A0A2K6BBG2_MACNE Loading...

Copine-4

Probable calcium-dependent phospholipid-binding protein that may play a role in calcium-mediated intracellular processes.

AlphaFold DB , UniProt , Accession A0A2K6BBG2, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene CPNE4, Length 575 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	35.9	Very low	39.1	Very low	243 Å²	243	112.8 Å²	112.8	100%	1.197	66%	0.663	S	S	*	*				0	90	0	-78.8	168.5	75.2	0	0	108.2
2	A	34.4	Very low	39.1	Very low	100 Å²	100	116.8 Å²	116.8	83%	0.826	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-103.9	119.7	165.9	0	0	0	0	0	105.8	E4	A2-E4 PolarHBondContact O-N 2.82Å
3	V	35.3	Very low	38.9	Very low	138 Å²	138	121.8 Å²	121.8	84%	0.836	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-75.4	117.4	-177.1	177.5	0	0	0	0	107.9
4	E	37.4	Very low	38.5	Very low	176 Å²	176	127.9 Å²	127.9	82%	0.822	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-65.3	137.1	171.5	-74.4	-174.7	153.4	0	0	110.3	A2	A2-E4 PolarHBondContact O-N 2.82Å
5	P	39.2	Very low	38.6	Very low	98 Å²	98	124.5 Å²	124.5	64%	0.636	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-72.4	137.3	177.9	27.9	-30.4	0	0	0	110.7
6	S	44.8	Very low	38.2	Very low	67 Å²	67	119.1 Å²	119.1	47%	0.469	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-55	145	-177.7	74.2	0	0	0	0	112.7	S8 E9	S6-S8 PolarHBondContact O-N 3.16Å; S6-S8 PolarHBondContact OG-OG 3.48Å; S6-E9 PolarHBondContact O-N 2.75Å
7	S	42.2	Very low	37.9	Very low	91 Å²	91	124.1 Å²	124.1	64%	0.636	65%	0.652	S	S	*	*	H	α-helix	trans	-52.2	-18.7	179.2	53.4	0	0	0	0	114.8	S10 I11	S7-S10 PolarHBondContact O-OG 3.27Å; S7-S10 VanDerWaalsContact O-OG 3.12Å; S7-I11 VanDerWaalsContact O-CD1 3.24Å; S7-I11 WeakPolarHBondContact O-CD1 3.35Å; S7-I11 WeakPolarHBondContact O-CG1 3.34Å; S7-I11 PolarHBondContact O-N 2.91Å
8	S	40.5	Very low	37.6	Very low	63 Å²	63	128 Å²	128	44%	0.441	66%	0.657	S	S	.	*	H	α-helix	trans	-75.7	-33.1	177.4	78.9	0	0	0	0	113.8	S6 K12	S6-S8 PolarHBondContact O-N 3.16Å; S6-S8 PolarHBondContact OG-OG 3.48Å; S8-K12 WeakPolarHBondContact O-CG 3.33Å; S8-K12 PolarHBondContact O-N 3.1Å; S8-K12 VanDerWaalsContact O-N 3.16Å
9	E	40.3	Very low	37.3	Very low	99 Å²	99	127.8 Å²	127.8	46%	0.463	66%	0.655	S	S	.	*	H	α-helix	trans	-79.2	-33.3	-179.2	-95.2	-173.4	132.1	0	0	112.5	S6 I11 K12 R13	S6-E9 PolarHBondContact O-N 2.75Å; E9-I11 VanDerWaalsContact C-N 3.34Å; E9-K12 PolarHBondContact O-N 3.5Å; E9-R13 WeakPolarHBondContact O-CB 3.22Å; E9-R13 WeakPolarHBondContact O-CG 3.29Å; E9-R13 PolarHBondContact O-N 2.99Å
10	S	38.1	Very low	37	Very low	62 Å²	62	129.3 Å²	129.3	43%	0.434	66%	0.656	S	S	.	*	H	α-helix	trans	-70.2	-31.9	175	54.2	0	0	0	0	112.1	S7 R14	S7-S10 PolarHBondContact O-OG 3.27Å; S7-S10 VanDerWaalsContact O-OG 3.12Å; S10-R14 WeakPolarHBondContact O-CB 3.3Å; S10-R14 PolarHBondContact O-N 2.8Å; S10-R14 VanDerWaalsContact O-N 3.1Å
11	I	42.3	Very low	36.7	Very low	104 Å²	104	130.5 Å²	130.5	53%	0.533	66%	0.657	S	S	.	*	H	α-helix	trans	-70.9	-46.1	172.3	-67.3	168.8	0	0	0	110.9	S7 E9 R13 R14 V15	S7-I11 VanDerWaalsContact O-CD1 3.24Å; S7-I11 WeakPolarHBondContact O-CD1 3.35Å; S7-I11 WeakPolarHBondContact O-CG1 3.34Å; S7-I11 PolarHBondContact O-N 2.91Å; E9-I11 VanDerWaalsContact C-N 3.34Å; I11-R13 VanDerWaalsContact C-N 3.34Å; I11-R13 PolarHBondContact O-N 2.89Å; I11-R14 PolarHBondContact O-N 3.42Å; I11-R14 VanDerWaalsContact O-N 3.15Å; I11-V15 HydrophobicContact CG2-CG2 4.28Å; I11-V15 WeakPolarHBondContact O-CG2 3.29Å; I11-V15 PolarHBondContact O-N 3.49Å
12	K	38.5	Very low	36.4	Very low	160 Å²	160	123.5 Å²	123.5	70%	0.696	62%	0.622	S	S	*	*	H	α-helix	trans	-60.7	-39.3	176.4	-76.5	-179.3	178.9	-179.2	0	112.8	S8 E9 G16	S8-K12 WeakPolarHBondContact O-CG 3.33Å; S8-K12 PolarHBondContact O-N 3.1Å; S8-K12 VanDerWaalsContact O-N 3.16Å; E9-K12 PolarHBondContact O-N 3.5Å; K12-G16 PolarHBondContact O-N 3.37Å
13	R	37	Very low	36.3	Very low	183 Å²	183	121.7 Å²	121.7	69%	0.691	60%	0.603	S	S	*	*	H	α-helix	trans	-69.2	-33.2	174.9	-72.7	-179.8	-178.1	-168.6	2.6	113	E9 I11 R17	E9-R13 WeakPolarHBondContact O-CB 3.22Å; E9-R13 WeakPolarHBondContact O-CG 3.29Å; E9-R13 PolarHBondContact O-N 2.99Å; I11-R13 VanDerWaalsContact C-N 3.34Å; I11-R13 PolarHBondContact O-N 2.89Å; R13-R17 WeakPolarHBondContact O-CB 3.46Å; R13-R17 WeakPolarHBondContact O-CG 3.46Å; R13-R17 PolarHBondContact O-N 3.34Å
14	R	33.3	Very low	36.2	Very low	206 Å²	206	119.8 Å²	119.8	78%	0.777	59%	0.589	S	S	*	*	H	α-helix	trans	-71.2	-41.2	173.5	-99.8	179.3	172.6	172.1	-1.5	112.4	S10 I11 R18	S10-R14 WeakPolarHBondContact O-CB 3.3Å; S10-R14 PolarHBondContact O-N 2.8Å; S10-R14 VanDerWaalsContact O-N 3.1Å; I11-R14 PolarHBondContact O-N 3.42Å; I11-R14 VanDerWaalsContact O-N 3.15Å; R14-R18 WeakPolarHBondContact O-CB 3.22Å; R14-R18 PolarHBondContact O-N 3.2Å
15	V	40.3	Very low	36.2	Very low	77 Å²	77	116.1 Å²	116.1	47%	0.467	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-44.6	176.5	176	0	0	0	0	110.6	I11 R17 R18 M19	I11-V15 HydrophobicContact CG2-CG2 4.28Å; I11-V15 WeakPolarHBondContact O-CG2 3.29Å; I11-V15 PolarHBondContact O-N 3.49Å; V15-R17 PolarHBondContact O-N 3.08Å; V15-R18 PolarHBondContact O-N 3.3Å; V15-R18 VanDerWaalsContact O-N 3.14Å; V15-M19 HydrophobicContact CG1-SD 4.15Å; V15-M19 PolarHBondContact O-N 3.08Å
16	G	32.2	Very low	36.1	Very low	38 Å²	38	119.4 Å²	119.4	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-63.5	-37	175.9	0	0	0	0	0	113.9	K12 K20	K12-G16 PolarHBondContact O-N 3.37Å; G16-K20 WeakPolarHBondContact O-CB 3.2Å; G16-K20 PolarHBondContact O-N 3.5Å
17	R	32.1	Very low	35.6	Very low	205 Å²	205	122 Å²	122	77%	0.774	58%	0.579	S	S	*	*	H	α-helix	trans	-70.5	-32.4	171.9	-82	-178.8	174.6	176.8	-1.6	112.8	R13 V15 K21	R13-R17 WeakPolarHBondContact O-CB 3.46Å; R13-R17 WeakPolarHBondContact O-CG 3.46Å; R13-R17 PolarHBondContact O-N 3.34Å; V15-R17 PolarHBondContact O-N 3.08Å; R17-K21 WeakPolarHBondContact O-CB 3.18Å; R17-K21 PolarHBondContact O-N 3.14Å
18	R	32.2	Very low	35.3	Very low	194 Å²	194	120.4 Å²	120.4	73%	0.732	57%	0.568	S	S	*	*	H	α-helix	trans	-75.1	-35.5	177.5	-153.2	174.6	-172.6	-180	1	111.8	R14 V15 K21 M22	R14-R18 WeakPolarHBondContact O-CB 3.22Å; R14-R18 PolarHBondContact O-N 3.2Å; V15-R18 PolarHBondContact O-N 3.3Å; V15-R18 VanDerWaalsContact O-N 3.14Å; R18-K21 PolarHBondContact O-N 3.32Å; R18-M22 WeakPolarHBondContact O-CB 3.36Å; R18-M22 WeakPolarHBondContact O-CG 3.44Å; R18-M22 PolarHBondContact O-N 3.28Å
19	M	33.2	Very low	35.2	Very low	125 Å²	125	119.8 Å²	119.8	62%	0.616	57%	0.567	S	S	*	*	H	α-helix	trans	-68.7	-44.5	171.1	-80.2	174.3	144.2	0	0	112.3	V15 K21 M22 S23	V15-M19 HydrophobicContact CG1-SD 4.15Å; V15-M19 PolarHBondContact O-N 3.08Å; M19-K21 VanDerWaalsContact C-N 3.3Å; M19-K21 PolarHBondContact O-N 3.24Å; M19-M22 HydrophobicContact CG-CE 4.41Å; M19-M22 PolarHBondContact O-N 3.17Å; M19-S23 PolarHBondContact O-N 3.26Å; M19-S23 PolarHBondContact O-OG 3.25Å
20	K	31.5	Very low	35	Very low	156 Å²	156	117.4 Å²	117.4	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-64.4	-31.6	171.9	-90.2	-172.9	172.4	-174.7	0	113.4	G16 S23 N24	G16-K20 WeakPolarHBondContact O-CB 3.2Å; G16-K20 PolarHBondContact O-N 3.5Å; K20-S23 WeakPolarHBondContact CA-OG 3.48Å; K20-S23 PolarHBondContact O-OG 3.01Å; K20-N24 WeakPolarHBondContact O-CB 3.27Å; K20-N24 VanDerWaalsContact O-CG 3.23Å; K20-N24 PolarHBondContact O-N 3.06Å; K20-N24 PolarHBondContact O-OD1 2.68Å
21	K	29.2	Very low	34.7	Very low	155 Å²	155	120.5 Å²	120.5	67%	0.674	58%	0.576	S	S	*	*	H	α-helix	trans	-75.9	-31.1	174.8	-156	174.5	-173.8	-175	0	111.5	R17 R18 M19 I25	R17-K21 WeakPolarHBondContact O-CB 3.18Å; R17-K21 PolarHBondContact O-N 3.14Å; R18-K21 PolarHBondContact O-N 3.32Å; M19-K21 VanDerWaalsContact C-N 3.3Å; M19-K21 PolarHBondContact O-N 3.24Å; K21-I25 WeakPolarHBondContact O-CD1 3.44Å; K21-I25 WeakPolarHBondContact O-CG1 3.37Å; K21-I25 PolarHBondContact O-N 2.93Å
22	M	30.6	Very low	34.5	Very low	96 Å²	96	121.4 Å²	121.4	47%	0.473	59%	0.586	S	S	.	*	H	α-helix	trans	-71.2	-44.8	171.2	-82.4	-168.4	-64.6	0	0	112.2	R18 M19 N24 I25 Y26	R18-M22 WeakPolarHBondContact O-CB 3.36Å; R18-M22 WeakPolarHBondContact O-CG 3.44Å; R18-M22 PolarHBondContact O-N 3.28Å; M19-M22 HydrophobicContact CG-CE 4.41Å; M19-M22 PolarHBondContact O-N 3.17Å; M22-N24 VanDerWaalsContact C-N 3.27Å; M22-N24 PolarHBondContact O-N 2.93Å; M22-I25 PolarHBondContact O-N 3.04Å; M22-Y26 WeakPolarHBondContact O-CD2 3.14Å; M22-Y26 PolarHBondContact O-N 2.98Å
23	S	32.9	Very low	34.6	Very low	62 Å²	62	116.3 Å²	116.3	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-58.2	-40.7	175.8	62.4	0	0	0	0	111.9	M19 K20 I25 Y26 E27	M19-S23 PolarHBondContact O-N 3.26Å; M19-S23 PolarHBondContact O-OG 3.25Å; K20-S23 WeakPolarHBondContact CA-OG 3.48Å; K20-S23 PolarHBondContact O-OG 3.01Å; S23-I25 VanDerWaalsContact C-N 3.31Å; S23-I25 PolarHBondContact O-N 3.12Å; S23-Y26 PolarHBondContact O-N 2.91Å; S23-E27 PolarHBondContact O-N 3.44Å
24	N	32.4	Very low	34.4	Very low	98 Å²	98	109.8 Å²	109.8	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-73	-19.1	177.5	-72	17.9	0	0	0	113.7	K20 M22 S28	K20-N24 WeakPolarHBondContact O-CB 3.27Å; K20-N24 VanDerWaalsContact O-CG 3.23Å; K20-N24 PolarHBondContact O-N 3.06Å; K20-N24 PolarHBondContact O-OD1 2.68Å; M22-N24 VanDerWaalsContact C-N 3.27Å; M22-N24 PolarHBondContact O-N 2.93Å; N24-S28 WeakPolarHBondContact O-CB 3.45Å; N24-S28 PolarHBondContact O-N 3.3Å; N24-S28 VanDerWaalsContact O-N 3.16Å
25	I	37.6	Very low	34.7	Very low	99 Å²	99	103.8 Å²	103.8	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-80.2	-39.5	175.4	-71.4	161.6	0	0	0	110.5	K21 M22 S23 E27 S28 A29	K21-I25 WeakPolarHBondContact O-CD1 3.44Å; K21-I25 WeakPolarHBondContact O-CG1 3.37Å; K21-I25 PolarHBondContact O-N 2.93Å; M22-I25 PolarHBondContact O-N 3.04Å; S23-I25 VanDerWaalsContact C-N 3.31Å; S23-I25 PolarHBondContact O-N 3.12Å; I25-E27 VanDerWaalsContact C-N 3.31Å; I25-E27 PolarHBondContact O-N 2.78Å; I25-S28 PolarHBondContact O-N 2.99Å; I25-S28 VanDerWaalsContact O-N 3.09Å; I25-S28 PolarHBondContact O-OG 3.09Å; I25-A29 PolarHBondContact O-N 2.78Å
26	Y	36.8	Very low	34.7	Very low	168 Å²	168	108.2 Å²	108.2	66%	0.659	55%	0.552	S	S	*	*	H	α-helix	trans	-61.8	-39.9	173.1	-73.3	-72.4	0	0	0	111.8	M22 S23 S28 A30	M22-Y26 WeakPolarHBondContact O-CD2 3.14Å; M22-Y26 PolarHBondContact O-N 2.98Å; S23-Y26 PolarHBondContact O-N 2.91Å; Y26-S28 VanDerWaalsContact C-N 3.3Å; Y26-S28 PolarHBondContact O-N 2.62Å; Y26-A30 PolarHBondContact O-N 2.65Å
27	E	35.1	Very low	35.1	Very low	122 Å²	122	114.8 Å²	114.8	57%	0.57	58%	0.578	S	S	*	*	H	α-helix	trans	-67.7	-31.3	173.9	-150.9	169.6	-154.7	0	0	111.7	S23 I25 N31	S23-E27 PolarHBondContact O-N 3.44Å; I25-E27 VanDerWaalsContact C-N 3.31Å; I25-E27 PolarHBondContact O-N 2.78Å; E27-N31 VanDerWaalsContact O-CB 3.26Å; E27-N31 WeakPolarHBondContact O-CB 3.05Å; E27-N31 PolarHBondContact O-N 3.28Å; E27-N31 VanDerWaalsContact O-N 3.08Å; E27-N31 PolarHBondContact O-ND2 2.83Å
28	S	36.1	Very low	36	Very low	56 Å²	56	107.3 Å²	107.3	39%	0.392	56%	0.557	S	S	.	*	H	α-helix	trans	-76.9	-30.8	178.5	84.2	0	0	0	0	114	N24 I25 Y26 T32	N24-S28 WeakPolarHBondContact O-CB 3.45Å; N24-S28 PolarHBondContact O-N 3.3Å; N24-S28 VanDerWaalsContact O-N 3.16Å; I25-S28 PolarHBondContact O-N 2.99Å; I25-S28 VanDerWaalsContact O-N 3.09Å; I25-S28 PolarHBondContact O-OG 3.09Å; Y26-S28 VanDerWaalsContact C-N 3.3Å; Y26-S28 PolarHBondContact O-N 2.62Å; S28-T32 VanDerWaalsContact O-CB 3.26Å; S28-T32 WeakPolarHBondContact O-CB 3.15Å; S28-T32 PolarHBondContact O-N 3.29Å; S28-T32 PolarHBondContact O-OG1 2.94Å
29	A	36.7	Very low	37.9	Very low	51 Å²	51	103.8 Å²	103.8	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-72.1	-41.1	176.2	0	0	0	0	0	111.5	I25 T32 L33	I25-A29 PolarHBondContact O-N 2.78Å; A29-T32 PolarHBondContact O-N 3.1Å; A29-L33 WeakPolarHBondContact O-CB 3.43Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 2.85Å; A29-L33 VanDerWaalsContact O-N 3.09Å
30	A	37.4	Very low	40	Very low	49 Å²	49	99.4 Å²	99.4	41%	0.405	54%	0.54	S	S	.	.	H	α-helix	trans	-62.4	-42.5	172.2	0	0	0	0	0	112.1	Y26 L33 G34	Y26-A30 PolarHBondContact O-N 2.65Å; A30-L33 PolarHBondContact O-N 2.94Å; A30-G34 PolarHBondContact O-N 3.3Å
31	N	32.2	Very low	42.5	Very low	127 Å²	127	95.4 Å²	95.4	68%	0.679	53%	0.526	S	S	*	.	H	α-helix	trans	-71	-28.2	176.4	-77.4	-37	0	0	0	113.9	E27	E27-N31 VanDerWaalsContact O-CB 3.26Å; E27-N31 WeakPolarHBondContact O-CB 3.05Å; E27-N31 PolarHBondContact O-N 3.28Å; E27-N31 VanDerWaalsContact O-N 3.08Å; E27-N31 PolarHBondContact O-ND2 2.83Å
32	T	36.6	Very low	45.3	Very low	123 Å²	123	88.8 Å²	88.8	76%	0.755	50%	0.499	S	S	*	.	H	α-helix	trans	-80.7	-24.2	177.8	-54	0	0	0	0	112	S28 A29	S28-T32 VanDerWaalsContact O-CB 3.26Å; S28-T32 WeakPolarHBondContact O-CB 3.15Å; S28-T32 PolarHBondContact O-N 3.29Å; S28-T32 PolarHBondContact O-OG1 2.94Å; A29-T32 PolarHBondContact O-N 3.1Å
33	L	40.5	Very low	48.1	Very low	52 Å²	52	88.6 Å²	88.6	27%	0.272	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.1	178.2	-71.4	166.8	0	0	0	114.1	A29 A30 I35 F77	A29-L33 WeakPolarHBondContact O-CB 3.43Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 2.85Å; A29-L33 VanDerWaalsContact O-N 3.09Å; A30-L33 PolarHBondContact O-N 2.94Å; L33-I35 HydrophobicContact CB-CD1 3.92Å; L33-I35 HydrophobicContact CB-CG1 3.85Å; L33-I35 HydrophobicContact CD1-CD1 4.21Å; L33-I35 PolarHBondContact O-N 3.47Å; L33-F77 HydrophobicContact CD2-CB 4.39Å; L33-F77 HydrophobicContact CD2-CD1 3.91Å; L33-F77 HydrophobicContact CD2-CD2 4.12Å; L33-F77 HydrophobicContact CD2-CE1 4.21Å; L33-F77 HydrophobicContact CD2-CE2 4.39Å; L33-F77 HydrophobicContact CD2-CG 3.86Å; L33-F77 HydrophobicContact CD2-CZ 4.44Å
34	G	32.9	Very low	50.9	Low	46 Å²	46	85.6 Å²	85.6	47%	0.474	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	31.2	178	0	0	0	0	0	113.9	A30 F36	A30-G34 PolarHBondContact O-N 3.3Å; G34-F36 PolarHBondContact O-N 3.36Å
35	I	40.2	Very low	53.8	Low	81 Å²	81	82.8 Å²	82.8	42%	0.415	46%	0.458	S	S	.	.			trans	-79	123.5	-179.6	-56.5	175.1	0	0	0	108.2	L33	L33-I35 HydrophobicContact CB-CD1 3.92Å; L33-I35 HydrophobicContact CB-CG1 3.85Å; L33-I35 HydrophobicContact CD1-CD1 4.21Å; L33-I35 PolarHBondContact O-N 3.47Å
36	F	39.9	Very low	56.3	Low	170 Å²	170	78.1 Å²	78.1	75%	0.746	43%	0.434	S	S	*	.			trans	-66.1	167.4	-164	-69.7	-91.5	0	0	0	115.9	G34 S38	G34-F36 PolarHBondContact O-N 3.36Å; F36-S38 PolarHBondContact O-N 2.73Å
37	N	41.7	Very low	58.8	Low	176 Å²	176	74.9 Å²	74.9	94%	0.941	42%	0.421	S	S	*	.	S	Bend	trans	-63.9	28.9	-177.4	-130.1	17.2	0	0	0	116.5
38	S	50.1	Low	61.4	Low	47 Å²	47	69.3 Å²	69.3	33%	0.329	40%	0.395	S	S	.	.			trans	-117.7	135	178	-58.4	0	0	0	0	111.2	F36 K539	F36-S38 PolarHBondContact O-N 2.73Å; S38-K539 PolarHBondContact OG-NZ 3.41Å
39	P	72.8	Confident	63.9	Low	121 Å²	121	68 Å²	68	79%	0.786	39%	0.387	S	S	*	.			trans	-65.4	138.9	173.9	28.7	-33	0	0	0	110.2
40	C	77.4	Confident	66.4	Low	32 Å²	32	65.9 Å²	65.9	22%	0.216	37%	0.37	C	S	.	.			trans	-63.8	154.7	168	63.2	0	0	0	0	110.7	T42 D100 Y102	C40-T42 VanDerWaalsContact C-N 3.32Å; C40-T42 PolarHBondContact O-N 2.83Å; C40-D100 HydrophobicContact CB-CB 3.82Å; C40-Y102 HydrophobicContact CB-CD1 4.19Å; C40-Y102 HydrophobicContact CB-CE1 3.64Å; C40-Y102 HydrophobicContact CB-CE2 3.99Å
41	L	84	Confident	68.8	Low	73 Å²	73	70.2 Å²	70.2	38%	0.382	38%	0.379	S	S	.	.	S	Bend	trans	-61	-45.7	176.1	-174.4	71.5	0	0	0	110.6	F101 F103 F314 P546	L41-F101 HydrophobicContact CB-CD1 4.19Å; L41-F101 HydrophobicContact CD2-CD1 3.92Å; L41-F101 HydrophobicContact CD2-CE1 3.73Å; L41-F101 PolarHBondContact N-O 3.3Å; L41-F103 HydrophobicContact CD2-CB 4.36Å; L41-F314 HydrophobicContact CD2-CB 4.23Å; L41-F314 HydrophobicContact CD2-CD1 3.7Å; L41-F314 HydrophobicContact CD2-CG 4.31Å; L41-P546 HydrophobicContact CD1-CB 3.96Å; L41-P546 HydrophobicContact CD1-CG 4.37Å; L41-P546 HydrophobicContact CD2-CB 4.1Å; L41-P546 HydrophobicContact CD2-CG 4.24Å
42	T	88.4	Confident	71.5	Confident	15 Å²	15	65.3 Å²	65.3	9%	0.092	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	176.5	178.7	-170.4	0	0	0	0	110.2	C40 F101 E167 L315	C40-T42 VanDerWaalsContact C-N 3.32Å; C40-T42 PolarHBondContact O-N 2.83Å; T42-F101 HydrophobicContact CG2-CB 4.12Å; T42-F101 HydrophobicContact CG2-CD1 4.07Å; T42-F101 HydrophobicContact CG2-CG 4.49Å; T42-F101 PolarHBondContact O-N 3Å; T42-E167 VanDerWaalsContact CB-OE1 3.23Å; T42-E167 WeakPolarHBondContact CB-OE1 3.12Å; T42-E167 HydrophobicContact CG2-CG 3.88Å; T42-E167 WeakPolarHBondContact CG2-OE1 3.32Å; T42-E167 WeakPolarHBondContact OG1-CG 3.4Å; T42-E167 PolarHBondContact OG1-OE1 3.18Å; T42-L315 HydrophobicContact CG2-CD1 3.3Å; T42-L315 HydrophobicContact CG2-CG 4Å
43	K	89.2	Confident	73.9	Confident	92 Å²	92	59.8 Å²	59.8	40%	0.4	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.5	171.4	-70.1	178.6	-177.8	-75.3	0	109.7	T98 V99 D100 L168	K43-T98 HydrophobicContact CB-CG2 4.16Å; K43-T98 HydrophobicContact CD-CG2 4.15Å; K43-T98 HydrophobicContact CG-CG2 4.5Å; K43-V99 WeakPolarHBondContact CA-O 3.45Å; K43-D100 WeakPolarHBondContact CG-OD1 3.44Å; K43-D100 IonicContact NZ-OD1 2.75Å; K43-D100 PolarHBondContact NZ-OD1 2.92Å; K43-L168 HydrophobicContact CB-CB 4.04Å; K43-L168 HydrophobicContact CB-CD1 3.95Å; K43-L168 WeakPolarHBondContact O-CB 3.5Å; K43-L168 PolarHBondContact O-N 3.34Å
44	V	91.4	Very high	75.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.3	178.3	179.5	0	0	0	0	109.5	L46 T98 V99 F101 L136 V140 A165 E166 L315 M319	V44-L46 HydrophobicContact CG1-CD2 3.7Å; V44-T98 WeakPolarHBondContact O-CA 3.31Å; V44-V99 PolarHBondContact N-O 2.78Å; V44-V99 PolarHBondContact O-N 2.8Å; V44-F101 HydrophobicContact CG2-CB 3.84Å; V44-F101 HydrophobicContact CG2-CG 4.38Å; V44-L136 HydrophobicContact CG1-CD1 4.42Å; V44-V140 HydrophobicContact CG1-CG1 4.16Å; V44-V140 HydrophobicContact CG2-CG1 4.13Å; V44-A165 HydrophobicContact CG1-CB 3.79Å; V44-E166 WeakPolarHBondContact CA-O 3.37Å; V44-L315 HydrophobicContact CG2-CD1 3.62Å; V44-M319 HydrophobicContact CG1-CE 4.36Å
45	E	92.5	Very high	77.2	Confident	39 Å²	39	61.5 Å²	61.5	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.2	168.5	-79.5	-175.8	166.6	0	0	110.7	R47 F97 A165 E166 L168	E45-R47 IonicContact OE2-NH2 2.8Å; E45-F97 CarbonylContact C-O 3.45Å; E45-F97 WeakPolarHBondContact CA-O 3.41Å; E45-A165 CarbonylContact O-C 3.51Å; E45-A165 VanDerWaalsContact O-CA 3.32Å; E45-A165 WeakPolarHBondContact O-CA 3.38Å; E45-E166 PolarHBondContact N-O 3.16Å; E45-E166 PolarHBondContact O-N 2.91Å; E45-L168 HydrophobicContact CG-CD1 3.68Å; E45-L168 HydrophobicContact CG-CD2 3.91Å; E45-L168 HydrophobicContact CG-CG 3.7Å; E45-L168 WeakPolarHBondContact OE1-CD2 3.49Å
46	L	90.8	Very high	78.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.3	176.2	-49	176.2	0	0	0	109.8	V44 F97 V99 L109 F111 L136 I139 V163 I164 A165	V44-L46 HydrophobicContact CG1-CD2 3.7Å; L46-F97 HydrophobicContact CB-CB 4.19Å; L46-F97 PolarHBondContact N-O 3.32Å; L46-F97 PolarHBondContact O-N 3.33Å; L46-F97 VanDerWaalsContact O-N 3.09Å; L46-V99 HydrophobicContact CD1-CG2 3.93Å; L46-L109 HydrophobicContact CD1-CD1 4.03Å; L46-F111 HydrophobicContact CD1-CZ 4.17Å; L46-L136 HydrophobicContact CD1-CD1 4.29Å; L46-L136 HydrophobicContact CD2-CD1 4.06Å; L46-I139 HydrophobicContact CD1-CD1 4.41Å; L46-I139 HydrophobicContact CD2-CD1 4.5Å; L46-I139 HydrophobicContact CD2-CG2 4.11Å; L46-V163 HydrophobicContact CB-CG1 3.97Å; L46-V163 HydrophobicContact CD2-CG1 4.29Å; L46-I164 WeakPolarHBondContact CA-O 3.18Å; L46-A165 HydrophobicContact CD2-CB 3.85Å
47	R	89.8	Confident	79.1	Confident	100 Å²	100	62.1 Å²	62.1	38%	0.377	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.1	172.2	-62.8	171.7	-171.4	-76.7	-8.7	109	E45 L96 V163 I164 E166	E45-R47 IonicContact OE2-NH2 2.8Å; R47-L96 HydrophobicContact CG-CD2 3.49Å; R47-L96 VanDerWaalsContact CG-CD2 3.49Å; R47-V163 CarbonylContact O-C 3.59Å; R47-V163 VanDerWaalsContact O-CA 3.3Å; R47-V163 WeakPolarHBondContact O-CA 3.18Å; R47-I164 HydrophobicContact CB-CB 4.35Å; R47-I164 PolarHBondContact N-O 2.88Å; R47-I164 PolarHBondContact O-N 3.07Å; R47-E166 IonicContact CZ-OE2 3.05Å; R47-E166 IonicContact NE-OE2 3.92Å; R47-E166 PolarHBondContact NE-OE2 3.23Å; R47-E166 IonicContact NH2-OE2 2.82Å; R47-E166 PolarHBondContact NH2-OE2 3.22Å
48	V	89.8	Confident	79.8	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.9	-175.2	-176.8	0	0	0	0	111.3	V66 Y93 F97 F111 I161 T162 V163	V48-V66 HydrophobicContact CG1-CG1 4.32Å; V48-V66 HydrophobicContact CG1-CG2 4.12Å; V48-Y93 HydrophobicContact CB-CD2 4.4Å; V48-Y93 HydrophobicContact CG1-CD2 4.35Å; V48-Y93 WeakPolarHBondContact O-CD2 3.39Å; V48-Y93 PolarHBondContact O-N 2.97Å; V48-F97 HydrophobicContact CG2-CD2 3.93Å; V48-F97 HydrophobicContact CG2-CE2 3.76Å; V48-F111 HydrophobicContact CG2-CD1 4.17Å; V48-F111 HydrophobicContact CG2-CE1 3.86Å; V48-I161 HydrophobicContact CG1-CD1 3.61Å; V48-I161 HydrophobicContact CG1-CG1 3.7Å; V48-T162 WeakPolarHBondContact CA-O 3.34Å; V48-V163 HydrophobicContact CG2-CG1 4.37Å; V48-V163 HydrophobicContact CG2-CG2 4.27Å
49	A	87	Confident	80.2	Confident	28 Å²	28	65 Å²	65	23%	0.231	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.1	168.2	0	0	0	0	0	110	P91 V92 I161 T162	A49-P91 CarbonylContact C-O 3.53Å; A49-P91 WeakPolarHBondContact CA-O 3.42Å; A49-V92 HydrophobicContact CB-CB 4.46Å; A49-V92 HydrophobicContact CB-CG1 4.45Å; A49-V92 HydrophobicContact CB-CG2 4.07Å; A49-I161 CarbonylContact O-C 3.48Å; A49-I161 WeakPolarHBondContact O-CA 3.48Å; A49-T162 PolarHBondContact N-O 2.97Å; A49-T162 PolarHBondContact O-N 3.21Å
50	C	90	Very high	80.2	Confident	7 Å²	7	62 Å²	62	5%	0.047	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	157.2	173.1	-56.6	0	0	0	0	110.8	I53 N90 P91 S160	C50-I53 HydrophobicContact CB-CD1 3.83Å; C50-I53 HydrophobicContact CB-CG1 4.09Å; C50-N90 CarbonylContact O-C 3.58Å; C50-N90 VanDerWaalsContact O-C 3.22Å; C50-N90 WeakPolarHBondContact O-CA 3.35Å; C50-P91 HydrophobicContact CB-CG 3.76Å; C50-P91 PolarHBondContact N-O 2.82Å; C50-S160 CarbonylContact C-O 3.41Å; C50-S160 WeakPolarHBondContact CA-O 3.47Å; C50-S160 WeakPolarHBondContact CB-O 3.2Å
51	K	88.8	Confident	80.4	Confident	141 Å²	141	66.3 Å²	66.3	61%	0.613	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	138.9	177	-172	-178.3	-178.7	177.2	0	110.5	N90 S159 S160	K51-N90 WeakPolarHBondContact CA-OD1 3.5Å; K51-N90 VanDerWaalsContact CG-OD1 3.25Å; K51-N90 WeakPolarHBondContact CG-OD1 3.35Å; K51-S159 CarbonylContact O-C 3.01Å; K51-S159 VanDerWaalsContact O-CA 3.28Å; K51-S159 WeakPolarHBondContact O-CA 3.43Å; K51-S160 PolarHBondContact N-O 2.84Å; K51-S160 PolarHBondContact O-N 3.24Å; K51-S160 PolarHBondContact O-OG 3.45Å
52	G	87.2	Confident	80.6	Confident	24 Å²	24	63 Å²	63	25%	0.247	33%	0.333	C	S	.	.			trans	68.3	32.4	171.5	0	0	0	0	0	114.4	S54 I89 N90 S159	G52-S54 PolarHBondContact O-N 3.03Å; G52-I89 PolarHBondContact N-O 3.43Å; G52-N90 PolarHBondContact N-OD1 2.87Å; G52-S159 VanDerWaalsContact O-CA 3.29Å; G52-S159 WeakPolarHBondContact O-CA 3.45Å; G52-S159 VanDerWaalsContact O-CB 3.28Å; G52-S159 WeakPolarHBondContact O-CB 3.32Å; G52-S159 PolarHBondContact O-N 3.48Å
53	I	87.8	Confident	80.6	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-57.5	130.6	173	-60	178.8	0	0	0	108.7	C50 P62 P64 I89 P91 V113 L129	C50-I53 HydrophobicContact CB-CD1 3.83Å; C50-I53 HydrophobicContact CB-CG1 4.09Å; I53-P62 HydrophobicContact CB-CG 4.46Å; I53-P62 HydrophobicContact CG2-CB 4.48Å; I53-P62 HydrophobicContact CG2-CG 3.78Å; I53-P64 HydrophobicContact CD1-CB 3.62Å; I53-P64 HydrophobicContact CD1-CG 3.92Å; I53-I89 PolarHBondContact N-O 3.32Å; I53-P91 HydrophobicContact CD1-CG 3.72Å; I53-V113 HydrophobicContact CD1-CG1 4.07Å; I53-L129 HydrophobicContact CG2-CB 4.5Å; I53-L129 HydrophobicContact CG2-CD1 3.74Å; I53-L129 HydrophobicContact CG2-CG 4.49Å
54	S	75.9	Confident	80.6	Confident	60 Å²	60	58.8 Å²	58.8	42%	0.42	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-70.9	135.3	-176.4	-60.3	0	0	0	0	112	G52	G52-S54 PolarHBondContact O-N 3.03Å
55	D	66.2	Low	80.6	Confident	75 Å²	75	58.8 Å²	58.8	40%	0.401	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-69.6	143.1	170.8	-80.8	-20.5	0	0	0	110.4	K61 P62	D55-K61 WeakPolarHBondContact OD1-CA 3.36Å; D55-P62 VanDerWaalsContact OD1-CD 3.31Å; D55-P62 WeakPolarHBondContact OD1-CD 3.44Å
56	R	60.2	Low	80.8	Confident	158 Å²	158	57 Å²	57	60%	0.596	31%	0.306	S	S	*	.	S	Bend	trans	-75.4	-35.2	176.1	-167.5	174.4	160.5	-172.6	-7.7	111.1	D127	R56-D127 IonicContact CZ-OD2 3.32Å; R56-D127 VanDerWaalsContact CZ-OD2 3.32Å; R56-D127 IonicContact NE-OD2 3.71Å; R56-D127 IonicContact NH1-OD2 2.64Å; R56-D127 PolarHBondContact NH1-OD2 3.25Å
57	D	59.3	Low	81	Confident	105 Å²	105	57.1 Å²	57.1	56%	0.561	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-148	150.7	174.4	-69.9	-53.7	0	0	0	109.5	L59 S60	D57-L59 PolarHBondContact O-N 3.46Å; D57-S60 PolarHBondContact O-N 3.22Å; D57-S60 VanDerWaalsContact O-N 3.12Å
58	A	56.9	Low	81.4	Confident	105 Å²	105	52.4 Å²	52.4	87%	0.868	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-0.1	-176.3	0	0	0	0	0	116
59	L	58.9	Low	81.8	Confident	178 Å²	178	54.3 Å²	54.3	93%	0.932	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-9.7	-174.3	-72.9	154.4	0	0	0	113.7	D57	D57-L59 PolarHBondContact O-N 3.46Å
60	S	73	Confident	82.2	Confident	58 Å²	58	55 Å²	55	41%	0.406	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-133.6	124.3	-179.5	61.5	0	0	0	0	112.6	D57	D57-S60 PolarHBondContact O-N 3.22Å; D57-S60 VanDerWaalsContact O-N 3.12Å
61	K	81.5	Confident	82.3	Confident	123 Å²	123	57.3 Å²	57.3	54%	0.535	31%	0.306	S	S	.	.			trans	-85.2	146.3	175.2	-66.7	-179.2	-177.7	175.9	0	110.5	D55 T87	D55-K61 WeakPolarHBondContact OD1-CA 3.36Å; K61-T87 VanDerWaalsContact CD-O 3.25Å; K61-T87 WeakPolarHBondContact CD-O 3.48Å
62	P	87.4	Confident	82.2	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.019	29%	0.286	C	S	.	.			trans	-71.2	160.3	179.2	30.2	-35.6	0	0	0	112.3	I53 D55 P64 T87 C88 I89 D115 L129	I53-P62 HydrophobicContact CB-CG 4.46Å; I53-P62 HydrophobicContact CG2-CB 4.48Å; I53-P62 HydrophobicContact CG2-CG 3.78Å; D55-P62 VanDerWaalsContact OD1-CD 3.31Å; D55-P62 WeakPolarHBondContact OD1-CD 3.44Å; P62-P64 WeakPolarHBondContact O-CD 2.84Å; P62-T87 CarbonylContact O-C 3Å; P62-T87 VanDerWaalsContact O-CA 3.29Å; P62-T87 WeakPolarHBondContact O-CA 3.35Å; P62-T87 PolarHBondContact O-N 2.97Å; P62-C88 PolarHBondContact O-N 3.46Å; P62-I89 HydrophobicContact CG-CG2 4.26Å; P62-D115 HydrophobicContact CB-CB 4.49Å; P62-L129 HydrophobicContact CB-CD1 4.22Å
63	D	88	Confident	81.9	Confident	19 Å²	19	58.5 Å²	58.5	10%	0.102	31%	0.31	C	S	.	.			trans	-107.6	73.5	170.5	-68.6	-19.6	0	0	0	109.5	V84 I85 R86 T87 D115 I116	D63-V84 HydrophobicContact CB-CG1 3.77Å; D63-V84 WeakPolarHBondContact O-CG1 3.34Å; D63-I85 WeakPolarHBondContact CA-O 3.44Å; D63-R86 WeakPolarHBondContact OD1-CA 3.47Å; D63-T87 PolarHBondContact OD1-N 2.75Å; D63-D115 PolarHBondContact N-OD1 2.78Å; D63-I116 PolarHBondContact O-N 2.98Å
64	P	90.2	Very high	81.7	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	140.1	-168.5	30.5	-41.9	0	0	0	114.5	I53 P62 I85 C88 P91 Y93 V113 H114 L129	I53-P64 HydrophobicContact CD1-CB 3.62Å; I53-P64 HydrophobicContact CD1-CG 3.92Å; P62-P64 WeakPolarHBondContact O-CD 2.84Å; P64-I85 WeakPolarHBondContact CD-O 3.4Å; P64-I85 PolarHBondContact O-N 3.41Å; P64-C88 WeakPolarHBondContact CD-O 3.23Å; P64-C88 VanDerWaalsContact CG-O 3.26Å; P64-C88 WeakPolarHBondContact CG-O 3.37Å; P64-P91 HydrophobicContact CB-CG 4.13Å; P64-P91 HydrophobicContact CG-CB 3.85Å; P64-P91 HydrophobicContact CG-CG 3.59Å; P64-Y93 VanDerWaalsContact C-OH 3.32Å; P64-Y93 WeakPolarHBondContact CB-OH 3.43Å; P64-Y93 PolarHBondContact O-OH 2.81Å; P64-V113 HydrophobicContact CB-CG1 4.14Å; P64-H114 CarbonylContact C-O 3.47Å; P64-H114 WeakPolarHBondContact CA-O 3.19Å; P64-L129 HydrophobicContact CB-CD1 4.41Å
65	C	92.5	Very high	82.5	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.007	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	139.5	171.5	179.6	0	0	0	0	109.8	T82 V84 V113 H114 I116	C65-T82 PolarHBondContact SG-O 3.21Å; C65-V84 HydrophobicContact CB-CG2 4.15Å; C65-V113 WeakPolarHBondContact O-CA 3.29Å; C65-H114 PolarHBondContact N-O 2.94Å; C65-H114 PolarHBondContact O-N 2.94Å; C65-I116 HydrophobicContact CB-CD1 3.43Å; C65-I116 VanDerWaalsContact CB-CD1 3.43Å; C65-I116 HydrophobicContact CB-CG1 3.88Å
66	V	95.1	Very high	83.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.6	175.1	-177.9	0	0	0	0	109.9	V48 R81 T82 Y93 F111 E112 V113 I161	V48-V66 HydrophobicContact CG1-CG1 4.32Å; V48-V66 HydrophobicContact CG1-CG2 4.12Å; V66-R81 CarbonylContact O-C 3.57Å; V66-R81 VanDerWaalsContact O-CA 3.27Å; V66-R81 WeakPolarHBondContact O-CA 3.35Å; V66-T82 HydrophobicContact CB-CG2 3.86Å; V66-T82 PolarHBondContact N-OG1 2.97Å; V66-T82 PolarHBondContact O-N 2.92Å; V66-Y93 HydrophobicContact CG2-CD2 4.19Å; V66-Y93 HydrophobicContact CG2-CE2 3.47Å; V66-Y93 VanDerWaalsContact CG2-CE2 3.47Å; V66-F111 HydrophobicContact CG1-CB 4.22Å; V66-F111 HydrophobicContact CG1-CD1 4.09Å; V66-E112 CarbonylContact C-O 3.49Å; V66-E112 WeakPolarHBondContact CA-O 3.42Å; V66-V113 HydrophobicContact CG2-CG2 4.21Å; V66-I161 HydrophobicContact CG1-CD1 4.27Å
