97Å; V566-L568 WeakPolarHBondContact CG1-O 3.47Å; V566-V569 HydrophobicContact CG1-CG2 3.92Å; V566-T588 WeakPolarHBondContact O-CB 3.4Å; V566-T588 PolarHBondContact O-OG1 3.33Å
567	E	91.4	Very high	84.6	Confident	67 Å²	67	33.4 Å²	33.4	31%	0.313	17%	0.166	S	C	.	.			trans	-81.4	-44	-179	-168.1	-179.7	157.9	0	0	111.1	F496 S497 R498 G565 T588 Q596	F496-E567 HydrophobicContact CD1-CG 4.41Å; F496-E567 WeakPolarHBondContact CD1-OE1 3.5Å; S497-E567 PolarHBondContact N-OE2 3.08Å; S497-E567 VanDerWaalsContact O-CB 3.26Å; S497-E567 WeakPolarHBondContact O-CB 3.33Å; S497-E567 PolarHBondContact OG-OE2 3.05Å; R498-E567 IonicContact NH2-OE2 3.53Å; R498-E567 PolarHBondContact O-N 3Å; G565-E567 PolarHBondContact O-N 3.19Å; E567-T588 PolarHBondContact O-OG1 2.85Å; E567-Q596 PolarHBondContact O-N 3.07Å; E567-Q596 VanDerWaalsContact O-N 3.11Å
568	L	93.4	Very high	85	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	130.7	-175.5	174.6	65.9	0	0	0	111	L490 F496 V499 L500 V566 V570 Q596 F598	L490-L568 HydrophobicContact CB-CD2 4.36Å; L490-L568 HydrophobicContact CD1-CD2 4.46Å; F496-L568 HydrophobicContact CB-CB 4.44Å; F496-L568 HydrophobicContact CB-CD2 3.93Å; F496-L568 HydrophobicContact CD1-CB 4.37Å; F496-L568 HydrophobicContact CD1-CD2 4.47Å; F496-L568 HydrophobicContact CD2-CD2 3.6Å; F496-L568 HydrophobicContact CE2-CD2 4.18Å; F496-L568 HydrophobicContact CG-CB 4.35Å; F496-L568 HydrophobicContact CG-CD2 3.77Å; V499-L568 WeakPolarHBondContact CA-O 3.42Å; V499-L568 HydrophobicContact CG1-CB 4.35Å; V499-L568 HydrophobicContact CG1-CD2 3.92Å; V499-L568 HydrophobicContact CG1-CG 4.09Å; V499-L568 HydrophobicContact CG2-CB 4.22Å; V499-L568 HydrophobicContact CG2-CD2 4.08Å; L500-L568 PolarHBondContact N-O 3.39Å; V566-L568 WeakPolarHBondContact CG1-O 3.47Å; L568-V570 HydrophobicContact CD1-CG2 4.41Å; L568-V570 HydrophobicContact CD2-CG2 3.74Å; L568-V570 HydrophobicContact CG-CG2 3.84Å; L568-Q596 WeakPolarHBondContact CA-O 3.45Å; L568-Q596 HydrophobicContact CD1-CB 3.9Å; L568-F598 HydrophobicContact CD1-CB 4.22Å; L568-F598 HydrophobicContact CD1-CD2 3.33Å; L568-F598 HydrophobicContact CD1-CE2 3.99Å; L568-F598 HydrophobicContact CD1-CG 4.07Å
569	V	94.4	Very high	85.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.3	166.2	172.8	0	0	0	0	109.1	L500 F502 V566 R584 R587 T588 Q596 A597 F598	L500-V569 CarbonylContact O-C 3.54Å; L500-V569 WeakPolarHBondContact O-CA 3.45Å; F502-V569 HydrophobicContact CD2-CG1 3.81Å; F502-V569 HydrophobicContact CE2-CG1 3.79Å; V566-V569 HydrophobicContact CG1-CG2 3.92Å; V569-R584 HydrophobicContact CG1-CB 4.42Å; V569-R587 HydrophobicContact CG2-CB 3.99Å; V569-T588 HydrophobicContact CB-CG2 4.34Å; V569-T588 HydrophobicContact CG2-CG2 3.75Å; V569-Q596 PolarHBondContact N-O 3.02Å; V569-A597 CarbonylContact O-C 3.56Å; V569-A597 WeakPolarHBondContact O-CA 3.35Å; V569-F598 PolarHBondContact O-N 3.18Å
570	V	95.7	Very high	85.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.3	175.2	-178.9	0	0	0	0	109.7	V487 L490 V499 L500 C501 F502 L568 Y572 F598 L600	V487-V570 HydrophobicContact CG2-CG1 4.23Å; L490-V570 HydrophobicContact CD1-CG2 4.01Å; V499-V570 HydrophobicContact CG1-CB 4.41Å; V499-V570 HydrophobicContact CG1-CG2 3.56Å; L500-V570 PolarHBondContact O-N 3.47Å; C501-V570 CarbonylContact C-O 3.58Å; C501-V570 VanDerWaalsContact CA-O 3.31Å; C501-V570 WeakPolarHBondContact CA-O 3.44Å; C501-V570 HydrophobicContact CB-CB 4.35Å; F502-V570 PolarHBondContact N-O 3.37Å; L568-V570 HydrophobicContact CD1-CG2 4.41Å; L568-V570 HydrophobicContact CD2-CG2 3.74Å; L568-V570 HydrophobicContact CG-CG2 3.84Å; V570-Y572 PolarHBondContact O-N 3.46Å; V570-F598 CarbonylContact C-O 3.52Å; V570-F598 WeakPolarHBondContact CA-O 3.37Å; V570-L600 HydrophobicContact CG1-CG 4.41Å
571	N	95.8	Very high	87	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	87.9	167.4	-61.8	-46.9	0	0	0	108.5	D573 R584 F598 T599 L600	N571-D573 VanDerWaalsContact C-N 3.29Å; N571-D573 PolarHBondContact O-N 2.82Å; N571-R584 WeakPolarHBondContact OD1-CD 3.48Å; N571-R584 PolarHBondContact OD1-NH1 3.29Å; N571-F598 PolarHBondContact N-O 3.25Å; N571-T599 HydrophobicContact CB-CG2 3.86Å; N571-T599 PolarHBondContact ND2-OG1 2.85Å; N571-L600 PolarHBondContact O-N 3.42Å
572	Y	95.3	Very high	87.4	Confident	31 Å²	31	35.3 Å²	35.3	12%	0.122	17%	0.174	C	C	.	.	S	Bend	trans	-61.3	-42	176.6	179.6	-91.3	0	0	0	111.4	K483 P484 V487 F502 T503 L512 V570 L600	K483-Y572 HydrophobicContact CB-CD2 4.28Å; K483-Y572 HydrophobicContact CB-CE2 3.51Å; K483-Y572 HydrophobicContact CD-CE1 4.18Å; K483-Y572 HydrophobicContact CD-CE2 4.35Å; K483-Y572 PolarHBondContact NZ-O 2.96Å; P484-Y572 HydrophobicContact CG-CE2 4.28Å; P484-Y572 WeakPolarHBondContact CG-OH 3.45Å; V487-Y572 HydrophobicContact CG2-CD2 3.74Å; V487-Y572 HydrophobicContact CG2-CE2 4.29Å; F502-Y572 WeakPolarHBondContact O-CB 3.41Å; F502-Y572 PolarHBondContact O-N 3.18Å; T503-Y572 HydrophobicContact CG2-CD1 3.95Å; T503-Y572 HydrophobicContact CG2-CG 4.27Å; L512-Y572 HydrophobicContact CD1-CE2 3.99Å; L512-Y572 HydrophobicContact CD2-CD2 3.9Å; L512-Y572 HydrophobicContact CD2-CE2 4.11Å; L512-Y572 HydrophobicContact CD2-CG 4.14Å; V570-Y572 PolarHBondContact O-N 3.46Å; Y572-L600 HydrophobicContact CD2-CD1 3.93Å
573	D	93.4	Very high	88	Confident	21 Å²	21	32.9 Å²	32.9	11%	0.112	16%	0.161	C	C	.	.	S	Bend	trans	-105.6	126.1	166.7	-67.9	-43.6	0	0	0	110	K483 F502 N504 N571 R584	K483-D573 IonicContact NZ-OD1 2.91Å; K483-D573 PolarHBondContact NZ-OD1 3.14Å; F502-D573 PolarHBondContact O-N 3.11Å; N504-D573 HydrophobicContact CB-CB 4.04Å; N504-D573 PolarHBondContact N-OD2 3.03Å; N504-D573 WeakPolarHBondContact ND2-CB 3.45Å; N504-D573 WeakPolarHBondContact OD1-CB 3.34Å; N571-D573 VanDerWaalsContact C-N 3.29Å; N571-D573 PolarHBondContact O-N 2.82Å; D573-R584 PolarHBondContact O-NH1 3.49Å
574	A	91.7	Very high	88.5	Confident	11 Å²	11	32.7 Å²	32.7	9%	0.091	16%	0.159	C	C	.	.			trans	-58.8	130.6	178.5	0	0	0	0	0	111	T599 L601	A574-T599 HydrophobicContact CB-CG2 4.29Å; A574-L601 HydrophobicContact CB-CD2 3.54Å
575	P	90.7	Very high	89.1	Confident	6 Å²	6	26.3 Å²	26.3	4%	0.039	13%	0.13	C	C	.	.			trans	-67.7	138.7	175.5	27.2	-32	0	0	0	110.6	Y577 T580 Y581 F609	P575-Y577 VanDerWaalsContact C-N 3.35Å; P575-T580 HydrophobicContact CB-CG2 3.81Å; P575-Y581 HydrophobicContact CG-CD2 3.87Å; P575-Y581 HydrophobicContact CG-CG 4.26Å; P575-F609 HydrophobicContact CG-CE2 4.03Å
576	Q	86.8	Confident	89.1	Confident	119 Å²	119	24.8 Å²	24.8	56%	0.556	11%	0.114	S	C	*	.	S	Bend	trans	-77.4	-22.4	-179.1	-62.1	-178.8	8.3	0	0	113.6
577	Y	86	Confident	89	Confident	151 Å²	151	25 Å²	25	59%	0.592	11%	0.114	S	C	*	.	S	Bend	trans	-131.2	142.6	-175.2	-54.9	-74.3	0	0	0	109.9	P575 R579 T580 Y581 M612	P575-Y577 VanDerWaalsContact C-N 3.35Å; Y577-R579 VanDerWaalsContact C-N 3.31Å; Y577-R579 PolarHBondContact O-N 3.13Å; Y577-T580 WeakPolarHBondContact O-CB 3.37Å; Y577-T580 PolarHBondContact O-N 2.99Å; Y577-Y581 PolarHBondContact O-N 3.15Å; Y577-M612 VanDerWaalsContact C-SD 3.58Å
578	L	84.9	Confident	88.8	Confident	21 Å²	21	21.9 Å²	21.9	11%	0.11	10%	0.099	C	C	.	.	H	α-helix	trans	-57.6	-42.1	-179	178.9	62.6	0	0	0	112.8	Y465 F467 T580 Y581 V582 M612 L613 A616	Y465-L578 HydrophobicContact CD2-CD2 3.36Å; Y465-L578 HydrophobicContact CD2-CG 4.13Å; Y465-L578 HydrophobicContact CE2-CD2 3.35Å; Y465-L578 HydrophobicContact CE2-CG 4.16Å; Y465-L578 HydrophobicContact CG-CD2 4.22Å; F467-L578 HydrophobicContact CZ-CD1 4.4Å; L578-T580 PolarHBondContact O-N 3.5Å; L578-Y581 HydrophobicContact CD1-CD1 4.49Å; L578-Y581 WeakPolarHBondContact O-CA 3.48Å; L578-Y581 VanDerWaalsContact O-CB 3.29Å; L578-Y581 WeakPolarHBondContact O-CB 3.42Å; L578-Y581 PolarHBondContact O-N 3.44Å; L578-V582 HydrophobicContact CD1-CG2 4.46Å; L578-V582 HydrophobicContact CG-CG2 4.42Å; L578-V582 WeakPolarHBondContact O-CG2 3.4Å; L578-V582 PolarHBondContact O-N 3.28Å; L578-M612 HydrophobicContact CB-CG 3.88Å; L578-M612 HydrophobicContact CB-SD 4.09Å; L578-M612 PolarHBondContact N-SD 3.16Å; L578-L613 HydrophobicContact CD1-CD2 3.88Å; L578-A616 HydrophobicContact CD1-CB 3.52Å; L578-A616 HydrophobicContact CD2-CB 3.26Å; L578-A616 HydrophobicContact CG-CB 3.98Å
579	R	80.7	Confident	88.3	Confident	51 Å²	51	22.1 Å²	22.1	19%	0.192	10%	0.101	C	C	.	.	H	α-helix	trans	-55.3	-40.2	176.2	178	168.1	166.3	-139	-11.8	112.4	D366 D370 T425 Y577 H583	D366-R579 PolarHBondContact O-NH2 3.46Å; D366-R579 IonicContact OD2-CZ 2.73Å; D366-R579 IonicContact OD2-NE 2.79Å; D366-R579 PolarHBondContact OD2-NE 3.49Å; D366-R579 IonicContact OD2-NH2 3.22Å; D366-R579 PolarHBondContact OD2-NH2 3.18Å; D370-R579 IonicContact OD2-CZ 3.76Å; D370-R579 IonicContact OD2-NH1 3.65Å; D370-R579 PolarHBondContact OD2-NH1 3.39Å; D370-R579 IonicContact OD2-NH2 3.41Å; D370-R579 PolarHBondContact OD2-NH2 3.43Å; T425-R579 VanDerWaalsContact OG1-CD 3.31Å; T425-R579 WeakPolarHBondContact OG1-CD 3.02Å; T425-R579 WeakPolarHBondContact OG1-CG 3.26Å; T425-R579 PolarHBondContact OG1-NE 3.13Å; Y577-R579 VanDerWaalsContact C-N 3.31Å; Y577-R579 PolarHBondContact O-N 3.13Å; R579-H583 PolarHBondContact O-CD2 3.37Å; R579-H583 VanDerWaalsContact O-CG 3.23Å; R579-H583 PolarHBondContact O-N 3.1Å; R579-H583 VanDerWaalsContact O-N 3.15Å
580	T	86.7	Confident	87.6	Confident	19 Å²	19	24.1 Å²	24.1	12%	0.117	11%	0.109	C	C	.	.	H	α-helix	trans	-66	-42.6	175.3	-59.7	0	0	0	0	110.8	D555 R559 P575 Y577 L578 H583 R584	D555-T580 WeakPolarHBondContact OD1-CG2 3.03Å; D555-T580 WeakPolarHBondContact OD2-CG2 3.41Å; R559-T580 PolarHBondContact NH2-OG1 3.17Å; P575-T580 HydrophobicContact CB-CG2 3.81Å; Y577-T580 WeakPolarHBondContact O-CB 3.37Å; Y577-T580 PolarHBondContact O-N 2.99Å; L578-T580 PolarHBondContact O-N 3.5Å; T580-H583 PolarHBondContact O-N 3.05Å; T580-R584 HydrophobicContact CG2-CG 4.42Å; T580-R584 WeakPolarHBondContact O-CG 3.44Å; T580-R584 PolarHBondContact O-N 3.1Å
581	Y	88.8	Confident	86.4	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.1	-50.1	175.6	179.5	-102.3	0	0	0	112.3	F467 H473 P575 Y577 L578 H583 R584 A585 F609 L613	F467-Y581 HydrophobicContact CE1-CD1 4.12Å; F467-Y581 HydrophobicContact CE1-CE1 4.08Å; H473-Y581 AromaticContact ND1-CE1 3.91Å; H473-Y581 AromaticContact ND1-CZ 3.68Å; H473-Y581 PolarHBondContact ND1-OH 3.48Å; P575-Y581 HydrophobicContact CG-CD2 3.87Å; P575-Y581 HydrophobicContact CG-CG 4.26Å; Y577-Y581 PolarHBondContact O-N 3.15Å; L578-Y581 HydrophobicContact CD1-CD1 4.49Å; L578-Y581 WeakPolarHBondContact O-CA 3.48Å; L578-Y581 VanDerWaalsContact O-CB 3.29Å; L578-Y581 WeakPolarHBondContact O-CB 3.42Å; L578-Y581 PolarHBondContact O-N 3.44Å; Y581-H583 VanDerWaalsContact C-N 3.27Å; Y581-H583 PolarHBondContact O-N 3.08Å; Y581-R584 PolarHBondContact O-N 3.19Å; Y581-R584 VanDerWaalsContact O-N 3.15Å; Y581-A585 WeakPolarHBondContact O-CB 3.47Å; Y581-A585 PolarHBondContact O-N 3.18Å; Y581-F609 HydrophobicContact CD2-CE2 4.19Å; Y581-F609 AromaticContact CD2-CZ 3.91Å; Y581-F609 HydrophobicContact CD2-CZ 3.91Å; Y581-F609 AromaticContact CE2-CZ 3.81Å; Y581-F609 HydrophobicContact CE2-CZ 3.81Å; Y581-L613 HydrophobicContact CD1-CD2 3.54Å; Y581-L613 HydrophobicContact CE1-CD2 3.47Å; Y581-L613 VanDerWaalsContact CE1-CD2 3.47Å; Y581-L613 HydrophobicContact CG-CD2 4.16Å
582	V	85.2	Confident	85.2	Confident	10 Å²	10	27.6 Å²	27.6	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-54.3	-44.4	177.3	175.5	0	0	0	0	110.8	T425 Y465 F467 L578 G586	T425-V582 HydrophobicContact CG2-CG1 4.11Å; Y465-V582 HydrophobicContact CD1-CG2 4.11Å; Y465-V582 HydrophobicContact CG-CG2 4.25Å; F467-V582 HydrophobicContact CE1-CB 4.39Å; F467-V582 HydrophobicContact CE1-CG2 3.59Å; F467-V582 HydrophobicContact CZ-CG2 3.6Å; L578-V582 HydrophobicContact CD1-CG2 4.46Å; L578-V582 HydrophobicContact CG-CG2 4.42Å; L578-V582 WeakPolarHBondContact O-CG2 3.4Å; L578-V582 PolarHBondContact O-N 3.28Å; V582-G586 PolarHBondContact O-N 2.72Å
583	H	83	Confident	84.5	Confident	3 Å²	3	32.7 Å²	32.7	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-70.7	-31.4	-179	-67.8	177.2	0	0	0	114.7	D366 R579 T580 Y581 R587	D366-H583 IonicContact OD2-CE1 3.77Å; D366-H583 PolarHBondContact OD2-CE1 3.35Å; D366-H583 VanDerWaalsContact OD2-CE1 3.22Å; D366-H583 IonicContact OD2-NE2 2.93Å; R579-H583 PolarHBondContact O-CD2 3.37Å; R579-H583 VanDerWaalsContact O-CG 3.23Å; R579-H583 PolarHBondContact O-N 3.1Å; R579-H583 VanDerWaalsContact O-N 3.15Å; T580-H583 PolarHBondContact O-N 3.05Å; Y581-H583 VanDerWaalsContact C-N 3.27Å; Y581-H583 PolarHBondContact O-N 3.08Å; H583-R587 PolarHBondContact O-NE 3.36Å
584	R	88.7	Confident	84.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-73.7	-51	174.7	-69	-175	-174.1	-176.5	1.6	110	F502 N504 D555 V569 N571 D573 T580 Y581 G586 R587	F502-R584 HydrophobicContact CD1-CG 3.82Å; F502-R584 HydrophobicContact CD2-CB 3.99Å; F502-R584 HydrophobicContact CD2-CG 3.93Å; F502-R584 HydrophobicContact CE1-CG 3.86Å; F502-R584 HydrophobicContact CE2-CB 3.88Å; F502-R584 HydrophobicContact CE2-CG 4.01Å; F502-R584 HydrophobicContact CG-CB 4.41Å; F502-R584 HydrophobicContact CG-CG 3.84Å; F502-R584 HydrophobicContact CZ-CB 4.2Å; F502-R584 HydrophobicContact CZ-CG 3.99Å; N504-R584 PolarHBondContact OD1-NH2 2.73Å; D555-R584 WeakPolarHBondContact OD1-CG 3.38Å; D555-R584 IonicContact OD1-CZ 3.09Å; D555-R584 IonicContact OD1-NE 2.73Å; D555-R584 PolarHBondContact OD1-NE 3.48Å; D555-R584 IonicContact OD1-NH2 3.95Å; D555-R584 IonicContact OD2-CZ 2.91Å; D555-R584 IonicContact OD2-NE 3.93Å; D555-R584 PolarHBondContact OD2-NE 3.35Å; D555-R584 IonicContact OD2-NH2 3.94Å; D555-R584 PolarHBondContact OD2-NH2 3.01Å; V569-R584 HydrophobicContact CG1-CB 4.42Å; N571-R584 WeakPolarHBondContact OD1-CD 3.48Å; N571-R584 PolarHBondContact OD1-NH1 3.29Å; D573-R584 PolarHBondContact O-NH1 3.49Å; T580-R584 HydrophobicContact CG2-CG 4.42Å; T580-R584 WeakPolarHBondContact O-CG 3.44Å; T580-R584 PolarHBondContact O-N 3.1Å; Y581-R584 PolarHBondContact O-N 3.19Å; Y581-R584 VanDerWaalsContact O-N 3.15Å; R584-G586 VanDerWaalsContact C-N 3.3Å; R584-G586 PolarHBondContact O-N 3.42Å; R584-R587 VanDerWaalsContact O-CB 3.25Å; R584-R587 WeakPolarHBondContact O-CB 3.45Å; R584-R587 WeakPolarHBondContact O-CG 3.4Å; R584-R587 PolarHBondContact O-N 3.36Å
585	A	86.9	Confident	84.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-34.4	-178.4	0	0	0	0	0	111.9	L471 Y581 R587 T588 A597	L471-A585 HydrophobicContact CD2-CB 3.79Å; Y581-A585 WeakPolarHBondContact O-CB 3.47Å; Y581-A585 PolarHBondContact O-N 3.18Å; A585-R587 PolarHBondContact O-N 3.23Å; A585-T588 VanDerWaalsContact O-CG2 3.24Å; A585-T588 WeakPolarHBondContact O-CG2 3.15Å; A585-T588 PolarHBondContact O-N 3.37Å; A585-T588 VanDerWaalsContact O-N 3.11Å; A585-A597 HydrophobicContact CB-CB 4.07Å
586	G	82.4	Confident	84.1	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	5.7	172.5	0	0	0	0	0	115.8	T250 V582 R584 R590	T250-G586 VanDerWaalsContact OG1-CA 3.25Å; T250-G586 WeakPolarHBondContact OG1-CA 3.34Å; T250-G586 PolarHBondContact OG1-O 3.09Å; V582-G586 PolarHBondContact O-N 2.72Å; R584-G586 VanDerWaalsContact C-N 3.3Å; R584-G586 PolarHBondContact O-N 3.42Å; G586-R590 PolarHBondContact O-NE 3.28Å; G586-R590 PolarHBondContact O-NH2 3.32Å