67	I	96.2	Very high	85.4	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	172.6	-53.4	175.8	0	0	0	108	K69 E78 R81 F111 E112 H114 L123	I67-K69 HydrophobicContact CG2-CG 4.22Å; I67-E78 HydrophobicContact CG2-CG 3.66Å; I67-R81 HydrophobicContact CG1-CB 4.33Å; I67-F111 WeakPolarHBondContact O-CA 3.19Å; I67-E112 HydrophobicContact CB-CB 4.49Å; I67-E112 PolarHBondContact N-O 3Å; I67-E112 PolarHBondContact O-N 3.09Å; I67-H114 VanDerWaalsContact CD1-CD2 3.4Å; I67-H114 WeakPolarHBondContact CD1-CD2 3.22Å; I67-L123 HydrophobicContact CD1-CD2 3.3Å; I67-L123 HydrophobicContact CG1-CD2 4.3Å
68	L	97.6	Very high	87.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.7	171	177.3	60.5	0	0	0	109.2	V79 D80 F97 V99 L109 F111	L68-V79 HydrophobicContact CB-CB 4.45Å; L68-V79 HydrophobicContact CD2-CB 4.21Å; L68-V79 HydrophobicContact CD2-CG1 4.22Å; L68-V79 HydrophobicContact CG-CB 4.09Å; L68-V79 HydrophobicContact CG-CG2 4.3Å; L68-V79 PolarHBondContact O-N 2.92Å; L68-D80 PolarHBondContact N-O 2.91Å; L68-F97 HydrophobicContact CB-CD1 4.07Å; L68-F97 HydrophobicContact CB-CD2 4.41Å; L68-F97 HydrophobicContact CB-CE1 3.94Å; L68-F97 HydrophobicContact CB-CE2 4.29Å; L68-F97 HydrophobicContact CB-CG 4.29Å; L68-F97 HydrophobicContact CB-CZ 4.03Å; L68-F97 HydrophobicContact CD2-CB 3.68Å; L68-F97 HydrophobicContact CD2-CD1 4.03Å; L68-F97 HydrophobicContact CD2-CD2 4.21Å; L68-F97 HydrophobicContact CD2-CG 3.73Å; L68-V99 HydrophobicContact CD2-CG2 4.07Å; L68-L109 HydrophobicContact CD1-CB 4.21Å; L68-L109 HydrophobicContact CD1-CD2 4.27Å; L68-F111 HydrophobicContact CD1-CD1 4.04Å; L68-F111 HydrophobicContact CD1-CD2 4.33Å; L68-F111 HydrophobicContact CD1-CE1 3.71Å; L68-F111 HydrophobicContact CD1-CE2 4.01Å; L68-F111 HydrophobicContact CD1-CG 4.35Å; L68-F111 HydrophobicContact CD1-CZ 3.68Å
69	K	97.3	Very high	88.8	Confident	45 Å²	45	56.7 Å²	56.7	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.3	170.8	-59.6	-178	-179.8	169.3	0	110.5	I67 W76 F77 L109 R110 E112	I67-K69 HydrophobicContact CG2-CG 4.22Å; K69-W76 HydrophobicContact CB-CE3 4.07Å; K69-W76 HydrophobicContact CD-CB 4.38Å; K69-F77 CarbonylContact C-O 3.43Å; K69-F77 WeakPolarHBondContact CA-O 3.28Å; K69-F77 WeakPolarHBondContact CB-O 3.16Å; K69-L109 CarbonylContact O-C 3.56Å; K69-L109 WeakPolarHBondContact O-CA 3.19Å; K69-R110 HydrophobicContact CB-CB 4.33Å; K69-R110 PolarHBondContact N-O 2.91Å; K69-R110 PolarHBondContact O-N 3.28Å; K69-E112 WeakPolarHBondContact CD-OE1 3.37Å; K69-E112 WeakPolarHBondContact CE-OE1 3.49Å; K69-E112 VanDerWaalsContact CE-OE2 3.32Å; K69-E112 WeakPolarHBondContact CE-OE2 3.48Å; K69-E112 IonicContact NZ-OE1 3.47Å; K69-E112 PolarHBondContact NZ-OE1 3.01Å; K69-E112 IonicContact NZ-OE2 2.71Å; K69-E112 PolarHBondContact NZ-OE2 2.66Å
70	M	95.8	Very high	90.4	Very high	43 Å²	43	50.8 Å²	50.8	21%	0.212	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.8	174.6	-175.4	167.1	67.8	0	0	109.7	F77 V79 V99 R108 L109	M70-F77 PolarHBondContact N-O 2.87Å; M70-F77 PolarHBondContact O-N 2.82Å; M70-V79 HydrophobicContact CB-CG2 3.59Å; M70-V99 HydrophobicContact SD-CG1 4.4Å; M70-R108 WeakPolarHBondContact CA-O 3.26Å; M70-L109 HydrophobicContact CB-CD2 4.04Å; M70-L109 HydrophobicContact CG-CD2 3.99Å; M70-L109 HydrophobicContact SD-CD2 4.26Å
71	Q	93.3	Very high	91.4	Very high	56 Å²	56	52.6 Å²	52.6	26%	0.262	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.9	178	-158.8	176.6	23.1	0	0	110.4	G74 Q75 W76 R108	Q71-G74 PolarHBondContact NE2-O 2.86Å; Q71-G74 VanDerWaalsContact NE2-O 3.14Å; Q71-Q75 CarbonylContact C-O 3.43Å; Q71-Q75 VanDerWaalsContact CA-O 3.29Å; Q71-Q75 WeakPolarHBondContact CA-O 3.36Å; Q71-Q75 WeakPolarHBondContact CG-O 3.41Å; Q71-W76 HydrophobicContact CB-CD2 4.14Å; Q71-W76 HydrophobicContact CB-CE3 3.88Å; Q71-W76 HydrophobicContact CB-CH2 4.06Å; Q71-W76 HydrophobicContact CB-CZ2 4.3Å; Q71-W76 HydrophobicContact CB-CZ3 3.82Å; Q71-W76 HydrophobicContact CG-CD2 4.31Å; Q71-R108 HydrophobicContact CB-CB 3.94Å; Q71-R108 PolarHBondContact N-O 2.95Å
72	S	86.1	Confident	91.7	Very high	27 Å²	27	47.2 Å²	47.2	19%	0.189	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	133.7	170.7	178.3	0	0	0	0	108.9	G74 Q75 F77	S72-G74 PolarHBondContact O-N 2.86Å; S72-G74 VanDerWaalsContact O-N 3.08Å; S72-Q75 PolarHBondContact N-O 3.5Å; S72-Q75 PolarHBondContact O-N 2.83Å; S72-Q75 VanDerWaalsContact O-O 3.09Å; S72-F77 WeakPolarHBondContact O-CE2 3.47Å
73	H	81.1	Confident	91.7	Very high	163 Å²	163	50.1 Å²	50.1	76%	0.755	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	38.4	-178.7	-57.9	84.7	0	0	0	113.9	Q75	H73-Q75 PolarHBondContact O-N 2.85Å
74	G	84	Confident	91.7	Very high	57 Å²	57	52 Å²	52	59%	0.588	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-7.5	-178.6	0	0	0	0	0	115.5	Q71 S72	Q71-G74 PolarHBondContact NE2-O 2.86Å; Q71-G74 VanDerWaalsContact NE2-O 3.14Å; S72-G74 PolarHBondContact O-N 2.86Å; S72-G74 VanDerWaalsContact O-N 3.08Å
75	Q	91.3	Very high	91.2	Very high	127 Å²	127	53.9 Å²	53.9	59%	0.593	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	148.1	-179.6	-63.5	-173.2	-8.1	0	0	111.9	Q71 S72 H73 F77	Q71-Q75 CarbonylContact C-O 3.43Å; Q71-Q75 VanDerWaalsContact CA-O 3.29Å; Q71-Q75 WeakPolarHBondContact CA-O 3.36Å; Q71-Q75 WeakPolarHBondContact CG-O 3.41Å; S72-Q75 PolarHBondContact N-O 3.5Å; S72-Q75 PolarHBondContact O-N 2.83Å; S72-Q75 VanDerWaalsContact O-O 3.09Å; H73-Q75 PolarHBondContact O-N 2.85Å; Q75-F77 HydrophobicContact CB-CE2 3.7Å; Q75-F77 HydrophobicContact CB-CZ 3.92Å; Q75-F77 WeakPolarHBondContact O-CD2 3.19Å
76	W	94.1	Very high	90.8	Very high	67 Å²	67	63.2 Å²	63.2	25%	0.254	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.7	177.9	-69	99.4	0	0	0	110.8	K69 Q71 R108 R110	K69-W76 HydrophobicContact CB-CE3 4.07Å; K69-W76 HydrophobicContact CD-CB 4.38Å; Q71-W76 HydrophobicContact CB-CD2 4.14Å; Q71-W76 HydrophobicContact CB-CE3 3.88Å; Q71-W76 HydrophobicContact CB-CH2 4.06Å; Q71-W76 HydrophobicContact CB-CZ2 4.3Å; Q71-W76 HydrophobicContact CB-CZ3 3.82Å; Q71-W76 HydrophobicContact CG-CD2 4.31Å; W76-R108 HydrophobicContact CH2-CB 4.1Å; W76-R110 HydrophobicContact CD2-CB 4.4Å; W76-R110 HydrophobicContact CE3-CB 3.82Å; W76-R110 HydrophobicContact CH2-CB 3.77Å; W76-R110 HydrophobicContact CZ2-CB 4.35Å; W76-R110 HydrophobicContact CZ3-CB 3.49Å; W76-R110 VanDerWaalsContact CZ3-CB 3.49Å
77	F	94.3	Very high	90.3	Very high	75 Å²	75	67.5 Å²	67.5	33%	0.329	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.2	177.3	-62.9	-86.7	0	0	0	110	L33 K69 M70 S72 Q75 V79	L33-F77 HydrophobicContact CD2-CB 4.39Å; L33-F77 HydrophobicContact CD2-CD1 3.91Å; L33-F77 HydrophobicContact CD2-CD2 4.12Å; L33-F77 HydrophobicContact CD2-CE1 4.21Å; L33-F77 HydrophobicContact CD2-CE2 4.39Å; L33-F77 HydrophobicContact CD2-CG 3.86Å; L33-F77 HydrophobicContact CD2-CZ 4.44Å; K69-F77 CarbonylContact C-O 3.43Å; K69-F77 WeakPolarHBondContact CA-O 3.28Å; K69-F77 WeakPolarHBondContact CB-O 3.16Å; M70-F77 PolarHBondContact N-O 2.87Å; M70-F77 PolarHBondContact O-N 2.82Å; S72-F77 WeakPolarHBondContact O-CE2 3.47Å; Q75-F77 HydrophobicContact CB-CE2 3.7Å; Q75-F77 HydrophobicContact CB-CZ 3.92Å; Q75-F77 WeakPolarHBondContact O-CD2 3.19Å; F77-V79 PolarHBondContact O-N 3.48Å
78	E	94.6	Very high	89.7	Confident	84 Å²	84	69 Å²	69	39%	0.393	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	125.1	170.9	-176.7	177.7	155.3	0	0	109.7	I67 R81	I67-E78 HydrophobicContact CG2-CG 3.66Å; E78-R81 VanDerWaalsContact CD-NH2 3.27Å; E78-R81 IonicContact OE1-CZ 3.51Å; E78-R81 IonicContact OE1-NE 2.67Å; E78-R81 PolarHBondContact OE1-NE 3.33Å; E78-R81 IonicContact OE1-NH2 2.84Å; E78-R81 PolarHBondContact OE1-NH2 2.6Å; E78-R81 IonicContact OE2-NH2 2.67Å; E78-R81 PolarHBondContact OE2-NH2 2.9Å
79	V	93.2	Very high	89.2	Confident	61 Å²	61	71.6 Å²	71.6	37%	0.37	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-55.9	175.1	178.9	0	0	0	0	109.1	L68 M70 F77	L68-V79 HydrophobicContact CB-CB 4.45Å; L68-V79 HydrophobicContact CD2-CB 4.21Å; L68-V79 HydrophobicContact CD2-CG1 4.22Å; L68-V79 HydrophobicContact CG-CB 4.09Å; L68-V79 HydrophobicContact CG-CG2 4.3Å; L68-V79 PolarHBondContact O-N 2.92Å; M70-V79 HydrophobicContact CB-CG2 3.59Å; F77-V79 PolarHBondContact O-N 3.48Å
80	D	92.2	Very high	88.5	Confident	53 Å²	53	73.1 Å²	73.1	28%	0.283	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	178.9	-179	-151.4	-26.1	0	0	0	110.1	L68 K95 F97	L68-D80 PolarHBondContact N-O 2.91Å; D80-K95 VanDerWaalsContact CG-CE 3.46Å; D80-K95 IonicContact OD1-NZ 3.79Å; D80-K95 WeakPolarHBondContact OD2-CE 3.37Å; D80-K95 IonicContact OD2-NZ 2.74Å; D80-K95 PolarHBondContact OD2-NZ 2.82Å; D80-F97 HydrophobicContact CB-CD1 3.83Å; D80-F97 HydrophobicContact CB-CE1 3.89Å
81	R	92.8	Very high	87.8	Confident	96 Å²	96	71.1 Å²	71.1	36%	0.362	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156.5	176.6	66.2	-173.1	71.3	163.1	-6.1	112.7	V66 I67 E78	V66-R81 CarbonylContact O-C 3.57Å; V66-R81 VanDerWaalsContact O-CA 3.27Å; V66-R81 WeakPolarHBondContact O-CA 3.35Å; I67-R81 HydrophobicContact CG1-CB 4.33Å; E78-R81 VanDerWaalsContact CD-NH2 3.27Å; E78-R81 IonicContact OE1-CZ 3.51Å; E78-R81 IonicContact OE1-NE 2.67Å; E78-R81 PolarHBondContact OE1-NE 3.33Å; E78-R81 IonicContact OE1-NH2 2.84Å; E78-R81 PolarHBondContact OE1-NH2 2.6Å; E78-R81 IonicContact OE2-NH2 2.67Å; E78-R81 PolarHBondContact OE2-NH2 2.9Å
82	T	89.6	Confident	87.3	Confident	10 Å²	10	73.6 Å²	73.6	6%	0.061	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-76.7	171.7	173.4	67.3	0	0	0	0	112.2	C65 V66 Y93 K95 F97	C65-T82 PolarHBondContact SG-O 3.21Å; V66-T82 HydrophobicContact CB-CG2 3.86Å; V66-T82 PolarHBondContact N-OG1 2.97Å; V66-T82 PolarHBondContact O-N 2.92Å; T82-Y93 VanDerWaalsContact CB-CD1 3.43Å; T82-Y93 HydrophobicContact CG2-CD1 3.87Å; T82-Y93 HydrophobicContact CG2-CD2 4.23Å; T82-Y93 HydrophobicContact CG2-CE1 4.44Å; T82-Y93 HydrophobicContact CG2-CG 3.73Å; T82-Y93 VanDerWaalsContact OG1-CD1 3.28Å; T82-Y93 WeakPolarHBondContact OG1-CD1 3.12Å; T82-Y93 VanDerWaalsContact OG1-CE1 3.23Å; T82-Y93 WeakPolarHBondContact OG1-CE1 3.26Å; T82-K95 HydrophobicContact CG2-CB 4.08Å; T82-K95 HydrophobicContact CG2-CG 4.35Å; T82-F97 HydrophobicContact CG2-CE1 4.49Å; T82-F97 HydrophobicContact CG2-CE2 3.9Å; T82-F97 HydrophobicContact CG2-CZ 3.55Å
83	E	87.6	Confident	87.2	Confident	64 Å²	64	73 Å²	73	30%	0.299	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-62	158.8	157.4	72.9	-83.2	-152.9	0	0	111.6	I85 Y93 S94 K95	E83-I85 HydrophobicContact CG-CG1 4.36Å; E83-Y93 HydrophobicContact CG-CD1 4.47Å; E83-Y93 WeakPolarHBondContact O-CE1 3.49Å; E83-S94 VanDerWaalsContact CD-OG 3.29Å; E83-S94 WeakPolarHBondContact OE1-CB 3.45Å; E83-S94 PolarHBondContact OE1-N 2.9Å; E83-S94 PolarHBondContact OE1-OG 3.4Å; E83-K95 VanDerWaalsContact OE2-CB 3.31Å; E83-K95 WeakPolarHBondContact OE2-CB 3.47Å; E83-K95 PolarHBondContact OE2-N 2.91Å
84	V	87.6	Confident	86.9	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.358	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-87.1	123.6	171.7	-176	0	0	0	0	108.7	D63 C65 I116	D63-V84 HydrophobicContact CB-CG1 3.77Å; D63-V84 WeakPolarHBondContact O-CG1 3.34Å; C65-V84 HydrophobicContact CB-CG2 4.15Å; V84-I116 HydrophobicContact CG1-CB 4.31Å; V84-I116 HydrophobicContact CG2-CB 4.06Å; V84-I116 HydrophobicContact CG2-CD1 3.97Å; V84-I116 HydrophobicContact CG2-CG1 4.41Å; V84-I116 HydrophobicContact CG2-CG2 4.4Å
85	I	79.6	Confident	86.9	Confident	40 Å²	40	70 Å²	70	21%	0.205	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-97.5	116.5	174.4	-58	-167.6	0	0	0	108.7	D63 P64 E83 C88 P91 V92 Y93	D63-I85 WeakPolarHBondContact CA-O 3.44Å; P64-I85 WeakPolarHBondContact CD-O 3.4Å; P64-I85 PolarHBondContact O-N 3.41Å; E83-I85 HydrophobicContact CG-CG1 4.36Å; I85-C88 HydrophobicContact CB-CB 4.4Å; I85-C88 HydrophobicContact CG2-CB 3.55Å; I85-P91 HydrophobicContact CB-CB 4.1Å; I85-P91 HydrophobicContact CD1-CB 3.75Å; I85-P91 HydrophobicContact CG1-CB 4.26Å; I85-P91 HydrophobicContact CG2-CB 4.44Å; I85-V92 WeakPolarHBondContact CD1-O 3.41Å; I85-Y93 HydrophobicContact CD1-CD1 3.78Å; I85-Y93 HydrophobicContact CD1-CE1 3.94Å; I85-Y93 HydrophobicContact CD1-CG 4.38Å; I85-Y93 HydrophobicContact CG1-CD1 3.92Å; I85-Y93 HydrophobicContact CG1-CE1 3.78Å
86	R	84	Confident	86.4	Confident	196 Å²	196	66.4 Å²	66.4	74%	0.74	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	138	-173.6	-66.3	-175	-179.6	-176.4	-1.4	113	D63 C88	D63-R86 WeakPolarHBondContact OD1-CA 3.47Å; R86-C88 VanDerWaalsContact C-N 3.34Å; R86-C88 PolarHBondContact O-N 3.49Å
87	T	84.6	Confident	86.2	Confident	91 Å²	91	63.2 Å²	63.2	56%	0.558	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	46.1	170.2	59	0	0	0	0	113.6	K61 P62 D63	K61-T87 VanDerWaalsContact CD-O 3.25Å; K61-T87 WeakPolarHBondContact CD-O 3.48Å; P62-T87 CarbonylContact O-C 3Å; P62-T87 VanDerWaalsContact O-CA 3.29Å; P62-T87 WeakPolarHBondContact O-CA 3.35Å; P62-T87 PolarHBondContact O-N 2.97Å; D63-T87 PolarHBondContact OD1-N 2.75Å
88	C	82.4	Confident	86.1	Confident	34 Å²	34	63 Å²	63	23%	0.23	33%	0.329	C	S	.	.			trans	-133.2	126	-170.2	-170.9	0	0	0	0	112.9	P62 P64 I85 R86 N90	P62-C88 PolarHBondContact O-N 3.46Å; P64-C88 WeakPolarHBondContact CD-O 3.23Å; P64-C88 VanDerWaalsContact CG-O 3.26Å; P64-C88 WeakPolarHBondContact CG-O 3.37Å; I85-C88 HydrophobicContact CB-CB 4.4Å; I85-C88 HydrophobicContact CG2-CB 3.55Å; R86-C88 VanDerWaalsContact C-N 3.34Å; R86-C88 PolarHBondContact O-N 3.49Å; C88-N90 VanDerWaalsContact SG-C 3.55Å
89	I	87.1	Confident	86	Confident	55 Å²	55	59.4 Å²	59.4	28%	0.282	31%	0.313	S	S	.	.	S	Bend	trans	-96.3	-8.7	177.9	60.7	167.8	0	0	0	113.6	G52 I53 P62 P91	G52-I89 PolarHBondContact N-O 3.43Å; I53-I89 PolarHBondContact N-O 3.32Å; P62-I89 HydrophobicContact CG-CG2 4.26Å; I89-P91 VanDerWaalsContact C-CD 3.47Å
90	N	83.3	Confident	86	Confident	78 Å²	78	59.2 Å²	59.2	42%	0.417	31%	0.31	S	S	.	.	S	Bend	trans	-131.8	57.7	178.4	-54.6	-59.1	0	0	0	110.9	C50 K51 G52 C88	C50-N90 CarbonylContact O-C 3.58Å; C50-N90 VanDerWaalsContact O-C 3.22Å; C50-N90 WeakPolarHBondContact O-CA 3.35Å; K51-N90 WeakPolarHBondContact CA-OD1 3.5Å; K51-N90 VanDerWaalsContact CG-OD1 3.25Å; K51-N90 WeakPolarHBondContact CG-OD1 3.35Å; G52-N90 PolarHBondContact N-OD1 2.87Å; C88-N90 VanDerWaalsContact SG-C 3.55Å
91	P	82.2	Confident	86	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	30%	0.296	C	S	.	.			trans	-66.9	138.2	-173.8	31.1	-38.7	0	0	0	111.7	A49 C50 I53 P64 I85 I89 Y93	A49-P91 CarbonylContact C-O 3.53Å; A49-P91 WeakPolarHBondContact CA-O 3.42Å; C50-P91 HydrophobicContact CB-CG 3.76Å; C50-P91 PolarHBondContact N-O 2.82Å; I53-P91 HydrophobicContact CD1-CG 3.72Å; P64-P91 HydrophobicContact CB-CG 4.13Å; P64-P91 HydrophobicContact CG-CB 3.85Å; P64-P91 HydrophobicContact CG-CG 3.59Å; I85-P91 HydrophobicContact CB-CB 4.1Å; I85-P91 HydrophobicContact CD1-CB 3.75Å; I85-P91 HydrophobicContact CG1-CB 4.26Å; I85-P91 HydrophobicContact CG2-CB 4.44Å; I89-P91 VanDerWaalsContact C-CD 3.47Å; P91-Y93 HydrophobicContact CB-CE1 4.13Å; P91-Y93 HydrophobicContact CB-CE2 3.82Å; P91-Y93 HydrophobicContact CG-CE2 3.81Å; P91-Y93 VanDerWaalsContact CG-OH 3.3Å; P91-Y93 WeakPolarHBondContact CG-OH 3.22Å
92	V	82.6	Confident	86	Confident	108 Å²	108	53 Å²	53	66%	0.655	28%	0.283	S	S	*	.	B	Isolated β-bridge	trans	-119.1	119.7	168.7	-179.7	0	0	0	0	106.9	A49 I85	A49-V92 HydrophobicContact CB-CB 4.46Å; A49-V92 HydrophobicContact CB-CG1 4.45Å; A49-V92 HydrophobicContact CB-CG2 4.07Å; I85-V92 WeakPolarHBondContact CD1-O 3.41Å
93	Y	82.5	Confident	86.1	Confident	14 Å²	14	52.6 Å²	52.6	6%	0.055	28%	0.28	C	S	.	.			trans	-94.5	142.2	-170.8	-59.2	-82.2	0	0	0	111.8	V48 P64 V66 T82 E83 I85 P91	V48-Y93 HydrophobicContact CB-CD2 4.4Å; V48-Y93 HydrophobicContact CG1-CD2 4.35Å; V48-Y93 WeakPolarHBondContact O-CD2 3.39Å; V48-Y93 PolarHBondContact O-N 2.97Å; P64-Y93 VanDerWaalsContact C-OH 3.32Å; P64-Y93 WeakPolarHBondContact CB-OH 3.43Å; P64-Y93 PolarHBondContact O-OH 2.81Å; V66-Y93 HydrophobicContact CG2-CD2 4.19Å; V66-Y93 HydrophobicContact CG2-CE2 3.47Å; V66-Y93 VanDerWaalsContact CG2-CE2 3.47Å; T82-Y93 VanDerWaalsContact CB-CD1 3.43Å; T82-Y93 HydrophobicContact CG2-CD1 3.87Å; T82-Y93 HydrophobicContact CG2-CD2 4.23Å; T82-Y93 HydrophobicContact CG2-CE1 4.44Å; T82-Y93 HydrophobicContact CG2-CG 3.73Å; T82-Y93 VanDerWaalsContact OG1-CD1 3.28Å; T82-Y93 WeakPolarHBondContact OG1-CD1 3.12Å; T82-Y93 VanDerWaalsContact OG1-CE1 3.23Å; T82-Y93 WeakPolarHBondContact OG1-CE1 3.26Å; E83-Y93 HydrophobicContact CG-CD1 4.47Å; E83-Y93 WeakPolarHBondContact O-CE1 3.49Å; I85-Y93 HydrophobicContact CD1-CD1 3.78Å; I85-Y93 HydrophobicContact CD1-CE1 3.94Å; I85-Y93 HydrophobicContact CD1-CG 4.38Å; I85-Y93 HydrophobicContact CG1-CD1 3.92Å; I85-Y93 HydrophobicContact CG1-CE1 3.78Å; P91-Y93 HydrophobicContact CB-CE1 4.13Å; P91-Y93 HydrophobicContact CB-CE2 3.82Å; P91-Y93 HydrophobicContact CG-CE2 3.81Å; P91-Y93 VanDerWaalsContact CG-OH 3.3Å; P91-Y93 WeakPolarHBondContact CG-OH 3.22Å
94	S	75.4	Confident	86.2	Confident	97 Å²	97	50.7 Å²	50.7	68%	0.678	27%	0.271	S	S	*	.			trans	-84.4	-24.3	172.9	64.2	0	0	0	0	112.5	E83 L96	E83-S94 VanDerWaalsContact CD-OG 3.29Å; E83-S94 WeakPolarHBondContact OE1-CB 3.45Å; E83-S94 PolarHBondContact OE1-N 2.9Å; E83-S94 PolarHBondContact OE1-OG 3.4Å; S94-L96 PolarHBondContact O-N 3.39Å
95	K	84.3	Confident	86.3	Confident	61 Å²	61	51.3 Å²	51.3	27%	0.265	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.1	174.1	178	67.4	174.3	178.2	0	111.3	D80 T82 E83 F97	D80-K95 VanDerWaalsContact CG-CE 3.46Å; D80-K95 IonicContact OD1-NZ 3.79Å; D80-K95 WeakPolarHBondContact OD2-CE 3.37Å; D80-K95 IonicContact OD2-NZ 2.74Å; D80-K95 PolarHBondContact OD2-NZ 2.82Å; T82-K95 HydrophobicContact CG2-CB 4.08Å; T82-K95 HydrophobicContact CG2-CG 4.35Å; E83-K95 VanDerWaalsContact OE2-CB 3.31Å; E83-K95 WeakPolarHBondContact OE2-CB 3.47Å; E83-K95 PolarHBondContact OE2-N 2.91Å; K95-F97 HydrophobicContact CG-CD1 4.44Å; K95-F97 HydrophobicContact CG-CE1 4.18Å
96	L	80.9	Confident	86.8	Confident	50 Å²	50	51.7 Å²	51.7	26%	0.262	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-99.8	129.4	168.1	-54.9	175	0	0	0	108.9	R47 S94	R47-L96 HydrophobicContact CG-CD2 3.49Å; R47-L96 VanDerWaalsContact CG-CD2 3.49Å; S94-L96 PolarHBondContact O-N 3.39Å
97	F	90	Very high	87.3	Confident	1 Å²	1	43 Å²	43	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.3	167	-58.8	-64.3	0	0	0	108.8	E45 L46 V48 L68 D80 T82 K95	E45-F97 CarbonylContact C-O 3.45Å; E45-F97 WeakPolarHBondContact CA-O 3.41Å; L46-F97 HydrophobicContact CB-CB 4.19Å; L46-F97 PolarHBondContact N-O 3.32Å; L46-F97 PolarHBondContact O-N 3.33Å; L46-F97 VanDerWaalsContact O-N 3.09Å; V48-F97 HydrophobicContact CG2-CD2 3.93Å; V48-F97 HydrophobicContact CG2-CE2 3.76Å; L68-F97 HydrophobicContact CB-CD1 4.07Å; L68-F97 HydrophobicContact CB-CD2 4.41Å; L68-F97 HydrophobicContact CB-CE1 3.94Å; L68-F97 HydrophobicContact CB-CE2 4.29Å; L68-F97 HydrophobicContact CB-CG 4.29Å; L68-F97 HydrophobicContact CB-CZ 4.03Å; L68-F97 HydrophobicContact CD2-CB 3.68Å; L68-F97 HydrophobicContact CD2-CD1 4.03Å; L68-F97 HydrophobicContact CD2-CD2 4.21Å; L68-F97 HydrophobicContact CD2-CG 3.73Å; D80-F97 HydrophobicContact CB-CD1 3.83Å; D80-F97 HydrophobicContact CB-CE1 3.89Å; T82-F97 HydrophobicContact CG2-CE1 4.49Å; T82-F97 HydrophobicContact CG2-CE2 3.9Å; T82-F97 HydrophobicContact CG2-CZ 3.55Å; K95-F97 HydrophobicContact CG-CD1 4.44Å; K95-F97 HydrophobicContact CG-CE1 4.18Å
98	T	90.7	Very high	87.8	Confident	69 Å²	69	44.1 Å²	44.1	42%	0.423	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123	174.4	-51.8	0	0	0	0	108.8	K43 V44 L168	K43-T98 HydrophobicContact CB-CG2 4.16Å; K43-T98 HydrophobicContact CD-CG2 4.15Å; K43-T98 HydrophobicContact CG-CG2 4.5Å; V44-T98 WeakPolarHBondContact O-CA 3.31Å; T98-L168 HydrophobicContact CG2-CD1 3.83Å
99	V	93	Very high	88.5	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.3	-179.3	-168.1	0	0	0	0	109	K43 V44 L46 L68 M70 L136	K43-V99 WeakPolarHBondContact CA-O 3.45Å; V44-V99 PolarHBondContact N-O 2.78Å; V44-V99 PolarHBondContact O-N 2.8Å; L46-V99 HydrophobicContact CD1-CG2 3.93Å; L68-V99 HydrophobicContact CD2-CG2 4.07Å; M70-V99 HydrophobicContact SD-CG1 4.4Å; V99-L136 HydrophobicContact CB-CD2 4.33Å; V99-L136 HydrophobicContact CG1-CD2 3.98Å
100	D	92.9	Very high	89	Confident	57 Å²	57	43 Å²	43	31%	0.305	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.5	172.2	-65.8	-16.1	0	0	0	109	C40 K43 Y102 Q107	C40-D100 HydrophobicContact CB-CB 3.82Å; K43-D100 WeakPolarHBondContact CG-OD1 3.44Å; K43-D100 IonicContact NZ-OD1 2.75Å; K43-D100 PolarHBondContact NZ-OD1 2.92Å; D100-Y102 HydrophobicContact CB-CD2 4.47Å; D100-Y102 HydrophobicContact CB-CE2 3.65Å; D100-Q107 PolarHBondContact O-NE2 3.28Å
101	F	92.6	Very high	89.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.5	179.4	176	-102.2	0	0	0	110.9	L41 T42 V44 F103 L136 V140 F314 L315 Y370	L41-F101 HydrophobicContact CB-CD1 4.19Å; L41-F101 HydrophobicContact CD2-CD1 3.92Å; L41-F101 HydrophobicContact CD2-CE1 3.73Å; L41-F101 PolarHBondContact N-O 3.3Å; T42-F101 HydrophobicContact CG2-CB 4.12Å; T42-F101 HydrophobicContact CG2-CD1 4.07Å; T42-F101 HydrophobicContact CG2-CG 4.49Å; T42-F101 PolarHBondContact O-N 3Å; V44-F101 HydrophobicContact CG2-CB 3.84Å; V44-F101 HydrophobicContact CG2-CG 4.38Å; F101-F103 HydrophobicContact CE1-CB 4.07Å; F101-F103 HydrophobicContact CZ-CB 4.27Å; F101-L136 HydrophobicContact CB-CD2 4.23Å; F101-L136 HydrophobicContact CD2-CD2 3.85Å; F101-L136 HydrophobicContact CD2-CG 4.05Å; F101-V140 HydrophobicContact CE2-CG2 3.84Å; F101-V140 HydrophobicContact CZ-CG2 4.28Å; F101-F314 HydrophobicContact CE1-CD1 4.35Å; F101-F314 HydrophobicContact CE1-CE1 4.31Å; F101-F314 HydrophobicContact CZ-CE1 4.47Å; F101-L315 HydrophobicContact CD1-CD1 3.81Å; F101-L315 HydrophobicContact CD1-CD2 4.03Å; F101-L315 HydrophobicContact CD1-CG 4.01Å; F101-L315 HydrophobicContact CE1-CD1 4.18Å; F101-L315 HydrophobicContact CE1-CD2 3.52Å; F101-L315 HydrophobicContact CE1-CG 3.91Å; F101-L315 HydrophobicContact CE2-CD2 4.27Å; F101-L315 HydrophobicContact CG-CD1 4.07Å; F101-L315 HydrophobicContact CZ-CD2 3.65Å; F101-L315 HydrophobicContact CZ-CG 4.5Å; F101-Y370 HydrophobicContact CE2-CE1 4.48Å; F101-Y370 VanDerWaalsContact CE2-OH 3.31Å; F101-Y370 WeakPolarHBondContact CE2-OH 3.28Å; F101-Y370 HydrophobicContact CZ-CE1 4.1Å; F101-Y370 WeakPolarHBondContact CZ-OH 3.37Å
102	Y	92.4	Very high	90.4	Very high	20 Å²	20	40 Å²	40	8%	0.078	21%	0.207	C	C	.	.			trans	-122.5	113.1	174.5	-59.3	-90.3	0	0	0	106.9	C40 D100 E104 E105 Q107	C40-Y102 HydrophobicContact CB-CD1 4.19Å; C40-Y102 HydrophobicContact CB-CE1 3.64Å; C40-Y102 HydrophobicContact CB-CE2 3.99Å; D100-Y102 HydrophobicContact CB-CD2 4.47Å; D100-Y102 HydrophobicContact CB-CE2 3.65Å; Y102-E104 PolarHBondContact O-N 3.05Å; Y102-E105 PolarHBondContact O-N 2.82Å; Y102-Q107 PolarHBondContact O-OE1 2.85Å
103	F	91.6	Very high	90.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-36.1	-178.8	167.1	-111.8	0	0	0	110.9	L41 F101 E105 F314 I366 Y370 L542 V545 P546	L41-F103 HydrophobicContact CD2-CB 4.36Å; F101-F103 HydrophobicContact CE1-CB 4.07Å; F101-F103 HydrophobicContact CZ-CB 4.27Å; F103-E105 VanDerWaalsContact C-N 3.29Å; F103-E105 PolarHBondContact O-N 2.96Å; F103-F314 HydrophobicContact CB-CE1 4.32Å; F103-F314 AromaticContact CD2-CE1 3.5Å; F103-F314 HydrophobicContact CD2-CE1 3.5Å; F103-F314 VanDerWaalsContact CD2-CE1 3.5Å; F103-F314 AromaticContact CD2-CZ 3.51Å; F103-F314 HydrophobicContact CD2-CZ 3.51Å; F103-F314 HydrophobicContact CE2-CE1 4.06Å; F103-F314 AromaticContact CE2-CZ 3.56Å; F103-F314 HydrophobicContact CE2-CZ 3.56Å; F103-F314 HydrophobicContact CG-CE1 4.04Å; F103-F314 HydrophobicContact CG-CZ 4.21Å; F103-F314 HydrophobicContact CZ-CZ 4.3Å; F103-I366 WeakPolarHBondContact O-CG2 3.4Å; F103-Y370 HydrophobicContact CD2-CD2 4.37Å; F103-Y370 HydrophobicContact CD2-CE1 4.27Å; F103-Y370 AromaticContact CD2-CE2 3.77Å; F103-Y370 HydrophobicContact CD2-CE2 3.77Å; F103-Y370 AromaticContact CD2-CZ 3.71Å; F103-Y370 AromaticContact CE2-CD2 3.82Å; F103-Y370 HydrophobicContact CE2-CD2 3.82Å; F103-Y370 HydrophobicContact CE2-CE1 4.48Å; F103-Y370 AromaticContact CE2-CE2 3.65Å; F103-Y370 HydrophobicContact CE2-CE2 3.65Å; F103-Y370 HydrophobicContact CE2-CG 4.3Å; F103-L542 HydrophobicContact CD1-CB 4.1Å; F103-L542 HydrophobicContact CE1-CB 3.81Å; F103-L542 HydrophobicContact CE1-CD1 4.33Å; F103-L542 HydrophobicContact CE1-CD2 4.08Å; F103-L542 HydrophobicContact CE1-CG 4.3Å; F103-V545 HydrophobicContact CE1-CB 3.73Å; F103-V545 HydrophobicContact CE1-CG1 3.74Å; F103-V545 HydrophobicContact CE1-CG2 4.43Å; F103-V545 HydrophobicContact CZ-CB 4.35Å; F103-V545 HydrophobicContact CZ-CG1 3.85Å; F103-P546 HydrophobicContact CB-CG 3.94Å; F103-P546 HydrophobicContact CD1-CG 3.62Å; F103-P546 HydrophobicContact CE1-CG 4.37Å; F103-P546 HydrophobicContact CG-CG 3.89Å
104	E	90.1	Very high	91.4	Very high	25 Å²	25	35.4 Å²	35.4	12%	0.117	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	10	-174.4	73.5	-84.6	-160.9	0	0	115	Y102 I366 K539 L542	Y102-E104 PolarHBondContact O-N 3.05Å; E104-I366 WeakPolarHBondContact O-CD1 3.42Å; E104-K539 HydrophobicContact CB-CB 4.42Å; E104-K539 HydrophobicContact CG-CB 3.81Å; E104-K539 HydrophobicContact CG-CD 4.24Å; E104-K539 HydrophobicContact CG-CG 3.85Å; E104-L542 HydrophobicContact CB-CB 4.05Å
105	E	89.9	Confident	92.1	Very high	72 Å²	72	31.3 Å²	31.3	34%	0.336	15%	0.149	S	C	.	.	S	Bend	trans	-129	141.1	-179.1	-62	-168.5	177.6	0	0	113	Y102 F103 Q107	Y102-E105 PolarHBondContact O-N 2.82Å; F103-E105 VanDerWaalsContact C-N 3.29Å; F103-E105 PolarHBondContact O-N 2.96Å; E105-Q107 HydrophobicContact CB-CG 3.99Å; E105-Q107 PolarHBondContact O-N 2.8Å
106	V	90.8	Very high	92.1	Very high	47 Å²	47	29.8 Å²	29.8	29%	0.285	14%	0.144	S	C	.	.			trans	-79.9	85.1	168	-171.5	0	0	0	0	109.5	R108 T135 E365 I366	V106-R108 HydrophobicContact CG1-CG 4.07Å; V106-R108 PolarHBondContact O-N 2.78Å; V106-R108 VanDerWaalsContact O-N 3.11Å; V106-T135 HydrophobicContact CG1-CG2 3.75Å; V106-E365 HydrophobicContact CG2-CB 4.25Å; V106-I366 HydrophobicContact CG2-CB 4.47Å; V106-I366 HydrophobicContact CG2-CG1 3.49Å; V106-I366 VanDerWaalsContact CG2-CG1 3.49Å
107	Q	93.3	Very high	91.7	Very high	14 Å²	14	28.5 Å²	28.5	7%	0.065	14%	0.139	C	C	.	.			trans	-80.9	92.5	-178.9	-60.6	-179.3	-98	0	0	111.4	D100 Y102 E105 T135 L136	D100-Q107 PolarHBondContact O-NE2 3.28Å; Y102-Q107 PolarHBondContact O-OE1 2.85Å; E105-Q107 HydrophobicContact CB-CG 3.99Å; E105-Q107 PolarHBondContact O-N 2.8Å; Q107-T135 CarbonylContact O-C 3.58Å; Q107-T135 VanDerWaalsContact O-CA 3.28Å; Q107-T135 WeakPolarHBondContact O-CA 3.27Å; Q107-L136 HydrophobicContact CB-CB 3.95Å; Q107-L136 PolarHBondContact O-N 2.99Å
108	R	95.7	Very high	90.4	Very high	115 Å²	115	33.6 Å²	33.6	43%	0.434	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	126.5	-177.3	-66.3	175.9	176.3	-139.5	2.9	111.9	M70 Q71 W76 V106 T135	M70-R108 WeakPolarHBondContact CA-O 3.26Å; Q71-R108 HydrophobicContact CB-CB 3.94Å; Q71-R108 PolarHBondContact N-O 2.95Å; W76-R108 HydrophobicContact CH2-CB 4.1Å; V106-R108 HydrophobicContact CG1-CG 4.07Å; V106-R108 PolarHBondContact O-N 2.78Å; V106-R108 VanDerWaalsContact O-N 3.11Å; R108-T135 HydrophobicContact CG-CG2 4.27Å
109	L	97.4	Very high	88.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142	-179.5	-57.6	-179.3	0	0	0	111	L46 L68 K69 M70 F111 E133 C134 L136 I139	L46-L109 HydrophobicContact CD1-CD1 4.03Å; L68-L109 HydrophobicContact CD1-CB 4.21Å; L68-L109 HydrophobicContact CD1-CD2 4.27Å; K69-L109 CarbonylContact O-C 3.56Å; K69-L109 WeakPolarHBondContact O-CA 3.19Å; M70-L109 HydrophobicContact CB-CD2 4.04Å; M70-L109 HydrophobicContact CG-CD2 3.99Å; M70-L109 HydrophobicContact SD-CD2 4.26Å; L109-F111 HydrophobicContact CB-CE2 3.98Å; L109-F111 HydrophobicContact CD1-CE2 4.35Å; L109-F111 HydrophobicContact CD1-CZ 4.4Å; L109-E133 WeakPolarHBondContact O-CA 3.1Å; L109-C134 PolarHBondContact N-O 3.03Å; L109-C134 PolarHBondContact O-N 3.03Å; L109-L136 HydrophobicContact CD1-CB 4.06Å; L109-L136 HydrophobicContact CD1-CD1 4.14Å; L109-I139 HydrophobicContact CD1-CD1 3.89Å
110	R	97.5	Very high	87.3	Confident	64 Å²	64	38.4 Å²	38.4	24%	0.242	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.6	171	-177.1	-171.9	-75.1	175.4	-2.8	109.4	K69 W76 E112 M132 E133	K69-R110 HydrophobicContact CB-CB 4.33Å; K69-R110 PolarHBondContact N-O 2.91Å; K69-R110 PolarHBondContact O-N 3.28Å; W76-R110 HydrophobicContact CD2-CB 4.4Å; W76-R110 HydrophobicContact CE3-CB 3.82Å; W76-R110 HydrophobicContact CH2-CB 3.77Å; W76-R110 HydrophobicContact CZ2-CB 4.35Å; W76-R110 HydrophobicContact CZ3-CB 3.49Å; W76-R110 VanDerWaalsContact CZ3-CB 3.49Å; R110-E112 WeakPolarHBondContact CD-OE1 3.43Å; R110-E112 HydrophobicContact CG-CG 3.95Å; R110-E112 IonicContact NH1-OE1 2.64Å; R110-M132 CarbonylContact C-O 3.5Å; R110-M132 WeakPolarHBondContact CA-O 3.47Å; R110-E133 HydrophobicContact CB-CG 4.04Å; R110-E133 HydrophobicContact CG-CG 3.86Å; R110-E133 IonicContact CZ-OE1 3.07Å; R110-E133 IonicContact NE-OE1 2.75Å; R110-E133 PolarHBondContact NE-OE1 3.15Å; R110-E133 IonicContact NH2-OE1 2.63Å; R110-E133 PolarHBondContact NH2-OE1 3.1Å