587	R	86.3	Confident	84.4	Confident	12 Å²	12	34.1 Å²	34.1	5%	0.045	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-23.8	167	-59.1	-72.9	142.3	-170	-2.6	112.2	L500 F502 I561 V569 H583 R584 A585 R590	L500-R587 HydrophobicContact CD2-CB 3.73Å; L500-R587 HydrophobicContact CD2-CG 3.85Å; F502-R587 HydrophobicContact CE2-CG 4.25Å; F502-R587 HydrophobicContact CZ-CG 3.91Å; I561-R587 PolarHBondContact O-NH1 3.44Å; V569-R587 HydrophobicContact CG2-CB 3.99Å; H583-R587 PolarHBondContact O-NE 3.36Å; R584-R587 VanDerWaalsContact O-CB 3.25Å; R584-R587 WeakPolarHBondContact O-CB 3.45Å; R584-R587 WeakPolarHBondContact O-CG 3.4Å; R584-R587 PolarHBondContact O-N 3.36Å; A585-R587 PolarHBondContact O-N 3.23Å; R587-R590 VanDerWaalsContact NH1-NH2 3.11Å; R587-R590 PolarHBondContact O-NE 2.9Å
588	T	88.4	Confident	84.9	Confident	2 Å²	2	27 Å²	27	1%	0.012	15%	0.149	C	C	.	.	S	Bend	trans	-105.2	-179.2	169.3	-171.9	0	0	0	0	110.3	L471 V566 E567 V569 A585 R590 G595	L471-T588 HydrophobicContact CD1-CG2 3.5Å; V566-T588 WeakPolarHBondContact O-CB 3.4Å; V566-T588 PolarHBondContact O-OG1 3.33Å; E567-T588 PolarHBondContact O-OG1 2.85Å; V569-T588 HydrophobicContact CB-CG2 4.34Å; V569-T588 HydrophobicContact CG2-CG2 3.75Å; A585-T588 VanDerWaalsContact O-CG2 3.24Å; A585-T588 WeakPolarHBondContact O-CG2 3.15Å; A585-T588 PolarHBondContact O-N 3.37Å; A585-T588 VanDerWaalsContact O-N 3.11Å; T588-R590 PolarHBondContact O-N 3.29Å; T588-R590 VanDerWaalsContact O-N 3.12Å; T588-G595 WeakPolarHBondContact OG1-CA 3.34Å
589	A	82.9	Confident	85.3	Confident	5 Å²	5	26 Å²	26	4%	0.041	14%	0.144	C	C	.	.	S	Bend	trans	50.7	35.7	-178.9	0	0	0	0	0	114.5	P468 L471 K593	P468-A589 HydrophobicContact CB-CB 3.98Å; P468-A589 WeakPolarHBondContact CB-O 3.34Å; P468-A589 HydrophobicContact CG-CB 4.43Å; L471-A589 HydrophobicContact CB-CB 3.9Å; L471-A589 HydrophobicContact CD1-CB 4.18Å; A589-K593 CarbonylContact C-O 3.6Å; A589-K593 WeakPolarHBondContact CA-O 3.45Å; A589-K593 WeakPolarHBondContact CB-O 3.39Å
590	R	79	Confident	86	Confident	42 Å²	42	23.6 Å²	23.6	16%	0.158	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-81.7	148.5	179.8	-67.3	-177	171.6	-162.6	-2.6	111.2	D562 G586 R587 T588 G592 K593	D562-R590 IonicContact OD1-CZ 3.73Å; D562-R590 IonicContact OD1-NH1 2.68Å; D562-R590 PolarHBondContact OD1-NH1 3.1Å; G586-R590 PolarHBondContact O-NE 3.28Å; G586-R590 PolarHBondContact O-NH2 3.32Å; R587-R590 VanDerWaalsContact NH1-NH2 3.11Å; R587-R590 PolarHBondContact O-NE 2.9Å; T588-R590 PolarHBondContact O-N 3.29Å; T588-R590 VanDerWaalsContact O-N 3.12Å; R590-G592 PolarHBondContact O-N 2.67Å; R590-G592 VanDerWaalsContact O-N 3.16Å; R590-K593 PolarHBondContact O-N 3.2Å; R590-K593 VanDerWaalsContact O-N 3.13Å
591	A	70.9	Confident	86.3	Confident	49 Å²	49	22.7 Å²	22.7	41%	0.405	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	49.3	38.7	-177.1	0	0	0	0	0	111.8	N185 F214 K593	N185-A591 PolarHBondContact OD1-O 3.25Å; F214-A591 HydrophobicContact CZ-CB 4.01Å; A591-K593 PolarHBondContact O-N 2.74Å; A591-K593 VanDerWaalsContact O-N 3.13Å
592	G	70.1	Confident	86.5	Confident	25 Å²	25	24.2 Å²	24.2	26%	0.258	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	53.4	26.9	-178.3	0	0	0	0	0	117.4	N185 R590	N185-G592 WeakPolarHBondContact ND2-CA 3.41Å; N185-G592 PolarHBondContact ND2-O 3.37Å; N185-G592 WeakPolarHBondContact OD1-CA 3.27Å; R590-G592 PolarHBondContact O-N 2.67Å; R590-G592 VanDerWaalsContact O-N 3.16Å
593	K	81.3	Confident	86.7	Confident	137 Å²	137	34.1 Å²	34.1	60%	0.596	17%	0.173	S	C	*	.			trans	-65.4	158.6	157.6	-63.9	-177.2	179.7	-176.6	0	110.1	A589 R590 A591	A589-K593 CarbonylContact C-O 3.6Å; A589-K593 WeakPolarHBondContact CA-O 3.45Å; A589-K593 WeakPolarHBondContact CB-O 3.39Å; R590-K593 PolarHBondContact O-N 3.2Å; R590-K593 VanDerWaalsContact O-N 3.13Å; A591-K593 PolarHBondContact O-N 2.74Å; A591-K593 VanDerWaalsContact O-N 3.13Å
594	T	87.2	Confident	87	Confident	123 Å²	123	40 Å²	40	76%	0.755	21%	0.209	S	C	*	.			trans	-75.4	150.7	169.7	54.2	0	0	0	0	110.5	G470	G470-T594 WeakPolarHBondContact O-CA 3.42Å
595	G	89	Confident	87.1	Confident	5 Å²	5	43.3 Å²	43.3	5%	0.052	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	154.4	179.6	0	0	0	0	0	111.8	G470 L471 T472 T588	G470-G595 PolarHBondContact O-N 3.45Å; L471-G595 WeakPolarHBondContact CA-O 3.41Å; T472-G595 PolarHBondContact N-O 3.37Å; T588-G595 WeakPolarHBondContact OG1-CA 3.34Å
596	Q	91.8	Very high	87.2	Confident	60 Å²	60	45 Å²	45	28%	0.28	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.8	179.8	-48.8	-165.6	21.6	0	0	110.9	T472 E567 L568 V569 F598	T472-Q596 WeakPolarHBondContact OG1-CG 3.42Å; E567-Q596 PolarHBondContact O-N 3.07Å; E567-Q596 VanDerWaalsContact O-N 3.11Å; L568-Q596 WeakPolarHBondContact CA-O 3.45Å; L568-Q596 HydrophobicContact CD1-CB 3.9Å; V569-Q596 PolarHBondContact N-O 3.02Å; Q596-F598 HydrophobicContact CB-CD2 4.42Å; Q596-F598 HydrophobicContact CB-CE2 4.26Å
597	A	93.2	Very high	87.5	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	111.6	173.9	0	0	0	0	0	110.4	L471 T472 H474 V569 A585	L471-A597 HydrophobicContact CD1-CB 4.16Å; T472-A597 PolarHBondContact O-N 3.35Å; H474-A597 PolarHBondContact N-O 2.94Å; V569-A597 CarbonylContact O-C 3.56Å; V569-A597 WeakPolarHBondContact O-CA 3.35Å; A585-A597 HydrophobicContact CB-CB 4.07Å
598	F	94.8	Very high	87.7	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.009	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130	176.5	-84.4	-116.6	0	0	0	110.4	H474 V476 L490 L568 V569 V570 N571 Q596 H624	H474-F598 HydrophobicContact CB-CD1 3.95Å; H474-F598 HydrophobicContact CB-CD2 3.76Å; H474-F598 HydrophobicContact CB-CE1 3.91Å; H474-F598 HydrophobicContact CB-CE2 3.74Å; H474-F598 HydrophobicContact CB-CG 3.89Å; H474-F598 HydrophobicContact CB-CZ 3.82Å; H474-F598 AromaticContact CD2-CE2 3.62Å; H474-F598 AromaticContact CG-CE2 3.63Å; H474-F598 AromaticContact CG-CZ 3.74Å; H474-F598 CarbonylContact O-C 3.57Å; H474-F598 WeakPolarHBondContact O-CA 3.39Å; V476-F598 HydrophobicContact CG2-CD1 3.78Å; V476-F598 HydrophobicContact CG2-CE1 4.27Å; L490-F598 HydrophobicContact CD1-CB 4.29Å; L490-F598 HydrophobicContact CD1-CD1 4.09Å; L490-F598 HydrophobicContact CD1-CG 4.31Å; L490-F598 HydrophobicContact CD2-CD1 3.84Å; L490-F598 HydrophobicContact CD2-CE1 3.75Å; L490-F598 HydrophobicContact CD2-CZ 4.35Å; L568-F598 HydrophobicContact CD1-CB 4.22Å; L568-F598 HydrophobicContact CD1-CD2 3.33Å; L568-F598 HydrophobicContact CD1-CE2 3.99Å; L568-F598 HydrophobicContact CD1-CG 4.07Å; V569-F598 PolarHBondContact O-N 3.18Å; V570-F598 CarbonylContact C-O 3.52Å; V570-F598 WeakPolarHBondContact CA-O 3.37Å; N571-F598 PolarHBondContact N-O 3.25Å; Q596-F598 HydrophobicContact CB-CD2 4.42Å; Q596-F598 HydrophobicContact CB-CE2 4.26Å; F598-H624 HydrophobicContact CE1-CB 4.16Å; F598-H624 AromaticContact CE1-CD2 4Å; F598-H624 AromaticContact CE1-CG 3.93Å
599	T	95	Very high	87.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.4	175.6	-54.5	0	0	0	0	111.6	H474 Y475 V476 N571 A574 L601 F609	H474-T599 PolarHBondContact O-N 2.83Å; Y475-T599 CarbonylContact C-O 3.56Å; Y475-T599 VanDerWaalsContact CA-O 3.31Å; Y475-T599 WeakPolarHBondContact CA-O 3.33Å; V476-T599 PolarHBondContact N-O 2.8Å; N571-T599 HydrophobicContact CB-CG2 3.86Å; N571-T599 PolarHBondContact ND2-OG1 2.85Å; A574-T599 HydrophobicContact CB-CG2 4.29Å; T599-L601 HydrophobicContact CG2-CD2 3.67Å; T599-L601 HydrophobicContact CG2-CG 4.1Å; T599-F609 HydrophobicContact CG2-CE1 4.12Å; T599-F609 HydrophobicContact CG2-CE2 4.06Å; T599-F609 HydrophobicContact CG2-CZ 3.71Å
600	L	94.9	Very high	88	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	116	177.2	-52.7	-168.9	0	0	0	109.3	V476 K483 V486 V487 V570 N571 Y572	V476-L600 HydrophobicContact CB-CD2 3.89Å; V476-L600 HydrophobicContact CG2-CD2 4.2Å; K483-L600 HydrophobicContact CB-CD1 4.21Å; K483-L600 HydrophobicContact CG-CD1 4.25Å; V486-L600 HydrophobicContact CB-CD1 4.42Å; V486-L600 HydrophobicContact CB-CD2 4.27Å; V486-L600 HydrophobicContact CG1-CD1 4.41Å; V486-L600 HydrophobicContact CG1-CD2 3.49Å; V486-L600 VanDerWaalsContact CG1-CD2 3.49Å; V487-L600 HydrophobicContact CG2-CD1 4Å; V570-L600 HydrophobicContact CG1-CG 4.41Å; N571-L600 PolarHBondContact O-N 3.42Å; Y572-L600 HydrophobicContact CD2-CD1 3.93Å
601	L	93.5	Very high	88.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.5	-175.1	-63.4	179.3	0	0	0	110.9	Y475 V476 P477 C478 A574 T599 F609	Y475-L601 HydrophobicContact CD2-CD1 3.74Å; Y475-L601 HydrophobicContact CG-CD1 4.06Å; V476-L601 PolarHBondContact O-N 2.77Å; P477-L601 WeakPolarHBondContact CA-O 3.25Å; C478-L601 PolarHBondContact N-O 3.27Å; A574-L601 HydrophobicContact CB-CD2 3.54Å; T599-L601 HydrophobicContact CG2-CD2 3.67Å; T599-L601 HydrophobicContact CG2-CG 4.1Å; L601-F609 HydrophobicContact CD1-CB 4.12Å; L601-F609 HydrophobicContact CD1-CD1 3.44Å; L601-F609 VanDerWaalsContact CD1-CD1 3.44Å; L601-F609 HydrophobicContact CD1-CE1 4.08Å; L601-F609 HydrophobicContact CD1-CG 3.96Å; L601-F609 HydrophobicContact CD2-CB 4.02Å; L601-F609 HydrophobicContact CD2-CD1 3.95Å; L601-F609 HydrophobicContact CD2-CD2 4.15Å; L601-F609 HydrophobicContact CD2-CE1 4.44Å; L601-F609 HydrophobicContact CD2-CG 3.76Å; L601-F609 HydrophobicContact CG-CD1 4.28Å
602	L	92.5	Very high	89.2	Confident	32 Å²	32	67.1 Å²	67.1	17%	0.168	31%	0.313	C	S	.	.			trans	-72.6	150.1	162.6	-57.1	177.5	0	0	0	109.1	C478 L480 V604 Q605 E606	C478-L602 WeakPolarHBondContact O-CD2 3.46Å; L480-L602 HydrophobicContact CD2-CD1 4Å; L480-L602 HydrophobicContact CD2-CD2 3.9Å; L480-L602 HydrophobicContact CG-CD1 4.31Å; L480-L602 HydrophobicContact CG-CD2 3.91Å; L602-V604 HydrophobicContact CB-CG2 4.09Å; L602-V604 PolarHBondContact O-N 3.28Å; L602-V604 VanDerWaalsContact O-N 3.08Å; L602-Q605 HydrophobicContact CB-CB 4.49Å; L602-Q605 HydrophobicContact CB-CG 4.16Å; L602-Q605 WeakPolarHBondContact O-CA 3.36Å; L602-Q605 WeakPolarHBondContact O-CB 3.33Å; L602-Q605 PolarHBondContact O-N 3.46Å; L602-E606 PolarHBondContact O-N 3.36Å
603	R	88.6	Confident	89.8	Confident	217 Å²	217	66.1 Å²	66.1	82%	0.819	30%	0.302	S	S	*	.	H	α-helix	trans	-52	-36.3	177.6	-71.4	-166.3	176.7	164.9	-0.1	113.3	Q605	R603-Q605 VanDerWaalsContact C-N 3.29Å; R603-Q605 PolarHBondContact O-N 3.18Å
604	V	90.2	Very high	89.8	Confident	127 Å²	127	64.7 Å²	64.7	77%	0.77	31%	0.305	S	S	*	.	H	α-helix	trans	-71	-21.6	177.7	-59.6	0	0	0	0	113.8	L602	L602-V604 HydrophobicContact CB-CG2 4.09Å; L602-V604 PolarHBondContact O-N 3.28Å; L602-V604 VanDerWaalsContact O-N 3.08Å
605	Q	90.5	Very high	89.1	Confident	70 Å²	70	64 Å²	64	33%	0.327	29%	0.293	S	S	.	.	H	α-helix	trans	-92.7	-23.7	-177.8	-66.1	175	-33.8	0	0	112.6	L602 R603 R607 R608 F609	L602-Q605 HydrophobicContact CB-CB 4.49Å; L602-Q605 HydrophobicContact CB-CG 4.16Å; L602-Q605 WeakPolarHBondContact O-CA 3.36Å; L602-Q605 WeakPolarHBondContact O-CB 3.33Å; L602-Q605 PolarHBondContact O-N 3.46Å; R603-Q605 VanDerWaalsContact C-N 3.29Å; R603-Q605 PolarHBondContact O-N 3.18Å; Q605-R607 PolarHBondContact O-N 3.5Å; Q605-R608 PolarHBondContact O-N 3.47Å; Q605-F609 WeakPolarHBondContact O-CB 3.38Å; Q605-F609 PolarHBondContact O-N 2.89Å
606	E	89.4	Confident	88.2	Confident	34 Å²	34	64 Å²	64	16%	0.159	29%	0.292	C	S	.	.	H	α-helix	trans	-50.9	-54.9	-174	-173.6	173.1	-178.6	0	0	111.9	Y475 L602 R608 F609 L610 R623	Y475-E606 HydrophobicContact CE2-CG 4Å; Y475-E606 WeakPolarHBondContact CE2-OE1 3.45Å; Y475-E606 PolarHBondContact OH-OE1 2.77Å; L602-E606 PolarHBondContact O-N 3.36Å; E606-R608 PolarHBondContact O-N 3.13Å; E606-F609 PolarHBondContact O-N 3.34Å; E606-L610 HydrophobicContact CG-CD1 3.82Å; E606-L610 HydrophobicContact CG-CG 4.33Å; E606-L610 WeakPolarHBondContact O-CB 3.34Å; E606-L610 VanDerWaalsContact O-CG 3.26Å; E606-L610 WeakPolarHBondContact O-CG 3.39Å; E606-L610 PolarHBondContact O-N 3.43Å; E606-R623 IonicContact OE1-NH1 3.09Å; E606-R623 PolarHBondContact OE1-NH1 3.48Å
607	R	88.8	Confident	87.1	Confident	214 Å²	214	63.1 Å²	63.1	81%	0.808	30%	0.3	S	S	*	.	H	α-helix	trans	-57.3	-48	-178.2	-174.1	178	178.7	173.8	2.4	113.2	Q605 F609 Q611	Q605-R607 PolarHBondContact O-N 3.5Å; R607-F609 VanDerWaalsContact C-N 3.34Å; R607-Q611 WeakPolarHBondContact O-CB 3.39Å; R607-Q611 PolarHBondContact O-N 3.43Å; R607-Q611 VanDerWaalsContact O-N 3.08Å
608	R	89.8	Confident	85.9	Confident	169 Å²	169	64.2 Å²	64.2	64%	0.638	31%	0.306	S	S	*	.	H	α-helix	trans	-66.2	-39.5	-178.7	-179.3	179.2	173.7	-177	-2.2	111.3	Q605 E606 M612	Q605-R608 PolarHBondContact O-N 3.47Å; E606-R608 PolarHBondContact O-N 3.13Å; R608-M612 WeakPolarHBondContact O-CB 3.09Å; R608-M612 PolarHBondContact O-N 3.06Å
609	F	89.8	Confident	84.5	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.035	33%	0.332	C	S	.	.	H	α-helix	trans	-69.9	-43.9	-178.7	-176.2	-98.9	0	0	0	112	P575 Y581 T599 L601 Q605 E606 R607 Q611 M612 L613 L621	P575-F609 HydrophobicContact CG-CE2 4.03Å; Y581-F609 HydrophobicContact CD2-CE2 4.19Å; Y581-F609 AromaticContact CD2-CZ 3.91Å; Y581-F609 HydrophobicContact CD2-CZ 3.91Å; Y581-F609 AromaticContact CE2-CZ 3.81Å; Y581-F609 HydrophobicContact CE2-CZ 3.81Å; T599-F609 HydrophobicContact CG2-CE1 4.12Å; T599-F609 HydrophobicContact CG2-CE2 4.06Å; T599-F609 HydrophobicContact CG2-CZ 3.71Å; L601-F609 HydrophobicContact CD1-CB 4.12Å; L601-F609 HydrophobicContact CD1-CD1 3.44Å; L601-F609 VanDerWaalsContact CD1-CD1 3.44Å; L601-F609 HydrophobicContact CD1-CE1 4.08Å; L601-F609 HydrophobicContact CD1-CG 3.96Å; L601-F609 HydrophobicContact CD2-CB 4.02Å; L601-F609 HydrophobicContact CD2-CD1 3.95Å; L601-F609 HydrophobicContact CD2-CD2 4.15Å; L601-F609 HydrophobicContact CD2-CE1 4.44Å; L601-F609 HydrophobicContact CD2-CG 3.76Å; L601-F609 HydrophobicContact CG-CD1 4.28Å; Q605-F609 WeakPolarHBondContact O-CB 3.38Å; Q605-F609 PolarHBondContact O-N 2.89Å; E606-F609 PolarHBondContact O-N 3.34Å; R607-F609 VanDerWaalsContact C-N 3.34Å; F609-Q611 VanDerWaalsContact C-N 3.34Å; F609-Q611 PolarHBondContact O-N 3.46Å; F609-M612 HydrophobicContact CD2-CE 3.45Å; F609-M612 VanDerWaalsContact CD2-CE 3.45Å; F609-M612 HydrophobicContact CE2-CE 3.49Å; F609-M612 VanDerWaalsContact CE2-CE 3.49Å; F609-M612 HydrophobicContact CG-CE 4.37Å; F609-M612 HydrophobicContact CZ-CE 4.44Å; F609-M612 WeakPolarHBondContact O-CB 3.5Å; F609-M612 PolarHBondContact O-N 3.22Å; F609-L613 HydrophobicContact CD1-CD1 3.92Å; F609-L613 HydrophobicContact CD1-CG 4.48Å; F609-L613 HydrophobicContact CE1-CD1 3.27Å; F609-L613 HydrophobicContact CE1-CG 4.1Å; F609-L613 HydrophobicContact CZ-CD1 3.64Å; F609-L613 HydrophobicContact CZ-CD2 4.49Å; F609-L613 HydrophobicContact CZ-CG 4.17Å; F609-L613 PolarHBondContact O-N 2.97Å; F609-L621 HydrophobicContact CE1-CD2 4.36Å