111	F	97.6	Very high	85.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116	173.3	-62.5	-101.4	0	0	0	108	L46 V48 V66 I67 L68 L109 G131 M132 I139 I161 V163	L46-F111 HydrophobicContact CD1-CZ 4.17Å; V48-F111 HydrophobicContact CG2-CD1 4.17Å; V48-F111 HydrophobicContact CG2-CE1 3.86Å; V66-F111 HydrophobicContact CG1-CB 4.22Å; V66-F111 HydrophobicContact CG1-CD1 4.09Å; I67-F111 WeakPolarHBondContact O-CA 3.19Å; L68-F111 HydrophobicContact CD1-CD1 4.04Å; L68-F111 HydrophobicContact CD1-CD2 4.33Å; L68-F111 HydrophobicContact CD1-CE1 3.71Å; L68-F111 HydrophobicContact CD1-CE2 4.01Å; L68-F111 HydrophobicContact CD1-CG 4.35Å; L68-F111 HydrophobicContact CD1-CZ 3.68Å; L109-F111 HydrophobicContact CB-CE2 3.98Å; L109-F111 HydrophobicContact CD1-CE2 4.35Å; L109-F111 HydrophobicContact CD1-CZ 4.4Å; F111-G131 CarbonylContact O-C 3.52Å; F111-G131 WeakPolarHBondContact O-CA 3.14Å; F111-M132 HydrophobicContact CB-CE 4.31Å; F111-M132 HydrophobicContact CD2-CE 3.25Å; F111-M132 HydrophobicContact CE2-CE 3.67Å; F111-M132 HydrophobicContact CG-CE 3.9Å; F111-M132 PolarHBondContact N-O 2.91Å; F111-M132 PolarHBondContact O-N 3.44Å; F111-I139 HydrophobicContact CE2-CD1 4.12Å; F111-I139 HydrophobicContact CZ-CD1 4.13Å; F111-I161 HydrophobicContact CB-CD1 3.63Å; F111-I161 HydrophobicContact CD1-CD1 4.2Å; F111-I161 HydrophobicContact CG-CD1 4.11Å; F111-V163 HydrophobicContact CD1-CG2 4.28Å; F111-V163 HydrophobicContact CE1-CG1 4.27Å; F111-V163 HydrophobicContact CE1-CG2 3.9Å; F111-V163 HydrophobicContact CE2-CG2 4.2Å; F111-V163 HydrophobicContact CZ-CG1 4.01Å; F111-V163 HydrophobicContact CZ-CG2 3.86Å
112	E	96.3	Very high	83.8	Confident	18 Å²	18	44.5 Å²	44.5	8%	0.084	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.4	177.9	-63.4	179.9	-175.2	0	0	109.9	V66 I67 K69 R110 H114 F128	V66-E112 CarbonylContact C-O 3.49Å; V66-E112 WeakPolarHBondContact CA-O 3.42Å; I67-E112 HydrophobicContact CB-CB 4.49Å; I67-E112 PolarHBondContact N-O 3Å; I67-E112 PolarHBondContact O-N 3.09Å; K69-E112 WeakPolarHBondContact CD-OE1 3.37Å; K69-E112 WeakPolarHBondContact CE-OE1 3.49Å; K69-E112 VanDerWaalsContact CE-OE2 3.32Å; K69-E112 WeakPolarHBondContact CE-OE2 3.48Å; K69-E112 IonicContact NZ-OE1 3.47Å; K69-E112 PolarHBondContact NZ-OE1 3.01Å; K69-E112 IonicContact NZ-OE2 2.71Å; K69-E112 PolarHBondContact NZ-OE2 2.66Å; R110-E112 WeakPolarHBondContact CD-OE1 3.43Å; R110-E112 HydrophobicContact CG-CG 3.95Å; R110-E112 IonicContact NH1-OE1 2.64Å; E112-H114 WeakPolarHBondContact CB-NE2 3.43Å; E112-H114 IonicContact OE2-CE1 3.76Å; E112-H114 IonicContact OE2-NE2 3.32Å; E112-H114 PolarHBondContact OE2-NE2 3.19Å; E112-F128 HydrophobicContact CB-CE2 3.96Å; E112-F128 HydrophobicContact CG-CE2 4.06Å
113	V	94.7	Very high	82.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.9	176.5	-166.5	0	0	0	0	108.7	I53 P64 C65 V66 L129 G130 L149 I161	I53-V113 HydrophobicContact CD1-CG1 4.07Å; P64-V113 HydrophobicContact CB-CG1 4.14Å; C65-V113 WeakPolarHBondContact O-CA 3.29Å; V66-V113 HydrophobicContact CG2-CG2 4.21Å; V113-L129 HydrophobicContact CB-CB 4.33Å; V113-L129 HydrophobicContact CG1-CB 4.32Å; V113-L129 HydrophobicContact CG1-CD1 4.11Å; V113-L129 WeakPolarHBondContact O-CB 3.45Å; V113-L129 PolarHBondContact O-N 2.91Å; V113-G130 PolarHBondContact N-O 3.07Å; V113-G130 PolarHBondContact O-N 3Å; V113-L149 HydrophobicContact CB-CD1 4.25Å; V113-L149 HydrophobicContact CG2-CD1 3.65Å; V113-L149 HydrophobicContact CG2-CD2 3.71Å; V113-L149 HydrophobicContact CG2-CG 4.36Å; V113-I161 HydrophobicContact CG2-CD1 4.5Å
114	H	92.1	Very high	80.8	Confident	24 Å²	24	56.7 Å²	56.7	11%	0.111	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.1	-177.4	-68	-93.8	0	0	0	110.7	P64 C65 I67 E112 A126 D127 F128	P64-H114 CarbonylContact C-O 3.47Å; P64-H114 WeakPolarHBondContact CA-O 3.19Å; C65-H114 PolarHBondContact N-O 2.94Å; C65-H114 PolarHBondContact O-N 2.94Å; I67-H114 VanDerWaalsContact CD1-CD2 3.4Å; I67-H114 WeakPolarHBondContact CD1-CD2 3.22Å; E112-H114 WeakPolarHBondContact CB-NE2 3.43Å; E112-H114 IonicContact OE2-CE1 3.76Å; E112-H114 IonicContact OE2-NE2 3.32Å; E112-H114 PolarHBondContact OE2-NE2 3.19Å; H114-A126 HydrophobicContact CB-CB 4.17Å; H114-D127 CarbonylContact C-O 3.54Å; H114-D127 WeakPolarHBondContact CA-O 3.38Å; H114-F128 AromaticContact CE1-CD2 3.7Å; H114-F128 AromaticContact NE2-CD2 3.96Å
115	D	89.9	Confident	79.7	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.064	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	115.8	170.4	-169	-1.8	0	0	0	109.6	P62 D63 A126 D127 L129	P62-D115 HydrophobicContact CB-CB 4.49Å; D63-D115 PolarHBondContact N-OD1 2.78Å; D115-A126 WeakPolarHBondContact O-CA 3.42Å; D115-A126 WeakPolarHBondContact O-CB 3.31Å; D115-D127 HydrophobicContact CB-CB 4.15Å; D115-D127 PolarHBondContact N-O 3.45Å; D115-D127 PolarHBondContact O-N 3.43Å; D115-L129 HydrophobicContact CB-CD1 3.87Å; D115-L129 HydrophobicContact CB-CD2 4.12Å; D115-L129 HydrophobicContact CB-CG 4.05Å
116	I	83.9	Confident	79.2	Confident	29 Å²	29	57.6 Å²	57.6	15%	0.149	30%	0.3	C	S	.	.			trans	-109.2	65.3	-179.8	-48	-172.2	0	0	0	108.9	D63 C65 V84 L123 A126	D63-I116 PolarHBondContact O-N 2.98Å; C65-I116 HydrophobicContact CB-CD1 3.43Å; C65-I116 VanDerWaalsContact CB-CD1 3.43Å; C65-I116 HydrophobicContact CB-CG1 3.88Å; V84-I116 HydrophobicContact CG1-CB 4.31Å; V84-I116 HydrophobicContact CG2-CB 4.06Å; V84-I116 HydrophobicContact CG2-CD1 3.97Å; V84-I116 HydrophobicContact CG2-CG1 4.41Å; V84-I116 HydrophobicContact CG2-CG2 4.4Å; I116-L123 HydrophobicContact CD1-CD1 4.49Å; I116-L123 HydrophobicContact CD1-CG 4.42Å; I116-A126 HydrophobicContact CG1-CB 4.21Å
117	S	73.9	Confident	79	Confident	23 Å²	23	57.8 Å²	57.8	16%	0.161	30%	0.299	C	S	.	.			trans	-58.6	149.9	176.5	90.7	0	0	0	0	112.3	N119 H120	S117-N119 PolarHBondContact O-N 3.28Å; S117-H120 WeakPolarHBondContact O-CB 3.44Å; S117-H120 PolarHBondContact O-N 2.69Å; S117-H120 PolarHBondContact OG-CD2 3.33Å; S117-H120 PolarHBondContact OG-NE2 3.42Å
118	S	62.1	Low	78.8	Confident	108 Å²	108	60.1 Å²	60.1	76%	0.755	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.6	179.7	55.9	0	0	0	0	115.1	H120	S118-H120 VanDerWaalsContact C-N 3.35Å
119	N	60.3	Low	78.6	Confident	139 Å²	139	55.9 Å²	55.9	74%	0.743	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-8.9	178.2	-63.6	-16.6	0	0	0	112.6	S117	S117-N119 PolarHBondContact O-N 3.28Å
120	H	58.3	Low	78.4	Confident	39 Å²	39	55.9 Å²	55.9	18%	0.181	30%	0.295	C	S	.	.	S	Bend	trans	-93	133.1	-179.8	-63.4	-52.6	0	0	0	111.8	S117 S118 G122 E125	S117-H120 WeakPolarHBondContact O-CB 3.44Å; S117-H120 PolarHBondContact O-N 2.69Å; S117-H120 PolarHBondContact OG-CD2 3.33Å; S117-H120 PolarHBondContact OG-NE2 3.42Å; S118-H120 VanDerWaalsContact C-N 3.35Å; H120-G122 PolarHBondContact O-N 3.39Å; H120-E125 WeakPolarHBondContact CA-OE2 3.33Å; H120-E125 HydrophobicContact CB-CB 3.97Å; H120-E125 PolarHBondContact CE1-O 2.71Å; H120-E125 WeakPolarHBondContact ND1-CB 3.32Å; H120-E125 PolarHBondContact ND1-O 3.32Å; H120-E125 IonicContact ND1-OE2 3.18Å
121	N	54	Low	78.3	Confident	152 Å²	152	53.2 Å²	53.2	81%	0.813	29%	0.288	S	S	*	.	S	Bend	trans	-79.3	52.9	174	-79.7	-35.9	0	0	0	112.1	E125	N121-E125 PolarHBondContact N-OE2 3.4Å
122	G	58.4	Low	78.2	Confident	34 Å²	34	53.4 Å²	53.4	35%	0.351	29%	0.289	S	S	.	.	S	Bend	trans	89.9	-169.4	-178.6	0	0	0	0	0	114.6	H120 K124 E125	H120-G122 PolarHBondContact O-N 3.39Å; G122-K124 PolarHBondContact O-N 3.17Å; G122-E125 PolarHBondContact O-N 3.19Å
123	L	60.3	Low	78.2	Confident	63 Å²	63	57.2 Å²	57.2	33%	0.33	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-61	-17.6	-169.1	-84.4	90.3	0	0	0	116	I67 I116 E125 A126	I67-L123 HydrophobicContact CD1-CD2 3.3Å; I67-L123 HydrophobicContact CG1-CD2 4.3Å; I116-L123 HydrophobicContact CD1-CD1 4.49Å; I116-L123 HydrophobicContact CD1-CG 4.42Å; L123-E125 PolarHBondContact O-N 3.08Å; L123-A126 PolarHBondContact O-N 3.41Å
124	K	60.1	Low	78.2	Confident	212 Å²	212	57.7 Å²	57.7	92%	0.922	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-67.2	-19.3	-177.9	-73.7	-172.4	176.2	-176.3	0	113.1	G122	G122-K124 PolarHBondContact O-N 3.17Å
125	E	66.8	Low	78.4	Confident	98 Å²	98	57.2 Å²	57.2	46%	0.458	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-118.2	8.5	-179.4	-61.9	173.9	170.1	0	0	112.2	H120 N121 G122 L123	H120-E125 WeakPolarHBondContact CA-OE2 3.33Å; H120-E125 HydrophobicContact CB-CB 3.97Å; H120-E125 PolarHBondContact CE1-O 2.71Å; H120-E125 WeakPolarHBondContact ND1-CB 3.32Å; H120-E125 PolarHBondContact ND1-O 3.32Å; H120-E125 IonicContact ND1-OE2 3.18Å; N121-E125 PolarHBondContact N-OE2 3.4Å; G122-E125 PolarHBondContact O-N 3.19Å; L123-E125 PolarHBondContact O-N 3.08Å
126	A	79.6	Confident	78.6	Confident	18 Å²	18	56.6 Å²	56.6	15%	0.149	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-71.8	138	-178.7	0	0	0	0	0	111.6	H114 D115 I116 L123	H114-A126 HydrophobicContact CB-CB 4.17Å; D115-A126 WeakPolarHBondContact O-CA 3.42Å; D115-A126 WeakPolarHBondContact O-CB 3.31Å; I116-A126 HydrophobicContact CG1-CB 4.21Å; L123-A126 PolarHBondContact O-N 3.41Å
127	D	86.4	Confident	79.1	Confident	51 Å²	51	55.5 Å²	55.5	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.2	179.3	-70.1	-39.6	0	0	0	110.8	R56 H114 D115 L129	R56-D127 IonicContact CZ-OD2 3.32Å; R56-D127 VanDerWaalsContact CZ-OD2 3.32Å; R56-D127 IonicContact NE-OD2 3.71Å; R56-D127 IonicContact NH1-OD2 2.64Å; R56-D127 PolarHBondContact NH1-OD2 3.25Å; H114-D127 CarbonylContact C-O 3.54Å; H114-D127 WeakPolarHBondContact CA-O 3.38Å; D115-D127 HydrophobicContact CB-CB 4.15Å; D115-D127 PolarHBondContact N-O 3.45Å; D115-D127 PolarHBondContact O-N 3.43Å; D127-L129 PolarHBondContact O-N 3.03Å
128	F	90.6	Very high	80	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.281	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	117.3	174.7	-178.8	-114.4	0	0	0	111.1	E112 H114 G130 G131 K151	E112-F128 HydrophobicContact CB-CE2 3.96Å; E112-F128 HydrophobicContact CG-CE2 4.06Å; H114-F128 AromaticContact CE1-CD2 3.7Å; H114-F128 AromaticContact NE2-CD2 3.96Å; F128-G130 VanDerWaalsContact CE2-C 3.4Å; F128-G130 VanDerWaalsContact CE2-O 3.3Å; F128-G130 WeakPolarHBondContact CE2-O 3.42Å; F128-G131 VanDerWaalsContact CZ-N 3.35Å; F128-K151 HydrophobicContact CD1-CG 4.25Å; F128-K151 HydrophobicContact CE1-CG 4.38Å; F128-K151 VanDerWaalsContact O-CE 3.3Å; F128-K151 WeakPolarHBondContact O-CE 3.33Å; F128-K151 PolarHBondContact O-NZ 3.16Å
129	L	90.4	Very high	81.5	Confident	25 Å²	25	51.1 Å²	51.1	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-29.2	-178.8	-62.5	173.2	0	0	0	111.9	I53 P62 P64 V113 D115 D127	I53-L129 HydrophobicContact CG2-CB 4.5Å; I53-L129 HydrophobicContact CG2-CD1 3.74Å; I53-L129 HydrophobicContact CG2-CG 4.49Å; P62-L129 HydrophobicContact CB-CD1 4.22Å; P64-L129 HydrophobicContact CB-CD1 4.41Å; V113-L129 HydrophobicContact CB-CB 4.33Å; V113-L129 HydrophobicContact CG1-CB 4.32Å; V113-L129 HydrophobicContact CG1-CD1 4.11Å; V113-L129 WeakPolarHBondContact O-CB 3.45Å; V113-L129 PolarHBondContact O-N 2.91Å; D115-L129 HydrophobicContact CB-CD1 3.87Å; D115-L129 HydrophobicContact CB-CD2 4.12Å; D115-L129 HydrophobicContact CB-CG 4.05Å; D127-L129 PolarHBondContact O-N 3.03Å
130	G	93.4	Very high	83.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.7	169.6	175.2	0	0	0	0	0	111.6	V113 F128 L150	V113-G130 PolarHBondContact N-O 3.07Å; V113-G130 PolarHBondContact O-N 3Å; F128-G130 VanDerWaalsContact CE2-C 3.4Å; F128-G130 VanDerWaalsContact CE2-O 3.3Å; F128-G130 WeakPolarHBondContact CE2-O 3.42Å; G130-L150 CarbonylContact C-O 3.55Å; G130-L150 VanDerWaalsContact CA-O 3.25Å; G130-L150 WeakPolarHBondContact CA-O 3.41Å
131	G	94.9	Very high	84.6	Confident	9 Å²	9	44.1 Å²	44.1	9%	0.093	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.5	179.4	0	0	0	0	0	113.7	F111 F128 L150	F111-G131 CarbonylContact O-C 3.52Å; F111-G131 WeakPolarHBondContact O-CA 3.14Å; F128-G131 VanDerWaalsContact CZ-N 3.35Å; G131-L150 PolarHBondContact N-O 3.28Å; G131-L150 PolarHBondContact O-N 2.86Å
132	M	95.6	Very high	86.2	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.3	174.7	176.8	-165.9	67.9	0	0	109.1	R110 F111 L145 K147 L149 I161 V163	R110-M132 CarbonylContact C-O 3.5Å; R110-M132 WeakPolarHBondContact CA-O 3.47Å; F111-M132 HydrophobicContact CB-CE 4.31Å; F111-M132 HydrophobicContact CD2-CE 3.25Å; F111-M132 HydrophobicContact CE2-CE 3.67Å; F111-M132 HydrophobicContact CG-CE 3.9Å; F111-M132 PolarHBondContact N-O 2.91Å; F111-M132 PolarHBondContact O-N 3.44Å; M132-L145 HydrophobicContact SD-CD2 4.48Å; M132-K147 HydrophobicContact CG-CB 3.93Å; M132-K147 HydrophobicContact CG-CD 3.89Å; M132-K147 HydrophobicContact CG-CG 4.34Å; M132-K147 HydrophobicContact SD-CB 3.65Å; M132-K147 HydrophobicContact SD-CD 3.89Å; M132-K147 HydrophobicContact SD-CG 3.86Å; M132-L149 HydrophobicContact CB-CD2 4.42Å; M132-I161 HydrophobicContact CB-CG2 3.6Å; M132-I161 HydrophobicContact CE-CG2 4.06Å; M132-I161 HydrophobicContact CG-CG2 4.11Å; M132-I161 HydrophobicContact SD-CG2 3.58Å; M132-I161 VanDerWaalsContact SD-CG2 3.58Å; M132-V163 HydrophobicContact CE-CG2 3.73Å
133	E	95.9	Very high	87.5	Confident	99 Å²	99	43.5 Å²	43.5	46%	0.463	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.5	168.3	-68.2	-177.8	-162.7	0	0	111	L109 R110 K147	L109-E133 WeakPolarHBondContact O-CA 3.1Å; R110-E133 HydrophobicContact CB-CG 4.04Å; R110-E133 HydrophobicContact CG-CG 3.86Å; R110-E133 IonicContact CZ-OE1 3.07Å; R110-E133 IonicContact NE-OE1 2.75Å; R110-E133 PolarHBondContact NE-OE1 3.15Å; R110-E133 IonicContact NH2-OE1 2.63Å; R110-E133 PolarHBondContact NH2-OE1 3.1Å; E133-K147 PolarHBondContact O-NZ 3.3Å
134	C	95.4	Very high	88.8	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.068	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	175.9	175.9	58.9	0	0	0	0	109.5	L109 L145	L109-C134 PolarHBondContact N-O 3.03Å; L109-C134 PolarHBondContact O-N 3.03Å; C134-L145 HydrophobicContact CB-CD2 3.78Å
135	T	95.4	Very high	90.4	Very high	13 Å²	13	36.4 Å²	36.4	8%	0.08	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	156.4	167.3	61.1	0	0	0	0	110	V106 Q107 R108 G137 Q138 I139 D369	V106-T135 HydrophobicContact CG1-CG2 3.75Å; Q107-T135 CarbonylContact O-C 3.58Å; Q107-T135 VanDerWaalsContact O-CA 3.28Å; Q107-T135 WeakPolarHBondContact O-CA 3.27Å; R108-T135 HydrophobicContact CG-CG2 4.27Å; T135-G137 PolarHBondContact O-N 2.92Å; T135-Q138 PolarHBondContact O-N 3.16Å; T135-Q138 VanDerWaalsContact OG1-CG 3.24Å; T135-Q138 WeakPolarHBondContact OG1-CG 3.39Å; T135-Q138 PolarHBondContact OG1-N 3.2Å; T135-I139 PolarHBondContact O-N 3.38Å; T135-D369 WeakPolarHBondContact CB-OD2 3.46Å; T135-D369 VanDerWaalsContact CG2-OD2 3.32Å; T135-D369 WeakPolarHBondContact CG2-OD2 3.28Å; T135-D369 PolarHBondContact OG1-OD2 3.08Å
136	L	95.7	Very high	91.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-38.1	172.1	-176	56.1	0	0	0	111.1	V44 L46 V99 F101 Q107 L109 Q138 I139 V140	V44-L136 HydrophobicContact CG1-CD1 4.42Å; L46-L136 HydrophobicContact CD1-CD1 4.29Å; L46-L136 HydrophobicContact CD2-CD1 4.06Å; V99-L136 HydrophobicContact CB-CD2 4.33Å; V99-L136 HydrophobicContact CG1-CD2 3.98Å; F101-L136 HydrophobicContact CB-CD2 4.23Å; F101-L136 HydrophobicContact CD2-CD2 3.85Å; F101-L136 HydrophobicContact CD2-CG 4.05Å; Q107-L136 HydrophobicContact CB-CB 3.95Å; Q107-L136 PolarHBondContact O-N 2.99Å; L109-L136 HydrophobicContact CD1-CB 4.06Å; L109-L136 HydrophobicContact CD1-CD1 4.14Å; L136-Q138 VanDerWaalsContact C-N 3.32Å; L136-Q138 PolarHBondContact O-N 3.46Å; L136-I139 PolarHBondContact O-N 3.12Å; L136-V140 HydrophobicContact CD1-CG1 4.17Å; L136-V140 HydrophobicContact CG-CG1 4.37Å; L136-V140 PolarHBondContact O-N 3.11Å
137	G	93.7	Very high	92.3	Very high	5 Å²	5	37.6 Å²	37.6	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-50.1	-47.9	173.1	0	0	0	0	0	113	T135 I139 V140 S141	T135-G137 PolarHBondContact O-N 2.92Å; G137-I139 VanDerWaalsContact C-N 3.32Å; G137-I139 PolarHBondContact O-N 3.49Å; G137-V140 VanDerWaalsContact O-CG2 3.27Å; G137-V140 WeakPolarHBondContact O-CG2 3.49Å; G137-V140 PolarHBondContact O-N 3.05Å; G137-S141 WeakPolarHBondContact O-CB 3.49Å; G137-S141 PolarHBondContact O-N 2.98Å; G137-S141 PolarHBondContact O-OG 3.27Å; G137-S141 VanDerWaalsContact O-OG 3.06Å
138	Q	93.6	Very high	92.8	Very high	39 Å²	39	38.2 Å²	38.2	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-34.5	177.1	-74.3	168.6	4.6	0	0	113.8	T135 L136 S141 Q142 D369	T135-Q138 PolarHBondContact O-N 3.16Å; T135-Q138 VanDerWaalsContact OG1-CG 3.24Å; T135-Q138 WeakPolarHBondContact OG1-CG 3.39Å; T135-Q138 PolarHBondContact OG1-N 3.2Å; L136-Q138 VanDerWaalsContact C-N 3.32Å; L136-Q138 PolarHBondContact O-N 3.46Å; Q138-S141 PolarHBondContact O-OG 2.8Å; Q138-Q142 WeakPolarHBondContact O-CG 3.23Å; Q138-Q142 PolarHBondContact O-N 3.05Å; Q138-D369 HydrophobicContact CG-CB 4.32Å; Q138-D369 WeakPolarHBondContact CG-OD1 3.11Å; Q138-D369 PolarHBondContact NE2-OD1 3.14Å
139	I	93.8	Very high	92.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-73.5	-44.5	179.7	-55.2	170.5	0	0	0	109.6	L46 L109 F111 T135 L136 G137 R143 L145 V163 A165	L46-I139 HydrophobicContact CD1-CD1 4.41Å; L46-I139 HydrophobicContact CD2-CD1 4.5Å; L46-I139 HydrophobicContact CD2-CG2 4.11Å; L109-I139 HydrophobicContact CD1-CD1 3.89Å; F111-I139 HydrophobicContact CE2-CD1 4.12Å; F111-I139 HydrophobicContact CZ-CD1 4.13Å; T135-I139 PolarHBondContact O-N 3.38Å; L136-I139 PolarHBondContact O-N 3.12Å; G137-I139 VanDerWaalsContact C-N 3.32Å; G137-I139 PolarHBondContact O-N 3.49Å; I139-R143 CarbonylContact O-C 3.56Å; I139-R143 VanDerWaalsContact O-CA 3.23Å; I139-R143 WeakPolarHBondContact O-CA 3.47Å; I139-R143 PolarHBondContact O-N 2.92Å; I139-L145 HydrophobicContact CG1-CB 4.44Å; I139-L145 HydrophobicContact CG1-CD2 3.85Å; I139-V163 HydrophobicContact CD1-CG1 4.11Å; I139-V163 HydrophobicContact CG2-CB 4.42Å; I139-V163 HydrophobicContact CG2-CG1 4.01Å; I139-A165 HydrophobicContact CG2-CB 3.76Å
140	V	92.9	Very high	93	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.8	-34.4	-178	-58.7	0	0	0	0	112.3	V44 F101 L136 G137 Q142 R143 A165 L315 I318 M319 Y370	V44-V140 HydrophobicContact CG1-CG1 4.16Å; V44-V140 HydrophobicContact CG2-CG1 4.13Å; F101-V140 HydrophobicContact CE2-CG2 3.84Å; F101-V140 HydrophobicContact CZ-CG2 4.28Å; L136-V140 HydrophobicContact CD1-CG1 4.17Å; L136-V140 HydrophobicContact CG-CG1 4.37Å; L136-V140 PolarHBondContact O-N 3.11Å; G137-V140 VanDerWaalsContact O-CG2 3.27Å; G137-V140 WeakPolarHBondContact O-CG2 3.49Å; G137-V140 PolarHBondContact O-N 3.05Å; V140-Q142 VanDerWaalsContact C-N 3.34Å; V140-Q142 PolarHBondContact O-N 3.07Å; V140-R143 PolarHBondContact O-N 3.19Å; V140-A165 HydrophobicContact CG1-CB 4.33Å; V140-L315 HydrophobicContact CB-CD2 4.12Å; V140-L315 HydrophobicContact CG2-CD2 4.01Å; V140-I318 HydrophobicContact CG2-CG2 4.47Å; V140-M319 HydrophobicContact CB-CE 3.88Å; V140-M319 HydrophobicContact CG1-CE 3.72Å; V140-M319 WeakPolarHBondContact O-CG 3.4Å; V140-Y370 HydrophobicContact CG2-CE1 4.1Å
141	S	90.6	Very high	92.8	Very high	32 Å²	32	41.8 Å²	41.8	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-30.9	176.9	62.6	0	0	0	0	113.3	G137 Q138 D369	G137-S141 WeakPolarHBondContact O-CB 3.49Å; G137-S141 PolarHBondContact O-N 2.98Å; G137-S141 PolarHBondContact O-OG 3.27Å; G137-S141 VanDerWaalsContact O-OG 3.06Å; Q138-S141 PolarHBondContact O-OG 2.8Å; S141-D369 WeakPolarHBondContact CB-O 3.29Å; S141-D369 PolarHBondContact OG-O 2.88Å
142	Q	87.3	Confident	92.3	Very high	109 Å²	109	49.1 Å²	49.1	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-95.5	-14.6	177	-64.5	177.3	40.9	0	0	113.2	Q138 V140 K144 L145	Q138-Q142 WeakPolarHBondContact O-CG 3.23Å; Q138-Q142 PolarHBondContact O-N 3.05Å; V140-Q142 VanDerWaalsContact C-N 3.34Å; V140-Q142 PolarHBondContact O-N 3.07Å; Q142-K144 PolarHBondContact O-N 2.91Å; Q142-L145 VanDerWaalsContact OE1-CD1 3.23Å
143	R	84.6	Confident	91.5	Very high	64 Å²	64	52 Å²	52	24%	0.242	28%	0.276	C	S	.	.	S	Bend	trans	59.2	-36.5	-168.2	-169.6	-179.7	178.3	-174.2	1.2	115.2	I139 V140 I164 A165 S563	I139-R143 CarbonylContact O-C 3.56Å; I139-R143 VanDerWaalsContact O-CA 3.23Å; I139-R143 WeakPolarHBondContact O-CA 3.47Å; I139-R143 PolarHBondContact O-N 2.92Å; V140-R143 PolarHBondContact O-N 3.19Å; R143-I164 CarbonylContact O-C 3.55Å; R143-I164 WeakPolarHBondContact O-CA 3.45Å; R143-A165 PolarHBondContact O-N 2.74Å; R143-S563 PolarHBondContact NH1-OG 3.27Å
144	K	89	Confident	90.9	Very high	120 Å²	120	53 Å²	53	52%	0.522	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	105.7	178.1	176.8	178.9	178.4	-175.6	0	109.3	Q142 T162 V163 I164	Q142-K144 PolarHBondContact O-N 2.91Å; K144-T162 HydrophobicContact CD-CG2 4.45Å; K144-T162 HydrophobicContact CG-CG2 3.92Å; K144-V163 CarbonylContact C-O 3.59Å; K144-V163 WeakPolarHBondContact CA-O 3.45Å; K144-I164 HydrophobicContact CB-CG1 4.25Å; K144-I164 HydrophobicContact CD-CG1 4.4Å; K144-I164 HydrophobicContact CG-CG1 3.96Å
145	L	92.2	Very high	90.4	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.4	177.6	-177.7	65	0	0	0	109.9	M132 C134 I139 Q142 K147 T162 V163	M132-L145 HydrophobicContact SD-CD2 4.48Å; C134-L145 HydrophobicContact CB-CD2 3.78Å; I139-L145 HydrophobicContact CG1-CB 4.44Å; I139-L145 HydrophobicContact CG1-CD2 3.85Å; Q142-L145 VanDerWaalsContact OE1-CD1 3.23Å; L145-K147 HydrophobicContact CD1-CG 4.27Å; L145-K147 HydrophobicContact CG-CG 4.3Å; L145-T162 CarbonylContact O-C 3.22Å; L145-T162 VanDerWaalsContact O-CA 3.31Å; L145-T162 WeakPolarHBondContact O-CA 3.42Å; L145-V163 PolarHBondContact N-O 3.18Å; L145-V163 PolarHBondContact O-N 3Å
146	S	93.3	Very high	89.7	Confident	69 Å²	69	56.5 Å²	56.5	48%	0.483	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.7	173.3	-160.6	0	0	0	0	109.9	I161 T162	S146-I161 WeakPolarHBondContact CA-O 3.37Å; S146-T162 PolarHBondContact OG-OG1 3.21Å
147	K	94.7	Very high	89.1	Confident	73 Å²	73	58.9 Å²	58.9	32%	0.317	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.3	176.3	-61.5	-171.6	-179.5	176.5	0	110.8	M132 E133 L145 S160 I161	M132-K147 HydrophobicContact CG-CB 3.93Å; M132-K147 HydrophobicContact CG-CD 3.89Å; M132-K147 HydrophobicContact CG-CG 4.34Å; M132-K147 HydrophobicContact SD-CB 3.65Å; M132-K147 HydrophobicContact SD-CD 3.89Å; M132-K147 HydrophobicContact SD-CG 3.86Å; E133-K147 PolarHBondContact O-NZ 3.3Å; L145-K147 HydrophobicContact CD1-CG 4.27Å; L145-K147 HydrophobicContact CG-CG 4.3Å; K147-S160 CarbonylContact O-C 3.56Å; K147-S160 VanDerWaalsContact O-CA 3.28Å; K147-S160 WeakPolarHBondContact O-CA 3.21Å; K147-S160 WeakPolarHBondContact O-CB 3.4Å; K147-I161 PolarHBondContact N-O 3.12Å; K147-I161 PolarHBondContact O-N 3.08Å
148	S	94.9	Very high	88.8	Confident	64 Å²	64	67.9 Å²	67.9	45%	0.448	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	145.5	168.3	-58.3	0	0	0	0	110.9	S159	S148-S159 WeakPolarHBondContact CA-O 3.4Å
149	L	93.4	Very high	88.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141	172.1	-67.2	170.2	0	0	0	110	V113 M132 A156 S159 I161	V113-L149 HydrophobicContact CB-CD1 4.25Å; V113-L149 HydrophobicContact CG2-CD1 3.65Å; V113-L149 HydrophobicContact CG2-CD2 3.71Å; V113-L149 HydrophobicContact CG2-CG 4.36Å; M132-L149 HydrophobicContact CB-CD2 4.42Å; L149-A156 HydrophobicContact CB-CB 4.29Å; L149-A156 WeakPolarHBondContact O-CB 3.32Å; L149-A156 PolarHBondContact O-N 2.81Å; L149-S159 WeakPolarHBondContact CB-OG 3.5Å; L149-S159 PolarHBondContact N-O 2.92Å; L149-I161 HydrophobicContact CD2-CB 3.85Å; L149-I161 HydrophobicContact CD2-CG2 3.57Å; L149-I161 HydrophobicContact CG-CB 4.32Å; L149-I161 HydrophobicContact CG-CG2 4.25Å
150	L	93.1	Very high	88.6	Confident	80 Å²	80	67.3 Å²	67.3	42%	0.419	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	133.1	178.2	-57.8	180	0	0	0	110.5	G130 G131 N154	G130-L150 CarbonylContact C-O 3.55Å; G130-L150 VanDerWaalsContact CA-O 3.25Å; G130-L150 WeakPolarHBondContact CA-O 3.41Å; G131-L150 PolarHBondContact N-O 3.28Å; G131-L150 PolarHBondContact O-N 2.86Å; L150-N154 CarbonylContact C-O 3.54Å; L150-N154 WeakPolarHBondContact CA-O 3.49Å
151	K	89.2	Confident	88.7	Confident	83 Å²	83	67.3 Å²	67.3	36%	0.361	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118	172.9	-174.9	170.3	178.5	160.7	0	108.6	F128 G153 N154 A156	F128-K151 HydrophobicContact CD1-CG 4.25Å; F128-K151 HydrophobicContact CE1-CG 4.38Å; F128-K151 VanDerWaalsContact O-CE 3.3Å; F128-K151 WeakPolarHBondContact O-CE 3.33Å; F128-K151 PolarHBondContact O-NZ 3.16Å; K151-G153 PolarHBondContact O-N 3.21Å; K151-N154 PolarHBondContact N-O 2.94Å; K151-N154 PolarHBondContact O-N 3.11Å; K151-N154 VanDerWaalsContact O-N 3.12Å; K151-A156 HydrophobicContact CB-CB 3.95Å
152	H	83.1	Confident	88.9	Confident	163 Å²	163	67.2 Å²	67.2	76%	0.755	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	38.9	-173.4	-51.9	-66.4	0	0	0	113.7	N154	H152-N154 VanDerWaalsContact C-N 3.27Å; H152-N154 PolarHBondContact O-N 2.95Å
153	G	79.3	Confident	89.2	Confident	63 Å²	63	62 Å²	62	65%	0.649	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-8.7	179.3	0	0	0	0	0	115.5	K151	K151-G153 PolarHBondContact O-N 3.21Å
154	N	84.5	Confident	89.4	Confident	121 Å²	121	61.9 Å²	61.9	65%	0.647	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	154.5	177.3	-66.8	-53	0	0	0	111.5	L150 K151 H152 A156	L150-N154 CarbonylContact C-O 3.54Å; L150-N154 WeakPolarHBondContact CA-O 3.49Å; K151-N154 PolarHBondContact N-O 2.94Å; K151-N154 PolarHBondContact O-N 3.11Å; K151-N154 VanDerWaalsContact O-N 3.12Å; H152-N154 VanDerWaalsContact C-N 3.27Å; H152-N154 PolarHBondContact O-N 2.95Å; N154-A156 PolarHBondContact O-N 2.87Å
155	T	83.2	Confident	89.5	Confident	84 Å²	84	56.1 Å²	56.1	52%	0.515	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	124.9	174.3	-47.2	0	0	0	0	110.8	G157	T155-G157 WeakPolarHBondContact CG2-O 3.5Å; T155-G157 PolarHBondContact O-N 3.44Å
156	A	82.3	Confident	89.1	Confident	12 Å²	12	58.3 Å²	58.3	10%	0.099	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	73.1	177.7	0	0	0	0	0	110.5	L149 K151 N154 K158 S159	L149-A156 HydrophobicContact CB-CB 4.29Å; L149-A156 WeakPolarHBondContact O-CB 3.32Å; L149-A156 PolarHBondContact O-N 2.81Å; K151-A156 HydrophobicContact CB-CB 3.95Å; N154-A156 PolarHBondContact O-N 2.87Å; A156-K158 PolarHBondContact O-N 3.36Å; A156-S159 WeakPolarHBondContact CB-OG 3.34Å; A156-S159 VanDerWaalsContact O-CB 3.26Å; A156-S159 WeakPolarHBondContact O-CB 3.01Å; A156-S159 PolarHBondContact O-N 2.85Å; A156-S159 VanDerWaalsContact O-N 3.11Å; A156-S159 PolarHBondContact O-OG 3.44Å
157	G	83.5	Confident	88.9	Confident	50 Å²	50	56.7 Å²	56.7	52%	0.515	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.7	-131.8	-178.7	0	0	0	0	0	112.6	T155 S159	T155-G157 WeakPolarHBondContact CG2-O 3.5Å; T155-G157 PolarHBondContact O-N 3.44Å; G157-S159 VanDerWaalsContact C-N 3.32Å
158	K	86.1	Confident	88.1	Confident	195 Å²	195	56.6 Å²	56.6	85%	0.848	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	13.7	175.4	-63.1	-177.2	-179.2	178.4	0	112.6	A156	A156-K158 PolarHBondContact O-N 3.36Å
159	S	91.3	Very high	86.8	Confident	3 Å²	3	57 Å²	57	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.8	-173.1	71.7	0	0	0	0	111.8	K51 G52 S148 L149 A156 G157	K51-S159 CarbonylContact O-C 3.01Å; K51-S159 VanDerWaalsContact O-CA 3.28Å; K51-S159 WeakPolarHBondContact O-CA 3.43Å; G52-S159 VanDerWaalsContact O-CA 3.29Å; G52-S159 WeakPolarHBondContact O-CA 3.45Å; G52-S159 VanDerWaalsContact O-CB 3.28Å; G52-S159 WeakPolarHBondContact O-CB 3.32Å; G52-S159 PolarHBondContact O-N 3.48Å; S148-S159 WeakPolarHBondContact CA-O 3.4Å; L149-S159 WeakPolarHBondContact CB-OG 3.5Å; L149-S159 PolarHBondContact N-O 2.92Å; A156-S159 WeakPolarHBondContact CB-OG 3.34Å; A156-S159 VanDerWaalsContact O-CB 3.26Å; A156-S159 WeakPolarHBondContact O-CB 3.01Å; A156-S159 PolarHBondContact O-N 2.85Å; A156-S159 VanDerWaalsContact O-N 3.11Å; A156-S159 PolarHBondContact O-OG 3.44Å; G157-S159 VanDerWaalsContact C-N 3.32Å
160	S	93.3	Very high	85.1	Confident	24 Å²	24	59.4 Å²	59.4	17%	0.168	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	154.4	-179.5	54.2	0	0	0	0	110.4	C50 K51 K147	C50-S160 CarbonylContact C-O 3.41Å; C50-S160 WeakPolarHBondContact CA-O 3.47Å; C50-S160 WeakPolarHBondContact CB-O 3.2Å; K51-S160 PolarHBondContact N-O 2.84Å; K51-S160 PolarHBondContact O-N 3.24Å; K51-S160 PolarHBondContact O-OG 3.45Å; K147-S160 CarbonylContact O-C 3.56Å; K147-S160 VanDerWaalsContact O-CA 3.28Å; K147-S160 WeakPolarHBondContact O-CA 3.21Å; K147-S160 WeakPolarHBondContact O-CB 3.4Å
161	I	94.5	Very high	83.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.2	173.8	-175.8	168.9	0	0	0	108.3	V48 A49 V66 F111 V113 M132 S146 K147 L149 V163	V48-I161 HydrophobicContact CG1-CD1 3.61Å; V48-I161 HydrophobicContact CG1-CG1 3.7Å; A49-I161 CarbonylContact O-C 3.48Å; A49-I161 WeakPolarHBondContact O-CA 3.48Å; V66-I161 HydrophobicContact CG1-CD1 4.27Å; F111-I161 HydrophobicContact CB-CD1 3.63Å; F111-I161 HydrophobicContact CD1-CD1 4.2Å; F111-I161 HydrophobicContact CG-CD1 4.11Å; V113-I161 HydrophobicContact CG2-CD1 4.5Å; M132-I161 HydrophobicContact CB-CG2 3.6Å; M132-I161 HydrophobicContact CE-CG2 4.06Å; M132-I161 HydrophobicContact CG-CG2 4.11Å; M132-I161 HydrophobicContact SD-CG2 3.58Å; M132-I161 VanDerWaalsContact SD-CG2 3.58Å; S146-I161 WeakPolarHBondContact CA-O 3.37Å; K147-I161 PolarHBondContact N-O 3.12Å; K147-I161 PolarHBondContact O-N 3.08Å; L149-I161 HydrophobicContact CD2-CB 3.85Å; L149-I161 HydrophobicContact CD2-CG2 3.57Å; L149-I161 HydrophobicContact CG-CB 4.32Å; L149-I161 HydrophobicContact CG-CG2 4.25Å; I161-V163 HydrophobicContact CG1-CG2 4.39Å
162	T	93.8	Very high	82.6	Confident	29 Å²	29	60.4 Å²	60.4	18%	0.178	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.3	175.7	-57.4	0	0	0	0	108.5	V48 A49 K144 L145 S146 I164	V48-T162 WeakPolarHBondContact CA-O 3.34Å; A49-T162 PolarHBondContact N-O 2.97Å; A49-T162 PolarHBondContact O-N 3.21Å; K144-T162 HydrophobicContact CD-CG2 4.45Å; K144-T162 HydrophobicContact CG-CG2 3.92Å; L145-T162 CarbonylContact O-C 3.22Å; L145-T162 VanDerWaalsContact O-CA 3.31Å; L145-T162 WeakPolarHBondContact O-CA 3.42Å; S146-T162 PolarHBondContact OG-OG1 3.21Å; T162-I164 HydrophobicContact CG2-CG1 4.43Å