610	L	88	Confident	83.3	Confident	53 Å²	53	75.6 Å²	75.6	28%	0.277	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-44	174.9	-68.6	176.9	0	0	0	111.6	Y475 E606 M612 L613 T614 L621	Y475-L610 HydrophobicContact CE1-CD2 4.27Å; E606-L610 HydrophobicContact CG-CD1 3.82Å; E606-L610 HydrophobicContact CG-CG 4.33Å; E606-L610 WeakPolarHBondContact O-CB 3.34Å; E606-L610 VanDerWaalsContact O-CG 3.26Å; E606-L610 WeakPolarHBondContact O-CG 3.39Å; E606-L610 PolarHBondContact O-N 3.43Å; L610-M612 PolarHBondContact O-N 3.29Å; L610-L613 PolarHBondContact O-N 3.31Å; L610-T614 WeakPolarHBondContact O-CB 3.43Å; L610-T614 PolarHBondContact O-N 3.28Å; L610-T614 PolarHBondContact O-OG1 3.09Å; L610-L621 HydrophobicContact CD2-CD2 3.29Å
611	Q	86.9	Confident	82.7	Confident	106 Å²	106	77.4 Å²	77.4	50%	0.495	38%	0.376	S	S	.	.	H	α-helix	trans	-58.7	-47.9	175.7	-177	179.6	-5.2	0	0	111.3	R607 F609 L613 T614 E615	R607-Q611 WeakPolarHBondContact O-CB 3.39Å; R607-Q611 PolarHBondContact O-N 3.43Å; R607-Q611 VanDerWaalsContact O-N 3.08Å; F609-Q611 VanDerWaalsContact C-N 3.34Å; F609-Q611 PolarHBondContact O-N 3.46Å; Q611-L613 VanDerWaalsContact C-N 3.3Å; Q611-L613 PolarHBondContact O-N 3.17Å; Q611-T614 PolarHBondContact O-N 2.99Å; Q611-E615 HydrophobicContact CG-CG 4.5Å; Q611-E615 VanDerWaalsContact CG-OE1 3.32Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.35Å; Q611-E615 PolarHBondContact NE2-OE1 3.44Å; Q611-E615 WeakPolarHBondContact O-CG 3.41Å; Q611-E615 PolarHBondContact O-N 2.94Å
612	M	87.2	Confident	82.4	Confident	27 Å²	27	84 Å²	84	13%	0.133	40%	0.401	C	S	.	.	H	α-helix	trans	-59	-38	178.7	178.4	-168.5	70.7	0	0	113	Y577 L578 R608 F609 L610 A616	Y577-M612 VanDerWaalsContact C-SD 3.58Å; L578-M612 HydrophobicContact CB-CG 3.88Å; L578-M612 HydrophobicContact CB-SD 4.09Å; L578-M612 PolarHBondContact N-SD 3.16Å; R608-M612 WeakPolarHBondContact O-CB 3.09Å; R608-M612 PolarHBondContact O-N 3.06Å; F609-M612 HydrophobicContact CD2-CE 3.45Å; F609-M612 VanDerWaalsContact CD2-CE 3.45Å; F609-M612 HydrophobicContact CE2-CE 3.49Å; F609-M612 VanDerWaalsContact CE2-CE 3.49Å; F609-M612 HydrophobicContact CG-CE 4.37Å; F609-M612 HydrophobicContact CZ-CE 4.44Å; F609-M612 WeakPolarHBondContact O-CB 3.5Å; F609-M612 PolarHBondContact O-N 3.22Å; L610-M612 PolarHBondContact O-N 3.29Å; M612-A616 PolarHBondContact O-N 2.93Å
613	L	83.4	Confident	82.2	Confident	5 Å²	5	88.4 Å²	88.4	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-77.4	-34.2	177.9	-69.9	-179.4	0	0	0	112.9	L578 Y581 F609 L610 Q611 A616 G617 V618 L621	L578-L613 HydrophobicContact CD1-CD2 3.88Å; Y581-L613 HydrophobicContact CD1-CD2 3.54Å; Y581-L613 HydrophobicContact CE1-CD2 3.47Å; Y581-L613 VanDerWaalsContact CE1-CD2 3.47Å; Y581-L613 HydrophobicContact CG-CD2 4.16Å; F609-L613 HydrophobicContact CD1-CD1 3.92Å; F609-L613 HydrophobicContact CD1-CG 4.48Å; F609-L613 HydrophobicContact CE1-CD1 3.27Å; F609-L613 HydrophobicContact CE1-CG 4.1Å; F609-L613 HydrophobicContact CZ-CD1 3.64Å; F609-L613 HydrophobicContact CZ-CD2 4.49Å; F609-L613 HydrophobicContact CZ-CG 4.17Å; F609-L613 PolarHBondContact O-N 2.97Å; L610-L613 PolarHBondContact O-N 3.31Å; Q611-L613 VanDerWaalsContact C-N 3.3Å; Q611-L613 PolarHBondContact O-N 3.17Å; L613-A616 VanDerWaalsContact O-CB 3.25Å; L613-A616 WeakPolarHBondContact O-CB 3.47Å; L613-A616 PolarHBondContact O-N 3.48Å; L613-G617 PolarHBondContact O-N 3.39Å; L613-V618 HydrophobicContact CB-CB 4.36Å; L613-V618 HydrophobicContact CB-CG2 4.13Å; L613-V618 HydrophobicContact CD2-CG2 3.7Å; L613-V618 HydrophobicContact CG-CG2 4.48Å; L613-V618 WeakPolarHBondContact O-CG2 3.48Å; L613-V618 PolarHBondContact O-N 3.49Å; L613-L621 HydrophobicContact CD1-CD1 3.93Å; L613-L621 HydrophobicContact CD1-CD2 3.91Å; L613-L621 HydrophobicContact CD1-CG 4.44Å
614	T	81.3	Confident	82	Confident	107 Å²	107	80.4 Å²	80.4	66%	0.656	39%	0.388	S	S	*	.	H	α-helix	trans	-65.8	-43.8	176.4	-52.1	0	0	0	0	110.2	L610 Q611 A616 G617	L610-T614 WeakPolarHBondContact O-CB 3.43Å; L610-T614 PolarHBondContact O-N 3.28Å; L610-T614 PolarHBondContact O-OG1 3.09Å; Q611-T614 PolarHBondContact O-N 2.99Å; T614-A616 PolarHBondContact O-N 2.96Å; T614-G617 PolarHBondContact O-N 3.5Å
615	E	73.7	Confident	81.5	Confident	109 Å²	109	80.6 Å²	80.6	51%	0.509	38%	0.38	S	S	.	.	H	α-helix	trans	-59.4	-29.5	173.3	-72.5	170.9	-172.2	0	0	112.3	Q611 G617	Q611-E615 HydrophobicContact CG-CG 4.5Å; Q611-E615 VanDerWaalsContact CG-OE1 3.32Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.35Å; Q611-E615 PolarHBondContact NE2-OE1 3.44Å; Q611-E615 WeakPolarHBondContact O-CG 3.41Å; Q611-E615 PolarHBondContact O-N 2.94Å; E615-G617 VanDerWaalsContact C-N 3.31Å; E615-G617 PolarHBondContact O-N 2.98Å
616	A	68.9	Low	80.9	Confident	3 Å²	3	78.8 Å²	78.8	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-74.6	-18.7	177.4	0	0	0	0	0	114.4	L578 M612 L613 T614 V618	L578-A616 HydrophobicContact CD1-CB 3.52Å; L578-A616 HydrophobicContact CD2-CB 3.26Å; L578-A616 HydrophobicContact CG-CB 3.98Å; M612-A616 PolarHBondContact O-N 2.93Å; L613-A616 VanDerWaalsContact O-CB 3.25Å; L613-A616 WeakPolarHBondContact O-CB 3.47Å; L613-A616 PolarHBondContact O-N 3.48Å; T614-A616 PolarHBondContact O-N 2.96Å; A616-V618 HydrophobicContact CB-CG2 3.66Å
617	G	69.1	Low	80.1	Confident	43 Å²	43	79.9 Å²	79.9	44%	0.443	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	29.6	-167.3	0	0	0	0	0	113.7	L613 T614 E615	L613-G617 PolarHBondContact O-N 3.39Å; T614-G617 PolarHBondContact O-N 3.5Å; E615-G617 VanDerWaalsContact C-N 3.31Å; E615-G617 PolarHBondContact O-N 2.98Å
618	V	68.6	Low	79.3	Confident	22 Å²	22	73.6 Å²	73.6	13%	0.133	37%	0.373	C	S	.	.			trans	-68.3	130.5	175.5	-173.7	0	0	0	0	109.2	F467 H473 L613 A616	F467-V618 HydrophobicContact CD2-CG2 4.2Å; F467-V618 HydrophobicContact CE1-CG2 4.07Å; F467-V618 HydrophobicContact CE2-CB 4.29Å; F467-V618 HydrophobicContact CE2-CG2 3.37Å; F467-V618 HydrophobicContact CZ-CB 4.47Å; F467-V618 HydrophobicContact CZ-CG2 3.29Å; H473-V618 WeakPolarHBondContact CD2-CG1 3.31Å; H473-V618 WeakPolarHBondContact NE2-CG1 3.46Å; L613-V618 HydrophobicContact CB-CB 4.36Å; L613-V618 HydrophobicContact CB-CG2 4.13Å; L613-V618 HydrophobicContact CD2-CG2 3.7Å; L613-V618 HydrophobicContact CG-CG2 4.48Å; L613-V618 WeakPolarHBondContact O-CG2 3.48Å; L613-V618 PolarHBondContact O-N 3.49Å; A616-V618 HydrophobicContact CB-CG2 3.66Å
619	P	63.8	Low	78.5	Confident	85 Å²	85	73.3 Å²	73.3	55%	0.552	38%	0.376	S	S	*	.			trans	-63.8	151.8	175.4	24.7	-31.5	0	0	0	111.9	L621	P619-L621 PolarHBondContact O-N 3.33Å
620	E	70.3	Confident	77.8	Confident	157 Å²	157	76.5 Å²	76.5	73%	0.734	39%	0.393	S	S	*	.			trans	-7.8	104.7	-179	-161.7	179.7	-165.8	0	0	116.5	R622	E620-R622 PolarHBondContact O-N 2.92Å
621	L	82.4	Confident	77.3	Confident	38 Å²	38	75.1 Å²	75.1	20%	0.199	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-81.4	117.2	174	-172.2	76.1	0	0	0	110.2	H473 Y475 F609 L610 L613 P619	H473-L621 HydrophobicContact CB-CD1 3.52Å; Y475-L621 HydrophobicContact CD1-CD2 3.37Å; Y475-L621 HydrophobicContact CD1-CG 3.69Å; Y475-L621 HydrophobicContact CE1-CD2 3.99Å; Y475-L621 HydrophobicContact CE1-CG 4.4Å; Y475-L621 HydrophobicContact CG-CD2 3.97Å; F609-L621 HydrophobicContact CE1-CD2 4.36Å; L610-L621 HydrophobicContact CD2-CD2 3.29Å; L613-L621 HydrophobicContact CD1-CD1 3.93Å; L613-L621 HydrophobicContact CD1-CD2 3.91Å; L613-L621 HydrophobicContact CD1-CG 4.44Å; P619-L621 PolarHBondContact O-N 3.33Å
622	R	86.8	Confident	76.9	Confident	137 Å²	137	75.9 Å²	75.9	52%	0.517	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120	-178.2	-65.9	-178.2	-179.7	-179.5	0.8	111.3	H473 H474 Y475 E620 H624	H473-R622 PolarHBondContact O-N 3.19Å; H474-R622 VanDerWaalsContact CA-O 3.27Å; H474-R622 WeakPolarHBondContact CA-O 3.33Å; Y475-R622 PolarHBondContact N-O 3.11Å; E620-R622 PolarHBondContact O-N 2.92Å; R622-H624 PolarHBondContact O-N 2.98Å
623	R	89.4	Confident	76.8	Confident	126 Å²	126	78.4 Å²	78.4	48%	0.475	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.5	169.3	-174.2	177.5	172.4	136.6	-12.6	109	Y475 E606 E625	Y475-R623 HydrophobicContact CD1-CB 4.2Å; Y475-R623 VanDerWaalsContact CE1-CA 3.46Å; Y475-R623 HydrophobicContact CE1-CB 3.45Å; Y475-R623 VanDerWaalsContact CE1-CB 3.45Å; Y475-R623 HydrophobicContact CE1-CG 3.91Å; Y475-R623 HydrophobicContact CE2-CB 4.46Å; Y475-R623 HydrophobicContact CE2-CG 4.01Å; Y475-R623 WeakPolarHBondContact OH-CD 3.41Å; E606-R623 IonicContact OE1-NH1 3.09Å; E606-R623 PolarHBondContact OE1-NH1 3.48Å; R623-E625 HydrophobicContact CG-CG 4.04Å; R623-E625 IonicContact CZ-OE1 2.81Å; R623-E625 IonicContact NE-OE1 3.88Å; R623-E625 PolarHBondContact NE-OE1 3.26Å; R623-E625 IonicContact NH2-OE1 2.75Å; R623-E625 PolarHBondContact NH2-OE1 3.14Å
624	H	84.9	Confident	76.7	Confident	49 Å²	49	79.2 Å²	79.2	23%	0.227	42%	0.419	C	S	.	.			trans	-108.8	101.6	173.9	-173	81.4	0	0	0	108.6	Y475 V476 F598 R622 L626	Y475-H624 PolarHBondContact O-N 3.47Å; V476-H624 HydrophobicContact CG2-CB 4.09Å; F598-H624 HydrophobicContact CE1-CB 4.16Å; F598-H624 AromaticContact CE1-CD2 4Å; F598-H624 AromaticContact CE1-CG 3.93Å; R622-H624 PolarHBondContact O-N 2.98Å; H624-L626 VanDerWaalsContact NE2-CD2 3.3Å; H624-L626 WeakPolarHBondContact NE2-CD2 3.31Å
625	E	79.4	Confident	77	Confident	130 Å²	130	76.3 Å²	76.3	61%	0.607	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-84.9	117	177	-64.1	-161.1	151.6	0	0	110.2	R623	R623-E625 HydrophobicContact CG-CG 4.04Å; R623-E625 IonicContact CZ-OE1 2.81Å; R623-E625 IonicContact NE-OE1 3.88Å; R623-E625 PolarHBondContact NE-OE1 3.26Å; R623-E625 IonicContact NH2-OE1 2.75Å; R623-E625 PolarHBondContact NH2-OE1 3.14Å
626	L	77.6	Confident	77.7	Confident	33 Å²	33	75.2 Å²	75.2	17%	0.173	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-87.3	120.8	172.4	-67.4	171.8	0	0	0	109	V476 V486 H489 H624 S628 L631	V476-L626 HydrophobicContact CG1-CD1 3.63Å; V476-L626 HydrophobicContact CG1-CG 4.08Å; V486-L626 HydrophobicContact CB-CD1 4.03Å; V486-L626 HydrophobicContact CG1-CD1 3.57Å; V486-L626 HydrophobicContact CG2-CD1 3.52Å; H489-L626 VanDerWaalsContact CD2-CD2 3.5Å; H489-L626 WeakPolarHBondContact CD2-CD2 3.44Å; H489-L626 WeakPolarHBondContact NE2-CD2 3.49Å; H624-L626 VanDerWaalsContact NE2-CD2 3.3Å; H624-L626 WeakPolarHBondContact NE2-CD2 3.31Å; L626-S628 PolarHBondContact O-N 3.47Å; L626-L631 HydrophobicContact CB-CD1 4.45Å
627	S	72.1	Confident	78.6	Confident	56 Å²	56	81.3 Å²	81.3	39%	0.392	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-65.9	136.3	173.1	85.3	0	0	0	0	109.4	K629 L630	S627-K629 PolarHBondContact O-N 3.09Å; S627-K629 VanDerWaalsContact O-N 3.09Å; S627-L630 PolarHBondContact O-N 3.44Å; S627-L630 VanDerWaalsContact O-N 3.11Å; S627-L630 WeakPolarHBondContact OG-CG 3.36Å; S627-L630 PolarHBondContact OG-N 3.13Å
628	S	71.9	Confident	79.5	Confident	83 Å²	83	80.1 Å²	80.1	58%	0.58	41%	0.408	S	S	*	.	H	α-helix	trans	-57.2	-26	177.6	47.9	0	0	0	0	112.8	L626 L631 Q632	L626-S628 PolarHBondContact O-N 3.47Å; S628-L631 PolarHBondContact O-N 3.25Å; S628-Q632 VanDerWaalsContact O-CG 3.26Å; S628-Q632 WeakPolarHBondContact O-CG 3.43Å; S628-Q632 PolarHBondContact O-N 3.19Å; S628-Q632 VanDerWaalsContact O-N 3.09Å
629	K	72.4	Confident	80.5	Confident	163 Å²	163	84.8 Å²	84.8	71%	0.709	43%	0.428	S	S	*	.	H	α-helix	trans	-66.5	-35.9	178	-62.8	-177.1	-179.5	-179.1	0	113.2	S627	S627-K629 PolarHBondContact O-N 3.09Å; S627-K629 VanDerWaalsContact O-N 3.09Å
630	L	75.1	Confident	81.8	Confident	75 Å²	75	86.2 Å²	86.2	39%	0.393	43%	0.428	S	S	.	.	H	α-helix	trans	-68.4	-43.8	178	-68.1	167.2	0	0	0	110.6	S627 Q632 A633	S627-L630 PolarHBondContact O-N 3.44Å; S627-L630 VanDerWaalsContact O-N 3.11Å; S627-L630 WeakPolarHBondContact OG-CG 3.36Å; S627-L630 PolarHBondContact OG-N 3.13Å; L630-Q632 VanDerWaalsContact C-N 3.33Å; L630-Q632 PolarHBondContact O-N 3.02Å; L630-A633 PolarHBondContact O-N 3.03Å
631	L	78.1	Confident	82.8	Confident	23 Å²	23	78.9 Å²	78.9	12%	0.12	39%	0.393	C	S	.	.	H	α-helix	trans	-68.6	-31.5	179.3	-61.1	176.4	0	0	0	112.6	L485 H489 L626 S628 A633 L634 V635	L485-L631 HydrophobicContact CB-CD2 4.15Å; H489-L631 HydrophobicContact CB-CD2 4.12Å; L626-L631 HydrophobicContact CB-CD1 4.45Å; S628-L631 PolarHBondContact O-N 3.25Å; L631-A633 PolarHBondContact O-N 3.46Å; L631-L634 PolarHBondContact O-N 3.47Å; L631-V635 WeakPolarHBondContact O-CG2 3.23Å; L631-V635 PolarHBondContact O-N 3.41Å
632	Q	79.8	Confident	83.1	Confident	122 Å²	122	80.2 Å²	80.2	57%	0.57	40%	0.4	S	S	*	.	H	α-helix	trans	-56.7	-33.1	179.9	-85.6	170.8	1.2	0	0	113.4	S628 L630 L634 V635 P636	S628-Q632 VanDerWaalsContact O-CG 3.26Å; S628-Q632 WeakPolarHBondContact O-CG 3.43Å; S628-Q632 PolarHBondContact O-N 3.19Å; S628-Q632 VanDerWaalsContact O-N 3.09Å; L630-Q632 VanDerWaalsContact C-N 3.33Å; L630-Q632 PolarHBondContact O-N 3.02Å; Q632-L634 PolarHBondContact O-N 3.32Å; Q632-V635 PolarHBondContact O-N 2.93Å; Q632-P636 WeakPolarHBondContact O-CD 3.16Å
633	A	83.3	Confident	83.3	Confident	80 Å²	80	77 Å²	77	66%	0.661	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.4	177.2	0	0	0	0	0	112.8	L630 L631	L630-A633 PolarHBondContact O-N 3.03Å; L631-A633 PolarHBondContact O-N 3.46Å
634	L	83.1	Confident	83.4	Confident	23 Å²	23	75 Å²	75	12%	0.12	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-14.5	-177.9	-57.8	174.6	0	0	0	113	L485 L488 H489 F519 L631 Q632 Y638	L485-L634 HydrophobicContact CD2-CB 3.95Å; L488-L634 HydrophobicContact CB-CD1 4.49Å; H489-L634 HydrophobicContact CB-CD1 4.24Å; F519-L634 HydrophobicContact CZ-CB 4.29Å; F519-L634 HydrophobicContact CZ-CD2 3.91Å; L631-L634 PolarHBondContact O-N 3.47Å; Q632-L634 PolarHBondContact O-N 3.32Å; L634-Y638 VanDerWaalsContact O-CB 3.24Å; L634-Y638 WeakPolarHBondContact O-CB 3.35Å; L634-Y638 PolarHBondContact O-N 2.99Å
635	V	86.6	Confident	83.7	Confident	45 Å²	45	73.5 Å²	73.5	27%	0.273	39%	0.389	S	S	.	.	H	α-helix	trans	-59.7	-48.2	-173.8	173.3	0	0	0	0	113.6	L485 L631 Q632 R637 Y638 E639	L485-V635 HydrophobicContact CD1-CG2 4.14Å; L631-V635 WeakPolarHBondContact O-CG2 3.23Å; L631-V635 PolarHBondContact O-N 3.41Å; Q632-V635 PolarHBondContact O-N 2.93Å; V635-R637 VanDerWaalsContact C-N 3.34Å; V635-R637 PolarHBondContact O-N 2.8Å; V635-Y638 WeakPolarHBondContact O-CB 3.44Å; V635-Y638 PolarHBondContact O-N 3.18Å; V635-Y638 VanDerWaalsContact O-N 3.08Å; V635-E639 HydrophobicContact CG1-CG 4.3Å; V635-E639 PolarHBondContact O-N 2.91Å
636	P	88.5	Confident	84.2	Confident	87 Å²	87	72.5 Å²	72.5	57%	0.565	38%	0.384	S	S	*	.	H	α-helix	trans	-60.8	-44.6	-174.9	-23.9	34.1	0	0	0	112.4	Q632 Y638 E639 E640	Q632-P636 WeakPolarHBondContact O-CD 3.16Å; P636-Y638 VanDerWaalsContact C-N 3.28Å; P636-Y638 PolarHBondContact O-N 3.16Å; P636-E639 PolarHBondContact O-N 3.26Å; P636-E640 PolarHBondContact O-N 2.99Å