163	V	93.8	Very high	82.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.2	176.7	-171.3	0	0	0	0	108.4	L46 R47 V48 F111 M132 I139 K144 L145 I161	L46-V163 HydrophobicContact CB-CG1 3.97Å; L46-V163 HydrophobicContact CD2-CG1 4.29Å; R47-V163 CarbonylContact O-C 3.59Å; R47-V163 VanDerWaalsContact O-CA 3.3Å; R47-V163 WeakPolarHBondContact O-CA 3.18Å; V48-V163 HydrophobicContact CG2-CG1 4.37Å; V48-V163 HydrophobicContact CG2-CG2 4.27Å; F111-V163 HydrophobicContact CD1-CG2 4.28Å; F111-V163 HydrophobicContact CE1-CG1 4.27Å; F111-V163 HydrophobicContact CE1-CG2 3.9Å; F111-V163 HydrophobicContact CE2-CG2 4.2Å; F111-V163 HydrophobicContact CZ-CG1 4.01Å; F111-V163 HydrophobicContact CZ-CG2 3.86Å; M132-V163 HydrophobicContact CE-CG2 3.73Å; I139-V163 HydrophobicContact CD1-CG1 4.11Å; I139-V163 HydrophobicContact CG2-CB 4.42Å; I139-V163 HydrophobicContact CG2-CG1 4.01Å; K144-V163 CarbonylContact C-O 3.59Å; K144-V163 WeakPolarHBondContact CA-O 3.45Å; L145-V163 PolarHBondContact N-O 3.18Å; L145-V163 PolarHBondContact O-N 3Å; I161-V163 HydrophobicContact CG1-CG2 4.39Å
164	I	89.1	Confident	83	Confident	61 Å²	61	53.1 Å²	53.1	31%	0.313	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.4	176.4	-59.4	170.6	0	0	0	108	L46 R47 R143 K144 T162	L46-I164 WeakPolarHBondContact CA-O 3.18Å; R47-I164 HydrophobicContact CB-CB 4.35Å; R47-I164 PolarHBondContact N-O 2.88Å; R47-I164 PolarHBondContact O-N 3.07Å; R143-I164 CarbonylContact O-C 3.55Å; R143-I164 WeakPolarHBondContact O-CA 3.45Å; K144-I164 HydrophobicContact CB-CG1 4.25Å; K144-I164 HydrophobicContact CD-CG1 4.4Å; K144-I164 HydrophobicContact CG-CG1 3.96Å; T162-I164 HydrophobicContact CG2-CG1 4.43Å
165	A	90.2	Very high	83.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	141.5	176.6	0	0	0	0	0	112	V44 E45 L46 I139 V140 R143 M319	V44-A165 HydrophobicContact CG1-CB 3.79Å; E45-A165 CarbonylContact O-C 3.51Å; E45-A165 VanDerWaalsContact O-CA 3.32Å; E45-A165 WeakPolarHBondContact O-CA 3.38Å; L46-A165 HydrophobicContact CD2-CB 3.85Å; I139-A165 HydrophobicContact CG2-CB 3.76Å; V140-A165 HydrophobicContact CG1-CB 4.33Å; R143-A165 PolarHBondContact O-N 2.74Å; A165-M319 HydrophobicContact CB-CE 4.04Å
166	E	85.6	Confident	83.8	Confident	51 Å²	51	45 Å²	45	24%	0.238	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.1	168.3	-65	-179.1	145.7	0	0	108.5	V44 E45 R47	V44-E166 WeakPolarHBondContact CA-O 3.37Å; E45-E166 PolarHBondContact N-O 3.16Å; E45-E166 PolarHBondContact O-N 2.91Å; R47-E166 IonicContact CZ-OE2 3.05Å; R47-E166 IonicContact NE-OE2 3.92Å; R47-E166 PolarHBondContact NE-OE2 3.23Å; R47-E166 IonicContact NH2-OE2 2.82Å; R47-E166 PolarHBondContact NH2-OE2 3.22Å
167	E	87.7	Confident	84.4	Confident	34 Å²	34	44.4 Å²	44.4	16%	0.159	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	136	173.5	-171.7	-174.8	-173.9	0	0	110.7	T42 S169 S313 L315 M319	T42-E167 VanDerWaalsContact CB-OE1 3.23Å; T42-E167 WeakPolarHBondContact CB-OE1 3.12Å; T42-E167 HydrophobicContact CG2-CG 3.88Å; T42-E167 WeakPolarHBondContact CG2-OE1 3.32Å; T42-E167 WeakPolarHBondContact OG1-CG 3.4Å; T42-E167 PolarHBondContact OG1-OE1 3.18Å; E167-S169 VanDerWaalsContact C-N 3.32Å; E167-S169 PolarHBondContact O-N 2.97Å; E167-S313 PolarHBondContact OE1-OG 2.91Å; E167-S313 WeakPolarHBondContact OE2-CB 3.25Å; E167-S313 PolarHBondContact OE2-OG 3.48Å; E167-L315 HydrophobicContact CB-CB 4.45Å; E167-L315 HydrophobicContact CB-CD1 4.44Å; E167-L315 HydrophobicContact CG-CB 4.35Å; E167-L315 HydrophobicContact CG-CD1 4.15Å; E167-M319 HydrophobicContact CB-CE 4.37Å; E167-M319 HydrophobicContact CB-SD 4.42Å
168	L	78.8	Confident	85	Confident	71 Å²	71	42.7 Å²	42.7	37%	0.372	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	73.8	164.7	-71.6	175.9	0	0	0	109.4	K43 E45 T98	K43-L168 HydrophobicContact CB-CB 4.04Å; K43-L168 HydrophobicContact CB-CD1 3.95Å; K43-L168 WeakPolarHBondContact O-CB 3.5Å; K43-L168 PolarHBondContact O-N 3.34Å; E45-L168 HydrophobicContact CG-CD1 3.68Å; E45-L168 HydrophobicContact CG-CD2 3.91Å; E45-L168 HydrophobicContact CG-CG 3.7Å; E45-L168 WeakPolarHBondContact OE1-CD2 3.49Å; T98-L168 HydrophobicContact CG2-CD1 3.83Å
169	S	66.6	Low	85.6	Confident	72 Å²	72	33.5 Å²	33.5	50%	0.503	19%	0.193	S	C	.	.			trans	-75.5	142.6	-178.8	54.2	0	0	0	0	112.5	E167	E167-S169 VanDerWaalsContact C-N 3.32Å; E167-S169 PolarHBondContact O-N 2.97Å
170	G	59.3	Low	85.9	Confident	51 Å²	51	34.4 Å²	34.4	53%	0.526	20%	0.198	S	C	.	.			trans	-76.1	150.3	160.2	0	0	0	0	0	110.1	D172	G170-D172 PolarHBondContact O-N 3.42Å
171	N	60.2	Low	86.1	Confident	74 Å²	74	33.3 Å²	33.3	40%	0.396	19%	0.191	S	C	.	.			trans	-81.3	88.7	178.9	-162.3	-1.8	0	0	0	110.7	D173 N233	N171-D173 VanDerWaalsContact C-N 3.28Å; N171-D173 VanDerWaalsContact OD1-CB 3.26Å; N171-D173 WeakPolarHBondContact OD1-CB 3.24Å; N171-D173 PolarHBondContact OD1-OD2 3.48Å; N171-N233 PolarHBondContact O-ND2 3.43Å
172	D	68.8	Low	86.2	Confident	110 Å²	110	39.9 Å²	39.9	59%	0.588	22%	0.215	S	C	*	.			trans	-89.4	9.4	177.8	-68.5	-29.6	0	0	0	113.4	G170 M311	G170-D172 PolarHBondContact O-N 3.42Å; D172-M311 HydrophobicContact CB-CB 4.45Å; D172-M311 WeakPolarHBondContact O-CG 3.46Å
173	D	83.9	Confident	86.3	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.128	24%	0.244	C	C	.	.			trans	-50.5	143.7	171.9	-71.8	-4.7	0	0	0	110.9	N171 V232 I308 K310 M311	N171-D173 VanDerWaalsContact C-N 3.28Å; N171-D173 VanDerWaalsContact OD1-CB 3.26Å; N171-D173 WeakPolarHBondContact OD1-CB 3.24Å; N171-D173 PolarHBondContact OD1-OD2 3.48Å; D173-V232 HydrophobicContact CB-CG2 3.94Å; D173-V232 WeakPolarHBondContact O-CB 3.2Å; D173-V232 WeakPolarHBondContact O-CG2 3.23Å; D173-V232 PolarHBondContact O-N 3.15Å; D173-I308 HydrophobicContact CB-CG2 4.3Å; D173-K310 VanDerWaalsContact OD1-CA 3.23Å; D173-K310 WeakPolarHBondContact OD1-CA 3.39Å; D173-M311 PolarHBondContact OD1-N 3.47Å
174	Y	86.5	Confident	86.5	Confident	49 Å²	49	47.1 Å²	47.1	19%	0.192	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151.5	169.7	68.1	-91.7	0	0	0	111.1	K229 V230 H309 M311	Y174-K229 HydrophobicContact CD2-CB 3.93Å; Y174-K229 HydrophobicContact CD2-CD 3.77Å; Y174-K229 HydrophobicContact CD2-CG 3.81Å; Y174-K229 HydrophobicContact CE2-CB 4.38Å; Y174-K229 HydrophobicContact CE2-CD 3.33Å; Y174-K229 VanDerWaalsContact CE2-CE 3.46Å; Y174-K229 HydrophobicContact CE2-CG 3.8Å; Y174-K229 PolarHBondContact OH-NZ 3.04Å; Y174-V230 CarbonylContact C-O 3.57Å; Y174-V230 VanDerWaalsContact CA-O 3.31Å; Y174-V230 WeakPolarHBondContact CA-O 3.32Å; Y174-V230 WeakPolarHBondContact CB-O 3.4Å; Y174-H309 HydrophobicContact CD1-CB 3.93Å; Y174-H309 HydrophobicContact CD2-CB 3.77Å; Y174-H309 AromaticContact CD2-CD2 3.65Å; Y174-H309 AromaticContact CD2-CG 3.97Å; Y174-H309 HydrophobicContact CE1-CB 3.45Å; Y174-H309 VanDerWaalsContact CE1-CB 3.45Å; Y174-H309 HydrophobicContact CE2-CB 3.28Å; Y174-H309 AromaticContact CE2-CD2 3.07Å; Y174-H309 WeakPolarHBondContact CE2-CD2 3.31Å; Y174-H309 AromaticContact CE2-CG 3.2Å; Y174-H309 AromaticContact CE2-ND1 3.98Å; Y174-H309 AromaticContact CE2-NE2 3.75Å; Y174-H309 HydrophobicContact CG-CB 4.09Å; Y174-H309 AromaticContact CZ-CD2 3.77Å; Y174-H309 AromaticContact CZ-CG 3.36Å; Y174-H309 AromaticContact CZ-ND1 3.91Å; Y174-H309 PolarHBondContact N-O 2.95Å; Y174-H309 VanDerWaalsContact N-O 3.16Å; Y174-H309 PolarHBondContact O-N 2.95Å; Y174-H309 WeakPolarHBondContact OH-CB 3.2Å; Y174-H309 PolarHBondContact OH-ND1 2.88Å; Y174-M311 HydrophobicContact CD1-CG 3.74Å; Y174-M311 HydrophobicContact CD1-SD 3.77Å; Y174-M311 HydrophobicContact CE1-CG 4.08Å; Y174-M311 HydrophobicContact CE1-SD 3.5Å; Y174-M311 WeakPolarHBondContact CE1-SD 3.31Å
175	V	90.6	Very high	86.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.9	171.7	62	0	0	0	0	109.5	L177 K229 V230 L235 F267 K307	V175-L177 HydrophobicContact CG1-CD1 4.25Å; V175-L177 HydrophobicContact CG1-CG 4.21Å; V175-L177 HydrophobicContact CG2-CD2 3.61Å; V175-L177 HydrophobicContact CG2-CG 3.94Å; V175-K229 WeakPolarHBondContact O-CA 3.23Å; V175-V230 HydrophobicContact CG1-CG2 3.76Å; V175-V230 PolarHBondContact N-O 3.3Å; V175-V230 PolarHBondContact O-N 3.04Å; V175-L235 HydrophobicContact CG1-CD2 3.61Å; V175-F267 HydrophobicContact CB-CE2 4.17Å; V175-F267 HydrophobicContact CB-CZ 4.39Å; V175-F267 HydrophobicContact CG1-CE2 4.3Å; V175-F267 HydrophobicContact CG2-CE2 3.92Å; V175-F267 HydrophobicContact CG2-CZ 4.45Å; V175-K307 WeakPolarHBondContact CA-O 3.39Å
176	E	93.9	Very high	86.8	Confident	35 Å²	35	49.6 Å²	49.6	16%	0.164	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.5	167	-174.8	178.8	-175	0	0	109.3	S227 F228 K229 L305 C306 K307 H309	E176-S227 PolarHBondContact OE1-OG 2.94Å; E176-S227 VanDerWaalsContact OE1-OG 3.11Å; E176-F228 VanDerWaalsContact CA-O 3.31Å; E176-F228 WeakPolarHBondContact CA-O 3.14Å; E176-K229 HydrophobicContact CB-CG 4.19Å; E176-K229 HydrophobicContact CG-CG 4.3Å; E176-L305 HydrophobicContact CG-CD2 3.85Å; E176-C306 WeakPolarHBondContact O-CA 3.44Å; E176-K307 HydrophobicContact CB-CB 4.38Å; E176-K307 PolarHBondContact N-O 3.15Å; E176-K307 PolarHBondContact O-N 3.22Å; E176-H309 WeakPolarHBondContact CB-NE2 3.28Å; E176-H309 IonicContact OE2-CE1 2.68Å; E176-H309 IonicContact OE2-NE2 2.81Å; E176-H309 PolarHBondContact OE2-NE2 2.86Å
177	L	95.3	Very high	87	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.5	-178.3	-60.2	172.3	0	0	0	109.9	V175 F179 S227 F228 L235 M270 L303 L305 C306	V175-L177 HydrophobicContact CG1-CD1 4.25Å; V175-L177 HydrophobicContact CG1-CG 4.21Å; V175-L177 HydrophobicContact CG2-CD2 3.61Å; V175-L177 HydrophobicContact CG2-CG 3.94Å; L177-F179 HydrophobicContact CB-CD2 4.37Å; L177-F179 HydrophobicContact CB-CE2 3.78Å; L177-F179 HydrophobicContact CD1-CE2 4.13Å; L177-F179 HydrophobicContact CD1-CZ 4.48Å; L177-F179 HydrophobicContact CG-CE2 4.46Å; L177-S227 CarbonylContact O-C 3.57Å; L177-S227 VanDerWaalsContact O-CA 3.23Å; L177-S227 WeakPolarHBondContact O-CA 3.32Å; L177-F228 HydrophobicContact CB-CE1 4.17Å; L177-F228 HydrophobicContact CB-CE2 4.01Å; L177-F228 HydrophobicContact CB-CZ 3.78Å; L177-F228 HydrophobicContact CD1-CE2 3.95Å; L177-F228 HydrophobicContact CD1-CZ 4.03Å; L177-F228 HydrophobicContact CG-CE2 4.46Å; L177-F228 PolarHBondContact N-O 3.2Å; L177-F228 PolarHBondContact O-N 3.01Å; L177-L235 HydrophobicContact CD1-CD2 4.48Å; L177-M270 HydrophobicContact CD1-SD 4.4Å; L177-L303 HydrophobicContact CB-CD1 4.33Å; L177-L303 HydrophobicContact CD2-CD1 3.92Å; L177-L305 VanDerWaalsContact CA-O 3.31Å; L177-L305 WeakPolarHBondContact CA-O 3.39Å; L177-C306 HydrophobicContact CD2-CB 4.24Å
178	A	96.5	Very high	86.8	Confident	13 Å²	13	48.9 Å²	48.9	11%	0.107	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	129.1	167.9	0	0	0	0	0	110	N304 L305	A178-N304 PolarHBondContact O-N 2.98Å; A178-L305 HydrophobicContact CB-CB 3.64Å; A178-L305 HydrophobicContact CB-CD2 4.45Å; A178-L305 PolarHBondContact N-O 3.14Å; A178-L305 PolarHBondContact O-N 2.88Å
179	F	97.6	Very high	86.9	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.5	-178.1	-67.7	-96.2	0	0	0	110.7	L177 L197 I199 W225 F228 M270 W281 V301 I302 L303	L177-F179 HydrophobicContact CB-CD2 4.37Å; L177-F179 HydrophobicContact CB-CE2 3.78Å; L177-F179 HydrophobicContact CD1-CE2 4.13Å; L177-F179 HydrophobicContact CD1-CZ 4.48Å; L177-F179 HydrophobicContact CG-CE2 4.46Å; F179-L197 HydrophobicContact CB-CD2 4.12Å; F179-L197 HydrophobicContact CD1-CD2 4.18Å; F179-L197 HydrophobicContact CD2-CD2 4Å; F179-L197 HydrophobicContact CE2-CD2 4.43Å; F179-L197 HydrophobicContact CG-CD2 3.85Å; F179-I199 HydrophobicContact CE2-CD1 3.88Å; F179-I199 HydrophobicContact CZ-CD1 4.09Å; F179-W225 HydrophobicContact CB-CE3 3.75Å; F179-W225 HydrophobicContact CB-CZ3 4.11Å; F179-W225 PolarHBondContact O-N 3.34Å; F179-W225 VanDerWaalsContact O-N 3.09Å; F179-F228 AromaticContact CD2-CE1 3.88Å; F179-F228 HydrophobicContact CD2-CE1 3.88Å; F179-F228 HydrophobicContact CD2-CZ 4.14Å; F179-F228 HydrophobicContact CE2-CE1 4.03Å; F179-F228 AromaticContact CE2-CZ 3.8Å; F179-F228 HydrophobicContact CE2-CZ 3.8Å; F179-M270 HydrophobicContact CZ-CE 4.15Å; F179-W281 HydrophobicContact CD1-CZ3 4.43Å; F179-W281 HydrophobicContact CE1-CH2 4.34Å; F179-W281 AromaticContact CE1-CZ3 3.85Å; F179-W281 HydrophobicContact CE1-CZ3 3.85Å; F179-V301 HydrophobicContact CD1-CG1 3.85Å; F179-I302 VanDerWaalsContact CA-O 3.32Å; F179-I302 WeakPolarHBondContact CA-O 3.41Å; F179-L303 HydrophobicContact CD1-CB 4.34Å; F179-L303 HydrophobicContact CD1-CD1 4.02Å; F179-L303 HydrophobicContact CD2-CD1 4.15Å; F179-L303 HydrophobicContact CE1-CB 4.18Å; F179-L303 HydrophobicContact CE1-CD1 3.67Å; F179-L303 HydrophobicContact CE1-CG 4.48Å; F179-L303 HydrophobicContact CE2-CD1 3.79Å; F179-L303 HydrophobicContact CG-CD1 4.27Å; F179-L303 HydrophobicContact CZ-CD1 3.55Å
180	N	97.2	Very high	87.5	Confident	22 Å²	22	61.4 Å²	61.4	12%	0.118	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	165.5	156.8	69.8	23.2	0	0	0	109.8	P223 A224 V301 I302 N304	N180-P223 CarbonylContact C-O 3.54Å; N180-P223 WeakPolarHBondContact CA-O 3.43Å; N180-P223 VanDerWaalsContact CB-O 3.26Å; N180-P223 WeakPolarHBondContact CB-O 3.33Å; N180-A224 HydrophobicContact CB-CB 4.17Å; N180-V301 CarbonylContact O-C 3.59Å; N180-V301 WeakPolarHBondContact O-CA 3.19Å; N180-I302 PolarHBondContact N-O 3.22Å; N180-I302 PolarHBondContact O-N 2.86Å; N180-I302 VanDerWaalsContact OD1-CB 3.23Å; N180-I302 WeakPolarHBondContact OD1-CB 3.47Å; N180-I302 WeakPolarHBondContact OD1-CD1 3.42Å; N180-N304 WeakPolarHBondContact CB-ND2 3.26Å; N180-N304 VanDerWaalsContact CG-ND2 3.29Å; N180-N304 PolarHBondContact ND2-ND2 3.38Å; N180-N304 PolarHBondContact ND2-OD1 3.08Å
181	A	97.8	Very high	88.9	Confident	2 Å²	2	61.6 Å²	61.6	2%	0.017	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	162.6	167.3	0	0	0	0	0	111	L184 S222 P223 W225 T300 V301	A181-L184 HydrophobicContact CB-CD1 3.82Å; A181-L184 HydrophobicContact CB-CD2 3.82Å; A181-L184 HydrophobicContact CB-CG 3.83Å; A181-S222 CarbonylContact O-C 3.51Å; A181-S222 VanDerWaalsContact O-C 3.27Å; A181-S222 WeakPolarHBondContact O-CA 3.37Å; A181-S222 WeakPolarHBondContact O-CB 3.49Å; A181-P223 HydrophobicContact CB-CG 3.96Å; A181-P223 PolarHBondContact N-O 2.77Å; A181-W225 HydrophobicContact CB-CH2 3.72Å; A181-W225 HydrophobicContact CB-CZ3 3.94Å; A181-T300 CarbonylContact C-O 3.56Å; A181-T300 WeakPolarHBondContact CA-O 3.31Å; A181-V301 HydrophobicContact CB-CG2 4.18Å
182	R	97.1	Very high	90.3	Very high	137 Å²	137	62.9 Å²	62.9	52%	0.517	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.8	178.6	-63.4	-173.8	-178.4	-173.1	-0.7	110.4	L184 G299 T300 I302	R182-L184 VanDerWaalsContact C-N 3.27Å; R182-L184 PolarHBondContact O-N 3.42Å; R182-G299 VanDerWaalsContact O-CA 3.26Å; R182-G299 WeakPolarHBondContact O-CA 3.43Å; R182-T300 PolarHBondContact N-O 2.99Å; R182-T300 PolarHBondContact O-N 2.67Å; R182-I302 HydrophobicContact CG-CD1 4.21Å
183	K	96.2	Very high	91.4	Very high	177 Å²	177	57.6 Å²	57.6	77%	0.77	27%	0.266	S	S	*	.	S	Bend	trans	50.5	46.6	174.7	-56.6	-179.1	178.8	-177.7	0	112.3	L221 S222 G299	K183-L221 PolarHBondContact N-O 3.28Å; K183-S222 PolarHBondContact N-OG 3.08Å; K183-G299 WeakPolarHBondContact O-CA 3.38Å; K183-G299 PolarHBondContact O-N 3.38Å
184	L	96.7	Very high	91.8	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.026	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-60.4	147.4	172.8	-66.5	178.9	0	0	0	110.2	A181 R182 D186 P195 L221 P223 V248 I260 S298	A181-L184 HydrophobicContact CB-CD1 3.82Å; A181-L184 HydrophobicContact CB-CD2 3.82Å; A181-L184 HydrophobicContact CB-CG 3.83Å; R182-L184 VanDerWaalsContact C-N 3.27Å; R182-L184 PolarHBondContact O-N 3.42Å; L184-D186 PolarHBondContact O-N 3.42Å; L184-P195 HydrophobicContact CD1-CB 3.62Å; L184-P195 HydrophobicContact CD1-CG 3.82Å; L184-L221 HydrophobicContact CB-CB 4.47Å; L184-L221 PolarHBondContact N-O 3.12Å; L184-P223 HydrophobicContact CD1-CG 3.92Å; L184-V248 HydrophobicContact CD1-CG1 4.05Å; L184-V248 HydrophobicContact CD2-CG1 4.36Å; L184-I260 HydrophobicContact CB-CG2 4.45Å; L184-I260 HydrophobicContact CD2-CG2 4.29Å; L184-S298 WeakPolarHBondContact CA-O 3.22Å; L184-S298 WeakPolarHBondContact CD2-O 3.27Å
185	D	93.3	Very high	92.1	Very high	42 Å²	42	55.2 Å²	55.2	23%	0.225	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-64.1	130	172.2	-91.5	1.3	0	0	0	109.7	I260 Y288 S298	D185-I260 HydrophobicContact CB-CG2 4.4Å; D185-Y288 WeakPolarHBondContact OD2-CD2 3.31Å; D185-Y288 WeakPolarHBondContact OD2-CE2 3.48Å; D185-S298 PolarHBondContact N-O 3.35Å; D185-S298 PolarHBondContact OD2-OG 3.33Å
186	D	92.5	Very high	92.3	Very high	70 Å²	70	55.4 Å²	55.4	37%	0.374	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-76.4	133.4	173.7	-152.5	-15.4	0	0	0	110.7	L184 D188 K192 S193 L221	L184-D186 PolarHBondContact O-N 3.42Å; D186-D188 PolarHBondContact OD1-N 3.28Å; D186-K192 VanDerWaalsContact OD1-CA 3.29Å; D186-K192 WeakPolarHBondContact OD1-CA 3.4Å; D186-S193 PolarHBondContact OD1-N 3.12Å; D186-S193 PolarHBondContact OD1-OG 3.02Å; D186-L221 HydrophobicContact CB-CD1 4.1Å; D186-L221 HydrophobicContact CB-CD2 3.99Å
187	K	90.4	Very high	92.4	Very high	29 Å²	29	53.8 Å²	53.8	13%	0.126	25%	0.25	C	S	.	.			trans	-110.2	-14.1	176.6	-51.3	-63.7	-172.1	-177.7	0	112.9	S193 D250 D258 F259 I260 Y288	K187-S193 PolarHBondContact N-OG 2.84Å; K187-D250 HydrophobicContact CB-CB 4.37Å; K187-D250 VanDerWaalsContact CB-OD2 3.29Å; K187-D250 WeakPolarHBondContact CB-OD2 3.02Å; K187-D250 HydrophobicContact CG-CB 4.13Å; K187-D258 HydrophobicContact CB-CB 4.18Å; K187-D258 HydrophobicContact CG-CB 4.16Å; K187-F259 WeakPolarHBondContact CE-O 3.41Å; K187-F259 PolarHBondContact NZ-O 2.8Å; K187-I260 HydrophobicContact CG-CG1 4.12Å; K187-Y288 PolarHBondContact NZ-OH 3.08Å
188	D	84.4	Confident	92.4	Very high	42 Å²	42	54.4 Å²	54.4	23%	0.225	25%	0.253	C	S	.	.			trans	-88.7	153.1	-179	-78.7	-28.5	0	0	0	113	D186 S191 K192	D186-D188 PolarHBondContact OD1-N 3.28Å; D188-S191 WeakPolarHBondContact CB-O 3.41Å; D188-S191 WeakPolarHBondContact CB-OG 3.19Å; D188-S191 PolarHBondContact OD2-OG 3.36Å; D188-K192 VanDerWaalsContact OD2-O 3.13Å
189	F	79.9	Confident	92.4	Very high	194 Å²	194	53.9 Å²	53.9	85%	0.851	25%	0.249	S	C	*	.	S	Bend	trans	-94	-28.2	179.3	-77.1	-88.9	0	0	0	113.9
190	F	80.3	Confident	92.2	Very high	212 Å²	212	55.3 Å²	55.3	93%	0.93	26%	0.255	S	S	*	.	S	Bend	trans	-128.7	-4.1	-175	-63.1	-70.9	0	0	0	114.2
191	S	87.4	Confident	92	Very high	54 Å²	54	55.6 Å²	55.6	38%	0.378	25%	0.254	S	S	.	.	S	Bend	trans	-128.6	178.1	171.6	41.7	0	0	0	0	108	D188	D188-S191 WeakPolarHBondContact CB-O 3.41Å; D188-S191 WeakPolarHBondContact CB-OG 3.19Å; D188-S191 PolarHBondContact OD2-OG 3.36Å
192	K	90.9	Very high	91.6	Very high	101 Å²	101	56.6 Å²	56.6	44%	0.439	26%	0.259	S	S	.	.			trans	-90.3	156.3	158	-57.5	165.7	-178.1	170.7	0	108.6	D186 D188 N219 L221	D186-K192 VanDerWaalsContact OD1-CA 3.29Å; D186-K192 WeakPolarHBondContact OD1-CA 3.4Å; D188-K192 VanDerWaalsContact OD2-O 3.13Å; K192-N219 WeakPolarHBondContact CB-OD1 3.4Å; K192-N219 WeakPolarHBondContact CD-OD1 3.28Å; K192-N219 VanDerWaalsContact CG-OD1 3.27Å; K192-N219 WeakPolarHBondContact CG-OD1 3.18Å; K192-N219 PolarHBondContact N-OD1 3.25Å; K192-N219 WeakPolarHBondContact O-CA 3.2Å; K192-L221 HydrophobicContact CB-CD2 4.05Å; K192-L221 HydrophobicContact CB-CG 4.05Å; K192-L221 HydrophobicContact CD-CG 4.21Å; K192-L221 HydrophobicContact CG-CD1 4.46Å; K192-L221 HydrophobicContact CG-CG 4.23Å
193	S	91.3	Very high	90.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.			trans	-45.6	148.8	167.6	-67	0	0	0	0	115	D186 K187 P195 N220 D250	D186-S193 PolarHBondContact OD1-N 3.12Å; D186-S193 PolarHBondContact OD1-OG 3.02Å; K187-S193 PolarHBondContact N-OG 2.84Å; S193-P195 WeakPolarHBondContact O-CD 3.33Å; S193-N220 PolarHBondContact O-N 2.82Å; S193-D250 WeakPolarHBondContact CA-OD1 3.32Å; S193-D250 VanDerWaalsContact CA-OD2 3.32Å; S193-D250 WeakPolarHBondContact CA-OD2 3.34Å; S193-D250 VanDerWaalsContact CB-CG 3.43Å; S193-D250 WeakPolarHBondContact CB-OD1 3.47Å; S193-D250 WeakPolarHBondContact CB-OD2 3.46Å; S193-D250 PolarHBondContact OG-OD2 2.64Å
194	D	92.1	Very high	90	Very high	23 Å²	23	50 Å²	50	12%	0.123	24%	0.242	C	C	.	.			trans	-106.1	71	176.8	-62.5	-29.4	0	0	0	111.1	V216 V217 M218 N219 D250 W251	D194-V216 HydrophobicContact CB-CG1 3.88Å; D194-V216 WeakPolarHBondContact O-CG1 3.33Å; D194-V217 CarbonylContact C-O 3.59Å; D194-V217 WeakPolarHBondContact CA-O 3.35Å; D194-M218 HydrophobicContact CB-SD 3.8Å; D194-M218 WeakPolarHBondContact OD1-CA 3.44Å; D194-M218 VanDerWaalsContact OD2-SD 3.4Å; D194-N219 PolarHBondContact OD1-N 2.94Å; D194-D250 WeakPolarHBondContact CA-OD1 2.87Å; D194-D250 PolarHBondContact N-OD1 3.25Å; D194-W251 HydrophobicContact CB-CB 4.09Å; D194-W251 WeakPolarHBondContact O-CB 3.32Å; D194-W251 PolarHBondContact O-N 3.09Å
195	P	93.7	Very high	89.3	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	144.6	-166.2	29.7	-40.9	0	0	0	116	L184 S193 V217 N220 P223 W225 V248 W249 I260	L184-P195 HydrophobicContact CD1-CB 3.62Å; L184-P195 HydrophobicContact CD1-CG 3.82Å; S193-P195 WeakPolarHBondContact O-CD 3.33Å; P195-V217 VanDerWaalsContact CD-O 3.23Å; P195-V217 WeakPolarHBondContact CD-O 3.49Å; P195-V217 PolarHBondContact O-N 3.04Å; P195-N220 VanDerWaalsContact CD-O 3.28Å; P195-N220 WeakPolarHBondContact CD-O 3.07Å; P195-N220 WeakPolarHBondContact CG-O 3.48Å; P195-P223 HydrophobicContact CB-CG 4.2Å; P195-P223 HydrophobicContact CG-CB 3.85Å; P195-P223 HydrophobicContact CG-CG 3.5Å; P195-P223 VanDerWaalsContact CG-CG 3.5Å; P195-W225 HydrophobicContact CB-CZ2 4.23Å; P195-W225 PolarHBondContact O-NE1 3.36Å; P195-W225 VanDerWaalsContact O-NE1 3.16Å; P195-V248 HydrophobicContact CB-CG1 4.27Å; P195-W249 CarbonylContact C-O 3.59Å; P195-W249 WeakPolarHBondContact CA-O 3.4Å; P195-I260 HydrophobicContact CB-CD1 4.2Å
196	F	93.5	Very high	88.7	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	156.7	164.4	69.2	-84.6	0	0	0	112.1	E198 R213 V216 V248 W249 W251 H257	F196-E198 HydrophobicContact CD2-CG 4.16Å; F196-E198 HydrophobicContact CE2-CG 3.88Å; F196-R213 HydrophobicContact CD2-CG 3.84Å; F196-R213 HydrophobicContact CE2-CG 4.22Å; F196-V216 HydrophobicContact CB-CG2 4.15Å; F196-V216 HydrophobicContact CD1-CG2 4.07Å; F196-V216 HydrophobicContact CG-CG2 4.34Å; F196-V248 WeakPolarHBondContact O-CA 3.5Å; F196-W249 HydrophobicContact CD1-CB 3.9Å; F196-W249 HydrophobicContact CD2-CB 4.33Å; F196-W249 HydrophobicContact CE1-CB 3.35Å; F196-W249 HydrophobicContact CE1-CG 4.23Å; F196-W249 HydrophobicContact CE2-CB 3.84Å; F196-W249 AromaticContact CE2-CD1 3.59Å; F196-W249 AromaticContact CE2-CG 3.96Å; F196-W249 HydrophobicContact CE2-CG 3.96Å; F196-W249 HydrophobicContact CG-CB 4.37Å; F196-W249 HydrophobicContact CZ-CB 3.32Å; F196-W249 AromaticContact CZ-CD1 3.79Å; F196-W249 AromaticContact CZ-CG 3.69Å; F196-W249 HydrophobicContact CZ-CG 3.69Å; F196-W249 PolarHBondContact N-O 3.27Å; F196-W249 PolarHBondContact O-N 2.78Å; F196-W251 HydrophobicContact CD1-CB 4.02Å; F196-W251 HydrophobicContact CE1-CB 4.09Å; F196-H257 HydrophobicContact CE1-CB 4.22Å; F196-H257 AromaticContact CE1-CD2 3.98Å; F196-H257 AromaticContact CE1-CG 3.88Å; F196-H257 HydrophobicContact CZ-CB 4.23Å; F196-H257 AromaticContact CZ-CD2 3.64Å; F196-H257 AromaticContact CZ-CG 3.91Å
197	L	95.9	Very high	88.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.5	-177.9	171.7	67.1	0	0	0	110.8	F179 I199 R213 T214 W225 C246 I247 V248 F263	F179-L197 HydrophobicContact CB-CD2 4.12Å; F179-L197 HydrophobicContact CD1-CD2 4.18Å; F179-L197 HydrophobicContact CD2-CD2 4Å; F179-L197 HydrophobicContact CE2-CD2 4.43Å; F179-L197 HydrophobicContact CG-CD2 3.85Å; L197-I199 HydrophobicContact CD2-CD1 4.43Å; L197-I199 HydrophobicContact CD2-CG1 4.37Å; L197-I199 HydrophobicContact CG-CG1 4.27Å; L197-R213 WeakPolarHBondContact O-CA 3.11Å; L197-T214 HydrophobicContact CB-CG2 3.93Å; L197-T214 HydrophobicContact CD2-CG2 4.49Å; L197-T214 PolarHBondContact N-OG1 3.24Å; L197-T214 PolarHBondContact O-N 2.9Å; L197-W225 HydrophobicContact CB-CH2 4.2Å; L197-W225 HydrophobicContact CB-CZ2 4.17Å; L197-W225 HydrophobicContact CB-CZ3 4.4Å; L197-W225 HydrophobicContact CD2-CZ3 4.48Å; L197-C246 HydrophobicContact CD1-CB 4.1Å; L197-I247 WeakPolarHBondContact CA-O 3.48Å; L197-V248 HydrophobicContact CD1-CG2 4.08Å; L197-F263 HydrophobicContact CD1-CE1 4.31Å
198	E	96.3	Very high	88	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.065	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.2	168.6	-65.2	-173.7	138.7	0	0	111.1	F196 F200 L210 H212 R213 C246 I247 W249	F196-E198 HydrophobicContact CD2-CG 4.16Å; F196-E198 HydrophobicContact CE2-CG 3.88Å; E198-F200 HydrophobicContact CB-CD2 4.25Å; E198-F200 HydrophobicContact CB-CE2 3.51Å; E198-F200 HydrophobicContact CB-CZ 4.16Å; E198-F200 HydrophobicContact CG-CE2 4.43Å; E198-F200 WeakPolarHBondContact OE2-CE2 3.16Å; E198-F200 WeakPolarHBondContact OE2-CZ 3.25Å; E198-L210 HydrophobicContact CB-CD1 4.05Å; E198-L210 HydrophobicContact CG-CD1 4.34Å; E198-H212 WeakPolarHBondContact CA-O 3.41Å; E198-R213 HydrophobicContact CG-CB 4.31Å; E198-R213 HydrophobicContact CG-CG 4.01Å; E198-R213 IonicContact OE1-CZ 2.73Å; E198-R213 IonicContact OE1-NE 2.66Å; E198-R213 PolarHBondContact OE1-NE 2.62Å; E198-R213 IonicContact OE1-NH2 3.14Å; E198-R213 PolarHBondContact OE1-NH2 3.02Å; E198-C246 CarbonylContact O-C 3.56Å; E198-C246 VanDerWaalsContact O-CA 3.29Å; E198-C246 WeakPolarHBondContact O-CA 3.44Å; E198-I247 PolarHBondContact N-O 3.41Å; E198-I247 PolarHBondContact O-N 3.24Å; E198-W249 PolarHBondContact OE2-NE1 3.49Å
199	I	95.9	Very high	88	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.5	176.9	-55.2	178.8	0	0	0	108.6	F179 L197 V211 H212 F228 L235	F179-I199 HydrophobicContact CE2-CD1 3.88Å; F179-I199 HydrophobicContact CZ-CD1 4.09Å; L197-I199 HydrophobicContact CD2-CD1 4.43Å; L197-I199 HydrophobicContact CD2-CG1 4.37Å; L197-I199 HydrophobicContact CG-CG1 4.27Å; I199-V211 HydrophobicContact CG2-CB 4.49Å; I199-V211 WeakPolarHBondContact O-CB 3.27Å; I199-V211 PolarHBondContact O-N 3.38Å; I199-H212 PolarHBondContact N-O 3.41Å; I199-H212 PolarHBondContact O-N 3.47Å; I199-F228 HydrophobicContact CD1-CE2 4.33Å; I199-F228 HydrophobicContact CD1-CZ 3.66Å; I199-L235 HydrophobicContact CG2-CD1 4.33Å
200	F	93.8	Very high	88.3	Confident	31 Å²	31	56.3 Å²	56.3	14%	0.136	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134.9	178	-63	-95	0	0	0	110.9	E198 Q208 Q209 L210 L244 K245 I247	E198-F200 HydrophobicContact CB-CD2 4.25Å; E198-F200 HydrophobicContact CB-CE2 3.51Å; E198-F200 HydrophobicContact CB-CZ 4.16Å; E198-F200 HydrophobicContact CG-CE2 4.43Å; E198-F200 WeakPolarHBondContact OE2-CE2 3.16Å; E198-F200 WeakPolarHBondContact OE2-CZ 3.25Å; F200-Q208 HydrophobicContact CB-CB 4.34Å; F200-Q208 HydrophobicContact CD1-CB 4.08Å; F200-Q209 CarbonylContact C-O 3.27Å; F200-Q209 VanDerWaalsContact CA-O 3.22Å; F200-Q209 WeakPolarHBondContact CA-O 3.46Å; F200-L210 HydrophobicContact CD1-CB 4.03Å; F200-L210 HydrophobicContact CD1-CD1 4.21Å; F200-L210 HydrophobicContact CE1-CB 3.8Å; F200-L210 HydrophobicContact CE1-CD1 3.8Å; F200-L210 HydrophobicContact CE1-CG 4.37Å; F200-L210 HydrophobicContact CE2-CD1 4.13Å; F200-L210 HydrophobicContact CZ-CD1 3.75Å; F200-L244 CarbonylContact O-C 3.45Å; F200-L244 WeakPolarHBondContact O-CA 3.44Å; F200-K245 HydrophobicContact CB-CB 4.3Å; F200-K245 PolarHBondContact N-O 3.09Å; F200-K245 PolarHBondContact O-N 3.4Å; F200-I247 HydrophobicContact CD2-CD1 4.22Å; F200-I247 HydrophobicContact CD2-CG1 4.47Å; F200-I247 HydrophobicContact CE2-CD1 3.88Å; F200-I247 HydrophobicContact CE2-CG1 4.35Å
201	R	92.9	Very high	88.7	Confident	29 Å²	29	47.4 Å²	47.4	11%	0.109	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.4	166	-173.9	-172.3	75.7	-155.4	4.1	109.2	N203 Q209 V211 N233 S234 L235 S237 R242 L244	R201-N203 PolarHBondContact NE-OD1 3.07Å; R201-N203 PolarHBondContact NH2-OD1 3.32Å; R201-Q209 PolarHBondContact N-O 3.22Å; R201-Q209 PolarHBondContact O-N 3.48Å; R201-V211 HydrophobicContact CB-CG2 3.71Å; R201-N233 PolarHBondContact NH1-O 3.06Å; R201-S234 PolarHBondContact NH1-O 3Å; R201-L235 WeakPolarHBondContact CG-O 3.23Å; R201-S237 WeakPolarHBondContact CD-OG 3.5Å; R201-S237 VanDerWaalsContact CZ-OG 3.25Å; R201-S237 PolarHBondContact NE-OG 3.18Å; R201-S237 PolarHBondContact NH1-OG 3.15Å; R201-S237 VanDerWaalsContact NH1-OG 3.08Å; R201-R242 HydrophobicContact CG-CG 4.31Å; R201-L244 HydrophobicContact CB-CD2 4.4Å
202	M	90.1	Very high	89	Confident	22 Å²	22	47.1 Å²	47.1	11%	0.108	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.2	169.8	-57.3	-62.4	-44	0	0	109.9	Q208 R243 K245	M202-Q208 HydrophobicContact CE-CG 3.77Å; M202-Q208 HydrophobicContact SD-CG 3.63Å; M202-R243 HydrophobicContact CB-CB 4.3Å; M202-R243 WeakPolarHBondContact CB-O 3.4Å; M202-R243 HydrophobicContact CG-CB 4.1Å; M202-R243 VanDerWaalsContact CG-O 3.31Å; M202-R243 WeakPolarHBondContact CG-O 3.49Å; M202-R243 PolarHBondContact N-O 3.09Å; M202-K245 HydrophobicContact SD-CB 4.12Å