637	R	87.3	Confident	84.8	Confident	130 Å²	130	77.1 Å²	77.1	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-70.1	-28.8	178.4	-165.9	176.7	180	174.8	1.5	112.2	F519 V635 A641	F519-R637 HydrophobicContact CD2-CB 4.32Å; F519-R637 HydrophobicContact CD2-CG 4.05Å; F519-R637 HydrophobicContact CE2-CB 3.68Å; F519-R637 HydrophobicContact CE2-CG 3.79Å; F519-R637 HydrophobicContact CZ-CB 4.14Å; F519-R637 HydrophobicContact CZ-CG 4.15Å; F519-R637 VanDerWaalsContact O-CZ 3.24Å; F519-R637 PolarHBondContact O-NE 3.18Å; F519-R637 PolarHBondContact O-NH2 2.66Å; V635-R637 VanDerWaalsContact C-N 3.34Å; V635-R637 PolarHBondContact O-N 2.8Å; R637-A641 WeakPolarHBondContact O-CB 3.17Å; R637-A641 PolarHBondContact O-N 2.99Å; R637-A641 VanDerWaalsContact O-N 3.08Å
638	Y	88.4	Confident	85.7	Confident	19 Å²	19	76.4 Å²	76.4	8%	0.075	40%	0.4	C	S	.	.	H	α-helix	trans	-71	-39.2	175.3	175.6	-108.6	0	0	0	112.6	S481 P484 L485 L515 L634 V635 P636 E640 A641 L642	S481-Y638 PolarHBondContact O-OH 3.39Å; P484-Y638 HydrophobicContact CB-CE2 3.71Å; P484-Y638 HydrophobicContact CG-CE2 4.25Å; P484-Y638 WeakPolarHBondContact CG-OH 3.37Å; L485-Y638 HydrophobicContact CD1-CD1 4.09Å; L485-Y638 HydrophobicContact CD1-CE1 4.32Å; L485-Y638 VanDerWaalsContact CD2-CB 3.49Å; L485-Y638 HydrophobicContact CD2-CD1 3.85Å; L485-Y638 HydrophobicContact CD2-CD2 3.75Å; L485-Y638 HydrophobicContact CD2-CE1 4.5Å; L485-Y638 HydrophobicContact CD2-CE2 4.42Å; L485-Y638 HydrophobicContact CD2-CG 3.41Å; L485-Y638 VanDerWaalsContact CD2-CG 3.41Å; L485-Y638 HydrophobicContact CG-CD1 3.97Å; L485-Y638 HydrophobicContact CG-CD2 4.2Å; L485-Y638 HydrophobicContact CG-CE1 4.18Å; L485-Y638 HydrophobicContact CG-CE2 4.41Å; L485-Y638 HydrophobicContact CG-CG 3.97Å; L515-Y638 HydrophobicContact CD1-CD2 4.46Å; L515-Y638 HydrophobicContact CD1-CE2 4.06Å; L515-Y638 HydrophobicContact CD2-CE2 3.85Å; L515-Y638 HydrophobicContact CG-CE2 4.2Å; L634-Y638 VanDerWaalsContact O-CB 3.24Å; L634-Y638 WeakPolarHBondContact O-CB 3.35Å; L634-Y638 PolarHBondContact O-N 2.99Å; V635-Y638 WeakPolarHBondContact O-CB 3.44Å; V635-Y638 PolarHBondContact O-N 3.18Å; V635-Y638 VanDerWaalsContact O-N 3.08Å; P636-Y638 VanDerWaalsContact C-N 3.28Å; P636-Y638 PolarHBondContact O-N 3.16Å; Y638-E640 VanDerWaalsContact C-N 3.33Å; Y638-A641 PolarHBondContact O-N 3.24Å; Y638-L642 HydrophobicContact CD1-CD1 3.92Å; Y638-L642 HydrophobicContact CD1-CG 4.45Å; Y638-L642 HydrophobicContact CE1-CD1 3.43Å; Y638-L642 VanDerWaalsContact CE1-CD1 3.43Å; Y638-L642 HydrophobicContact CE1-CG 4.07Å; Y638-L642 HydrophobicContact CE2-CD1 4.49Å; Y638-L642 HydrophobicContact CE2-CD2 4.45Å; Y638-L642 HydrophobicContact CE2-CG 4.26Å; Y638-L642 WeakPolarHBondContact O-CG 3.12Å; Y638-L642 PolarHBondContact O-N 3.38Å
639	E	90.1	Very high	86.5	Confident	119 Å²	119	74.1 Å²	74.1	56%	0.556	38%	0.381	S	S	*	.	H	α-helix	trans	-62.1	-41.9	174.4	-71.6	177	173.1	0	0	111.3	V635 P636 L642 S643	V635-E639 HydrophobicContact CG1-CG 4.3Å; V635-E639 PolarHBondContact O-N 2.91Å; P636-E639 PolarHBondContact O-N 3.26Å; E639-L642 WeakPolarHBondContact O-CB 3.39Å; E639-L642 PolarHBondContact O-N 3.4Å; E639-S643 PolarHBondContact O-N 2.82Å; E639-S643 VanDerWaalsContact O-N 3.13Å; E639-S643 PolarHBondContact O-OG 3.02Å
640	E	90.6	Very high	87.4	Confident	116 Å²	116	71.5 Å²	71.5	54%	0.542	37%	0.369	S	S	.	.	H	α-helix	trans	-61.4	-46.1	173.7	-171.9	-178.9	-178.2	0	0	112.1	P636 Y638 L642 S643 Q644	P636-E640 PolarHBondContact O-N 2.99Å; Y638-E640 VanDerWaalsContact C-N 3.33Å; E640-L642 VanDerWaalsContact C-N 3.27Å; E640-L642 PolarHBondContact O-N 3.45Å; E640-S643 PolarHBondContact O-N 3.15Å; E640-Q644 PolarHBondContact O-N 3.46Å; E640-Q644 VanDerWaalsContact O-N 3.12Å
641	A	90.4	Very high	88	Confident	2 Å²	2	73.3 Å²	73.3	2%	0.017	38%	0.376	C	S	.	.	H	α-helix	trans	-63.1	-32.8	177.1	0	0	0	0	0	112.6	L515 A518 F519 R637 Y638 L645	L515-A641 HydrophobicContact CD1-CB 4.09Å; A518-A641 HydrophobicContact CB-CB 4.07Å; F519-A641 HydrophobicContact CB-CB 4.11Å; F519-A641 HydrophobicContact CD2-CB 4.37Å; R637-A641 WeakPolarHBondContact O-CB 3.17Å; R637-A641 PolarHBondContact O-N 2.99Å; R637-A641 VanDerWaalsContact O-N 3.08Å; Y638-A641 PolarHBondContact O-N 3.24Å; A641-L645 WeakPolarHBondContact O-CB 3.13Å; A641-L645 PolarHBondContact O-N 3.17Å
642	L	90.4	Very high	88.5	Confident	66 Å²	66	74.8 Å²	74.8	35%	0.346	38%	0.382	S	S	.	.	H	α-helix	trans	-66.7	-40.4	174.3	-78.7	174.4	0	0	0	112.1	L515 Y638 E639 E640 L645 E646	L515-L642 HydrophobicContact CD1-CD2 3.8Å; L515-L642 HydrophobicContact CD1-CG 4.15Å; L515-L642 HydrophobicContact CD2-CD2 4.4Å; Y638-L642 HydrophobicContact CD1-CD1 3.92Å; Y638-L642 HydrophobicContact CD1-CG 4.45Å; Y638-L642 HydrophobicContact CE1-CD1 3.43Å; Y638-L642 VanDerWaalsContact CE1-CD1 3.43Å; Y638-L642 HydrophobicContact CE1-CG 4.07Å; Y638-L642 HydrophobicContact CE2-CD1 4.49Å; Y638-L642 HydrophobicContact CE2-CD2 4.45Å; Y638-L642 HydrophobicContact CE2-CG 4.26Å; Y638-L642 WeakPolarHBondContact O-CG 3.12Å; Y638-L642 PolarHBondContact O-N 3.38Å; E639-L642 WeakPolarHBondContact O-CB 3.39Å; E639-L642 PolarHBondContact O-N 3.4Å; E640-L642 VanDerWaalsContact C-N 3.27Å; E640-L642 PolarHBondContact O-N 3.45Å; L642-L645 HydrophobicContact CD2-CD2 4.41Å; L642-L645 WeakPolarHBondContact O-CB 3.48Å; L642-L645 PolarHBondContact O-N 3.22Å; L642-E646 PolarHBondContact O-N 3.05Å
643	S	91.3	Very high	88.8	Confident	71 Å²	71	74.1 Å²	74.1	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-45.9	174.8	-62.1	0	0	0	0	111.4	E639 E640 L645 E646 E647	E639-S643 PolarHBondContact O-N 2.82Å; E639-S643 VanDerWaalsContact O-N 3.13Å; E639-S643 PolarHBondContact O-OG 3.02Å; E640-S643 PolarHBondContact O-N 3.15Å; S643-L645 VanDerWaalsContact C-N 3.33Å; S643-L645 PolarHBondContact O-N 3.25Å; S643-E646 PolarHBondContact O-N 2.89Å; S643-E647 PolarHBondContact O-N 2.91Å
644	Q	91	Very high	88.9	Confident	82 Å²	82	77.2 Å²	77.2	38%	0.383	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-37.8	175.9	-65.2	177.6	16.8	0	0	112.4	A518 E640 E646 E647 S648	A518-Q644 HydrophobicContact CB-CB 4.26Å; E640-Q644 PolarHBondContact O-N 3.46Å; E640-Q644 VanDerWaalsContact O-N 3.12Å; Q644-E646 VanDerWaalsContact C-N 3.33Å; Q644-E646 PolarHBondContact O-N 3.32Å; Q644-E647 PolarHBondContact O-N 3.45Å; Q644-S648 PolarHBondContact O-N 3.17Å; Q644-S648 PolarHBondContact O-OG 2.86Å
645	L	90.3	Very high	88.9	Confident	18 Å²	18	82.4 Å²	82.4	9%	0.094	40%	0.401	C	S	.	.	H	α-helix	trans	-60.9	-44.4	174.8	178.6	68.5	0	0	0	111	L514 L515 A641 L642 S643 E647 S648 I649	L514-L645 HydrophobicContact CB-CD1 3.4Å; L514-L645 VanDerWaalsContact CB-CD1 3.4Å; L514-L645 HydrophobicContact CD1-CD1 4.11Å; L514-L645 HydrophobicContact CG-CD1 4.42Å; L515-L645 HydrophobicContact CB-CD2 4.12Å; L515-L645 HydrophobicContact CD1-CB 4.45Å; L515-L645 HydrophobicContact CD1-CD2 4.12Å; L515-L645 HydrophobicContact CG-CD2 4.49Å; A641-L645 WeakPolarHBondContact O-CB 3.13Å; A641-L645 PolarHBondContact O-N 3.17Å; L642-L645 HydrophobicContact CD2-CD2 4.41Å; L642-L645 WeakPolarHBondContact O-CB 3.48Å; L642-L645 PolarHBondContact O-N 3.22Å; S643-L645 VanDerWaalsContact C-N 3.33Å; S643-L645 PolarHBondContact O-N 3.25Å; L645-E647 VanDerWaalsContact C-N 3.31Å; L645-E647 PolarHBondContact O-N 3.08Å; L645-S648 WeakPolarHBondContact CA-OG 3.44Å; L645-S648 PolarHBondContact O-N 3.39Å; L645-S648 PolarHBondContact O-OG 3.24Å; L645-I649 HydrophobicContact CD1-CD1 3.75Å; L645-I649 HydrophobicContact CD1-CG1 4.11Å; L645-I649 HydrophobicContact CD2-CD1 4.29Å; L645-I649 HydrophobicContact CG-CD1 3.71Å; L645-I649 HydrophobicContact CG-CG1 4.37Å; L645-I649 WeakPolarHBondContact O-CB 3.21Å; L645-I649 VanDerWaalsContact O-CG1 3.27Å; L645-I649 WeakPolarHBondContact O-CG1 3.49Å; L645-I649 PolarHBondContact O-N 3.18Å