203	N	80.5	Confident	89.1	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.182	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-84.5	165	176	-65.4	-31	0	0	0	111.6	R201 D205 A206 T207	R201-N203 PolarHBondContact NE-OD1 3.07Å; R201-N203 PolarHBondContact NH2-OD1 3.32Å; N203-D205 WeakPolarHBondContact CB-OD1 3.34Å; N203-D205 PolarHBondContact O-N 3.16Å; N203-A206 WeakPolarHBondContact O-CA 3.36Å; N203-A206 PolarHBondContact O-N 2.67Å; N203-T207 WeakPolarHBondContact CB-OG1 3.09Å; N203-T207 PolarHBondContact N-O 2.89Å; N203-T207 PolarHBondContact ND2-OG1 3.08Å
204	D	79.2	Confident	89.2	Confident	142 Å²	142	49 Å²	49	76%	0.759	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27	-179.2	-63.8	-19.7	0	0	0	112.5	A206 R242	D204-A206 PolarHBondContact O-N 2.89Å; D204-R242 IonicContact OD1-CZ 2.82Å; D204-R242 IonicContact OD1-NH1 3.88Å; D204-R242 PolarHBondContact OD1-NH1 3.31Å; D204-R242 IonicContact OD1-NH2 3.84Å; D204-R242 PolarHBondContact OD1-NH2 2.87Å; D204-R242 IonicContact OD2-NH1 3.4Å
205	D	81.5	Confident	89.2	Confident	110 Å²	110	50.9 Å²	50.9	59%	0.588	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	10.1	173.8	68.7	-6.1	0	0	0	113.4	N203 T207	N203-D205 WeakPolarHBondContact CB-OD1 3.34Å; N203-D205 PolarHBondContact O-N 3.16Å; D205-T207 PolarHBondContact O-N 2.9Å; D205-T207 VanDerWaalsContact OD1-CB 3.31Å; D205-T207 WeakPolarHBondContact OD1-CB 3.26Å; D205-T207 WeakPolarHBondContact OD1-CG2 3.31Å; D205-T207 PolarHBondContact OD1-N 3.34Å; D205-T207 PolarHBondContact OD1-OG1 3.47Å; D205-T207 WeakPolarHBondContact OD2-CG2 3.26Å; D205-T207 PolarHBondContact OD2-OG1 3.35Å
206	A	79.6	Confident	89.1	Confident	74 Å²	74	53 Å²	53	61%	0.612	28%	0.275	S	S	*	.	S	Bend	trans	64.4	7.3	-175.7	0	0	0	0	0	115.8	N203 D204	N203-A206 WeakPolarHBondContact O-CA 3.36Å; N203-A206 PolarHBondContact O-N 2.67Å; D204-A206 PolarHBondContact O-N 2.89Å
207	T	82.3	Confident	89	Confident	64 Å²	64	54.1 Å²	54.1	39%	0.393	28%	0.282	S	S	.	.			trans	-69.9	156.4	169.9	65.1	0	0	0	0	111	N203 D205	N203-T207 WeakPolarHBondContact CB-OG1 3.09Å; N203-T207 PolarHBondContact N-O 2.89Å; N203-T207 PolarHBondContact ND2-OG1 3.08Å; D205-T207 PolarHBondContact O-N 2.9Å; D205-T207 VanDerWaalsContact OD1-CB 3.31Å; D205-T207 WeakPolarHBondContact OD1-CB 3.26Å; D205-T207 WeakPolarHBondContact OD1-CG2 3.31Å; D205-T207 PolarHBondContact OD1-N 3.34Å; D205-T207 PolarHBondContact OD1-OG1 3.47Å; D205-T207 WeakPolarHBondContact OD2-CG2 3.26Å; D205-T207 PolarHBondContact OD2-OG1 3.35Å
208	Q	87.1	Confident	88.7	Confident	97 Å²	97	59.3 Å²	59.3	45%	0.453	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.2	178.4	-70.1	174.1	31.3	0	0	109.3	F200 M202	F200-Q208 HydrophobicContact CB-CB 4.34Å; F200-Q208 HydrophobicContact CD1-CB 4.08Å; M202-Q208 HydrophobicContact CE-CG 3.77Å; M202-Q208 HydrophobicContact SD-CG 3.63Å
209	Q	83.9	Confident	88.5	Confident	91 Å²	91	62.9 Å²	62.9	43%	0.425	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.5	171.5	-177	171.1	-1.7	0	0	109.3	F200 R201 V211	F200-Q209 CarbonylContact C-O 3.27Å; F200-Q209 VanDerWaalsContact CA-O 3.22Å; F200-Q209 WeakPolarHBondContact CA-O 3.46Å; R201-Q209 PolarHBondContact N-O 3.22Å; R201-Q209 PolarHBondContact O-N 3.48Å; Q209-V211 PolarHBondContact O-N 3.47Å
210	L	86.5	Confident	88.3	Confident	78 Å²	78	65.3 Å²	65.3	41%	0.408	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	123.5	173.4	-178.2	66.7	0	0	0	108.9	E198 F200 H212	E198-L210 HydrophobicContact CB-CD1 4.05Å; E198-L210 HydrophobicContact CG-CD1 4.34Å; F200-L210 HydrophobicContact CD1-CB 4.03Å; F200-L210 HydrophobicContact CD1-CD1 4.21Å; F200-L210 HydrophobicContact CE1-CB 3.8Å; F200-L210 HydrophobicContact CE1-CD1 3.8Å; F200-L210 HydrophobicContact CE1-CG 4.37Å; F200-L210 HydrophobicContact CE2-CD1 4.13Å; F200-L210 HydrophobicContact CZ-CD1 3.75Å; L210-H212 WeakPolarHBondContact CD1-O 3.18Å
211	V	89	Confident	88.3	Confident	25 Å²	25	65.7 Å²	65.7	15%	0.152	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-45.9	177.6	179.1	0	0	0	0	110	I199 R201 Q209 V230 S234 L235	I199-V211 HydrophobicContact CG2-CB 4.49Å; I199-V211 WeakPolarHBondContact O-CB 3.27Å; I199-V211 PolarHBondContact O-N 3.38Å; R201-V211 HydrophobicContact CB-CG2 3.71Å; Q209-V211 PolarHBondContact O-N 3.47Å; V211-V230 HydrophobicContact CG1-CB 4.24Å; V211-V230 HydrophobicContact CG1-CG1 4.06Å; V211-V230 HydrophobicContact CG1-CG2 4.36Å; V211-S234 WeakPolarHBondContact CG2-O 3.26Å; V211-L235 HydrophobicContact CG1-CB 4.45Å; V211-L235 HydrophobicContact CG1-CD1 4.01Å
212	H	92.9	Very high	88.5	Confident	48 Å²	48	67.1 Å²	67.1	22%	0.222	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	150	-178.4	-167.8	72.3	0	0	0	111.8	E198 I199 L210 F228 V230	E198-H212 WeakPolarHBondContact CA-O 3.41Å; I199-H212 PolarHBondContact N-O 3.41Å; I199-H212 PolarHBondContact O-N 3.47Å; L210-H212 WeakPolarHBondContact CD1-O 3.18Å; H212-F228 HydrophobicContact CB-CD2 4.19Å; H212-F228 HydrophobicContact CB-CE2 3.89Å; H212-F228 HydrophobicContact CB-CZ 4.44Å; H212-F228 AromaticContact CD2-CD1 3.53Å; H212-F228 AromaticContact CD2-CD2 3.41Å; H212-F228 VanDerWaalsContact CD2-CD2 3.41Å; H212-F228 WeakPolarHBondContact CD2-CD2 3.22Å; H212-F228 AromaticContact CD2-CE1 3.66Å; H212-F228 AromaticContact CD2-CE2 3.55Å; H212-F228 AromaticContact CD2-CG 3.4Å; H212-F228 VanDerWaalsContact CD2-CG 3.4Å; H212-F228 WeakPolarHBondContact CD2-CG 3.34Å; H212-F228 AromaticContact CD2-CZ 3.67Å; H212-F228 VanDerWaalsContact CE1-CB 3.5Å; H212-F228 WeakPolarHBondContact CE1-CB 3.5Å; H212-F228 AromaticContact CE1-CD2 3.84Å; H212-F228 AromaticContact CE1-CG 3.65Å; H212-F228 AromaticContact CG-CD2 3.51Å; H212-F228 AromaticContact CG-CE2 3.65Å; H212-F228 AromaticContact CG-CG 3.94Å; H212-F228 AromaticContact ND1-CD2 3.77Å; H212-F228 WeakPolarHBondContact NE2-CB 3.38Å; H212-F228 AromaticContact NE2-CD1 3.47Å; H212-F228 WeakPolarHBondContact NE2-CD1 3.47Å; H212-F228 AromaticContact NE2-CD2 3.64Å; H212-F228 AromaticContact NE2-CG 3.21Å; H212-F228 WeakPolarHBondContact NE2-CG 3.21Å; H212-V230 HydrophobicContact CB-CG1 4.13Å
213	R	93.8	Very high	88.8	Confident	130 Å²	130	66 Å²	66	49%	0.491	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	127.4	168.8	-179.6	-172.8	-68.9	168.5	-3.5	108.4	F196 L197 E198	F196-R213 HydrophobicContact CD2-CG 3.84Å; F196-R213 HydrophobicContact CE2-CG 4.22Å; L197-R213 WeakPolarHBondContact O-CA 3.11Å; E198-R213 HydrophobicContact CG-CB 4.31Å; E198-R213 HydrophobicContact CG-CG 4.01Å; E198-R213 IonicContact OE1-CZ 2.73Å; E198-R213 IonicContact OE1-NE 2.66Å; E198-R213 PolarHBondContact OE1-NE 2.62Å; E198-R213 IonicContact OE1-NH2 3.14Å; E198-R213 PolarHBondContact OE1-NH2 3.02Å
214	T	92.7	Very high	89.6	Confident	10 Å²	10	67.7 Å²	67.7	6%	0.061	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-74.3	171.9	178	65.7	0	0	0	0	111.9	L197 W225 F228	L197-T214 HydrophobicContact CB-CG2 3.93Å; L197-T214 HydrophobicContact CD2-CG2 4.49Å; L197-T214 PolarHBondContact N-OG1 3.24Å; L197-T214 PolarHBondContact O-N 2.9Å; T214-W225 HydrophobicContact CG2-CB 4.02Å; T214-W225 HydrophobicContact CG2-CD2 4.49Å; T214-W225 HydrophobicContact CG2-CG 4.03Å; T214-W225 VanDerWaalsContact OG1-CD1 3.27Å; T214-W225 PolarHBondContact OG1-NE1 2.79Å; T214-F228 HydrophobicContact CG2-CD1 4.48Å; T214-F228 HydrophobicContact CG2-CE1 4.21Å
215	E	91.9	Very high	90.4	Very high	63 Å²	63	61.5 Å²	61.5	29%	0.294	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-65.1	160.9	164.1	78.6	-75	-172.9	0	0	112.3	V217 W225 K226	E215-V217 HydrophobicContact CG-CG2 4.48Å; E215-W225 VanDerWaalsContact O-CD1 3.24Å; E215-W225 PolarHBondContact O-NE1 3.09Å; E215-W225 VanDerWaalsContact OE1-CA 3.27Å; E215-W225 WeakPolarHBondContact OE1-CA 3.47Å; E215-K226 WeakPolarHBondContact OE1-CG 3.48Å; E215-K226 PolarHBondContact OE1-N 3.16Å; E215-K226 PolarHBondContact OE2-N 3.18Å
216	V	91.1	Very high	90.9	Very high	46 Å²	46	63.4 Å²	63.4	28%	0.279	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-83.8	130.5	171.3	178.8	0	0	0	0	109	D194 F196 M218 W251	D194-V216 HydrophobicContact CB-CG1 3.88Å; D194-V216 WeakPolarHBondContact O-CG1 3.33Å; F196-V216 HydrophobicContact CB-CG2 4.15Å; F196-V216 HydrophobicContact CD1-CG2 4.07Å; F196-V216 HydrophobicContact CG-CG2 4.34Å; V216-M218 HydrophobicContact CG1-CE 3.87Å; V216-M218 HydrophobicContact CG1-SD 3.75Å; V216-W251 HydrophobicContact CB-CB 4.4Å; V216-W251 HydrophobicContact CG1-CB 3.57Å; V216-W251 HydrophobicContact CG1-CD2 4.47Å; V216-W251 HydrophobicContact CG1-CG 3.99Å; V216-W251 HydrophobicContact CG2-CB 3.86Å; V216-W251 HydrophobicContact CG2-CG 3.82Å
217	V	91.3	Very high	91.6	Very high	27 Å²	27	62.9 Å²	62.9	16%	0.164	33%	0.331	C	S	.	.			trans	-108.6	107.4	175.4	-178.3	0	0	0	0	109	D194 P195 E215 N220 P223	D194-V217 CarbonylContact C-O 3.59Å; D194-V217 WeakPolarHBondContact CA-O 3.35Å; P195-V217 VanDerWaalsContact CD-O 3.23Å; P195-V217 WeakPolarHBondContact CD-O 3.49Å; P195-V217 PolarHBondContact O-N 3.04Å; E215-V217 HydrophobicContact CG-CG2 4.48Å; V217-N220 HydrophobicContact CG1-CB 3.86Å; V217-P223 HydrophobicContact CB-CB 3.83Å; V217-P223 HydrophobicContact CG1-CB 4.01Å; V217-P223 HydrophobicContact CG2-CB 3.99Å
218	M	90.5	Very high	92.1	Very high	109 Å²	109	60.7 Å²	60.7	54%	0.537	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	140.6	-173	-56.2	-63.2	-175.5	0	0	113.1	D194 V216 N220 W251	D194-M218 HydrophobicContact CB-SD 3.8Å; D194-M218 WeakPolarHBondContact OD1-CA 3.44Å; D194-M218 VanDerWaalsContact OD2-SD 3.4Å; V216-M218 HydrophobicContact CG1-CE 3.87Å; V216-M218 HydrophobicContact CG1-SD 3.75Å; M218-N220 PolarHBondContact O-N 2.9Å; M218-W251 HydrophobicContact CE-CE3 4.02Å; M218-W251 HydrophobicContact CE-CZ3 4.06Å; M218-W251 HydrophobicContact SD-CE3 4.39Å
219	N	91.3	Very high	92.2	Very high	88 Å²	88	61.7 Å²	61.7	47%	0.471	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	49	169.3	-166	10.6	0	0	0	113.5	K192 D194	K192-N219 WeakPolarHBondContact CB-OD1 3.4Å; K192-N219 WeakPolarHBondContact CD-OD1 3.28Å; K192-N219 VanDerWaalsContact CG-OD1 3.27Å; K192-N219 WeakPolarHBondContact CG-OD1 3.18Å; K192-N219 PolarHBondContact N-OD1 3.25Å; K192-N219 WeakPolarHBondContact O-CA 3.2Å; D194-N219 PolarHBondContact OD1-N 2.94Å
220	N	92.4	Very high	92.4	Very high	54 Å²	54	58 Å²	58	29%	0.289	30%	0.303	S	S	.	.			trans	-148	109.1	-169.9	-166.1	-13.6	0	0	0	114.1	S193 P195 V217 M218 S222 P223	S193-N220 PolarHBondContact O-N 2.82Å; P195-N220 VanDerWaalsContact CD-O 3.28Å; P195-N220 WeakPolarHBondContact CD-O 3.07Å; P195-N220 WeakPolarHBondContact CG-O 3.48Å; V217-N220 HydrophobicContact CG1-CB 3.86Å; M218-N220 PolarHBondContact O-N 2.9Å; N220-S222 PolarHBondContact O-N 2.71Å; N220-S222 WeakPolarHBondContact OD1-CA 3.19Å; N220-S222 PolarHBondContact OD1-N 3.25Å; N220-S222 PolarHBondContact OD1-O 2.94Å; N220-P223 WeakPolarHBondContact O-CD 3.44Å
221	L	94.6	Very high	92.4	Very high	39 Å²	39	56.3 Å²	56.3	20%	0.204	30%	0.297	C	S	.	.	S	Bend	trans	-81.3	2.7	175.1	-54.7	-179.7	0	0	0	114	K183 L184 D186 K192	K183-L221 PolarHBondContact N-O 3.28Å; L184-L221 HydrophobicContact CB-CB 4.47Å; L184-L221 PolarHBondContact N-O 3.12Å; D186-L221 HydrophobicContact CB-CD1 4.1Å; D186-L221 HydrophobicContact CB-CD2 3.99Å; K192-L221 HydrophobicContact CB-CD2 4.05Å; K192-L221 HydrophobicContact CB-CG 4.05Å; K192-L221 HydrophobicContact CD-CG 4.21Å; K192-L221 HydrophobicContact CG-CD1 4.46Å; K192-L221 HydrophobicContact CG-CG 4.23Å
222	S	96.5	Very high	92.3	Very high	58 Å²	58	55.4 Å²	55.4	41%	0.406	29%	0.292	S	S	.	.	S	Bend	trans	-139.3	59.6	175.4	-60.1	0	0	0	0	110.6	A181 K183 N220	A181-S222 CarbonylContact O-C 3.51Å; A181-S222 VanDerWaalsContact O-C 3.27Å; A181-S222 WeakPolarHBondContact O-CA 3.37Å; A181-S222 WeakPolarHBondContact O-CB 3.49Å; K183-S222 PolarHBondContact N-OG 3.08Å; N220-S222 PolarHBondContact O-N 2.71Å; N220-S222 WeakPolarHBondContact OD1-CA 3.19Å; N220-S222 PolarHBondContact OD1-N 3.25Å; N220-S222 PolarHBondContact OD1-O 2.94Å
223	P	96.9	Very high	91.8	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.			trans	-66.3	146.1	-175.1	32.9	-40.4	0	0	0	111.1	N180 A181 L184 P195 V217 N220 W225	N180-P223 CarbonylContact C-O 3.54Å; N180-P223 WeakPolarHBondContact CA-O 3.43Å; N180-P223 VanDerWaalsContact CB-O 3.26Å; N180-P223 WeakPolarHBondContact CB-O 3.33Å; A181-P223 HydrophobicContact CB-CG 3.96Å; A181-P223 PolarHBondContact N-O 2.77Å; L184-P223 HydrophobicContact CD1-CG 3.92Å; P195-P223 HydrophobicContact CB-CG 4.2Å; P195-P223 HydrophobicContact CG-CB 3.85Å; P195-P223 HydrophobicContact CG-CG 3.5Å; P195-P223 VanDerWaalsContact CG-CG 3.5Å; V217-P223 HydrophobicContact CB-CB 3.83Å; V217-P223 HydrophobicContact CG1-CB 4.01Å; V217-P223 HydrophobicContact CG2-CB 3.99Å; N220-P223 WeakPolarHBondContact O-CD 3.44Å; P223-W225 HydrophobicContact CB-CD2 4.5Å; P223-W225 HydrophobicContact CB-CZ2 4.17Å; P223-W225 HydrophobicContact CG-CD2 4.47Å; P223-W225 HydrophobicContact CG-CH2 3.74Å; P223-W225 HydrophobicContact CG-CZ2 3.48Å; P223-W225 VanDerWaalsContact CG-CZ2 3.48Å; P223-W225 HydrophobicContact CG-CZ3 4.32Å
224	A	96.6	Very high	91.3	Very high	69 Å²	69	52.6 Å²	52.6	57%	0.57	29%	0.292	S	S	*	.	B	Isolated β-bridge	trans	-113.7	112.9	161.5	0	0	0	0	0	106.9	N180	N180-A224 HydrophobicContact CB-CB 4.17Å
225	W	96.7	Very high	91.1	Very high	12 Å²	12	52.1 Å²	52.1	5%	0.045	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-83.2	152.5	178.7	-60.3	-75.3	0	0	0	110.4	F179 A181 P195 L197 T214 E215 P223	F179-W225 HydrophobicContact CB-CE3 3.75Å; F179-W225 HydrophobicContact CB-CZ3 4.11Å; F179-W225 PolarHBondContact O-N 3.34Å; F179-W225 VanDerWaalsContact O-N 3.09Å; A181-W225 HydrophobicContact CB-CH2 3.72Å; A181-W225 HydrophobicContact CB-CZ3 3.94Å; P195-W225 HydrophobicContact CB-CZ2 4.23Å; P195-W225 PolarHBondContact O-NE1 3.36Å; P195-W225 VanDerWaalsContact O-NE1 3.16Å; L197-W225 HydrophobicContact CB-CH2 4.2Å; L197-W225 HydrophobicContact CB-CZ2 4.17Å; L197-W225 HydrophobicContact CB-CZ3 4.4Å; L197-W225 HydrophobicContact CD2-CZ3 4.48Å; T214-W225 HydrophobicContact CG2-CB 4.02Å; T214-W225 HydrophobicContact CG2-CD2 4.49Å; T214-W225 HydrophobicContact CG2-CG 4.03Å; T214-W225 VanDerWaalsContact OG1-CD1 3.27Å; T214-W225 PolarHBondContact OG1-NE1 2.79Å; E215-W225 VanDerWaalsContact O-CD1 3.24Å; E215-W225 PolarHBondContact O-NE1 3.09Å; E215-W225 VanDerWaalsContact OE1-CA 3.27Å; E215-W225 WeakPolarHBondContact OE1-CA 3.47Å; P223-W225 HydrophobicContact CB-CD2 4.5Å; P223-W225 HydrophobicContact CB-CZ2 4.17Å; P223-W225 HydrophobicContact CG-CD2 4.47Å; P223-W225 HydrophobicContact CG-CH2 3.74Å; P223-W225 HydrophobicContact CG-CZ2 3.48Å; P223-W225 VanDerWaalsContact CG-CZ2 3.48Å; P223-W225 HydrophobicContact CG-CZ3 4.32Å
226	K	91.7	Very high	91	Very high	150 Å²	150	49.1 Å²	49.1	65%	0.652	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-59.3	150.9	174.7	-71.3	174	-176.5	178.6	0	110.5	E215	E215-K226 WeakPolarHBondContact OE1-CG 3.48Å; E215-K226 PolarHBondContact OE1-N 3.16Å; E215-K226 PolarHBondContact OE2-N 3.18Å
227	S	94	Very high	90.6	Very high	62 Å²	62	49.4 Å²	49.4	43%	0.434	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-67	148.7	171	66.6	0	0	0	0	110.3	E176 L177	E176-S227 PolarHBondContact OE1-OG 2.94Å; E176-S227 VanDerWaalsContact OE1-OG 3.11Å; L177-S227 CarbonylContact O-C 3.57Å; L177-S227 VanDerWaalsContact O-CA 3.23Å; L177-S227 WeakPolarHBondContact O-CA 3.32Å
228	F	92.6	Very high	89.8	Confident	19 Å²	19	50.1 Å²	50.1	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	157.2	177.6	62.9	-93.6	0	0	0	110.6	E176 L177 F179 I199 H212 T214 V230	E176-F228 VanDerWaalsContact CA-O 3.31Å; E176-F228 WeakPolarHBondContact CA-O 3.14Å; L177-F228 HydrophobicContact CB-CE1 4.17Å; L177-F228 HydrophobicContact CB-CE2 4.01Å; L177-F228 HydrophobicContact CB-CZ 3.78Å; L177-F228 HydrophobicContact CD1-CE2 3.95Å; L177-F228 HydrophobicContact CD1-CZ 4.03Å; L177-F228 HydrophobicContact CG-CE2 4.46Å; L177-F228 PolarHBondContact N-O 3.2Å; L177-F228 PolarHBondContact O-N 3.01Å; F179-F228 AromaticContact CD2-CE1 3.88Å; F179-F228 HydrophobicContact CD2-CE1 3.88Å; F179-F228 HydrophobicContact CD2-CZ 4.14Å; F179-F228 HydrophobicContact CE2-CE1 4.03Å; F179-F228 AromaticContact CE2-CZ 3.8Å; F179-F228 HydrophobicContact CE2-CZ 3.8Å; I199-F228 HydrophobicContact CD1-CE2 4.33Å; I199-F228 HydrophobicContact CD1-CZ 3.66Å; H212-F228 HydrophobicContact CB-CD2 4.19Å; H212-F228 HydrophobicContact CB-CE2 3.89Å; H212-F228 HydrophobicContact CB-CZ 4.44Å; H212-F228 AromaticContact CD2-CD1 3.53Å; H212-F228 AromaticContact CD2-CD2 3.41Å; H212-F228 VanDerWaalsContact CD2-CD2 3.41Å; H212-F228 WeakPolarHBondContact CD2-CD2 3.22Å; H212-F228 AromaticContact CD2-CE1 3.66Å; H212-F228 AromaticContact CD2-CE2 3.55Å; H212-F228 AromaticContact CD2-CG 3.4Å; H212-F228 VanDerWaalsContact CD2-CG 3.4Å; H212-F228 WeakPolarHBondContact CD2-CG 3.34Å; H212-F228 AromaticContact CD2-CZ 3.67Å; H212-F228 VanDerWaalsContact CE1-CB 3.5Å; H212-F228 WeakPolarHBondContact CE1-CB 3.5Å; H212-F228 AromaticContact CE1-CD2 3.84Å; H212-F228 AromaticContact CE1-CG 3.65Å; H212-F228 AromaticContact CG-CD2 3.51Å; H212-F228 AromaticContact CG-CE2 3.65Å; H212-F228 AromaticContact CG-CG 3.94Å; H212-F228 AromaticContact ND1-CD2 3.77Å; H212-F228 WeakPolarHBondContact NE2-CB 3.38Å; H212-F228 AromaticContact NE2-CD1 3.47Å; H212-F228 WeakPolarHBondContact NE2-CD1 3.47Å; H212-F228 AromaticContact NE2-CD2 3.64Å; H212-F228 AromaticContact NE2-CG 3.21Å; H212-F228 WeakPolarHBondContact NE2-CG 3.21Å; T214-F228 HydrophobicContact CG2-CD1 4.48Å; T214-F228 HydrophobicContact CG2-CE1 4.21Å; F228-V230 HydrophobicContact CD2-CG1 4.05Å; F228-V230 HydrophobicContact CE2-CG1 4.22Å; F228-V230 HydrophobicContact CE2-CG2 4.45Å
229	K	90.1	Very high	89.6	Confident	117 Å²	117	47.7 Å²	47.7	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.7	-180	-65.2	176.3	175.3	-163.9	0	110	Y174 V175 E176	Y174-K229 HydrophobicContact CD2-CB 3.93Å; Y174-K229 HydrophobicContact CD2-CD 3.77Å; Y174-K229 HydrophobicContact CD2-CG 3.81Å; Y174-K229 HydrophobicContact CE2-CB 4.38Å; Y174-K229 HydrophobicContact CE2-CD 3.33Å; Y174-K229 VanDerWaalsContact CE2-CE 3.46Å; Y174-K229 HydrophobicContact CE2-CG 3.8Å; Y174-K229 PolarHBondContact OH-NZ 3.04Å; V175-K229 WeakPolarHBondContact O-CA 3.23Å; E176-K229 HydrophobicContact CB-CG 4.19Å; E176-K229 HydrophobicContact CG-CG 4.3Å
230	V	88.1	Confident	89.5	Confident	15 Å²	15	45.1 Å²	45.1	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.4	172.7	-68.6	0	0	0	0	109.9	Y174 V175 V211 H212 F228 L235	Y174-V230 CarbonylContact C-O 3.57Å; Y174-V230 VanDerWaalsContact CA-O 3.31Å; Y174-V230 WeakPolarHBondContact CA-O 3.32Å; Y174-V230 WeakPolarHBondContact CB-O 3.4Å; V175-V230 HydrophobicContact CG1-CG2 3.76Å; V175-V230 PolarHBondContact N-O 3.3Å; V175-V230 PolarHBondContact O-N 3.04Å; V211-V230 HydrophobicContact CG1-CB 4.24Å; V211-V230 HydrophobicContact CG1-CG1 4.06Å; V211-V230 HydrophobicContact CG1-CG2 4.36Å; H212-V230 HydrophobicContact CB-CG1 4.13Å; F228-V230 HydrophobicContact CD2-CG1 4.05Å; F228-V230 HydrophobicContact CE2-CG1 4.22Å; F228-V230 HydrophobicContact CE2-CG2 4.45Å; V230-L235 HydrophobicContact CG2-CB 4.24Å; V230-L235 HydrophobicContact CG2-CD1 4.42Å
231	S	85.4	Confident	89.6	Confident	41 Å²	41	46.8 Å²	46.8	29%	0.287	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	145.4	174.8	70.3	0	0	0	0	111	N233 S234 L235	S231-N233 PolarHBondContact O-N 3Å; S231-S234 PolarHBondContact O-N 3.47Å; S231-S234 VanDerWaalsContact O-N 3.08Å; S231-S234 WeakPolarHBondContact OG-CB 3.21Å; S231-S234 PolarHBondContact OG-N 2.68Å; S231-S234 VanDerWaalsContact OG-N 3.12Å; S231-S234 PolarHBondContact OG-OG 2.79Å; S231-L235 PolarHBondContact O-N 3.24Å
232	V	86.9	Confident	89.5	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-35.6	176.9	172.1	0	0	0	0	110.3	D173 L235 C236 S237 F267	D173-V232 HydrophobicContact CB-CG2 3.94Å; D173-V232 WeakPolarHBondContact O-CB 3.2Å; D173-V232 WeakPolarHBondContact O-CG2 3.23Å; D173-V232 PolarHBondContact O-N 3.15Å; V232-L235 PolarHBondContact O-N 3.25Å; V232-C236 PolarHBondContact O-N 3.13Å; V232-C236 PolarHBondContact O-SG 3.46Å; V232-C236 VanDerWaalsContact O-SG 3.36Å; V232-S237 PolarHBondContact O-N 3.22Å; V232-F267 HydrophobicContact CG1-CE1 4.18Å; V232-F267 HydrophobicContact CG2-CE1 4.27Å; V232-F267 HydrophobicContact CG2-CZ 4.36Å
233	N	83.6	Confident	89.5	Confident	62 Å²	62	50.7 Å²	50.7	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-64.3	-42.6	173	-85.5	-17	0	0	0	113.4	N171 R201 S231 L235 S237 G238	N171-N233 PolarHBondContact O-ND2 3.43Å; R201-N233 PolarHBondContact NH1-O 3.06Å; S231-N233 PolarHBondContact O-N 3Å; N233-L235 VanDerWaalsContact C-N 3.34Å; N233-S237 VanDerWaalsContact O-CA 3.22Å; N233-S237 WeakPolarHBondContact O-CA 3.41Å; N233-S237 PolarHBondContact O-N 2.72Å; N233-G238 PolarHBondContact OD1-N 3.33Å
234	S	82.9	Confident	89.5	Confident	57 Å²	57	50.7 Å²	50.7	40%	0.399	28%	0.282	S	S	.	.	H	α-helix	trans	-64.8	-42.6	175.4	-62.1	0	0	0	0	111.1	R201 V211 S231	R201-S234 PolarHBondContact NH1-O 3Å; V211-S234 WeakPolarHBondContact CG2-O 3.26Å; S231-S234 PolarHBondContact O-N 3.47Å; S231-S234 VanDerWaalsContact O-N 3.08Å; S231-S234 WeakPolarHBondContact OG-CB 3.21Å; S231-S234 PolarHBondContact OG-N 2.68Å; S231-S234 VanDerWaalsContact OG-N 3.12Å; S231-S234 PolarHBondContact OG-OG 2.79Å
235	L	89	Confident	89.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-52.7	-178.6	-174.3	64.6	0	0	0	112	V175 L177 I199 R201 V211 V230 S231 V232 N233 L244 F267	V175-L235 HydrophobicContact CG1-CD2 3.61Å; L177-L235 HydrophobicContact CD1-CD2 4.48Å; I199-L235 HydrophobicContact CG2-CD1 4.33Å; R201-L235 WeakPolarHBondContact CG-O 3.23Å; V211-L235 HydrophobicContact CG1-CB 4.45Å; V211-L235 HydrophobicContact CG1-CD1 4.01Å; V230-L235 HydrophobicContact CG2-CB 4.24Å; V230-L235 HydrophobicContact CG2-CD1 4.42Å; S231-L235 PolarHBondContact O-N 3.24Å; V232-L235 PolarHBondContact O-N 3.25Å; N233-L235 VanDerWaalsContact C-N 3.34Å; L235-L244 HydrophobicContact CD1-CD1 3.76Å; L235-L244 HydrophobicContact CD1-CD2 4.01Å; L235-L244 HydrophobicContact CG-CD1 4.13Å; L235-L244 HydrophobicContact CG-CD2 4.4Å; L235-L244 WeakPolarHBondContact O-CD2 3.34Å; L235-F267 HydrophobicContact CD2-CB 4.36Å; L235-F267 HydrophobicContact CD2-CD2 3.74Å; L235-F267 HydrophobicContact CD2-CE2 4.28Å; L235-F267 HydrophobicContact CD2-CG 4.14Å
236	C	88.1	Confident	89.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-139.2	9.9	-167.8	75	0	0	0	0	115.1	V232 G238 D239 R242 F267	V232-C236 PolarHBondContact O-N 3.13Å; V232-C236 PolarHBondContact O-SG 3.46Å; V232-C236 VanDerWaalsContact O-SG 3.36Å; C236-G238 PolarHBondContact O-N 3.05Å; C236-D239 VanDerWaalsContact CB-O 3.27Å; C236-D239 WeakPolarHBondContact CB-O 3.48Å; C236-D239 PolarHBondContact O-N 3.12Å; C236-D239 PolarHBondContact SG-O 2.84Å; C236-R242 HydrophobicContact CB-CB 4.15Å; C236-R242 WeakPolarHBondContact O-CD 3.44Å; C236-R242 PolarHBondContact O-NE 3.47Å; C236-F267 HydrophobicContact CB-CB 4.19Å
237	S	82.7	Confident	89.8	Confident	51 Å²	51	42.3 Å²	42.3	36%	0.357	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	37.3	179.4	-55.2	0	0	0	0	113.4	R201 V232 N233 D239	R201-S237 WeakPolarHBondContact CD-OG 3.5Å; R201-S237 VanDerWaalsContact CZ-OG 3.25Å; R201-S237 PolarHBondContact NE-OG 3.18Å; R201-S237 PolarHBondContact NH1-OG 3.15Å; R201-S237 VanDerWaalsContact NH1-OG 3.08Å; V232-S237 PolarHBondContact O-N 3.22Å; N233-S237 VanDerWaalsContact O-CA 3.22Å; N233-S237 WeakPolarHBondContact O-CA 3.41Å; N233-S237 PolarHBondContact O-N 2.72Å; S237-D239 PolarHBondContact O-N 3.48Å
238	G	75	Confident	90	Very high	42 Å²	42	39.3 Å²	39.3	43%	0.433	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-2.7	-178	0	0	0	0	0	115.3	N233 C236 P240	N233-G238 PolarHBondContact OD1-N 3.33Å; C236-G238 PolarHBondContact O-N 3.05Å; G238-P240 WeakPolarHBondContact O-CD 3.43Å
239	D	86.1	Confident	90.1	Very high	58 Å²	58	41.2 Å²	41.2	31%	0.31	22%	0.219	S	C	.	.			trans	-103.6	104.5	178.7	174.6	6.7	0	0	0	110.7	C236 S237 D241 R242	C236-D239 VanDerWaalsContact CB-O 3.27Å; C236-D239 WeakPolarHBondContact CB-O 3.48Å; C236-D239 PolarHBondContact O-N 3.12Å; C236-D239 PolarHBondContact SG-O 2.84Å; S237-D239 PolarHBondContact O-N 3.48Å; D239-D241 PolarHBondContact O-N 3.13Å; D239-D241 PolarHBondContact OD1-N 3.26Å; D239-R242 HydrophobicContact CB-CB 4.14Å; D239-R242 WeakPolarHBondContact O-CB 3.37Å; D239-R242 PolarHBondContact O-N 3.02Å; D239-R242 IonicContact OD2-NE 2.71Å; D239-R242 IonicContact OD2-NH2 2.85Å
240	P	90.4	Very high	90.3	Very high	35 Å²	35	35.6 Å²	35.6	23%	0.227	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.4	-177.3	-22.1	34.5	0	0	0	114.3	G238 R242 F267 K268	G238-P240 WeakPolarHBondContact O-CD 3.43Å; P240-R242 VanDerWaalsContact C-N 3.3Å; P240-F267 HydrophobicContact CB-CD1 4.38Å; P240-F267 PolarHBondContact O-N 2.86Å; P240-K268 HydrophobicContact CB-CB 4.11Å; P240-K268 VanDerWaalsContact O-CB 3.31Å; P240-K268 WeakPolarHBondContact O-CB 3.3Å; P240-K268 PolarHBondContact O-N 3.47Å
241	D	93.9	Very high	90.4	Very high	88 Å²	88	39.2 Å²	39.2	47%	0.471	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-3.1	178.4	-75.8	-78	0	0	0	111.8	D239 R243 T266 K268	D239-D241 PolarHBondContact O-N 3.13Å; D239-D241 PolarHBondContact OD1-N 3.26Å; D241-R243 PolarHBondContact O-N 3.05Å; D241-T266 WeakPolarHBondContact O-CG2 3.15Å; D241-K268 VanDerWaalsContact CG-NZ 3.34Å; D241-K268 WeakPolarHBondContact OD1-CD 3.24Å; D241-K268 IonicContact OD1-NZ 3.13Å; D241-K268 PolarHBondContact OD1-NZ 3.3Å; D241-K268 IonicContact OD2-NZ 3.07Å; D241-K268 PolarHBondContact OD2-NZ 2.99Å
242	R	92.1	Very high	90.4	Very high	42 Å²	42	38.7 Å²	38.7	16%	0.158	20%	0.201	C	C	.	.			trans	-61.7	134.9	177.8	-168	159	-62.3	-107.2	-11.8	111.6	R201 D204 C236 D239 P240	R201-R242 HydrophobicContact CG-CG 4.31Å; D204-R242 IonicContact OD1-CZ 2.82Å; D204-R242 IonicContact OD1-NH1 3.88Å; D204-R242 PolarHBondContact OD1-NH1 3.31Å; D204-R242 IonicContact OD1-NH2 3.84Å; D204-R242 PolarHBondContact OD1-NH2 2.87Å; D204-R242 IonicContact OD2-NH1 3.4Å; C236-R242 HydrophobicContact CB-CB 4.15Å; C236-R242 WeakPolarHBondContact O-CD 3.44Å; C236-R242 PolarHBondContact O-NE 3.47Å; D239-R242 HydrophobicContact CB-CB 4.14Å; D239-R242 WeakPolarHBondContact O-CB 3.37Å; D239-R242 PolarHBondContact O-N 3.02Å; D239-R242 IonicContact OD2-NE 2.71Å; D239-R242 IonicContact OD2-NH2 2.85Å; P240-R242 VanDerWaalsContact C-N 3.3Å
243	R	96	Very high	90	Very high	138 Å²	138	43.5 Å²	43.5	52%	0.521	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.7	-172.2	-151.3	177.8	76	175.9	-0.3	111.4	M202 D241 T264	M202-R243 HydrophobicContact CB-CB 4.3Å; M202-R243 WeakPolarHBondContact CB-O 3.4Å; M202-R243 HydrophobicContact CG-CB 4.1Å; M202-R243 VanDerWaalsContact CG-O 3.31Å; M202-R243 WeakPolarHBondContact CG-O 3.49Å; M202-R243 PolarHBondContact N-O 3.09Å; D241-R243 PolarHBondContact O-N 3.05Å; R243-T264 HydrophobicContact CG-CG2 3.32Å
244	L	96.9	Very high	89.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131	174.6	-59	177	0	0	0	109.5	F200 R201 L235 T264 S265 M270	F200-L244 CarbonylContact O-C 3.45Å; F200-L244 WeakPolarHBondContact O-CA 3.44Å; R201-L244 HydrophobicContact CB-CD2 4.4Å; L235-L244 HydrophobicContact CD1-CD1 3.76Å; L235-L244 HydrophobicContact CD1-CD2 4.01Å; L235-L244 HydrophobicContact CG-CD1 4.13Å; L235-L244 HydrophobicContact CG-CD2 4.4Å; L235-L244 WeakPolarHBondContact O-CD2 3.34Å; L244-T264 VanDerWaalsContact O-CA 3.32Å; L244-T264 WeakPolarHBondContact O-CA 3.35Å; L244-T264 WeakPolarHBondContact O-CG2 3.46Å; L244-S265 PolarHBondContact N-O 3.46Å; L244-S265 PolarHBondContact O-N 3.05Å; L244-M270 HydrophobicContact CD1-CE 3.56Å; L244-M270 HydrophobicContact CD1-SD 3.95Å
245	K	96.7	Very high	89.4	Confident	43 Å²	43	45.6 Å²	45.6	19%	0.187	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.9	172.1	-176.8	179.3	-176.1	-179.2	0	108.9	F200 M202 I247 E262	F200-K245 HydrophobicContact CB-CB 4.3Å; F200-K245 PolarHBondContact N-O 3.09Å; F200-K245 PolarHBondContact O-N 3.4Å; M202-K245 HydrophobicContact SD-CB 4.12Å; K245-I247 HydrophobicContact CD-CD1 4.33Å; K245-I247 HydrophobicContact CG-CG1 4.3Å; K245-E262 WeakPolarHBondContact CE-OE2 3.38Å; K245-E262 IonicContact NZ-OE2 2.91Å; K245-E262 PolarHBondContact NZ-OE2 3.04Å
246	C	97.8	Very high	89.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	-178.9	-62	0	0	0	0	109.6	L197 E198 E262 F263	L197-C246 HydrophobicContact CD1-CB 4.1Å; E198-C246 CarbonylContact O-C 3.56Å; E198-C246 VanDerWaalsContact O-CA 3.29Å; E198-C246 WeakPolarHBondContact O-CA 3.44Å; C246-E262 CarbonylContact O-C 3.56Å; C246-E262 VanDerWaalsContact O-CA 3.22Å; C246-E262 WeakPolarHBondContact O-CA 3.42Å; C246-E262 WeakPolarHBondContact O-CB 3.16Å; C246-F263 HydrophobicContact CB-CD1 3.73Å; C246-F263 HydrophobicContact CB-CD2 3.9Å; C246-F263 HydrophobicContact CB-CE1 3.31Å; C246-F263 HydrophobicContact CB-CE2 3.52Å; C246-F263 HydrophobicContact CB-CG 4.01Å; C246-F263 HydrophobicContact CB-CZ 3.21Å; C246-F263 PolarHBondContact N-O 3.29Å; C246-F263 PolarHBondContact O-N 3.35Å
247	I	97.4	Very high	89	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.7	-176.6	-52.3	178.4	0	0	0	109.6	L197 E198 F200 K245 W249 F259 E262	L197-I247 WeakPolarHBondContact CA-O 3.48Å; E198-I247 PolarHBondContact N-O 3.41Å; E198-I247 PolarHBondContact O-N 3.24Å; F200-I247 HydrophobicContact CD2-CD1 4.22Å; F200-I247 HydrophobicContact CD2-CG1 4.47Å; F200-I247 HydrophobicContact CE2-CD1 3.88Å; F200-I247 HydrophobicContact CE2-CG1 4.35Å; K245-I247 HydrophobicContact CD-CD1 4.33Å; K245-I247 HydrophobicContact CG-CG1 4.3Å; I247-W249 HydrophobicContact CG2-CD2 4.1Å; I247-W249 VanDerWaalsContact CG2-CE2 3.44Å; I247-W249 HydrophobicContact CG2-CG 4.3Å; I247-W249 HydrophobicContact CG2-CZ2 3.8Å; I247-W249 VanDerWaalsContact CG2-NE1 3.3Å; I247-F259 HydrophobicContact CG2-CD2 3.79Å; I247-F259 HydrophobicContact CG2-CE2 3.51Å; I247-E262 HydrophobicContact CG1-CB 4.26Å
248	V	97.8	Very high	89.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.4	173.2	-171.8	0	0	0	0	108.5	L184 P195 F196 L197 I260 G261 V301	L184-V248 HydrophobicContact CD1-CG1 4.05Å; L184-V248 HydrophobicContact CD2-CG1 4.36Å; P195-V248 HydrophobicContact CB-CG1 4.27Å; F196-V248 WeakPolarHBondContact O-CA 3.5Å; L197-V248 HydrophobicContact CD1-CG2 4.08Å; V248-I260 HydrophobicContact CB-CB 4.4Å; V248-I260 HydrophobicContact CG1-CB 4.29Å; V248-I260 HydrophobicContact CG1-CD1 4.17Å; V248-I260 WeakPolarHBondContact O-CB 3.34Å; V248-I260 PolarHBondContact O-N 2.84Å; V248-I260 VanDerWaalsContact O-N 3.09Å; V248-G261 PolarHBondContact N-O 2.97Å; V248-G261 PolarHBondContact O-N 3.46Å; V248-V301 HydrophobicContact CG2-CG2 3.96Å
249	W	94.4	Very high	90.4	Very high	58 Å²	58	57.3 Å²	57.3	22%	0.22	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	155.3	-179.2	-65.6	102.9	0	0	0	110.4	P195 F196 E198 I247 H257 D258 F259	P195-W249 CarbonylContact C-O 3.59Å; P195-W249 WeakPolarHBondContact CA-O 3.4Å; F196-W249 HydrophobicContact CD1-CB 3.9Å; F196-W249 HydrophobicContact CD2-CB 4.33Å; F196-W249 HydrophobicContact CE1-CB 3.35Å; F196-W249 HydrophobicContact CE1-CG 4.23Å; F196-W249 HydrophobicContact CE2-CB 3.84Å; F196-W249 AromaticContact CE2-CD1 3.59Å; F196-W249 AromaticContact CE2-CG 3.96Å; F196-W249 HydrophobicContact CE2-CG 3.96Å; F196-W249 HydrophobicContact CG-CB 4.37Å; F196-W249 HydrophobicContact CZ-CB 3.32Å; F196-W249 AromaticContact CZ-CD1 3.79Å; F196-W249 AromaticContact CZ-CG 3.69Å; F196-W249 HydrophobicContact CZ-CG 3.69Å; F196-W249 PolarHBondContact N-O 3.27Å; F196-W249 PolarHBondContact O-N 2.78Å; E198-W249 PolarHBondContact OE2-NE1 3.49Å; I247-W249 HydrophobicContact CG2-CD2 4.1Å; I247-W249 VanDerWaalsContact CG2-CE2 3.44Å; I247-W249 HydrophobicContact CG2-CG 4.3Å; I247-W249 HydrophobicContact CG2-CZ2 3.8Å; I247-W249 VanDerWaalsContact CG2-NE1 3.3Å; W249-H257 HydrophobicContact CB-CB 4.36Å; W249-H257 HydrophobicContact CE3-CB 4.11Å; W249-H257 WeakPolarHBondContact CZ3-O 3.45Å; W249-D258 CarbonylContact C-O 3.54Å; W249-F259 HydrophobicContact CE3-CB 3.98Å; W249-F259 HydrophobicContact CE3-CD2 4.28Å; W249-F259 HydrophobicContact CH2-CB 4.24Å; W249-F259 AromaticContact CH2-CD2 3.85Å; W249-F259 HydrophobicContact CH2-CD2 3.85Å; W249-F259 HydrophobicContact CZ2-CD2 4.16Å; W249-F259 HydrophobicContact CZ3-CB 3.58Å; W249-F259 AromaticContact CZ3-CD2 3.93Å; W249-F259 HydrophobicContact CZ3-CD2 3.93Å; W249-F259 HydrophobicContact CZ3-CG 4.25Å
250	D	94.3	Very high	90.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.4	162.6	-164.6	5.4	0	0	0	109.4	K187 S193 D194 H257 D258 I260	K187-D250 HydrophobicContact CB-CB 4.37Å; K187-D250 VanDerWaalsContact CB-OD2 3.29Å; K187-D250 WeakPolarHBondContact CB-OD2 3.02Å; K187-D250 HydrophobicContact CG-CB 4.13Å; S193-D250 WeakPolarHBondContact CA-OD1 3.32Å; S193-D250 VanDerWaalsContact CA-OD2 3.32Å; S193-D250 WeakPolarHBondContact CA-OD2 3.34Å; S193-D250 VanDerWaalsContact CB-CG 3.43Å; S193-D250 WeakPolarHBondContact CB-OD1 3.47Å; S193-D250 WeakPolarHBondContact CB-OD2 3.46Å; S193-D250 PolarHBondContact OG-OD2 2.64Å; D194-D250 WeakPolarHBondContact CA-OD1 2.87Å; D194-D250 PolarHBondContact N-OD1 3.25Å; D250-H257 CarbonylContact O-C 3.54Å; D250-H257 WeakPolarHBondContact O-CA 3.31Å; D250-H257 WeakPolarHBondContact O-CB 3.42Å; D250-D258 HydrophobicContact CB-CB 4Å; D250-D258 PolarHBondContact N-O 3.42Å; D250-D258 PolarHBondContact O-N 3.43Å; D250-D258 VanDerWaalsContact O-N 3.08Å; D250-I260 HydrophobicContact CB-CD1 4.02Å; D250-I260 HydrophobicContact CB-CG1 4.11Å
251	W	91.1	Very high	91.2	Very high	90 Å²	90	52.9 Å²	52.9	34%	0.341	27%	0.265	S	S	.	.			trans	-78.1	142.7	-179.4	-179.2	85.8	0	0	0	111.2	D194 F196 V216 M218 H257	D194-W251 HydrophobicContact CB-CB 4.09Å; D194-W251 WeakPolarHBondContact O-CB 3.32Å; D194-W251 PolarHBondContact O-N 3.09Å; F196-W251 HydrophobicContact CD1-CB 4.02Å; F196-W251 HydrophobicContact CE1-CB 4.09Å; V216-W251 HydrophobicContact CB-CB 4.4Å; V216-W251 HydrophobicContact CG1-CB 3.57Å; V216-W251 HydrophobicContact CG1-CD2 4.47Å; V216-W251 HydrophobicContact CG1-CG 3.99Å; V216-W251 HydrophobicContact CG2-CB 3.86Å; V216-W251 HydrophobicContact CG2-CG 3.82Å; M218-W251 HydrophobicContact CE-CE3 4.02Å; M218-W251 HydrophobicContact CE-CZ3 4.06Å; M218-W251 HydrophobicContact SD-CE3 4.39Å; W251-H257 AromaticContact CD1-CE1 3.22Å; W251-H257 AromaticContact CD1-ND1 3.79Å; W251-H257 AromaticContact CD1-NE2 3.9Å; W251-H257 AromaticContact CG-CE1 3.97Å; W251-H257 AromaticContact NE1-CE1 3.56Å
252	D	84.9	Confident	91.4	Very high	31 Å²	31	51.2 Å²	51.2	17%	0.166	25%	0.254	C	S	.	.			trans	-137	132	-178.7	-85	-66.7	0	0	0	108.7	N254 G255 H257 D258	D252-N254 PolarHBondContact O-N 3.24Å; D252-N254 VanDerWaalsContact O-N 3.1Å; D252-G255 PolarHBondContact O-N 3.05Å; D252-H257 PolarHBondContact N-ND1 2.71Å; D252-H257 PolarHBondContact O-CE1 3.11Å; D252-D258 PolarHBondContact OD2-N 3.46Å
253	S	79.8	Confident	91.7	Very high	107 Å²	107	49.8 Å²	49.8	75%	0.748	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	-180	60.6	0	0	0	0	114.2	G255	S253-G255 VanDerWaalsContact C-N 3.29Å; S253-G255 PolarHBondContact O-N 2.97Å
254	N	80.3	Confident	91.8	Very high	110 Å²	110	46.8 Å²	46.8	59%	0.588	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-1.7	177.7	68.1	27	0	0	0	113.6	D252 K256	D252-N254 PolarHBondContact O-N 3.24Å; D252-N254 VanDerWaalsContact O-N 3.1Å; N254-K256 VanDerWaalsContact C-N 3.3Å; N254-K256 PolarHBondContact O-N 3.15Å; N254-K256 WeakPolarHBondContact OD1-CA 3.29Å; N254-K256 WeakPolarHBondContact OD1-CB 3.03Å; N254-K256 PolarHBondContact OD1-N 3.22Å
255	G	72.8	Confident	91.8	Very high	52 Å²	52	46.8 Å²	46.8	54%	0.536	25%	0.246	S	C	.	.	S	Bend	trans	78.9	0.1	-179.7	0	0	0	0	0	115.6	D252 S253 H257	D252-G255 PolarHBondContact O-N 3.05Å; S253-G255 VanDerWaalsContact C-N 3.29Å; S253-G255 PolarHBondContact O-N 2.97Å; G255-H257 PolarHBondContact O-N 2.83Å
256	K	83.8	Confident	91.8	Very high	167 Å²	167	45.6 Å²	45.6	73%	0.726	24%	0.243	S	C	*	.			trans	-100.4	69.7	176	-65.7	-176.5	179.4	176.5	0	110.8	N254 D258	N254-K256 VanDerWaalsContact C-N 3.3Å; N254-K256 PolarHBondContact O-N 3.15Å; N254-K256 WeakPolarHBondContact OD1-CA 3.29Å; N254-K256 WeakPolarHBondContact OD1-CB 3.03Å; N254-K256 PolarHBondContact OD1-N 3.22Å; K256-D258 PolarHBondContact O-N 2.99Å
257	H	84.4	Confident	91.6	Very high	51 Å²	51	45.9 Å²	45.9	24%	0.236	24%	0.244	C	C	.	.			trans	-54.9	133.4	-178.9	-56.5	-36.5	0	0	0	113.1	F196 W249 D250 W251 D252 G255	F196-H257 HydrophobicContact CE1-CB 4.22Å; F196-H257 AromaticContact CE1-CD2 3.98Å; F196-H257 AromaticContact CE1-CG 3.88Å; F196-H257 HydrophobicContact CZ-CB 4.23Å; F196-H257 AromaticContact CZ-CD2 3.64Å; F196-H257 AromaticContact CZ-CG 3.91Å; W249-H257 HydrophobicContact CB-CB 4.36Å; W249-H257 HydrophobicContact CE3-CB 4.11Å; W249-H257 WeakPolarHBondContact CZ3-O 3.45Å; D250-H257 CarbonylContact O-C 3.54Å; D250-H257 WeakPolarHBondContact O-CA 3.31Å; D250-H257 WeakPolarHBondContact O-CB 3.42Å; W251-H257 AromaticContact CD1-CE1 3.22Å; W251-H257 AromaticContact CD1-ND1 3.79Å; W251-H257 AromaticContact CD1-NE2 3.9Å; W251-H257 AromaticContact CG-CE1 3.97Å; W251-H257 AromaticContact NE1-CE1 3.56Å; D252-H257 PolarHBondContact N-ND1 2.71Å; D252-H257 PolarHBondContact O-CE1 3.11Å; G255-H257 PolarHBondContact O-N 2.83Å
258	D	91.7	Very high	91.5	Very high	77 Å²	77	50.4 Å²	50.4	41%	0.412	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131.9	-179.7	-96.9	-23.4	0	0	0	112.4	K187 W249 D250 D252 K256 I260	K187-D258 HydrophobicContact CB-CB 4.18Å; K187-D258 HydrophobicContact CG-CB 4.16Å; W249-D258 CarbonylContact C-O 3.54Å; D250-D258 HydrophobicContact CB-CB 4Å; D250-D258 PolarHBondContact N-O 3.42Å; D250-D258 PolarHBondContact O-N 3.43Å; D250-D258 VanDerWaalsContact O-N 3.08Å; D252-D258 PolarHBondContact OD2-N 3.46Å; K256-D258 PolarHBondContact O-N 2.99Å; D258-I260 PolarHBondContact O-N 3.39Å
259	F	94.9	Very high	91.4	Very high	45 Å²	45	54.9 Å²	54.9	20%	0.197	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	115.7	-176.8	179.8	-97.6	0	0	0	111.6	K187 I247 W249 E262 N285	K187-F259 WeakPolarHBondContact CE-O 3.41Å; K187-F259 PolarHBondContact NZ-O 2.8Å; I247-F259 HydrophobicContact CG2-CD2 3.79Å; I247-F259 HydrophobicContact CG2-CE2 3.51Å; W249-F259 HydrophobicContact CE3-CB 3.98Å; W249-F259 HydrophobicContact CE3-CD2 4.28Å; W249-F259 HydrophobicContact CH2-CB 4.24Å; W249-F259 AromaticContact CH2-CD2 3.85Å; W249-F259 HydrophobicContact CH2-CD2 3.85Å; W249-F259 HydrophobicContact CZ2-CD2 4.16Å; W249-F259 HydrophobicContact CZ3-CB 3.58Å; W249-F259 AromaticContact CZ3-CD2 3.93Å; W249-F259 HydrophobicContact CZ3-CD2 3.93Å; W249-F259 HydrophobicContact CZ3-CG 4.25Å; F259-E262 HydrophobicContact CE2-CB 4.23Å; F259-E262 HydrophobicContact CZ-CB 3.94Å; F259-E262 HydrophobicContact CZ-CG 3.97Å; F259-N285 WeakPolarHBondContact CD1-ND2 3.32Å; F259-N285 HydrophobicContact CE1-CB 4.35Å; F259-N285 PolarHBondContact O-ND2 2.78Å
260	I	96.8	Very high	91.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-58.9	175.9	-60.8	180	0	0	0	109.9	L184 D185 K187 P195 V248 D250 D258 N285 S298	L184-I260 HydrophobicContact CB-CG2 4.45Å; L184-I260 HydrophobicContact CD2-CG2 4.29Å; D185-I260 HydrophobicContact CB-CG2 4.4Å; K187-I260 HydrophobicContact CG-CG1 4.12Å; P195-I260 HydrophobicContact CB-CD1 4.2Å; V248-I260 HydrophobicContact CB-CB 4.4Å; V248-I260 HydrophobicContact CG1-CB 4.29Å; V248-I260 HydrophobicContact CG1-CD1 4.17Å; V248-I260 WeakPolarHBondContact O-CB 3.34Å; V248-I260 PolarHBondContact O-N 2.84Å; V248-I260 VanDerWaalsContact O-N 3.09Å; D250-I260 HydrophobicContact CB-CD1 4.02Å; D250-I260 HydrophobicContact CB-CG1 4.11Å; D258-I260 PolarHBondContact O-N 3.39Å; I260-N285 WeakPolarHBondContact O-CB 3.41Å; I260-N285 PolarHBondContact O-ND2 2.99Å; I260-S298 WeakPolarHBondContact O-CB 3.32Å; I260-S298 PolarHBondContact O-OG 3.25Å; I260-S298 VanDerWaalsContact O-OG 3.1Å
261	G	97.6	Very high	91.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.4	175.7	178.6	0	0	0	0	0	113.5	V248 C283 I284	V248-G261 PolarHBondContact N-O 2.97Å; V248-G261 PolarHBondContact O-N 3.46Å; G261-C283 WeakPolarHBondContact CA-SG 3.44Å; G261-I284 CarbonylContact C-O 3.58Å; G261-I284 WeakPolarHBondContact CA-O 3.21Å
262	E	98.1	Very high	91.3	Very high	53 Å²	53	52.7 Å²	52.7	25%	0.248	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	158.9	-179.6	66	-176.8	-164.9	0	0	111.9	K245 C246 I247 F259 I284 P286	K245-E262 WeakPolarHBondContact CE-OE2 3.38Å; K245-E262 IonicContact NZ-OE2 2.91Å; K245-E262 PolarHBondContact NZ-OE2 3.04Å; C246-E262 CarbonylContact O-C 3.56Å; C246-E262 VanDerWaalsContact O-CA 3.22Å; C246-E262 WeakPolarHBondContact O-CA 3.42Å; C246-E262 WeakPolarHBondContact O-CB 3.16Å; I247-E262 HydrophobicContact CG1-CB 4.26Å; F259-E262 HydrophobicContact CE2-CB 4.23Å; F259-E262 HydrophobicContact CZ-CB 3.94Å; F259-E262 HydrophobicContact CZ-CG 3.97Å; E262-I284 PolarHBondContact N-O 3.44Å; E262-I284 PolarHBondContact O-N 3.4Å; E262-P286 HydrophobicContact CG-CG 4.49Å
263	F	98.1	Very high	91.5	Very high	12 Å²	12	52.3 Å²	52.3	5%	0.053	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	168.1	168.9	65.6	-83.8	0	0	0	110.3	L197 C246 W281 V301	L197-F263 HydrophobicContact CD1-CE1 4.31Å; C246-F263 HydrophobicContact CB-CD1 3.73Å; C246-F263 HydrophobicContact CB-CD2 3.9Å; C246-F263 HydrophobicContact CB-CE1 3.31Å; C246-F263 HydrophobicContact CB-CE2 3.52Å; C246-F263 HydrophobicContact CB-CG 4.01Å; C246-F263 HydrophobicContact CB-CZ 3.21Å; C246-F263 PolarHBondContact N-O 3.29Å; C246-F263 PolarHBondContact O-N 3.35Å; F263-W281 HydrophobicContact CB-CB 3.9Å; F263-W281 HydrophobicContact CD1-CB 4.39Å; F263-W281 HydrophobicContact CD2-CB 3.42Å; F263-W281 VanDerWaalsContact CD2-CB 3.42Å; F263-W281 AromaticContact CD2-CD1 3.84Å; F263-W281 AromaticContact CD2-CD2 3.67Å; F263-W281 HydrophobicContact CD2-CD2 3.67Å; F263-W281 HydrophobicContact CD2-CE3 4.13Å; F263-W281 AromaticContact CD2-CG 3.34Å; F263-W281 HydrophobicContact CD2-CG 3.34Å; F263-W281 HydrophobicContact CE2-CB 3.96Å; F263-W281 AromaticContact CE2-CD2 3.46Å; F263-W281 HydrophobicContact CE2-CD2 3.46Å; F263-W281 VanDerWaalsContact CE2-CD2 3.46Å; F263-W281 AromaticContact CE2-CE3 3.48Å; F263-W281 HydrophobicContact CE2-CE3 3.48Å; F263-W281 VanDerWaalsContact CE2-CE3 3.48Å; F263-W281 AromaticContact CE2-CG 3.68Å; F263-W281 HydrophobicContact CE2-CG 3.68Å; F263-W281 HydrophobicContact CE2-CZ3 4.13Å; F263-W281 HydrophobicContact CG-CB 3.66Å; F263-W281 HydrophobicContact CG-CG 4.11Å; F263-W281 HydrophobicContact CZ-CD2 4.37Å; F263-W281 AromaticContact CZ-CE3 3.98Å; F263-W281 HydrophobicContact CZ-CE3 3.98Å; F263-V301 HydrophobicContact CD1-CB 4.48Å; F263-V301 HydrophobicContact CD1-CG2 4.32Å; F263-V301 HydrophobicContact CE1-CB 3.8Å; F263-V301 HydrophobicContact CE1-CG1 3.89Å; F263-V301 HydrophobicContact CE1-CG2 3.79Å; F263-V301 HydrophobicContact CZ-CB 4.1Å; F263-V301 HydrophobicContact CZ-CG1 3.85Å
264	T	97.4	Very high	91.9	Very high	75 Å²	75	51.7 Å²	51.7	46%	0.46	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.2	176.5	-58.1	0	0	0	0	109.1	R243 L244	R243-T264 HydrophobicContact CG-CG2 3.32Å; L244-T264 VanDerWaalsContact O-CA 3.32Å; L244-T264 WeakPolarHBondContact O-CA 3.35Å; L244-T264 WeakPolarHBondContact O-CG2 3.46Å
265	S	96.9	Very high	92.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	-174	173.2	-168.3	0	0	0	0	111.4	L244 E269 W281	L244-S265 PolarHBondContact N-O 3.46Å; L244-S265 PolarHBondContact O-N 3.05Å; S265-E269 VanDerWaalsContact CA-OE2 3.32Å; S265-E269 WeakPolarHBondContact CA-OE2 3.49Å; S265-E269 WeakPolarHBondContact CB-OE2 3.46Å; S265-E269 PolarHBondContact OG-OE2 3.48Å; S265-W281 VanDerWaalsContact OG-CE2 3.31Å; S265-W281 WeakPolarHBondContact OG-CZ2 3.47Å; S265-W281 PolarHBondContact OG-NE1 3.41Å
266	T	97	Very high	92.8	Very high	19 Å²	19	53.8 Å²	53.8	12%	0.117	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.2	172.9	62	0	0	0	0	109.1	D241 K268 E269 M270	D241-T266 WeakPolarHBondContact O-CG2 3.15Å; T266-K268 PolarHBondContact O-N 2.97Å; T266-E269 PolarHBondContact O-N 2.9Å; T266-E269 WeakPolarHBondContact OG1-CG 3.44Å; T266-E269 PolarHBondContact OG1-N 3.21Å; T266-E269 VanDerWaalsContact OG1-N 3.17Å; T266-M270 WeakPolarHBondContact O-CG 3.3Å; T266-M270 PolarHBondContact O-N 3.01Å; T266-M270 VanDerWaalsContact O-N 3.11Å
267	F	94.6	Very high	93.1	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-32.6	175.3	-178.7	-133.9	0	0	0	111.6	V175 V232 L235 C236 P240 E269 M270 R271 I308	V175-F267 HydrophobicContact CB-CE2 4.17Å; V175-F267 HydrophobicContact CB-CZ 4.39Å; V175-F267 HydrophobicContact CG1-CE2 4.3Å; V175-F267 HydrophobicContact CG2-CE2 3.92Å; V175-F267 HydrophobicContact CG2-CZ 4.45Å; V232-F267 HydrophobicContact CG1-CE1 4.18Å; V232-F267 HydrophobicContact CG2-CE1 4.27Å; V232-F267 HydrophobicContact CG2-CZ 4.36Å; L235-F267 HydrophobicContact CD2-CB 4.36Å; L235-F267 HydrophobicContact CD2-CD2 3.74Å; L235-F267 HydrophobicContact CD2-CE2 4.28Å; L235-F267 HydrophobicContact CD2-CG 4.14Å; C236-F267 HydrophobicContact CB-CB 4.19Å; P240-F267 HydrophobicContact CB-CD1 4.38Å; P240-F267 PolarHBondContact O-N 2.86Å; F267-E269 PolarHBondContact O-N 3.02Å; F267-M270 HydrophobicContact CD2-CB 4.36Å; F267-M270 PolarHBondContact O-N 2.67Å; F267-R271 HydrophobicContact CD2-CG 4.32Å; F267-R271 HydrophobicContact CE1-CG 4.33Å; F267-R271 HydrophobicContact CE2-CG 3.95Å; F267-R271 HydrophobicContact CZ-CG 3.98Å; F267-R271 WeakPolarHBondContact O-CG 3.28Å; F267-R271 PolarHBondContact O-N 3.18Å; F267-I308 HydrophobicContact CE1-CD1 4.31Å; F267-I308 HydrophobicContact CZ-CD1 3.71Å; F267-I308 HydrophobicContact CZ-CG1 3.93Å
268	K	94.8	Very high	93.4	Very high	105 Å²	105	56.2 Å²	56.2	46%	0.457	29%	0.291	S	S	.	.	H	α-helix	trans	-57.6	-43.2	172.7	-177.3	178.9	-176.4	171.7	0	113.2	P240 D241 T266	P240-K268 HydrophobicContact CB-CB 4.11Å; P240-K268 VanDerWaalsContact O-CB 3.31Å; P240-K268 WeakPolarHBondContact O-CB 3.3Å; P240-K268 PolarHBondContact O-N 3.47Å; D241-K268 VanDerWaalsContact CG-NZ 3.34Å; D241-K268 WeakPolarHBondContact OD1-CD 3.24Å; D241-K268 IonicContact OD1-NZ 3.13Å; D241-K268 PolarHBondContact OD1-NZ 3.3Å; D241-K268 IonicContact OD2-NZ 3.07Å; D241-K268 PolarHBondContact OD2-NZ 2.99Å; T266-K268 PolarHBondContact O-N 2.97Å
269	E	95.3	Very high	93.6	Very high	94 Å²	94	53.2 Å²	53.2	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-46.3	173.4	-75	170.2	-163.8	0	0	111.6	S265 T266 F267 R271 G272 W281	S265-E269 VanDerWaalsContact CA-OE2 3.32Å; S265-E269 WeakPolarHBondContact CA-OE2 3.49Å; S265-E269 WeakPolarHBondContact CB-OE2 3.46Å; S265-E269 PolarHBondContact OG-OE2 3.48Å; T266-E269 PolarHBondContact O-N 2.9Å; T266-E269 WeakPolarHBondContact OG1-CG 3.44Å; T266-E269 PolarHBondContact OG1-N 3.21Å; T266-E269 VanDerWaalsContact OG1-N 3.17Å; F267-E269 PolarHBondContact O-N 3.02Å; E269-R271 PolarHBondContact O-N 3.44Å; E269-G272 PolarHBondContact O-N 3.11Å; E269-W281 PolarHBondContact OE2-NE1 2.99Å
270	M	95.4	Very high	93.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-35.6	179.7	-67.3	-179	178.8	0	0	112.4	L177 F179 L244 T266 F267 G272 A273 W281 L303	L177-M270 HydrophobicContact CD1-SD 4.4Å; F179-M270 HydrophobicContact CZ-CE 4.15Å; L244-M270 HydrophobicContact CD1-CE 3.56Å; L244-M270 HydrophobicContact CD1-SD 3.95Å; T266-M270 WeakPolarHBondContact O-CG 3.3Å; T266-M270 PolarHBondContact O-N 3.01Å; T266-M270 VanDerWaalsContact O-N 3.11Å; F267-M270 HydrophobicContact CD2-CB 4.36Å; F267-M270 PolarHBondContact O-N 2.67Å; M270-G272 PolarHBondContact O-N 3.45Å; M270-G272 VanDerWaalsContact O-N 3.16Å; M270-A273 WeakPolarHBondContact O-CB 3.27Å; M270-A273 PolarHBondContact O-N 3.41Å; M270-A273 VanDerWaalsContact O-N 3.09Å; M270-W281 HydrophobicContact CG-CH2 4.06Å; M270-W281 HydrophobicContact CG-CZ2 4.21Å; M270-L303 HydrophobicContact CB-CD2 3.67Å; M270-L303 HydrophobicContact CG-CD2 3.93Å
271	R	92.3	Very high	93.8	Very high	92 Å²	92	57 Å²	57	35%	0.347	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-61.2	-19.3	174.7	-73.2	-170.5	-58	-179.2	0.2	113.6	F267 E269 A273 M274 I308	F267-R271 HydrophobicContact CD2-CG 4.32Å; F267-R271 HydrophobicContact CE1-CG 4.33Å; F267-R271 HydrophobicContact CE2-CG 3.95Å; F267-R271 HydrophobicContact CZ-CG 3.98Å; F267-R271 WeakPolarHBondContact O-CG 3.28Å; F267-R271 PolarHBondContact O-N 3.18Å; E269-R271 PolarHBondContact O-N 3.44Å; R271-A273 PolarHBondContact O-N 2.74Å; R271-A273 VanDerWaalsContact O-N 3.15Å; R271-M274 HydrophobicContact CB-SD 4.22Å; R271-M274 HydrophobicContact CG-SD 3.96Å; R271-M274 VanDerWaalsContact O-CB 3.25Å; R271-M274 WeakPolarHBondContact O-CB 3.38Å; R271-M274 PolarHBondContact O-N 3.1Å; R271-I308 HydrophobicContact CG-CD1 4.41Å
272	G	89.7	Confident	93.8	Very high	10 Å²	10	61.4 Å²	61.4	10%	0.103	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-55.6	-30.1	171.6	0	0	0	0	0	113	E269 M270 M274 E275 K277	E269-G272 PolarHBondContact O-N 3.11Å; M270-G272 PolarHBondContact O-N 3.45Å; M270-G272 VanDerWaalsContact O-N 3.16Å; G272-M274 VanDerWaalsContact C-N 3.25Å; G272-M274 PolarHBondContact O-N 3.4Å; G272-E275 WeakPolarHBondContact O-CB 3.25Å; G272-E275 PolarHBondContact O-N 2.86Å; G272-K277 VanDerWaalsContact O-CB 3.27Å; G272-K277 WeakPolarHBondContact O-CB 3.35Å; G272-K277 PolarHBondContact O-N 3.31Å; G272-K277 VanDerWaalsContact O-N 3.09Å
273	A	89.8	Confident	93.8	Very high	24 Å²	24	58.9 Å²	58.9	20%	0.198	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-65.8	-28.2	176.3	0	0	0	0	0	112.6	M270 R271 E275 G276 K277 V279 L303 C306	M270-A273 WeakPolarHBondContact O-CB 3.27Å; M270-A273 PolarHBondContact O-N 3.41Å; M270-A273 VanDerWaalsContact O-N 3.09Å; R271-A273 PolarHBondContact O-N 2.74Å; R271-A273 VanDerWaalsContact O-N 3.15Å; A273-E275 PolarHBondContact O-N 2.6Å; A273-G276 PolarHBondContact O-N 3.48Å; A273-K277 WeakPolarHBondContact CA-O 3.47Å; A273-V279 HydrophobicContact CB-CB 4.43Å; A273-V279 HydrophobicContact CB-CG2 3.85Å; A273-V279 VanDerWaalsContact N-CG2 3.29Å; A273-L303 HydrophobicContact CB-CD2 4.03Å; A273-L303 HydrophobicContact CB-CG 4.34Å; A273-C306 HydrophobicContact CB-CB 3.83Å
274	M	88.8	Confident	93.7	Very high	94 Å²	94	60 Å²	60	46%	0.463	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.7	-25.4	173.7	-58.8	172	66.8	0	0	112.1	R271 G272 G276 C306 I308	R271-M274 HydrophobicContact CB-SD 4.22Å; R271-M274 HydrophobicContact CG-SD 3.96Å; R271-M274 VanDerWaalsContact O-CB 3.25Å; R271-M274 WeakPolarHBondContact O-CB 3.38Å; R271-M274 PolarHBondContact O-N 3.1Å; G272-M274 VanDerWaalsContact C-N 3.25Å; G272-M274 PolarHBondContact O-N 3.4Å; M274-G276 VanDerWaalsContact C-N 3.26Å; M274-C306 HydrophobicContact CG-CB 4.11Å; M274-C306 WeakPolarHBondContact CG-O 3.22Å; M274-I308 HydrophobicContact CE-CB 4.15Å; M274-I308 HydrophobicContact CE-CD1 3.88Å; M274-I308 HydrophobicContact CE-CG1 3.88Å; M274-I308 HydrophobicContact SD-CD1 3.74Å; M274-I308 HydrophobicContact SD-CG1 3.79Å
275	E	87	Confident	93.7	Very high	133 Å²	133	56.7 Å²	56.7	62%	0.621	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-89.9	10.1	178.1	-57.5	174.1	175.4	0	0	112	G272 A273 K277	G272-E275 WeakPolarHBondContact O-CB 3.25Å; G272-E275 PolarHBondContact O-N 2.86Å; A273-E275 PolarHBondContact O-N 2.6Å; E275-K277 VanDerWaalsContact C-N 3.26Å; E275-K277 PolarHBondContact O-N 3.36Å; E275-K277 VanDerWaalsContact OE2-CE 3.31Å; E275-K277 WeakPolarHBondContact OE2-CE 3.22Å; E275-K277 IonicContact OE2-NZ 3.68Å; E275-K277 PolarHBondContact OE2-NZ 2.99Å
276	G	83.9	Confident	93.6	Very high	73 Å²	73	59.6 Å²	59.6	75%	0.753	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	9.7	-177.3	0	0	0	0	0	114.4	A273 M274	A273-G276 PolarHBondContact O-N 3.48Å; M274-G276 VanDerWaalsContact C-N 3.26Å
277	K	90.4	Very high	93.5	Very high	127 Å²	127	65.9 Å²	65.9	55%	0.552	33%	0.331	S	S	*	.			trans	-75.7	139.4	173.8	-60.9	169.4	176	158.4	0	109.6	G272 A273 E275 V279	G272-K277 VanDerWaalsContact O-CB 3.27Å; G272-K277 WeakPolarHBondContact O-CB 3.35Å; G272-K277 PolarHBondContact O-N 3.31Å; G272-K277 VanDerWaalsContact O-N 3.09Å; A273-K277 WeakPolarHBondContact CA-O 3.47Å; E275-K277 VanDerWaalsContact C-N 3.26Å; E275-K277 PolarHBondContact O-N 3.36Å; E275-K277 VanDerWaalsContact OE2-CE 3.31Å; E275-K277 WeakPolarHBondContact OE2-CE 3.22Å; E275-K277 IonicContact OE2-NZ 3.68Å; E275-K277 PolarHBondContact OE2-NZ 2.99Å; K277-V279 PolarHBondContact O-N 3.41Å
278	Q	91.1	Very high	93.4	Very high	141 Å²	141	68.7 Å²	68.7	66%	0.659	34%	0.342	S	S	*	.			trans	-71.6	111.7	168.5	-175.2	174.4	41.7	0	0	109.1
279	V	96.9	Very high	93.3	Very high	15 Å²	15	70.5 Å²	70.5	9%	0.091	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.9	177.3	-173.6	0	0	0	0	108.8	A273 K277 W281 I302 L303	A273-V279 HydrophobicContact CB-CB 4.43Å; A273-V279 HydrophobicContact CB-CG2 3.85Å; A273-V279 VanDerWaalsContact N-CG2 3.29Å; K277-V279 PolarHBondContact O-N 3.41Å; V279-W281 HydrophobicContact CB-CH2 4.36Å; V279-W281 HydrophobicContact CG1-CH2 3.25Å; V279-W281 HydrophobicContact CG1-CZ2 3.24Å; V279-W281 HydrophobicContact CG1-CZ3 4.01Å; V279-I302 WeakPolarHBondContact O-CG2 3.44Å; V279-L303 HydrophobicContact CB-CB 4.22Å; V279-L303 HydrophobicContact CB-CD2 4.5Å; V279-L303 HydrophobicContact CG1-CB 4.48Å; V279-L303 PolarHBondContact O-N 2.94Å
280	Q	96.9	Very high	93.1	Very high	96 Å²	96	70.3 Å²	70.3	45%	0.449	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.5	-178.6	65.2	179.1	37.7	0	0	111.8	T300 V301 I302	Q280-T300 HydrophobicContact CB-CG2 4.11Å; Q280-T300 HydrophobicContact CG-CG2 4.43Å; Q280-V301 CarbonylContact C-O 3.5Å; Q280-V301 WeakPolarHBondContact CA-O 3.27Å; Q280-V301 WeakPolarHBondContact CB-O 3.23Å; Q280-I302 HydrophobicContact CB-CB 4.28Å; Q280-I302 HydrophobicContact CB-CG1 3.93Å; Q280-I302 HydrophobicContact CB-CG2 4.26Å
281	W	98.1	Very high	93	Very high	29 Å²	29	78.6 Å²	78.6	11%	0.11	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.8	179.8	-54.9	-93.1	0	0	0	110.8	F179 F263 S265 E269 M270 V279 C283 T300 V301 L303	F179-W281 HydrophobicContact CD1-CZ3 4.43Å; F179-W281 HydrophobicContact CE1-CH2 4.34Å; F179-W281 AromaticContact CE1-CZ3 3.85Å; F179-W281 HydrophobicContact CE1-CZ3 3.85Å; F263-W281 HydrophobicContact CB-CB 3.9Å; F263-W281 HydrophobicContact CD1-CB 4.39Å; F263-W281 HydrophobicContact CD2-CB 3.42Å; F263-W281 VanDerWaalsContact CD2-CB 3.42Å; F263-W281 AromaticContact CD2-CD1 3.84Å; F263-W281 AromaticContact CD2-CD2 3.67Å; F263-W281 HydrophobicContact CD2-CD2 3.67Å; F263-W281 HydrophobicContact CD2-CE3 4.13Å; F263-W281 AromaticContact CD2-CG 3.34Å; F263-W281 HydrophobicContact CD2-CG 3.34Å; F263-W281 HydrophobicContact CE2-CB 3.96Å; F263-W281 AromaticContact CE2-CD2 3.46Å; F263-W281 HydrophobicContact CE2-CD2 3.46Å; F263-W281 VanDerWaalsContact CE2-CD2 3.46Å; F263-W281 AromaticContact CE2-CE3 3.48Å; F263-W281 HydrophobicContact CE2-CE3 3.48Å; F263-W281 VanDerWaalsContact CE2-CE3 3.48Å; F263-W281 AromaticContact CE2-CG 3.68Å; F263-W281 HydrophobicContact CE2-CG 3.68Å; F263-W281 HydrophobicContact CE2-CZ3 4.13Å; F263-W281 HydrophobicContact CG-CB 3.66Å; F263-W281 HydrophobicContact CG-CG 4.11Å; F263-W281 HydrophobicContact CZ-CD2 4.37Å; F263-W281 AromaticContact CZ-CE3 3.98Å; F263-W281 HydrophobicContact CZ-CE3 3.98Å; S265-W281 VanDerWaalsContact OG-CE2 3.31Å; S265-W281 WeakPolarHBondContact OG-CZ2 3.47Å; S265-W281 PolarHBondContact OG-NE1 3.41Å; E269-W281 PolarHBondContact OE2-NE1 2.99Å; M270-W281 HydrophobicContact CG-CH2 4.06Å; M270-W281 HydrophobicContact CG-CZ2 4.21Å; V279-W281 HydrophobicContact CB-CH2 4.36Å; V279-W281 HydrophobicContact CG1-CH2 3.25Å; V279-W281 HydrophobicContact CG1-CZ2 3.24Å; V279-W281 HydrophobicContact CG1-CZ3 4.01Å; W281-C283 PolarHBondContact O-N 3.03Å; W281-T300 WeakPolarHBondContact O-CA 3.31Å; W281-T300 WeakPolarHBondContact O-CG2 3.43Å; W281-V301 PolarHBondContact N-O 3.33Å; W281-V301 PolarHBondContact O-N 2.8Å; W281-L303 HydrophobicContact CH2-CB 3.97Å; W281-L303 HydrophobicContact CH2-CD2 4.27Å; W281-L303 HydrophobicContact CZ3-CB 3.87Å
282	E	97.7	Very high	92.9	Very high	92 Å²	92	78.9 Å²	78.9	43%	0.43	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.6	168	-63.9	-164.1	123.8	0	0	109.3	I284 K296 N297	E282-I284 HydrophobicContact CB-CD1 4.03Å; E282-I284 PolarHBondContact O-N 3.48Å; E282-K296 WeakPolarHBondContact OE1-CE 3.45Å; E282-N297 HydrophobicContact CB-CB 4Å; E282-N297 HydrophobicContact CG-CB 4.49Å; E282-N297 PolarHBondContact OE1-ND2 2.94Å
283	C	96.9	Very high	92.7	Very high	0 Å²	0	88.6 Å²	88.6	0%	0	44%	0.443	C	S	.	.			trans	-80.6	118.2	175.4	-169.6	0	0	0	0	108.6	G261 W281 Y295 N297 S298 G299 V301	G261-C283 WeakPolarHBondContact CA-SG 3.44Å; W281-C283 PolarHBondContact O-N 3.03Å; C283-Y295 PolarHBondContact O-OH 3.1Å; C283-N297 WeakPolarHBondContact O-CB 3.12Å; C283-S298 PolarHBondContact O-N 3.46Å; C283-G299 WeakPolarHBondContact CB-O 3.39Å; C283-G299 PolarHBondContact N-O 3.38Å; C283-V301 HydrophobicContact CB-CG2 4.41Å
284	I	98	Very high	92.6	Very high	36 Å²	36	95.2 Å²	95.2	19%	0.185	48%	0.476	C	S	.	.	B	Isolated β-bridge	trans	-112.6	124.9	-171.8	-59	-58.7	0	0	0	111.1	G261 E262 E282 P286 K289 Y295 N297	G261-I284 CarbonylContact C-O 3.58Å; G261-I284 WeakPolarHBondContact CA-O 3.21Å; E262-I284 PolarHBondContact N-O 3.44Å; E262-I284 PolarHBondContact O-N 3.4Å; E282-I284 HydrophobicContact CB-CD1 4.03Å; E282-I284 PolarHBondContact O-N 3.48Å; I284-P286 WeakPolarHBondContact O-CD 3.48Å; I284-K289 HydrophobicContact CG2-CB 4.4Å; I284-K289 HydrophobicContact CG2-CD 3.87Å; I284-Y295 WeakPolarHBondContact CA-OH 3.33Å; I284-Y295 HydrophobicContact CD1-CE1 4.36Å; I284-Y295 HydrophobicContact CG2-CE1 4.38Å; I284-N297 HydrophobicContact CD1-CB 3.97Å
285	N	97.1	Very high	92.8	Very high	5 Å²	5	92.6 Å²	92.6	3%	0.027	46%	0.461	C	S	.	.			trans	-90.9	111.1	165.3	-168.7	-55.5	0	0	0	110.6	F259 I260 K287 Y288 K289 Y295 S298	F259-N285 WeakPolarHBondContact CD1-ND2 3.32Å; F259-N285 HydrophobicContact CE1-CB 4.35Å; F259-N285 PolarHBondContact O-ND2 2.78Å; I260-N285 WeakPolarHBondContact O-CB 3.41Å; I260-N285 PolarHBondContact O-ND2 2.99Å; N285-K287 VanDerWaalsContact C-N 3.25Å; N285-K287 PolarHBondContact O-N 2.92Å; N285-K287 WeakPolarHBondContact OD1-CB 3.49Å; N285-K287 PolarHBondContact OD1-N 2.83Å; N285-K287 VanDerWaalsContact OD1-N 3.08Å; N285-Y288 HydrophobicContact CB-CD2 3.98Å; N285-Y288 HydrophobicContact CB-CG 4.03Å; N285-Y288 PolarHBondContact O-N 2.57Å; N285-Y288 VanDerWaalsContact O-N 3.14Å; N285-Y288 PolarHBondContact OD1-N 2.89Å; N285-Y288 VanDerWaalsContact OD1-N 3.17Å; N285-K289 PolarHBondContact O-N 3.35Å; N285-Y295 PolarHBondContact N-OH 2.99Å; N285-S298 WeakPolarHBondContact CB-OG 3.16Å
286	P	94.7	Very high	93.1	Very high	60 Å²	60	93.8 Å²	93.8	39%	0.39	46%	0.464	S	S	.	.	H	α-helix	trans	-60.8	-34.3	-177.1	-24.7	35.5	0	0	0	112.9	E262 I284 A290	E262-P286 HydrophobicContact CG-CG 4.49Å; I284-P286 WeakPolarHBondContact O-CD 3.48Å; P286-A290 WeakPolarHBondContact O-CB 3.43Å; P286-A290 PolarHBondContact O-N 2.78Å