646	E	90.6	Very high	88.6	Confident	110 Å²	110	87.1 Å²	87.1	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-61.9	-41.3	179.6	-166.2	-177.2	160.5	0	0	111.6	L642 S643 Q644 K650	L642-E646 PolarHBondContact O-N 3.05Å; S643-E646 PolarHBondContact O-N 2.89Å; Q644-E646 VanDerWaalsContact C-N 3.33Å; Q644-E646 PolarHBondContact O-N 3.32Å; E646-K650 HydrophobicContact CG-CD 4.4Å; E646-K650 WeakPolarHBondContact O-CB 3.39Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.27Å; E646-K650 PolarHBondContact O-N 2.86Å; E646-K650 WeakPolarHBondContact OE1-CE 3.35Å; E646-K650 IonicContact OE1-NZ 2.85Å; E646-K650 PolarHBondContact OE1-NZ 2.85Å
647	E	90.6	Very high	87.9	Confident	130 Å²	130	87.4 Å²	87.4	61%	0.607	42%	0.423	S	S	*	.	H	α-helix	trans	-64.1	-50.1	175.3	-69.4	-178.8	174.9	0	0	112.3	S643 Q644 L645 I649 K650 E651	S643-E647 PolarHBondContact O-N 2.91Å; Q644-E647 PolarHBondContact O-N 3.45Å; L645-E647 VanDerWaalsContact C-N 3.31Å; L645-E647 PolarHBondContact O-N 3.08Å; E647-I649 VanDerWaalsContact C-N 3.32Å; E647-I649 PolarHBondContact O-N 3.49Å; E647-K650 WeakPolarHBondContact O-CB 3.41Å; E647-K650 PolarHBondContact O-N 2.83Å; E647-K650 VanDerWaalsContact O-N 3.12Å; E647-E651 WeakPolarHBondContact O-CG 3.37Å; E647-E651 PolarHBondContact O-N 3.43Å
648	S	89.7	Confident	86.7	Confident	40 Å²	40	87.7 Å²	87.7	28%	0.28	45%	0.454	S	S	.	.	H	α-helix	trans	-61	-38.8	179.7	63	0	0	0	0	112.9	Q644 L645 E651 E652	Q644-S648 PolarHBondContact O-N 3.17Å; Q644-S648 PolarHBondContact O-OG 2.86Å; L645-S648 WeakPolarHBondContact CA-OG 3.44Å; L645-S648 PolarHBondContact O-N 3.39Å; L645-S648 PolarHBondContact O-OG 3.24Å; S648-E651 PolarHBondContact O-N 3.35Å; S648-E652 PolarHBondContact O-N 2.65Å
649	I	89.8	Confident	86.6	Confident	35 Å²	35	91.2 Å²	91.2	18%	0.179	47%	0.473	C	S	.	.	H	α-helix	trans	-66.8	-42.4	175.4	-70.9	173.9	0	0	0	110.6	R511 L514 L645 E647 E651 E652 H653	R511-I649 HydrophobicContact CG-CD1 3.94Å; L514-I649 HydrophobicContact CD1-CG1 4.4Å; L645-I649 HydrophobicContact CD1-CD1 3.75Å; L645-I649 HydrophobicContact CD1-CG1 4.11Å; L645-I649 HydrophobicContact CD2-CD1 4.29Å; L645-I649 HydrophobicContact CG-CD1 3.71Å; L645-I649 HydrophobicContact CG-CG1 4.37Å; L645-I649 WeakPolarHBondContact O-CB 3.21Å; L645-I649 VanDerWaalsContact O-CG1 3.27Å; L645-I649 WeakPolarHBondContact O-CG1 3.49Å; L645-I649 PolarHBondContact O-N 3.18Å; E647-I649 VanDerWaalsContact C-N 3.32Å; E647-I649 PolarHBondContact O-N 3.49Å; I649-E651 VanDerWaalsContact C-N 3.33Å; I649-E651 PolarHBondContact O-N 2.85Å; I649-E652 PolarHBondContact O-N 3.36Å; I649-H653 VanDerWaalsContact CG2-CD2 3.5Å; I649-H653 WeakPolarHBondContact CG2-CD2 3.38Å; I649-H653 WeakPolarHBondContact O-CB 3.43Å; I649-H653 PolarHBondContact O-CD2 3.4Å; I649-H653 PolarHBondContact O-N 2.89Å
650	K	89.8	Confident	86.5	Confident	108 Å²	108	89.7 Å²	89.7	47%	0.47	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-42.1	175.9	-76.9	170.2	-177	167.1	0	111.4	E646 E647 H653 K654	E646-K650 HydrophobicContact CG-CD 4.4Å; E646-K650 WeakPolarHBondContact O-CB 3.39Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.27Å; E646-K650 PolarHBondContact O-N 2.86Å; E646-K650 WeakPolarHBondContact OE1-CE 3.35Å; E646-K650 IonicContact OE1-NZ 2.85Å; E646-K650 PolarHBondContact OE1-NZ 2.85Å; E647-K650 WeakPolarHBondContact O-CB 3.41Å; E647-K650 PolarHBondContact O-N 2.83Å; E647-K650 VanDerWaalsContact O-N 3.12Å; K650-H653 PolarHBondContact O-N 3.33Å; K650-K654 WeakPolarHBondContact O-CG 3.47Å; K650-K654 PolarHBondContact O-N 3.46Å
651	E	89.1	Confident	86.2	Confident	113 Å²	113	88.2 Å²	88.2	53%	0.528	46%	0.464	S	S	.	.	H	α-helix	trans	-60.5	-50	174.8	-70.1	-106.5	131.1	0	0	111.8	E647 S648 I649 H653 K654 Q655	E647-E651 WeakPolarHBondContact O-CG 3.37Å; E647-E651 PolarHBondContact O-N 3.43Å; S648-E651 PolarHBondContact O-N 3.35Å; I649-E651 VanDerWaalsContact C-N 3.33Å; I649-E651 PolarHBondContact O-N 2.85Å; E651-H653 VanDerWaalsContact C-N 3.3Å; E651-H653 PolarHBondContact O-N 2.96Å; E651-K654 WeakPolarHBondContact O-CB 3.42Å; E651-K654 PolarHBondContact O-N 2.92Å; E651-Q655 WeakPolarHBondContact O-CG 3.46Å; E651-Q655 PolarHBondContact O-N 3.02Å
652	E	88	Confident	86	Confident	54 Å²	54	93.3 Å²	93.3	25%	0.252	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-40.3	177	-79.9	-156.9	173.9	0	0	112.5	H510 S648 I649 Q655 R656	H510-E652 IonicContact CE1-OE1 2.78Å; H510-E652 IonicContact NE2-OE1 3.32Å; H510-E652 PolarHBondContact NE2-OE1 3.02Å; H510-E652 VanDerWaalsContact NE2-OE1 3.08Å; H510-E652 IonicContact NE2-OE2 3.72Å; H510-E652 PolarHBondContact NE2-OE2 3.44Å; S648-E652 PolarHBondContact O-N 2.65Å; I649-E652 PolarHBondContact O-N 3.36Å; E652-Q655 PolarHBondContact O-N 2.96Å; E652-R656 WeakPolarHBondContact O-CG 3.33Å; E652-R656 PolarHBondContact O-N 3.19Å; E652-R656 IonicContact OE2-CZ 3.63Å; E652-R656 IonicContact OE2-NH2 3.91Å; E652-R656 PolarHBondContact OE2-NH2 3.22Å
653	H	86.1	Confident	85.7	Confident	108 Å²	108	95 Å²	95	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-39.4	178	-85.6	-68.6	0	0	0	111.8	I649 K650 E651 R656 A657	I649-H653 VanDerWaalsContact CG2-CD2 3.5Å; I649-H653 WeakPolarHBondContact CG2-CD2 3.38Å; I649-H653 WeakPolarHBondContact O-CB 3.43Å; I649-H653 PolarHBondContact O-CD2 3.4Å; I649-H653 PolarHBondContact O-N 2.89Å; K650-H653 PolarHBondContact O-N 3.33Å; E651-H653 VanDerWaalsContact C-N 3.3Å; E651-H653 PolarHBondContact O-N 2.96Å; H653-R656 PolarHBondContact O-N 2.76Å; H653-A657 WeakPolarHBondContact O-CB 3.36Å; H653-A657 PolarHBondContact O-N 3.25Å; H653-A657 VanDerWaalsContact O-N 3.17Å
654	K	85.9	Confident	85.3	Confident	145 Å²	145	96.6 Å²	96.6	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-44.8	172.9	-72.2	174.2	-177.5	177.5	0	111.4	K650 E651 R656 A657 A658	K650-K654 WeakPolarHBondContact O-CG 3.47Å; K650-K654 PolarHBondContact O-N 3.46Å; E651-K654 WeakPolarHBondContact O-CB 3.42Å; E651-K654 PolarHBondContact O-N 2.92Å; K654-R656 VanDerWaalsContact C-N 3.3Å; K654-R656 PolarHBondContact O-N 3.49Å; K654-A657 PolarHBondContact O-N 3.29Å; K654-A657 VanDerWaalsContact O-N 3.16Å; K654-A658 PolarHBondContact O-N 2.97Å
655	Q	82.6	Confident	84.9	Confident	133 Å²	133	97.6 Å²	97.6	62%	0.621	51%	0.508	S	S	*	.	H	α-helix	trans	-66	-28.5	179.1	-70.6	177	11.5	0	0	113.8	E651 E652	E651-Q655 WeakPolarHBondContact O-CG 3.46Å; E651-Q655 PolarHBondContact O-N 3.02Å; E652-Q655 PolarHBondContact O-N 2.96Å
656	R	79.8	Confident	84.5	Confident	144 Å²	144	103.8 Å²	103.8	54%	0.543	54%	0.54	S	S	.	.	H	α-helix	trans	-80.5	-21.4	173.8	-75.4	-174.8	-170.9	143.5	21.9	113.7	E652 H653 K654	E652-R656 WeakPolarHBondContact O-CG 3.33Å; E652-R656 PolarHBondContact O-N 3.19Å; E652-R656 IonicContact OE2-CZ 3.63Å; E652-R656 IonicContact OE2-NH2 3.91Å; E652-R656 PolarHBondContact OE2-NH2 3.22Å; H653-R656 PolarHBondContact O-N 2.76Å; K654-R656 VanDerWaalsContact C-N 3.3Å; K654-R656 PolarHBondContact O-N 3.49Å
657	A	74.5	Confident	84	Confident	92 Å²	92	103.3 Å²	103.3	76%	0.76	54%	0.542	S	S	*	.	H	α-helix	trans	-89	-26	180	0	0	0	0	0	112.7	H653 K654	H653-A657 WeakPolarHBondContact O-CB 3.36Å; H653-A657 PolarHBondContact O-N 3.25Å; H653-A657 VanDerWaalsContact O-N 3.17Å; K654-A657 PolarHBondContact O-N 3.29Å; K654-A657 VanDerWaalsContact O-N 3.16Å
658	A	62.3	Low	83.4	Confident	137 Å²	137	100.8 Å²	100.8	100%	1.132	54%	0.536	S	S	*	.			trans	-77.2	0	166.6	0	0	0	0	0	111	K654	K654-A658 PolarHBondContact O-N 2.97Å

Retrieved 658 of 658 residues in 156.2 ms (Link to these results)

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