287	K	93.9	Very high	93.6	Very high	151 Å²	151	91.8 Å²	91.8	66%	0.657	44%	0.436	S	S	*	.	H	α-helix	trans	-67.2	-41	178	-63.1	178.5	-179.9	172.3	0	111.1	N285 K291	N285-K287 VanDerWaalsContact C-N 3.25Å; N285-K287 PolarHBondContact O-N 2.92Å; N285-K287 WeakPolarHBondContact OD1-CB 3.49Å; N285-K287 PolarHBondContact OD1-N 2.83Å; N285-K287 VanDerWaalsContact OD1-N 3.08Å; K287-K291 WeakPolarHBondContact O-CB 3.46Å; K287-K291 VanDerWaalsContact O-CG 3.3Å; K287-K291 WeakPolarHBondContact O-CG 3.44Å; K287-K291 PolarHBondContact O-N 3.33Å; K287-K291 VanDerWaalsContact O-N 3.16Å
288	Y	93.8	Very high	93.9	Very high	65 Å²	65	85.7 Å²	85.7	26%	0.255	41%	0.41	S	S	.	.	H	α-helix	trans	-71.6	-41.5	177.3	-68.4	-5.1	0	0	0	111.7	D185 K187 N285 A290 K291 K292 Y295	D185-Y288 WeakPolarHBondContact OD2-CD2 3.31Å; D185-Y288 WeakPolarHBondContact OD2-CE2 3.48Å; K187-Y288 PolarHBondContact NZ-OH 3.08Å; N285-Y288 HydrophobicContact CB-CD2 3.98Å; N285-Y288 HydrophobicContact CB-CG 4.03Å; N285-Y288 PolarHBondContact O-N 2.57Å; N285-Y288 VanDerWaalsContact O-N 3.14Å; N285-Y288 PolarHBondContact OD1-N 2.89Å; N285-Y288 VanDerWaalsContact OD1-N 3.17Å; Y288-A290 PolarHBondContact O-N 2.79Å; Y288-K291 PolarHBondContact O-N 3.11Å; Y288-K291 VanDerWaalsContact O-N 3.12Å; Y288-K292 HydrophobicContact CD1-CD 4.49Å; Y288-K292 HydrophobicContact CD2-CD 4.45Å; Y288-K292 HydrophobicContact CG-CD 4.11Å; Y288-K292 WeakPolarHBondContact O-CB 3.08Å; Y288-K292 PolarHBondContact O-N 3.49Å; Y288-Y295 HydrophobicContact CD2-CD2 4.38Å; Y288-Y295 HydrophobicContact CD2-CE2 4.02Å; Y288-Y295 HydrophobicContact CG-CE2 4.4Å
289	K	91.6	Very high	94.2	Very high	144 Å²	144	79 Å²	79	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-57.8	-36.5	175.2	-170.5	171.8	-178.5	174.9	0	112.7	I284 N285 Y295	I284-K289 HydrophobicContact CG2-CB 4.4Å; I284-K289 HydrophobicContact CG2-CD 3.87Å; N285-K289 PolarHBondContact O-N 3.35Å; K289-Y295 HydrophobicContact CB-CD1 3.93Å; K289-Y295 HydrophobicContact CB-CE1 4Å; K289-Y295 HydrophobicContact CG-CD1 4.41Å
290	A	91.8	Very high	94.3	Very high	89 Å²	89	79.7 Å²	79.7	74%	0.736	38%	0.383	S	S	*	.	H	α-helix	trans	-76.8	-31.3	176.6	0	0	0	0	0	113.9	P286 Y288	P286-A290 WeakPolarHBondContact O-CB 3.43Å; P286-A290 PolarHBondContact O-N 2.78Å; Y288-A290 PolarHBondContact O-N 2.79Å
291	K	92.2	Very high	94.3	Very high	175 Å²	175	75.1 Å²	75.1	76%	0.761	36%	0.361	S	S	*	.	H	α-helix	trans	-101.7	-30.7	-170.3	-69	-177.9	178.7	-173	0	115	K287 Y288	K287-K291 WeakPolarHBondContact O-CB 3.46Å; K287-K291 VanDerWaalsContact O-CG 3.3Å; K287-K291 WeakPolarHBondContact O-CG 3.44Å; K287-K291 PolarHBondContact O-N 3.33Å; K287-K291 VanDerWaalsContact O-N 3.16Å; Y288-K291 PolarHBondContact O-N 3.11Å; Y288-K291 VanDerWaalsContact O-N 3.12Å
292	K	91	Very high	94.3	Very high	98 Å²	98	74.1 Å²	74.1	43%	0.426	36%	0.358	S	S	.	.			trans	-103.5	116.2	-171.3	-66.7	-176.8	-177.7	176.3	0	110.2	Y288 N294 Y295	Y288-K292 HydrophobicContact CD1-CD 4.49Å; Y288-K292 HydrophobicContact CD2-CD 4.45Å; Y288-K292 HydrophobicContact CG-CD 4.11Å; Y288-K292 WeakPolarHBondContact O-CB 3.08Å; Y288-K292 PolarHBondContact O-N 3.49Å; K292-N294 VanDerWaalsContact C-N 3.3Å; K292-N294 PolarHBondContact O-N 2.98Å; K292-Y295 HydrophobicContact CD-CD2 4.46Å; K292-Y295 PolarHBondContact O-N 3.48Å
293	K	84.9	Confident	94.3	Very high	213 Å²	213	70 Å²	70	93%	0.926	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.1	-177.1	-83.2	-173.3	174.3	-178.5	0	115.1
294	N	89	Confident	94.1	Very high	163 Å²	163	74.4 Å²	74.4	87%	0.872	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	24.5	-176.1	-64.2	-16.2	0	0	0	112.8	K292 K296	K292-N294 VanDerWaalsContact C-N 3.3Å; K292-N294 PolarHBondContact O-N 2.98Å; N294-K296 PolarHBondContact O-N 3.5Å
295	Y	92.6	Very high	93.9	Very high	40 Å²	40	75.5 Å²	75.5	16%	0.157	37%	0.368	C	S	.	.			trans	-75	125.6	179.7	172.1	-93.2	0	0	0	111.1	C283 I284 N285 Y288 K289 K292 N297 S298	C283-Y295 PolarHBondContact O-OH 3.1Å; I284-Y295 WeakPolarHBondContact CA-OH 3.33Å; I284-Y295 HydrophobicContact CD1-CE1 4.36Å; I284-Y295 HydrophobicContact CG2-CE1 4.38Å; N285-Y295 PolarHBondContact N-OH 2.99Å; Y288-Y295 HydrophobicContact CD2-CD2 4.38Å; Y288-Y295 HydrophobicContact CD2-CE2 4.02Å; Y288-Y295 HydrophobicContact CG-CE2 4.4Å; K289-Y295 HydrophobicContact CB-CD1 3.93Å; K289-Y295 HydrophobicContact CB-CE1 4Å; K289-Y295 HydrophobicContact CG-CD1 4.41Å; K292-Y295 HydrophobicContact CD-CD2 4.46Å; K292-Y295 PolarHBondContact O-N 3.48Å; Y295-N297 VanDerWaalsContact CE2-C 3.46Å; Y295-N297 WeakPolarHBondContact CE2-O 3.22Å; Y295-N297 VanDerWaalsContact CZ-C 3.45Å; Y295-N297 VanDerWaalsContact CZ-CA 3.47Å; Y295-N297 WeakPolarHBondContact OH-CA 3.39Å; Y295-S298 PolarHBondContact OH-N 2.88Å; Y295-S298 PolarHBondContact OH-OG 3.08Å
296	K	91.9	Very high	93.8	Very high	157 Å²	157	75.7 Å²	75.7	68%	0.683	37%	0.37	S	S	*	.			trans	-96.4	-64	175.3	-169.7	-177.8	177.9	-178.2	0	110.8	E282 N294	E282-K296 WeakPolarHBondContact OE1-CE 3.45Å; N294-K296 PolarHBondContact O-N 3.5Å
297	N	95.8	Very high	93.6	Very high	31 Å²	31	78 Å²	78	17%	0.166	37%	0.374	C	S	.	.			trans	-159.6	169.5	178.3	59.2	52.3	0	0	0	109.8	E282 C283 I284 Y295 G299	E282-N297 HydrophobicContact CB-CB 4Å; E282-N297 HydrophobicContact CG-CB 4.49Å; E282-N297 PolarHBondContact OE1-ND2 2.94Å; C283-N297 WeakPolarHBondContact O-CB 3.12Å; I284-N297 HydrophobicContact CD1-CB 3.97Å; Y295-N297 VanDerWaalsContact CE2-C 3.46Å; Y295-N297 WeakPolarHBondContact CE2-O 3.22Å; Y295-N297 VanDerWaalsContact CZ-C 3.45Å; Y295-N297 VanDerWaalsContact CZ-CA 3.47Å; Y295-N297 WeakPolarHBondContact OH-CA 3.39Å; N297-G299 VanDerWaalsContact C-N 3.26Å; N297-G299 WeakPolarHBondContact OD1-CA 3.41Å; N297-G299 PolarHBondContact OD1-N 2.81Å; N297-G299 PolarHBondContact OD1-O 2.84Å
298	S	96.8	Very high	93.3	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.354	C	S	.	.	S	Bend	trans	-96.4	33.2	172.9	-61.9	0	0	0	0	110.3	L184 D185 I260 C283 N285 Y295	L184-S298 WeakPolarHBondContact CA-O 3.22Å; L184-S298 WeakPolarHBondContact CD2-O 3.27Å; D185-S298 PolarHBondContact N-O 3.35Å; D185-S298 PolarHBondContact OD2-OG 3.33Å; I260-S298 WeakPolarHBondContact O-CB 3.32Å; I260-S298 PolarHBondContact O-OG 3.25Å; I260-S298 VanDerWaalsContact O-OG 3.1Å; C283-S298 PolarHBondContact O-N 3.46Å; N285-S298 WeakPolarHBondContact CB-OG 3.16Å; Y295-S298 PolarHBondContact OH-N 2.88Å; Y295-S298 PolarHBondContact OH-OG 3.08Å
299	G	97.1	Very high	92.9	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.35	C	S	.	.			trans	106.1	-178	-172	0	0	0	0	0	114.2	R182 K183 C283 N297	R182-G299 VanDerWaalsContact O-CA 3.26Å; R182-G299 WeakPolarHBondContact O-CA 3.43Å; K183-G299 WeakPolarHBondContact O-CA 3.38Å; K183-G299 PolarHBondContact O-N 3.38Å; C283-G299 WeakPolarHBondContact CB-O 3.39Å; C283-G299 PolarHBondContact N-O 3.38Å; N297-G299 VanDerWaalsContact C-N 3.26Å; N297-G299 WeakPolarHBondContact OD1-CA 3.41Å; N297-G299 PolarHBondContact OD1-N 2.81Å; N297-G299 PolarHBondContact OD1-O 2.84Å
300	T	97.9	Very high	92.4	Very high	30 Å²	30	71.8 Å²	71.8	18%	0.184	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135	-178.7	-53.5	0	0	0	0	109.6	A181 R182 Q280 W281 I302	A181-T300 CarbonylContact C-O 3.56Å; A181-T300 WeakPolarHBondContact CA-O 3.31Å; R182-T300 PolarHBondContact N-O 2.99Å; R182-T300 PolarHBondContact O-N 2.67Å; Q280-T300 HydrophobicContact CB-CG2 4.11Å; Q280-T300 HydrophobicContact CG-CG2 4.43Å; W281-T300 WeakPolarHBondContact O-CA 3.31Å; W281-T300 WeakPolarHBondContact O-CG2 3.43Å; T300-I302 HydrophobicContact CG2-CG1 4.37Å
301	V	98.1	Very high	92	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.2	175.1	-179.6	0	0	0	0	108.5	F179 N180 A181 V248 F263 Q280 W281 C283	F179-V301 HydrophobicContact CD1-CG1 3.85Å; N180-V301 CarbonylContact O-C 3.59Å; N180-V301 WeakPolarHBondContact O-CA 3.19Å; A181-V301 HydrophobicContact CB-CG2 4.18Å; V248-V301 HydrophobicContact CG2-CG2 3.96Å; F263-V301 HydrophobicContact CD1-CB 4.48Å; F263-V301 HydrophobicContact CD1-CG2 4.32Å; F263-V301 HydrophobicContact CE1-CB 3.8Å; F263-V301 HydrophobicContact CE1-CG1 3.89Å; F263-V301 HydrophobicContact CE1-CG2 3.79Å; F263-V301 HydrophobicContact CZ-CB 4.1Å; F263-V301 HydrophobicContact CZ-CG1 3.85Å; Q280-V301 CarbonylContact C-O 3.5Å; Q280-V301 WeakPolarHBondContact CA-O 3.27Å; Q280-V301 WeakPolarHBondContact CB-O 3.23Å; W281-V301 PolarHBondContact N-O 3.33Å; W281-V301 PolarHBondContact O-N 2.8Å; C283-V301 HydrophobicContact CB-CG2 4.41Å
302	I	97.6	Very high	91.8	Very high	7 Å²	7	63.6 Å²	63.6	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.3	-176.6	-46.1	169.1	0	0	0	108.3	F179 N180 R182 V279 Q280 T300	F179-I302 VanDerWaalsContact CA-O 3.32Å; F179-I302 WeakPolarHBondContact CA-O 3.41Å; N180-I302 PolarHBondContact N-O 3.22Å; N180-I302 PolarHBondContact O-N 2.86Å; N180-I302 VanDerWaalsContact OD1-CB 3.23Å; N180-I302 WeakPolarHBondContact OD1-CB 3.47Å; N180-I302 WeakPolarHBondContact OD1-CD1 3.42Å; R182-I302 HydrophobicContact CG-CD1 4.21Å; V279-I302 WeakPolarHBondContact O-CG2 3.44Å; Q280-I302 HydrophobicContact CB-CB 4.28Å; Q280-I302 HydrophobicContact CB-CG1 3.93Å; Q280-I302 HydrophobicContact CB-CG2 4.26Å; T300-I302 HydrophobicContact CG2-CG1 4.37Å
303	L	97.4	Very high	91.7	Very high	7 Å²	7	60.3 Å²	60.3	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	108.6	170.4	-178.2	66.8	0	0	0	108.8	L177 F179 M270 A273 V279 W281 L305 C306	L177-L303 HydrophobicContact CB-CD1 4.33Å; L177-L303 HydrophobicContact CD2-CD1 3.92Å; F179-L303 HydrophobicContact CD1-CB 4.34Å; F179-L303 HydrophobicContact CD1-CD1 4.02Å; F179-L303 HydrophobicContact CD2-CD1 4.15Å; F179-L303 HydrophobicContact CE1-CB 4.18Å; F179-L303 HydrophobicContact CE1-CD1 3.67Å; F179-L303 HydrophobicContact CE1-CG 4.48Å; F179-L303 HydrophobicContact CE2-CD1 3.79Å; F179-L303 HydrophobicContact CG-CD1 4.27Å; F179-L303 HydrophobicContact CZ-CD1 3.55Å; M270-L303 HydrophobicContact CB-CD2 3.67Å; M270-L303 HydrophobicContact CG-CD2 3.93Å; A273-L303 HydrophobicContact CB-CD2 4.03Å; A273-L303 HydrophobicContact CB-CG 4.34Å; V279-L303 HydrophobicContact CB-CB 4.22Å; V279-L303 HydrophobicContact CB-CD2 4.5Å; V279-L303 HydrophobicContact CG1-CB 4.48Å; V279-L303 PolarHBondContact O-N 2.94Å; W281-L303 HydrophobicContact CH2-CB 3.97Å; W281-L303 HydrophobicContact CH2-CD2 4.27Å; W281-L303 HydrophobicContact CZ3-CB 3.87Å; L303-L305 WeakPolarHBondContact CD1-O 3.49Å; L303-C306 HydrophobicContact CD2-CB 3.92Å; L303-C306 HydrophobicContact CG-CB 4.43Å
304	N	93.3	Very high	92.1	Very high	91 Å²	91	50.4 Å²	50.4	49%	0.487	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-32.6	-179.3	-64.6	-35.1	0	0	0	112.6	A178 N180	A178-N304 PolarHBondContact O-N 2.98Å; N180-N304 WeakPolarHBondContact CB-ND2 3.26Å; N180-N304 VanDerWaalsContact CG-ND2 3.29Å; N180-N304 PolarHBondContact ND2-ND2 3.38Å; N180-N304 PolarHBondContact ND2-OD1 3.08Å
305	L	93.4	Very high	92.2	Very high	59 Å²	59	42.7 Å²	42.7	31%	0.309	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.7	-179.4	-178.9	65.3	0	0	0	109.1	E176 L177 A178 L303 K307	E176-L305 HydrophobicContact CG-CD2 3.85Å; L177-L305 VanDerWaalsContact CA-O 3.31Å; L177-L305 WeakPolarHBondContact CA-O 3.39Å; A178-L305 HydrophobicContact CB-CB 3.64Å; A178-L305 HydrophobicContact CB-CD2 4.45Å; A178-L305 PolarHBondContact N-O 3.14Å; A178-L305 PolarHBondContact O-N 2.88Å; L303-L305 WeakPolarHBondContact CD1-O 3.49Å; L305-K307 HydrophobicContact CD1-CB 4.14Å; L305-K307 HydrophobicContact CG-CB 4.47Å
306	C	94.4	Very high	92.1	Very high	10 Å²	10	43.3 Å²	43.3	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	111.2	162.9	-174.4	0	0	0	0	105.9	E176 L177 A273 M274 L303	E176-C306 WeakPolarHBondContact O-CA 3.44Å; L177-C306 HydrophobicContact CD2-CB 4.24Å; A273-C306 HydrophobicContact CB-CB 3.83Å; M274-C306 HydrophobicContact CG-CB 4.11Å; M274-C306 WeakPolarHBondContact CG-O 3.22Å; L303-C306 HydrophobicContact CD2-CB 3.92Å; L303-C306 HydrophobicContact CG-CB 4.43Å
307	K	91.5	Very high	92.2	Very high	109 Å²	109	35.9 Å²	35.9	47%	0.474	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	116.4	180	-177.3	177	175.2	-177.1	0	109.2	V175 E176 L305 H309	V175-K307 WeakPolarHBondContact CA-O 3.39Å; E176-K307 HydrophobicContact CB-CB 4.38Å; E176-K307 PolarHBondContact N-O 3.15Å; E176-K307 PolarHBondContact O-N 3.22Å; L305-K307 HydrophobicContact CD1-CB 4.14Å; L305-K307 HydrophobicContact CG-CB 4.47Å; K307-H309 VanDerWaalsContact CE-CE1 3.5Å; K307-H309 WeakPolarHBondContact CE-CE1 3.43Å; K307-H309 PolarHBondContact O-CD2 3.1Å
308	I	88.1	Confident	92.1	Very high	47 Å²	47	34.4 Å²	34.4	24%	0.241	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	126.1	171.7	-59.1	175.7	0	0	0	107.6	D173 F267 R271 M274	D173-I308 HydrophobicContact CB-CG2 4.3Å; F267-I308 HydrophobicContact CE1-CD1 4.31Å; F267-I308 HydrophobicContact CZ-CD1 3.71Å; F267-I308 HydrophobicContact CZ-CG1 3.93Å; R271-I308 HydrophobicContact CG-CD1 4.41Å; M274-I308 HydrophobicContact CE-CB 4.15Å; M274-I308 HydrophobicContact CE-CD1 3.88Å; M274-I308 HydrophobicContact CE-CG1 3.88Å; M274-I308 HydrophobicContact SD-CD1 3.74Å; M274-I308 HydrophobicContact SD-CG1 3.79Å
309	H	84	Confident	91.7	Very high	34 Å²	34	35.5 Å²	35.5	16%	0.157	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.7	170.5	-62.7	-98.9	0	0	0	106.8	Y174 E176 K307 M311	Y174-H309 HydrophobicContact CD1-CB 3.93Å; Y174-H309 HydrophobicContact CD2-CB 3.77Å; Y174-H309 AromaticContact CD2-CD2 3.65Å; Y174-H309 AromaticContact CD2-CG 3.97Å; Y174-H309 HydrophobicContact CE1-CB 3.45Å; Y174-H309 VanDerWaalsContact CE1-CB 3.45Å; Y174-H309 HydrophobicContact CE2-CB 3.28Å; Y174-H309 AromaticContact CE2-CD2 3.07Å; Y174-H309 WeakPolarHBondContact CE2-CD2 3.31Å; Y174-H309 AromaticContact CE2-CG 3.2Å; Y174-H309 AromaticContact CE2-ND1 3.98Å; Y174-H309 AromaticContact CE2-NE2 3.75Å; Y174-H309 HydrophobicContact CG-CB 4.09Å; Y174-H309 AromaticContact CZ-CD2 3.77Å; Y174-H309 AromaticContact CZ-CG 3.36Å; Y174-H309 AromaticContact CZ-ND1 3.91Å; Y174-H309 PolarHBondContact N-O 2.95Å; Y174-H309 VanDerWaalsContact N-O 3.16Å; Y174-H309 PolarHBondContact O-N 2.95Å; Y174-H309 WeakPolarHBondContact OH-CB 3.2Å; Y174-H309 PolarHBondContact OH-ND1 2.88Å; E176-H309 WeakPolarHBondContact CB-NE2 3.28Å; E176-H309 IonicContact OE2-CE1 2.68Å; E176-H309 IonicContact OE2-NE2 2.81Å; E176-H309 PolarHBondContact OE2-NE2 2.86Å; K307-H309 VanDerWaalsContact CE-CE1 3.5Å; K307-H309 WeakPolarHBondContact CE-CE1 3.43Å; K307-H309 PolarHBondContact O-CD2 3.1Å; H309-M311 PolarHBondContact O-N 2.73Å
310	K	82.1	Confident	91.4	Very high	147 Å²	147	36.2 Å²	36.2	64%	0.639	18%	0.184	S	C	*	.	P	Polyproline II helix	trans	-69.8	129.1	176.8	-73	-164.9	171.3	-165.9	0	109.5	D173	D173-K310 VanDerWaalsContact OD1-CA 3.23Å; D173-K310 WeakPolarHBondContact OD1-CA 3.39Å
311	M	82.7	Confident	91	Very high	60 Å²	60	36.6 Å²	36.6	30%	0.296	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-97.5	123.2	172.1	-71.3	-60.4	-66.2	0	0	108.2	D172 D173 Y174 H309 N554	D172-M311 HydrophobicContact CB-CB 4.45Å; D172-M311 WeakPolarHBondContact O-CG 3.46Å; D173-M311 PolarHBondContact OD1-N 3.47Å; Y174-M311 HydrophobicContact CD1-CG 3.74Å; Y174-M311 HydrophobicContact CD1-SD 3.77Å; Y174-M311 HydrophobicContact CE1-CG 4.08Å; Y174-M311 HydrophobicContact CE1-SD 3.5Å; Y174-M311 WeakPolarHBondContact CE1-SD 3.31Å; H309-M311 PolarHBondContact O-N 2.73Å; M311-N554 HydrophobicContact CE-CB 3.86Å; M311-N554 HydrophobicContact SD-CB 4.17Å
312	H	87.4	Confident	90.8	Very high	33 Å²	33	36.8 Å²	36.8	15%	0.153	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-92.6	132.4	176.3	-67.1	-65.7	0	0	0	109.8	D316 Y317 N554 P560	H312-D316 WeakPolarHBondContact CA-OD2 3.46Å; H312-D316 HydrophobicContact CB-CB 4.11Å; H312-D316 IonicContact ND1-OD2 3.56Å; H312-D316 PolarHBondContact ND1-OD2 2.87Å; H312-Y317 HydrophobicContact CB-CD2 4.36Å; H312-Y317 HydrophobicContact CB-CE2 3.61Å; H312-N554 PolarHBondContact N-OD1 3.2Å; H312-N554 VanDerWaalsContact N-OD1 3.1Å; H312-N554 PolarHBondContact O-ND2 3.31Å; H312-P560 HydrophobicContact CB-CG 3.67Å; H312-P560 WeakPolarHBondContact CD2-CD 3.27Å
313	S	90.4	Very high	90.6	Very high	28 Å²	28	39.1 Å²	39.1	20%	0.196	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-72.1	169.4	176.3	77.1	0	0	0	0	110.7	E167 L315 D316 Y317	E167-S313 PolarHBondContact OE1-OG 2.91Å; E167-S313 WeakPolarHBondContact OE2-CB 3.25Å; E167-S313 PolarHBondContact OE2-OG 3.48Å; S313-L315 VanDerWaalsContact C-N 3.31Å; S313-L315 PolarHBondContact O-N 2.54Å; S313-L315 PolarHBondContact OG-N 3.49Å; S313-D316 PolarHBondContact N-OD2 3.17Å; S313-D316 VanDerWaalsContact N-OD2 3.11Å; S313-D316 WeakPolarHBondContact O-CB 3.47Å; S313-D316 PolarHBondContact O-N 2.96Å; S313-D316 PolarHBondContact OG-N 3.01Å; S313-Y317 WeakPolarHBondContact O-CD2 3.35Å; S313-Y317 PolarHBondContact O-N 3.24Å
314	F	92.7	Very high	90.4	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-57.9	-44.5	169.6	172.4	-105.6	0	0	0	111.9	L41 F101 F103 D316 Y317 I318 I324 P546 V549 V550	L41-F314 HydrophobicContact CD2-CB 4.23Å; L41-F314 HydrophobicContact CD2-CD1 3.7Å; L41-F314 HydrophobicContact CD2-CG 4.31Å; F101-F314 HydrophobicContact CE1-CD1 4.35Å; F101-F314 HydrophobicContact CE1-CE1 4.31Å; F101-F314 HydrophobicContact CZ-CE1 4.47Å; F103-F314 HydrophobicContact CB-CE1 4.32Å; F103-F314 AromaticContact CD2-CE1 3.5Å; F103-F314 HydrophobicContact CD2-CE1 3.5Å; F103-F314 VanDerWaalsContact CD2-CE1 3.5Å; F103-F314 AromaticContact CD2-CZ 3.51Å; F103-F314 HydrophobicContact CD2-CZ 3.51Å; F103-F314 HydrophobicContact CE2-CE1 4.06Å; F103-F314 AromaticContact CE2-CZ 3.56Å; F103-F314 HydrophobicContact CE2-CZ 3.56Å; F103-F314 HydrophobicContact CG-CE1 4.04Å; F103-F314 HydrophobicContact CG-CZ 4.21Å; F103-F314 HydrophobicContact CZ-CZ 4.3Å; F314-D316 VanDerWaalsContact C-N 3.33Å; F314-D316 PolarHBondContact O-N 3.26Å; F314-Y317 PolarHBondContact O-N 3.46Å; F314-I318 HydrophobicContact CD1-CG1 4.21Å; F314-I318 HydrophobicContact CD2-CG1 4.37Å; F314-I318 HydrophobicContact CE1-CD1 4.45Å; F314-I318 HydrophobicContact CE1-CG1 3.71Å; F314-I318 HydrophobicContact CE2-CD1 3.99Å; F314-I318 HydrophobicContact CE2-CG1 3.89Å; F314-I318 HydrophobicContact CZ-CD1 3.79Å; F314-I318 HydrophobicContact CZ-CG1 3.54Å; F314-I318 PolarHBondContact O-N 2.91Å; F314-I318 VanDerWaalsContact O-N 3.14Å; F314-I324 HydrophobicContact CE2-CD1 4.49Å; F314-P546 HydrophobicContact CB-CB 3.94Å; F314-P546 HydrophobicContact CD1-CB 4.24Å; F314-P546 HydrophobicContact CD2-CB 4.04Å; F314-P546 HydrophobicContact CG-CB 3.8Å; F314-P546 HydrophobicContact CG-CG 4.48Å; F314-V549 HydrophobicContact CD2-CB 4.02Å; F314-V549 HydrophobicContact CD2-CG1 4.04Å; F314-V549 HydrophobicContact CD2-CG2 4.27Å; F314-V549 HydrophobicContact CE2-CB 4.35Å; F314-V549 HydrophobicContact CE2-CG1 4.4Å; F314-V549 HydrophobicContact CE2-CG2 4.11Å; F314-V550 HydrophobicContact CB-CG2 4.06Å
315	L	91.6	Very high	90.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-68.8	-29.5	179.8	-79.4	-167.6	0	0	0	113	T42 V44 F101 V140 E167 S313 Y317 I318 M319	T42-L315 HydrophobicContact CG2-CD1 3.3Å; T42-L315 HydrophobicContact CG2-CG 4Å; V44-L315 HydrophobicContact CG2-CD1 3.62Å; F101-L315 HydrophobicContact CD1-CD1 3.81Å; F101-L315 HydrophobicContact CD1-CD2 4.03Å; F101-L315 HydrophobicContact CD1-CG 4.01Å; F101-L315 HydrophobicContact CE1-CD1 4.18Å; F101-L315 HydrophobicContact CE1-CD2 3.52Å; F101-L315 HydrophobicContact CE1-CG 3.91Å; F101-L315 HydrophobicContact CE2-CD2 4.27Å; F101-L315 HydrophobicContact CG-CD1 4.07Å; F101-L315 HydrophobicContact CZ-CD2 3.65Å; F101-L315 HydrophobicContact CZ-CG 4.5Å; V140-L315 HydrophobicContact CB-CD2 4.12Å; V140-L315 HydrophobicContact CG2-CD2 4.01Å; E167-L315 HydrophobicContact CB-CB 4.45Å; E167-L315 HydrophobicContact CB-CD1 4.44Å; E167-L315 HydrophobicContact CG-CB 4.35Å; E167-L315 HydrophobicContact CG-CD1 4.15Å; S313-L315 VanDerWaalsContact C-N 3.31Å; S313-L315 PolarHBondContact O-N 2.54Å; S313-L315 PolarHBondContact OG-N 3.49Å; L315-Y317 VanDerWaalsContact C-N 3.26Å; L315-Y317 PolarHBondContact O-N 3.34Å; L315-I318 HydrophobicContact CD2-CB 4.43Å; L315-I318 PolarHBondContact O-N 2.93Å; L315-M319 HydrophobicContact CB-CE 4.47Å; L315-M319 HydrophobicContact CD1-CE 4Å; L315-M319 WeakPolarHBondContact O-CB 3.41Å; L315-M319 VanDerWaalsContact O-CG 3.29Å; L315-M319 WeakPolarHBondContact O-CG 3.48Å; L315-M319 PolarHBondContact O-N 3.28Å
316	D	90.7	Very high	90.6	Very high	53 Å²	53	32.4 Å²	32.4	28%	0.283	17%	0.17	S	C	.	.	H	α-helix	trans	-57	-43.2	171.9	-81.6	-30.8	0	0	0	110.9	H312 S313 F314 G320 P560	H312-D316 WeakPolarHBondContact CA-OD2 3.46Å; H312-D316 HydrophobicContact CB-CB 4.11Å; H312-D316 IonicContact ND1-OD2 3.56Å; H312-D316 PolarHBondContact ND1-OD2 2.87Å; S313-D316 PolarHBondContact N-OD2 3.17Å; S313-D316 VanDerWaalsContact N-OD2 3.11Å; S313-D316 WeakPolarHBondContact O-CB 3.47Å; S313-D316 PolarHBondContact O-N 2.96Å; S313-D316 PolarHBondContact OG-N 3.01Å; F314-D316 VanDerWaalsContact C-N 3.33Å; F314-D316 PolarHBondContact O-N 3.26Å; D316-G320 WeakPolarHBondContact O-CA 3.15Å; D316-G320 PolarHBondContact O-N 3.48Å; D316-P560 HydrophobicContact CB-CB 4.48Å; D316-P560 HydrophobicContact CB-CG 3.8Å; D316-P560 WeakPolarHBondContact O-CB 3.28Å
317	Y	93.3	Very high	90.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67	-49	176.9	-70.9	-71.7	0	0	0	111.8	H312 S313 F314 L315 G320 G321 C322 A451 V549 Y553 N554 I558 P560	H312-Y317 HydrophobicContact CB-CD2 4.36Å; H312-Y317 HydrophobicContact CB-CE2 3.61Å; S313-Y317 WeakPolarHBondContact O-CD2 3.35Å; S313-Y317 PolarHBondContact O-N 3.24Å; F314-Y317 PolarHBondContact O-N 3.46Å; L315-Y317 VanDerWaalsContact C-N 3.26Å; L315-Y317 PolarHBondContact O-N 3.34Å; Y317-G320 CarbonylContact O-C 3.55Å; Y317-G320 WeakPolarHBondContact O-CA 3.47Å; Y317-G320 PolarHBondContact O-N 3.44Å; Y317-G321 PolarHBondContact O-N 2.97Å; Y317-C322 WeakPolarHBondContact O-CB 3.5Å; Y317-C322 PolarHBondContact O-N 3.36Å; Y317-A451 HydrophobicContact CD1-CB 3.59Å; Y317-A451 HydrophobicContact CE1-CB 3.88Å; Y317-V549 HydrophobicContact CD2-CG1 4.47Å; Y317-Y553 AromaticContact CD1-CD2 3.86Å; Y317-Y553 HydrophobicContact CD1-CD2 3.86Å; Y317-Y553 HydrophobicContact CD1-CE2 4.42Å; Y317-Y553 HydrophobicContact CD1-CG 4.14Å; Y317-Y553 HydrophobicContact CD2-CD2 4.39Å; Y317-Y553 VanDerWaalsContact CE1-CB 3.41Å; Y317-Y553 HydrophobicContact CE1-CD1 4.47Å; Y317-Y553 AromaticContact CE1-CD2 3.89Å; Y317-Y553 HydrophobicContact CE1-CD2 3.89Å; Y317-Y553 AromaticContact CE1-CG 3.71Å; Y317-Y553 HydrophobicContact CE1-CG 3.71Å; Y317-Y553 HydrophobicContact CE2-CD2 4.43Å; Y317-Y553 HydrophobicContact CG-CD2 4.14Å; Y317-Y553 AromaticContact CZ-CG 3.99Å; Y317-Y553 WeakPolarHBondContact OH-CB 3.2Å; Y317-N554 PolarHBondContact OH-N 2.64Å; Y317-N554 PolarHBondContact OH-OD1 3.11Å; Y317-I558 PolarHBondContact OH-O 3.02Å; Y317-P560 HydrophobicContact CD1-CB 4.01Å; Y317-P560 HydrophobicContact CD1-CG 3.66Å; Y317-P560 HydrophobicContact CD2-CG 4.48Å; Y317-P560 HydrophobicContact CE1-CB 4.33Å; Y317-P560 VanDerWaalsContact CE1-CD 3.47Å; Y317-P560 HydrophobicContact CE1-CG 3.65Å; Y317-P560 HydrophobicContact CE2-CG 4.45Å; Y317-P560 HydrophobicContact CG-CG 4.08Å
318	I	93.2	Very high	91	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-49.4	179.9	-63.2	-57.6	0	0	0	111.5	V140 F314 L315 G320 G321 I324 Y370	V140-I318 HydrophobicContact CG2-CG2 4.47Å; F314-I318 HydrophobicContact CD1-CG1 4.21Å; F314-I318 HydrophobicContact CD2-CG1 4.37Å; F314-I318 HydrophobicContact CE1-CD1 4.45Å; F314-I318 HydrophobicContact CE1-CG1 3.71Å; F314-I318 HydrophobicContact CE2-CD1 3.99Å; F314-I318 HydrophobicContact CE2-CG1 3.89Å; F314-I318 HydrophobicContact CZ-CD1 3.79Å; F314-I318 HydrophobicContact CZ-CG1 3.54Å; F314-I318 PolarHBondContact O-N 2.91Å; F314-I318 VanDerWaalsContact O-N 3.14Å; L315-I318 HydrophobicContact CD2-CB 4.43Å; L315-I318 PolarHBondContact O-N 2.93Å; I318-G320 PolarHBondContact O-N 3.4Å; I318-G321 PolarHBondContact O-N 3.3Å; I318-I324 HydrophobicContact CD1-CD1 3.93Å; I318-I324 HydrophobicContact CD1-CG1 3.82Å; I318-Y370 HydrophobicContact CD1-CD1 4.46Å; I318-Y370 HydrophobicContact CG2-CD1 3.99Å; I318-Y370 HydrophobicContact CG2-CE1 4.42Å
319	M	89.9	Confident	91.5	Very high	23 Å²	23	24.8 Å²	24.8	11%	0.113	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-22.1	176.6	-67.3	-175.7	179.8	0	0	112.6	V44 V140 A165 E167 L315 G321	V44-M319 HydrophobicContact CG1-CE 4.36Å; V140-M319 HydrophobicContact CB-CE 3.88Å; V140-M319 HydrophobicContact CG1-CE 3.72Å; V140-M319 WeakPolarHBondContact O-CG 3.4Å; A165-M319 HydrophobicContact CB-CE 4.04Å; E167-M319 HydrophobicContact CB-CE 4.37Å; E167-M319 HydrophobicContact CB-SD 4.42Å; L315-M319 HydrophobicContact CB-CE 4.47Å; L315-M319 HydrophobicContact CD1-CE 4Å; L315-M319 WeakPolarHBondContact O-CB 3.41Å; L315-M319 VanDerWaalsContact O-CG 3.29Å; L315-M319 WeakPolarHBondContact O-CG 3.48Å; L315-M319 PolarHBondContact O-N 3.28Å; M319-G321 PolarHBondContact O-N 3.19Å
320	G	89.7	Confident	92.2	Very high	15 Å²	15	23.3 Å²	23.3	16%	0.155	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-2.4	168.8	0	0	0	0	0	113.7	D316 Y317 I318 K561	D316-G320 WeakPolarHBondContact O-CA 3.15Å; D316-G320 PolarHBondContact O-N 3.48Å; Y317-G320 CarbonylContact O-C 3.55Å; Y317-G320 WeakPolarHBondContact O-CA 3.47Å; Y317-G320 PolarHBondContact O-N 3.44Å; I318-G320 PolarHBondContact O-N 3.4Å; G320-K561 WeakPolarHBondContact CA-O 3.48Å; G320-K561 WeakPolarHBondContact O-CB 3.29Å
321	G	90.6	Very high	93	Very high	38 Å²	38	16.3 Å²	16.3	39%	0.392	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	14.8	179.1	0	0	0	0	0	114.5	Y317 I318 M319 Q323	Y317-G321 PolarHBondContact O-N 2.97Å; I318-G321 PolarHBondContact O-N 3.3Å; M319-G321 PolarHBondContact O-N 3.19Å; G321-Q323 PolarHBondContact O-N 3.34Å
322	C	93.7	Very high	93.7	Very high	4 Å²	4	13.4 Å²	13.4	3%	0.027	8%	0.083	C	C	.	.			trans	-66	124.8	165.9	-173.8	0	0	0	0	109.1	Y317 A451 S452	Y317-C322 WeakPolarHBondContact O-CB 3.5Å; Y317-C322 PolarHBondContact O-N 3.36Å; C322-A451 WeakPolarHBondContact CA-O 3.21Å; C322-A451 WeakPolarHBondContact CB-O 3.03Å; C322-S452 CarbonylContact C-O 3.57Å; C322-S452 WeakPolarHBondContact CA-O 3.38Å
323	Q	92.4	Very high	94.2	Very high	56 Å²	56	12 Å²	12	26%	0.262	8%	0.076	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	145.6	177.9	-56.5	-171	-1.3	0	0	110.3	G321 S372 S452 Q453 Y454	G321-Q323 PolarHBondContact O-N 3.34Å; Q323-S372 VanDerWaalsContact CD-OG 3.24Å; Q323-S372 VanDerWaalsContact NE2-CB 3.33Å; Q323-S372 PolarHBondContact NE2-OG 3.29Å; Q323-S372 PolarHBondContact OE1-OG 3.32Å; Q323-S372 VanDerWaalsContact OE1-OG 3.07Å; Q323-S452 PolarHBondContact N-O 3.33Å; Q323-Q453 CarbonylContact O-C 3.46Å; Q323-Q453 WeakPolarHBondContact O-CA 3.39Å; Q323-Y454 PolarHBondContact O-N 3.35Å
324	I	93	Very high	94.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	108.4	173.7	-60.4	-57.4	0	0	0	108.2	F314 I318 F326 Y370 Y454 I456	F314-I324 HydrophobicContact CE2-CD1 4.49Å; I318-I324 HydrophobicContact CD1-CD1 3.93Å; I318-I324 HydrophobicContact CD1-CG1 3.82Å; I324-F326 PolarHBondContact O-N 2.83Å; I324-Y370 PolarHBondContact N-O 2.72Å; I324-Y454 CarbonylContact C-O 3.52Å; I324-Y454 WeakPolarHBondContact CA-O 3.35Å; I324-I456 HydrophobicContact CG2-CD1 3.31Å; I324-I456 HydrophobicContact CG2-CG1 3.81Å
325	Q	95.1	Very high	94.5	Very high	15 Å²	15	16.6 Å²	16.6	7%	0.07	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	108	179.4	-150.8	59.2	14.2	0	0	111	D371 Y454 F455 I456	Q325-D371 PolarHBondContact NE2-OD2 3.38Å; Q325-D371 PolarHBondContact OE1-OD2 2.84Å; Q325-Y454 PolarHBondContact N-O 3Å; Q325-F455 HydrophobicContact CB-CD1 3.88Å; Q325-F455 HydrophobicContact CB-CE1 4.05Å; Q325-F455 HydrophobicContact CB-CG 4.44Å; Q325-F455 HydrophobicContact CG-CD1 4.37Å; Q325-F455 HydrophobicContact CG-CE1 4.26Å; Q325-F455 WeakPolarHBondContact O-CA 3.2Å; Q325-I456 PolarHBondContact O-N 3.43Å
326	F	95.7	Very high	94.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114.2	-172.6	-174.9	-112.9	0	0	0	111.3	I324 V328 V363 C367 F376 I409 I456 L458	I324-F326 PolarHBondContact O-N 2.83Å; F326-V328 HydrophobicContact CD1-CG2 4.06Å; F326-V328 HydrophobicContact CE1-CG2 3.49Å; F326-V328 VanDerWaalsContact CE1-CG2 3.49Å; F326-V328 HydrophobicContact CZ-CG2 4.04Å; F326-V363 HydrophobicContact CE2-CG1 3.94Å; F326-V363 HydrophobicContact CZ-CG1 3.87Å; F326-C367 HydrophobicContact CB-CB 4.09Å; F326-C367 HydrophobicContact CD1-CB 4.18Å; F326-C367 HydrophobicContact CD2-CB 3.83Å; F326-C367 HydrophobicContact CE2-CB 4.25Å; F326-C367 HydrophobicContact CG-CB 3.78Å; F326-F376 HydrophobicContact CB-CD1 3.79Å; F326-F376 HydrophobicContact CB-CE1 3.93Å; F326-F376 HydrophobicContact CD1-CD1 4.04Å; F326-F376 HydrophobicContact CD1-CE1 4.41Å; F326-F376 HydrophobicContact CD1-CG 4.4Å; F326-F376 HydrophobicContact CG-CD1 4.43Å; F326-F376 WeakPolarHBondContact O-CD1 3.42Å; F326-I409 HydrophobicContact CD1-CD1 4.18Å; F326-I409 HydrophobicContact CE1-CD1 3.99Å; F326-I456 HydrophobicContact CD2-CB 4.14Å; F326-I456 HydrophobicContact CD2-CG2 3.93Å; F326-I456 HydrophobicContact CE2-CG2 4.15Å; F326-L458 HydrophobicContact CE2-CB 3.77Å; F326-L458 HydrophobicContact CE2-CD2 4.33Å; F326-L458 HydrophobicContact CZ-CB 3.81Å; F326-L458 HydrophobicContact CZ-CD2 3.64Å; F326-L458 HydrophobicContact CZ-CG 4.36Å
327	T	97.8	Very high	95	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.043	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.5	176.3	-61.6	0	0	0	0	110	P377 F379 V438 I456 L457 L458	T327-P377 WeakPolarHBondContact CA-O 3.31Å; T327-P377 HydrophobicContact CG2-CB 4.16Å; T327-F379 HydrophobicContact CG2-CD2 3.66Å; T327-F379 HydrophobicContact CG2-CE2 3.74Å; T327-V438 HydrophobicContact CG2-CG2 3.76Å; T327-I456 PolarHBondContact N-O 2.85Å; T327-L457 HydrophobicContact CG2-CD1 3.99Å; T327-L457 WeakPolarHBondContact O-CA 3.27Å; T327-L458 PolarHBondContact O-N 3.43Å
328	V	98.2	Very high	95	Very high	0 Å²	0	19 Å²	19	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.7	178.6	-179.8	0	0	0	0	109.8	F326 I330 L360 P377 A378 F379 V412 L458	F326-V328 HydrophobicContact CD1-CG2 4.06Å; F326-V328 HydrophobicContact CE1-CG2 3.49Å; F326-V328 VanDerWaalsContact CE1-CG2 3.49Å; F326-V328 HydrophobicContact CZ-CG2 4.04Å; V328-I330 HydrophobicContact CG1-CD1 4.19Å; V328-I330 HydrophobicContact CG1-CG1 3.8Å; V328-L360 HydrophobicContact CB-CD1 4.35Å; V328-L360 HydrophobicContact CG1-CD1 3.69Å; V328-L360 HydrophobicContact CG2-CD1 3.77Å; V328-P377 PolarHBondContact N-O 2.84Å; V328-A378 WeakPolarHBondContact O-CA 3.45Å; V328-F379 PolarHBondContact O-N 2.9Å; V328-V412 HydrophobicContact CB-CG1 4.41Å; V328-V412 HydrophobicContact CG1-CG1 4.4Å; V328-V412 HydrophobicContact CG2-CG1 4.45Å; V328-L458 CarbonylContact C-O 3.56Å
329	A	98.4	Very high	95.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.3	172.7	0	0	0	0	0	110	F379 F381 I434 L457 L458 I459 L460	A329-F379 CarbonylContact C-O 3.57Å; A329-F379 VanDerWaalsContact CA-O 3.31Å; A329-F379 WeakPolarHBondContact CA-O 3.34Å; A329-F381 HydrophobicContact CB-CD1 4.26Å; A329-F381 HydrophobicContact CB-CE1 4.19Å; A329-I434 HydrophobicContact CB-CG1 3.65Å; A329-I434 HydrophobicContact CB-CG2 4.29Å; A329-L457 HydrophobicContact CB-CD1 3.86Å; A329-L458 PolarHBondContact N-O 2.83Å; A329-I459 HydrophobicContact CB-CG1 4.28Å; A329-I459 WeakPolarHBondContact O-CA 3.39Å; A329-L460 PolarHBondContact O-N 3.44Å
330	I	98.5	Very high	95.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.8	-175	-52.6	178.8	0	0	0	109.6	V328 F332 Y356 F379 G380 F381 I397 Y416	V328-I330 HydrophobicContact CG1-CD1 4.19Å; V328-I330 HydrophobicContact CG1-CG1 3.8Å; I330-F332 HydrophobicContact CB-CD2 4.36Å; I330-F332 HydrophobicContact CB-CE2 3.76Å; I330-F332 HydrophobicContact CB-CZ 4.28Å; I330-F332 HydrophobicContact CG2-CD2 4.34Å; I330-F332 HydrophobicContact CG2-CE2 3.88Å; I330-F332 HydrophobicContact CG2-CZ 4.03Å; I330-F332 WeakPolarHBondContact O-CD2 3.28Å; I330-F332 PolarHBondContact O-N 2.65Å; I330-Y356 HydrophobicContact CG2-CD1 3.87Å; I330-Y356 HydrophobicContact CG2-CE1 4.11Å; I330-F379 PolarHBondContact N-O 2.81Å; I330-G380 CarbonylContact O-C 3.59Å; I330-G380 VanDerWaalsContact O-CA 3.24Å; I330-G380 WeakPolarHBondContact O-CA 3.32Å; I330-F381 VanDerWaalsContact C-CE1 3.43Å; I330-F381 WeakPolarHBondContact O-CD1 3.38Å; I330-F381 PolarHBondContact O-N 2.94Å; I330-I397 HydrophobicContact CD1-CD1 4.3Å; I330-Y416 HydrophobicContact CD1-CD2 3.57Å; I330-Y416 HydrophobicContact CD1-CE2 4.3Å; I330-Y416 HydrophobicContact CD1-CG 4.17Å; I330-Y416 HydrophobicContact CG2-CD2 4.08Å; I330-Y416 HydrophobicContact CG2-CE2 3.86Å
331	D	97.8	Very high	95.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.5	172.2	-170.5	-14.9	0	0	0	110.4	T333 H346 Y356 F381 L460 T461 D462	D331-T333 WeakPolarHBondContact OD1-CB 3.11Å; D331-T333 WeakPolarHBondContact OD1-CG2 3.31Å; D331-T333 PolarHBondContact OD1-N 2.93Å; D331-T333 PolarHBondContact OD1-OG1 2.98Å; D331-T333 PolarHBondContact OD2-OG1 3.07Å; D331-H346 PolarHBondContact O-CE1 3.34Å; D331-H346 PolarHBondContact O-NE2 3.2Å; D331-Y356 HydrophobicContact CB-CE1 4.36Å; D331-F381 VanDerWaalsContact CA-CZ 3.5Å; D331-F381 HydrophobicContact CB-CD2 4.48Å; D331-F381 HydrophobicContact CB-CE1 4.07Å; D331-F381 HydrophobicContact CB-CE2 3.66Å; D331-F381 HydrophobicContact CB-CZ 3.43Å; D331-F381 VanDerWaalsContact CB-CZ 3.43Å; D331-F381 VanDerWaalsContact N-CE1 3.31Å; D331-L460 WeakPolarHBondContact CB-O 3.36Å; D331-L460 PolarHBondContact N-O 3.03Å; D331-T461 WeakPolarHBondContact OD2-CA 3.42Å; D331-T461 WeakPolarHBondContact OD2-CB 3.37Å; D331-T461 PolarHBondContact OD2-OG1 2.84Å; D331-D462 PolarHBondContact OD2-N 2.66Å
332	F	97.9	Very high	95.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.			trans	-123.4	31.5	173.3	-69.6	-84.4	0	0	0	111.1	I330 H346 F381 A383 F395 I397 Y416 L420 L423 L425 Y426	I330-F332 HydrophobicContact CB-CD2 4.36Å; I330-F332 HydrophobicContact CB-CE2 3.76Å; I330-F332 HydrophobicContact CB-CZ 4.28Å; I330-F332 HydrophobicContact CG2-CD2 4.34Å; I330-F332 HydrophobicContact CG2-CE2 3.88Å; I330-F332 HydrophobicContact CG2-CZ 4.03Å; I330-F332 WeakPolarHBondContact O-CD2 3.28Å; I330-F332 PolarHBondContact O-N 2.65Å; F332-H346 AromaticContact CD1-CE1 4Å; F332-F381 PolarHBondContact N-O 3.24Å; F332-A383 HydrophobicContact CB-CB 3.69Å; F332-F395 HydrophobicContact CD2-CE1 4.49Å; F332-F395 AromaticContact CD2-CZ 3.8Å; F332-F395 HydrophobicContact CD2-CZ 3.8Å; F332-F395 HydrophobicContact CE2-CZ 4.17Å; F332-F395 HydrophobicContact CG-CZ 4.44Å; F332-I397 HydrophobicContact CE2-CG2 3.96Å; F332-I397 HydrophobicContact CZ-CG2 4.43Å; F332-Y416 HydrophobicContact CE1-CD2 4.08Å; F332-Y416 AromaticContact CE1-CE2 3.99Å; F332-Y416 HydrophobicContact CE1-CE2 3.99Å; F332-Y416 AromaticContact CZ-CD2 3.75Å; F332-Y416 HydrophobicContact CZ-CD2 3.75Å; F332-Y416 HydrophobicContact CZ-CE2 4.06Å; F332-L420 HydrophobicContact CD1-CD1 3.79Å; F332-L420 HydrophobicContact CE1-CB 4.35Å; F332-L420 HydrophobicContact CE1-CD1 3.68Å; F332-L423 HydrophobicContact CB-CD1 4.31Å; F332-L423 HydrophobicContact CD1-CD1 3.53Å; F332-L423 HydrophobicContact CD2-CD1 4.07Å; F332-L423 HydrophobicContact CE1-CD1 3.67Å; F332-L423 HydrophobicContact CE2-CD1 4.19Å; F332-L423 HydrophobicContact CG-CD1 3.73Å; F332-L423 HydrophobicContact CZ-CD1 4Å; F332-L425 HydrophobicContact CB-CD2 3.81Å; F332-L425 HydrophobicContact CD1-CD2 4.02Å; F332-L425 HydrophobicContact CG-CD2 4.43Å; F332-L425 WeakPolarHBondContact O-CA 3.49Å; F332-L425 WeakPolarHBondContact O-CB 3.29Å; F332-L425 WeakPolarHBondContact O-CD2 3.4Å; F332-Y426 PolarHBondContact O-N 3.13Å
333	T	97.1	Very high	95.7	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-73.1	157.3	175.7	58.4	0	0	0	0	112.2	D331 S335 N336 Y426 T429	D331-T333 WeakPolarHBondContact OD1-CB 3.11Å; D331-T333 WeakPolarHBondContact OD1-CG2 3.31Å; D331-T333 PolarHBondContact OD1-N 2.93Å; D331-T333 PolarHBondContact OD1-OG1 2.98Å; D331-T333 PolarHBondContact OD2-OG1 3.07Å; T333-S335 PolarHBondContact O-N 3.43Å; T333-S335 PolarHBondContact OG1-OG 3.22Å; T333-N336 WeakPolarHBondContact O-CB 3.27Å; T333-N336 PolarHBondContact O-N 2.84Å; T333-N336 PolarHBondContact O-ND2 3.13Å; T333-N336 VanDerWaalsContact O-ND2 3.09Å; T333-N336 PolarHBondContact OG1-ND2 3.09Å; T333-Y426 CarbonylContact C-O 3.6Å; T333-Y426 WeakPolarHBondContact CA-O 3.4Å; T333-Y426 WeakPolarHBondContact CB-O 3.42Å; T333-T429 HydrophobicContact CG2-CG2 4.45Å
334	A	95.8	Very high	95.9	Very high	57 Å²	57	37.7 Å²	37.7	47%	0.471	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-67.4	-17.1	-176.2	0	0	0	0	0	113.5	N336 G337 L425 Y426	A334-N336 PolarHBondContact O-N 2.95Å; A334-G337 PolarHBondContact O-N 2.97Å; A334-L425 HydrophobicContact CB-CB 4.44Å; A334-Y426 PolarHBondContact N-O 3.36Å
335	S	94.9	Very high	96.1	Very high	74 Å²	74	39.8 Å²	39.8	52%	0.517	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-57.3	-29.5	172.4	39.9	0	0	0	0	112.3	T333 G337 D462	T333-S335 PolarHBondContact O-N 3.43Å; T333-S335 PolarHBondContact OG1-OG 3.22Å; S335-G337 PolarHBondContact O-N 3.11Å; S335-G337 VanDerWaalsContact O-N 3.16Å; S335-D462 VanDerWaalsContact CB-OD2 3.26Å; S335-D462 WeakPolarHBondContact CB-OD2 3.39Å; S335-D462 PolarHBondContact OG-OD1 2.79Å; S335-D462 PolarHBondContact OG-OD2 3.33Å
336	N	96	Very high	96.2	Very high	3 Å²	3	39 Å²	39	2%	0.016	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-67	-14.6	177.4	-70.8	-82	0	0	0	113.9	T333 A334 S344 L345 H346 Y356 L425 D462	T333-N336 WeakPolarHBondContact O-CB 3.27Å; T333-N336 PolarHBondContact O-N 2.84Å; T333-N336 PolarHBondContact O-ND2 3.13Å; T333-N336 VanDerWaalsContact O-ND2 3.09Å; T333-N336 PolarHBondContact OG1-ND2 3.09Å; A334-N336 PolarHBondContact O-N 2.95Å; N336-S344 VanDerWaalsContact O-CA 3.27Å; N336-S344 WeakPolarHBondContact O-CA 3.37Å; N336-S344 WeakPolarHBondContact O-CB 3.16Å; N336-S344 PolarHBondContact O-OG 3.38Å; N336-L345 HydrophobicContact CB-CB 4.37Å; N336-L345 PolarHBondContact O-N 3.24Å; N336-H346 WeakPolarHBondContact CB-CD2 3.41Å; N336-Y356 VanDerWaalsContact OD1-CE2 3.25Å; N336-Y356 WeakPolarHBondContact OD1-CE2 3.36Å; N336-Y356 PolarHBondContact OD1-OH 3.09Å; N336-L425 HydrophobicContact CB-CD1 4.41Å; N336-D462 WeakPolarHBondContact CA-OD2 3.27Å; N336-D462 PolarHBondContact N-OD2 3.24Å; N336-D462 VanDerWaalsContact N-OD2 3.13Å; N336-D462 PolarHBondContact ND2-OD1 3.03Å; N336-D462 VanDerWaalsContact OD1-CB 3.27Å; N336-D462 WeakPolarHBondContact OD1-CB 3.36Å; N336-D462 PolarHBondContact OD1-OD2 2.88Å
337	G	95.2	Very high	96.3	Very high	29 Å²	29	42.3 Å²	42.3	30%	0.299	24%	0.244	S	C	.	.			trans	75.2	163	-177.3	0	0	0	0	0	113.9	A334 S335 P339 S344 L425	A334-G337 PolarHBondContact O-N 2.97Å; S335-G337 PolarHBondContact O-N 3.11Å; S335-G337 VanDerWaalsContact O-N 3.16Å; G337-P339 WeakPolarHBondContact O-CD 3.16Å; G337-S344 PolarHBondContact O-OG 2.9Å; G337-L425 VanDerWaalsContact O-CD1 3.24Å; G337-L425 WeakPolarHBondContact O-CD1 3.33Å
338	D	94.9	Very high	96.1	Very high	73 Å²	73	45.2 Å²	45.2	39%	0.39	26%	0.258	S	S	.	.			trans	-57.7	119.3	-178.1	-173.8	-28.2	0	0	0	111.6	R340 N341 S344	D338-R340 PolarHBondContact O-N 3.13Å; D338-R340 VanDerWaalsContact OD1-CB 3.32Å; D338-R340 WeakPolarHBondContact OD1-CB 3.2Å; D338-R340 WeakPolarHBondContact OD1-CG 3.4Å; D338-R340 IonicContact OD1-CZ 2.65Å; D338-R340 PolarHBondContact OD1-N 2.85Å; D338-R340 IonicContact OD1-NE 3.67Å; D338-R340 PolarHBondContact OD1-NE 2.9Å; D338-R340 IonicContact OD1-NH2 3.61Å; D338-R340 IonicContact OD2-CZ 3.78Å; D338-R340 IonicContact OD2-NE 2.94Å; D338-R340 PolarHBondContact OD2-NE 2.88Å; D338-R340 IonicContact OD2-NH2 3.96Å; D338-R340 PolarHBondContact OD2-NH2 3.18Å; D338-N341 WeakPolarHBondContact O-CB 3.49Å; D338-N341 PolarHBondContact O-N 3.24Å; D338-S344 WeakPolarHBondContact O-CB 3.46Å
339	P	95.4	Very high	95.8	Very high	31 Å²	31	48.8 Å²	48.8	20%	0.201	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-16	-177.1	-26.7	36	0	0	0	115.2	G337 N341 H346 Y347 L420 L425	G337-P339 WeakPolarHBondContact O-CD 3.16Å; P339-N341 VanDerWaalsContact C-N 3.32Å; P339-H346 HydrophobicContact CB-CB 4.16Å; P339-H346 HydrophobicContact CG-CB 4.09Å; P339-Y347 WeakPolarHBondContact O-CD2 3.21Å; P339-L420 HydrophobicContact CB-CD1 4.15Å; P339-L420 HydrophobicContact CB-CD2 3.97Å; P339-L420 HydrophobicContact CB-CG 3.99Å; P339-L420 HydrophobicContact CG-CD1 3.68Å; P339-L420 HydrophobicContact CG-CD2 4.43Å; P339-L420 HydrophobicContact CG-CG 4.02Å; P339-L425 HydrophobicContact CG-CD1 3.85Å; P339-L425 HydrophobicContact CG-CG 4.31Å
340	R	93.3	Very high	95.4	Very high	208 Å²	208	53.4 Å²	53.4	79%	0.785	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-17.7	175.6	-60.2	171.5	-67.9	-174.4	1.2	112.6	D338	D338-R340 PolarHBondContact O-N 3.13Å; D338-R340 VanDerWaalsContact OD1-CB 3.32Å; D338-R340 WeakPolarHBondContact OD1-CB 3.2Å; D338-R340 WeakPolarHBondContact OD1-CG 3.4Å; D338-R340 IonicContact OD1-CZ 2.65Å; D338-R340 PolarHBondContact OD1-N 2.85Å; D338-R340 IonicContact OD1-NE 3.67Å; D338-R340 PolarHBondContact OD1-NE 2.9Å; D338-R340 IonicContact OD1-NH2 3.61Å; D338-R340 IonicContact OD2-CZ 3.78Å; D338-R340 IonicContact OD2-NE 2.94Å; D338-R340 PolarHBondContact OD2-NE 2.88Å; D338-R340 IonicContact OD2-NH2 3.96Å; D338-R340 PolarHBondContact OD2-NH2 3.18Å
341	N	94.9	Very high	95	Very high	83 Å²	83	62.8 Å²	62.8	44%	0.444	34%	0.341	S	S	.	.	S	Bend	trans	-88.9	133.8	178.3	-172.6	-15.4	0	0	0	110.2	D338 P339 C343 S344 Y347	D338-N341 WeakPolarHBondContact O-CB 3.49Å; D338-N341 PolarHBondContact O-N 3.24Å; P339-N341 VanDerWaalsContact C-N 3.32Å; N341-C343 PolarHBondContact O-N 3.38Å; N341-C343 VanDerWaalsContact O-N 3.13Å; N341-C343 PolarHBondContact OD1-N 2.62Å; N341-C343 VanDerWaalsContact OD1-N 3.07Å; N341-S344 VanDerWaalsContact O-CB 3.31Å; N341-S344 WeakPolarHBondContact O-CB 3.41Å; N341-S344 PolarHBondContact O-N 3.46Å; N341-Y347 WeakPolarHBondContact O-CB 3.41Å; N341-Y347 VanDerWaalsContact O-CD2 3.28Å; N341-Y347 WeakPolarHBondContact O-CD2 3.43Å
342	S	94.1	Very high	94.7	Very high	86 Å²	86	68.8 Å²	68.8	60%	0.601	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.2	177.6	55.2	0	0	0	0	114.4
343	C	93.4	Very high	94.4	Very high	110 Å²	110	72 Å²	72	74%	0.743	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.7	174	-61.9	0	0	0	0	114.1	N341	N341-C343 PolarHBondContact O-N 3.38Å; N341-C343 VanDerWaalsContact O-N 3.13Å; N341-C343 PolarHBondContact OD1-N 2.62Å; N341-C343 VanDerWaalsContact OD1-N 3.07Å
344	S	96.7	Very high	94.4	Very high	12 Å²	12	72.8 Å²	72.8	8%	0.084	39%	0.394	C	S	.	.	S	Bend	trans	-70.4	144	178.7	171.4	0	0	0	0	111.5	N336 G337 D338 N341 H346 Y347	N336-S344 VanDerWaalsContact O-CA 3.27Å; N336-S344 WeakPolarHBondContact O-CA 3.37Å; N336-S344 WeakPolarHBondContact O-CB 3.16Å; N336-S344 PolarHBondContact O-OG 3.38Å; G337-S344 PolarHBondContact O-OG 2.9Å; D338-S344 WeakPolarHBondContact O-CB 3.46Å; N341-S344 VanDerWaalsContact O-CB 3.31Å; N341-S344 WeakPolarHBondContact O-CB 3.41Å; N341-S344 PolarHBondContact O-N 3.46Å; S344-H346 PolarHBondContact O-N 2.62Å; S344-H346 PolarHBondContact OG-N 3.16Å; S344-Y347 VanDerWaalsContact O-CB 3.28Å; S344-Y347 WeakPolarHBondContact O-CB 3.17Å; S344-Y347 PolarHBondContact O-N 2.91Å; S344-Y347 VanDerWaalsContact O-N 3.15Å
345	L	96.6	Very high	94.4	Very high	43 Å²	43	71.4 Å²	71.4	23%	0.225	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-21.5	172.7	-63.1	174.7	0	0	0	112.1	N336 N354 Y356 D462 V490	N336-L345 HydrophobicContact CB-CB 4.37Å; N336-L345 PolarHBondContact O-N 3.24Å; L345-N354 WeakPolarHBondContact O-CB 3.07Å; L345-Y356 HydrophobicContact CB-CE2 3.93Å; L345-D462 HydrophobicContact CD1-CB 3.35Å; L345-V490 HydrophobicContact CD1-CG1 4.38Å; L345-V490 HydrophobicContact CD2-CG1 4.43Å
346	H	97.5	Very high	94.5	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.7	173.3	-77.2	-58.8	0	0	0	114.2	D331 F332 N336 P339 S344 I348 N354 Y356 Y416 L420	D331-H346 PolarHBondContact O-CE1 3.34Å; D331-H346 PolarHBondContact O-NE2 3.2Å; F332-H346 AromaticContact CD1-CE1 4Å; N336-H346 WeakPolarHBondContact CB-CD2 3.41Å; P339-H346 HydrophobicContact CB-CB 4.16Å; P339-H346 HydrophobicContact CG-CB 4.09Å; S344-H346 PolarHBondContact O-N 2.62Å; S344-H346 PolarHBondContact OG-N 3.16Å; H346-I348 PolarHBondContact O-N 3.44Å; H346-I348 VanDerWaalsContact O-N 3.12Å; H346-N354 PolarHBondContact O-ND2 2.88Å; H346-Y356 AromaticContact CE1-CD2 3.96Å; H346-Y356 AromaticContact CE1-CE2 3.73Å; H346-Y356 AromaticContact CE1-CZ 3.92Å; H346-Y356 AromaticContact ND1-CD2 3.94Å; H346-Y416 AromaticContact CE1-CE2 3.96Å; H346-Y416 AromaticContact ND1-CE2 3.65Å; H346-Y416 AromaticContact ND1-CZ 3.64Å; H346-Y416 PolarHBondContact ND1-OH 2.65Å; H346-L420 HydrophobicContact CB-CD1 3.84Å; H346-L420 HydrophobicContact CB-CD2 3.97Å; H346-L420 WeakPolarHBondContact O-CD2 3.46Å
347	Y	97.2	Very high	94.5	Very high	69 Å²	69	68.4 Å²	68.4	27%	0.271	36%	0.356	S	S	.	.			trans	-57.2	121.7	-176.6	-176.5	-110.4	0	0	0	111.6	P339 N341 S344 H349 N354	P339-Y347 WeakPolarHBondContact O-CD2 3.21Å; N341-Y347 WeakPolarHBondContact O-CB 3.41Å; N341-Y347 VanDerWaalsContact O-CD2 3.28Å; N341-Y347 WeakPolarHBondContact O-CD2 3.43Å; S344-Y347 VanDerWaalsContact O-CB 3.28Å; S344-Y347 WeakPolarHBondContact O-CB 3.17Å; S344-Y347 PolarHBondContact O-N 2.91Å; S344-Y347 VanDerWaalsContact O-N 3.15Å; Y347-H349 HydrophobicContact CD1-CB 3.86Å; Y347-H349 HydrophobicContact CE1-CB 3.69Å; Y347-H349 AromaticContact CE1-CD2 3.87Å; Y347-H349 PolarHBondContact O-N 2.87Å; Y347-N354 PolarHBondContact O-ND2 2.87Å
348	I	94.3	Very high	94.5	Very high	67 Å²	67	71 Å²	71	34%	0.344	36%	0.359	S	S	.	.			trans	-87.9	91.5	177.2	-58.4	177.4	0	0	0	108.1	H346 Q417 L420	H346-I348 PolarHBondContact O-N 3.44Å; H346-I348 VanDerWaalsContact O-N 3.12Å; I348-Q417 HydrophobicContact CD1-CB 4.12Å; I348-Q417 HydrophobicContact CD1-CG 3.99Å; I348-L420 HydrophobicContact CD1-CD2 3.76Å; I348-L420 HydrophobicContact CG1-CD2 3.95Å
349	H	92.6	Very high	94.5	Very high	76 Å²	76	67.5 Å²	67.5	35%	0.352	34%	0.34	S	S	.	.			trans	-78.2	138.9	177.3	-177.2	-85.3	0	0	0	111	Y347 Y351 Q352	Y347-H349 HydrophobicContact CD1-CB 3.86Å; Y347-H349 HydrophobicContact CE1-CB 3.69Å; Y347-H349 AromaticContact CE1-CD2 3.87Å; Y347-H349 PolarHBondContact O-N 2.87Å; H349-Y351 AromaticContact CE1-CD2 3.69Å; H349-Y351 PolarHBondContact ND1-N 2.74Å; H349-Y351 PolarHBondContact O-N 2.84Å; H349-Y351 VanDerWaalsContact O-N 3.16Å; H349-Q352 WeakPolarHBondContact CB-O 3.35Å; H349-Q352 PolarHBondContact ND1-N 2.78Å; H349-Q352 VanDerWaalsContact ND1-N 3.17Å
350	P	89.8	Confident	94.5	Very high	97 Å²	97	66.1 Å²	66.1	63%	0.63	33%	0.331	S	S	*	.	S	Bend	trans	-65	-21	-174.3	22.7	-34	0	0	0	115.1
351	Y	89.9	Confident	94.6	Very high	198 Å²	198	58.5 Å²	58.5	78%	0.776	31%	0.308	S	S	*	.	S	Bend	trans	-121.3	-9.1	-175.9	-52.6	-72.8	0	0	0	114.8	H349	H349-Y351 AromaticContact CE1-CD2 3.69Å; H349-Y351 PolarHBondContact ND1-N 2.74Å; H349-Y351 PolarHBondContact O-N 2.84Å; H349-Y351 VanDerWaalsContact O-N 3.16Å
352	Q	90.4	Very high	94.5	Very high	126 Å²	126	54.9 Å²	54.9	59%	0.589	29%	0.29	S	S	*	.	S	Bend	trans	-142.2	126.6	-173.3	-69	-171.5	13.3	0	0	109.7	H349	H349-Q352 WeakPolarHBondContact CB-O 3.35Å; H349-Q352 PolarHBondContact ND1-N 2.78Å; H349-Q352 VanDerWaalsContact ND1-N 3.17Å
353	P	93.3	Very high	94.4	Very high	68 Å²	68	50.8 Å²	50.8	44%	0.442	26%	0.261	S	S	.	.			trans	-68.1	145.2	174.6	25.5	-30.3	0	0	0	110.6	L357 K358	P353-L357 HydrophobicContact CB-CB 3.75Å; P353-L357 HydrophobicContact CB-CD1 4.28Å; P353-K358 HydrophobicContact CB-CG 4.07Å; P353-K358 HydrophobicContact CG-CD 4.47Å; P353-K358 HydrophobicContact CG-CG 3.75Å; P353-K358 WeakPolarHBondContact O-CE 3.2Å
354	N	95.5	Very high	94.3	Very high	18 Å²	18	45.6 Å²	45.6	10%	0.096	23%	0.226	C	C	.	.			trans	-70.3	173.2	169.1	65.1	33.3	0	0	0	111.1	L345 H346 Y347 Y356 L357 K358 Y416	L345-N354 WeakPolarHBondContact O-CB 3.07Å; H346-N354 PolarHBondContact O-ND2 2.88Å; Y347-N354 PolarHBondContact O-ND2 2.87Å; N354-Y356 VanDerWaalsContact C-N 3.32Å; N354-Y356 PolarHBondContact O-N 2.94Å; N354-Y356 WeakPolarHBondContact OD1-CB 3.46Å; N354-Y356 PolarHBondContact OD1-N 2.96Å; N354-L357 PolarHBondContact O-N 2.95Å; N354-L357 WeakPolarHBondContact OD1-CB 3.18Å; N354-L357 WeakPolarHBondContact OD1-CG 3.24Å; N354-L357 PolarHBondContact OD1-N 3.26Å; N354-K358 WeakPolarHBondContact O-CG 3.11Å; N354-K358 PolarHBondContact O-N 2.84Å; N354-Y416 PolarHBondContact ND2-OH 3.04Å; N354-Y416 VanDerWaalsContact ND2-OH 3.09Å
355	E	95.8	Very high	94.1	Very high	28 Å²	28	48.8 Å²	48.8	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-35.6	-176.2	-65.2	-170.1	-176.3	0	0	112.3	K358 A359 V490 G491 F526 K530	E355-K358 PolarHBondContact O-N 3.42Å; E355-A359 WeakPolarHBondContact O-CB 3.24Å; E355-A359 PolarHBondContact O-N 3.2Å; E355-V490 HydrophobicContact CB-CG1 3.47Å; E355-V490 VanDerWaalsContact CB-CG1 3.47Å; E355-V490 HydrophobicContact CB-CG2 4.44Å; E355-V490 HydrophobicContact CG-CG1 4.41Å; E355-G491 PolarHBondContact OE2-N 3.4Å; E355-F526 HydrophobicContact CB-CD1 3.87Å; E355-F526 HydrophobicContact CB-CE1 3.88Å; E355-F526 HydrophobicContact CB-CG 4.39Å; E355-F526 HydrophobicContact CB-CZ 4.36Å; E355-F526 HydrophobicContact CG-CD1 3.73Å; E355-F526 HydrophobicContact CG-CE1 3.55Å; E355-F526 HydrophobicContact CG-CZ 4.38Å; E355-F526 WeakPolarHBondContact OE2-CD1 3.38Å; E355-K530 VanDerWaalsContact OE1-CE 3.22Å; E355-K530 WeakPolarHBondContact OE1-CE 3.4Å; E355-K530 IonicContact OE1-NZ 3.07Å; E355-K530 PolarHBondContact OE1-NZ 3.26Å
356	Y	97.3	Very high	93.8	Very high	2 Å²	2	47 Å²	47	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-52.1	173	-74.1	-85	0	0	0	112.2	I330 D331 N336 L345 H346 N354 K358 A359 L360 L460 D462 V490	I330-Y356 HydrophobicContact CG2-CD1 3.87Å; I330-Y356 HydrophobicContact CG2-CE1 4.11Å; D331-Y356 HydrophobicContact CB-CE1 4.36Å; N336-Y356 VanDerWaalsContact OD1-CE2 3.25Å; N336-Y356 WeakPolarHBondContact OD1-CE2 3.36Å; N336-Y356 PolarHBondContact OD1-OH 3.09Å; L345-Y356 HydrophobicContact CB-CE2 3.93Å; H346-Y356 AromaticContact CE1-CD2 3.96Å; H346-Y356 AromaticContact CE1-CE2 3.73Å; H346-Y356 AromaticContact CE1-CZ 3.92Å; H346-Y356 AromaticContact ND1-CD2 3.94Å; N354-Y356 VanDerWaalsContact C-N 3.32Å; N354-Y356 PolarHBondContact O-N 2.94Å; N354-Y356 WeakPolarHBondContact OD1-CB 3.46Å; N354-Y356 PolarHBondContact OD1-N 2.96Å; Y356-K358 VanDerWaalsContact C-N 3.32Å; Y356-K358 PolarHBondContact O-N 3.38Å; Y356-A359 PolarHBondContact O-N 3.33Å; Y356-L360 VanDerWaalsContact O-CB 3.26Å; Y356-L360 WeakPolarHBondContact O-CB 3.47Å; Y356-L360 PolarHBondContact O-N 3.45Å; Y356-L460 HydrophobicContact CD1-CB 3.55Å; Y356-L460 HydrophobicContact CD1-CD1 3.99Å; Y356-L460 HydrophobicContact CD1-CG 4.42Å; Y356-L460 HydrophobicContact CE1-CB 3.7Å; Y356-D462 PolarHBondContact OH-N 3.03Å; Y356-V490 HydrophobicContact CD1-CG2 4.27Å; Y356-V490 HydrophobicContact CD2-CG1 4.01Å; Y356-V490 HydrophobicContact CE1-CG2 4.23Å; Y356-V490 HydrophobicContact CE2-CB 4.28Å; Y356-V490 HydrophobicContact CE2-CG1 3.79Å; Y356-V490 HydrophobicContact CG-CG2 4.43Å
357	L	96.1	Very high	93.5	Very high	12 Å²	12	47 Å²	47	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-39.3	179	-75.6	174.7	0	0	0	111.9	P353 N354 V361 V413 Y416	P353-L357 HydrophobicContact CB-CB 3.75Å; P353-L357 HydrophobicContact CB-CD1 4.28Å; N354-L357 PolarHBondContact O-N 2.95Å; N354-L357 WeakPolarHBondContact OD1-CB 3.18Å; N354-L357 WeakPolarHBondContact OD1-CG 3.24Å; N354-L357 PolarHBondContact OD1-N 3.26Å; L357-V361 WeakPolarHBondContact O-CB 3.33Å; L357-V361 VanDerWaalsContact O-CG2 3.3Å; L357-V361 WeakPolarHBondContact O-CG2 3.12Å; L357-V361 PolarHBondContact O-N 3.38Å; L357-V413 HydrophobicContact CD2-CB 4.35Å; L357-V413 HydrophobicContact CD2-CG1 3.82Å; L357-V413 HydrophobicContact CD2-CG2 4.05Å; L357-Y416 HydrophobicContact CD1-CE1 4.23Å; L357-Y416 HydrophobicContact CD2-CD1 3.66Å; L357-Y416 HydrophobicContact CD2-CE1 3.87Å; L357-Y416 HydrophobicContact CG-CD1 4.14Å; L357-Y416 HydrophobicContact CG-CE1 3.8Å
358	K	95.4	Very high	93.2	Very high	83 Å²	83	46.1 Å²	46.1	36%	0.361	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-46.9	176.4	-74.2	173.8	179.4	166	0	111.6	P353 N354 E355 Y356 A362 F526	P353-K358 HydrophobicContact CB-CG 4.07Å; P353-K358 HydrophobicContact CG-CD 4.47Å; P353-K358 HydrophobicContact CG-CG 3.75Å; P353-K358 WeakPolarHBondContact O-CE 3.2Å; N354-K358 WeakPolarHBondContact O-CG 3.11Å; N354-K358 PolarHBondContact O-N 2.84Å; E355-K358 PolarHBondContact O-N 3.42Å; Y356-K358 VanDerWaalsContact C-N 3.32Å; Y356-K358 PolarHBondContact O-N 3.38Å; K358-A362 WeakPolarHBondContact O-CB 3.27Å; K358-A362 PolarHBondContact O-N 3.14Å; K358-F526 HydrophobicContact CB-CE2 3.79Å; K358-F526 HydrophobicContact CB-CZ 3.68Å; K358-F526 HydrophobicContact CD-CZ 3.82Å; K358-F526 HydrophobicContact CG-CZ 4.41Å
359	A	95.4	Very high	93.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.5	-46.8	177.9	0	0	0	0	0	111.6	E355 Y356 V361 A362 V363 L460 V488 F526 L537	E355-A359 WeakPolarHBondContact O-CB 3.24Å; E355-A359 PolarHBondContact O-N 3.2Å; Y356-A359 PolarHBondContact O-N 3.33Å; A359-V361 PolarHBondContact O-N 3.44Å; A359-A362 PolarHBondContact O-N 2.78Å; A359-V363 WeakPolarHBondContact O-CG2 3.4Å; A359-V363 PolarHBondContact O-N 3.34Å; A359-V363 VanDerWaalsContact O-N 3.09Å; A359-L460 HydrophobicContact CB-CD2 3.85Å; A359-V488 HydrophobicContact CB-CG1 4.03Å; A359-F526 HydrophobicContact CB-CD2 4.07Å; A359-F526 HydrophobicContact CB-CE2 4.29Å; A359-L537 HydrophobicContact CB-CD2 4.29Å
360	L	95.3	Very high	93	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-55.9	-51.1	178.8	178.7	62.9	0	0	0	112.1	V328 Y356 G364 I409 V412 V413 L460	V328-L360 HydrophobicContact CB-CD1 4.35Å; V328-L360 HydrophobicContact CG1-CD1 3.69Å; V328-L360 HydrophobicContact CG2-CD1 3.77Å; Y356-L360 VanDerWaalsContact O-CB 3.26Å; Y356-L360 WeakPolarHBondContact O-CB 3.47Å; Y356-L360 PolarHBondContact O-N 3.45Å; L360-G364 WeakPolarHBondContact O-CA 3.43Å; L360-G364 PolarHBondContact O-N 3.38Å; L360-I409 HydrophobicContact CG-CG2 4.49Å; L360-V412 HydrophobicContact CD1-CG1 3.99Å; L360-V412 HydrophobicContact CD2-CB 4.38Å; L360-V412 HydrophobicContact CD2-CG1 3.84Å; L360-V412 HydrophobicContact CG-CG1 4.5Å; L360-V413 HydrophobicContact CD2-CG2 3.75Å; L360-V413 HydrophobicContact CG-CG2 4.47Å; L360-L460 HydrophobicContact CB-CD1 4.24Å
361	V	94.4	Very high	93	Very high	49 Å²	49	35.7 Å²	35.7	30%	0.297	17%	0.17	S	C	.	.	H	α-helix	trans	-66.8	-44.5	-179.7	172.6	0	0	0	0	110.8	L357 A359 V363 E365 I409 V413	L357-V361 WeakPolarHBondContact O-CB 3.33Å; L357-V361 VanDerWaalsContact O-CG2 3.3Å; L357-V361 WeakPolarHBondContact O-CG2 3.12Å; L357-V361 PolarHBondContact O-N 3.38Å; A359-V361 PolarHBondContact O-N 3.44Å; V361-V363 PolarHBondContact O-N 2.93Å; V361-E365 HydrophobicContact CG1-CG 4.04Å; V361-E365 VanDerWaalsContact O-CB 3.29Å; V361-E365 WeakPolarHBondContact O-CB 3.49Å; V361-E365 VanDerWaalsContact O-CG 3.32Å; V361-E365 WeakPolarHBondContact O-CG 3.5Å; V361-E365 PolarHBondContact O-N 2.91Å; V361-I409 HydrophobicContact CG2-CG2 4.47Å; V361-V413 HydrophobicContact CG2-CG2 3.99Å
362	A	92.8	Very high	92.7	Very high	7 Å²	7	30.1 Å²	30.1	6%	0.058	16%	0.16	C	C	.	.	H	α-helix	trans	-59.2	-44.4	-177.4	0	0	0	0	0	112.8	K358 A359 I366 P534 L537	K358-A362 WeakPolarHBondContact O-CB 3.27Å; K358-A362 PolarHBondContact O-N 3.14Å; A359-A362 PolarHBondContact O-N 2.78Å; A362-I366 WeakPolarHBondContact O-CD1 3.42Å; A362-P534 HydrophobicContact CB-CB 4.03Å; A362-L537 HydrophobicContact CB-CD2 4.09Å
363	V	92.3	Very high	92.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-81.5	-47	-178.4	-178.8	0	0	0	0	110.7	F326 A359 V361 E365 I366 C367 L458 V541 L542	F326-V363 HydrophobicContact CE2-CG1 3.94Å; F326-V363 HydrophobicContact CZ-CG1 3.87Å; A359-V363 WeakPolarHBondContact O-CG2 3.4Å; A359-V363 PolarHBondContact O-N 3.34Å; A359-V363 VanDerWaalsContact O-N 3.09Å; V361-V363 PolarHBondContact O-N 2.93Å; V363-E365 VanDerWaalsContact C-N 3.3Å; V363-E365 PolarHBondContact O-N 2.85Å; V363-I366 PolarHBondContact O-N 3.39Å; V363-C367 PolarHBondContact O-N 3.03Å; V363-L458 HydrophobicContact CB-CD2 4.13Å; V363-L458 HydrophobicContact CG1-CD2 4.19Å; V363-L458 HydrophobicContact CG2-CD2 4.47Å; V363-V541 HydrophobicContact CG1-CG1 4.2Å; V363-V541 HydrophobicContact CG2-CB 4.11Å; V363-V541 HydrophobicContact CG2-CG1 3.61Å; V363-V541 HydrophobicContact CG2-CG2 4.35Å; V363-L542 HydrophobicContact CG1-CD1 4.5Å; V363-L542 HydrophobicContact CG1-CD2 4.07Å; V363-L542 HydrophobicContact CG1-CG 4.37Å
364	G	92.6	Very high	92.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.3	-36.5	-175.6	0	0	0	0	0	113.2	L360 I366 C367 Q368 I409	L360-G364 WeakPolarHBondContact O-CA 3.43Å; L360-G364 PolarHBondContact O-N 3.38Å; G364-I366 PolarHBondContact O-N 3.11Å; G364-I366 VanDerWaalsContact O-N 3.16Å; G364-C367 PolarHBondContact O-N 2.86Å; G364-Q368 WeakPolarHBondContact O-CG 3.35Å; G364-Q368 PolarHBondContact O-N 2.95Å; G364-Q368 VanDerWaalsContact O-N 3.08Å; G364-I409 WeakPolarHBondContact O-CG1 3.31Å
365	E	91.5	Very high	92.7	Very high	79 Å²	79	29.6 Å²	29.6	37%	0.369	15%	0.153	S	C	.	.	H	α-helix	trans	-60.5	-25.5	-179.3	-84.2	-167.7	167.8	0	0	113.2	V106 V361 V363 Q368	V106-E365 HydrophobicContact CG2-CB 4.25Å; V361-E365 HydrophobicContact CG1-CG 4.04Å; V361-E365 VanDerWaalsContact O-CB 3.29Å; V361-E365 WeakPolarHBondContact O-CB 3.49Å; V361-E365 VanDerWaalsContact O-CG 3.32Å; V361-E365 WeakPolarHBondContact O-CG 3.5Å; V361-E365 PolarHBondContact O-N 2.91Å; V363-E365 VanDerWaalsContact C-N 3.3Å; V363-E365 PolarHBondContact O-N 2.85Å; E365-Q368 VanDerWaalsContact O-CG 3.26Å; E365-Q368 WeakPolarHBondContact O-CG 3.43Å; E365-Q368 PolarHBondContact O-NE2 2.96Å; E365-Q368 VanDerWaalsContact O-NE2 3.09Å
366	I	91.6	Very high	92.7	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.036	15%	0.147	C	C	.	.	H	α-helix	trans	-86.9	-51.4	177.1	-66.6	155.1	0	0	0	110.3	F103 E104 V106 A362 V363 G364 Q368 D369 Y370 A538 L542	F103-I366 WeakPolarHBondContact O-CG2 3.4Å; E104-I366 WeakPolarHBondContact O-CD1 3.42Å; V106-I366 HydrophobicContact CG2-CB 4.47Å; V106-I366 HydrophobicContact CG2-CG1 3.49Å; V106-I366 VanDerWaalsContact CG2-CG1 3.49Å; A362-I366 WeakPolarHBondContact O-CD1 3.42Å; V363-I366 PolarHBondContact O-N 3.39Å; G364-I366 PolarHBondContact O-N 3.11Å; G364-I366 VanDerWaalsContact O-N 3.16Å; I366-Q368 PolarHBondContact O-N 3.09Å; I366-D369 PolarHBondContact O-N 2.84Å; I366-Y370 HydrophobicContact CG2-CE2 4.19Å; I366-Y370 WeakPolarHBondContact O-CD2 3.47Å; I366-Y370 WeakPolarHBondContact O-CE2 3.31Å; I366-A538 HydrophobicContact CD1-CB 3.26Å; I366-L542 HydrophobicContact CB-CD1 3.94Å; I366-L542 HydrophobicContact CD1-CD1 3.93Å; I366-L542 HydrophobicContact CG2-CD1 3.63Å
367	C	90.2	Very high	92.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.5	-33.5	-176.5	-66.3	0	0	0	0	112.6	F326 V363 G364 D369 Y370	F326-C367 HydrophobicContact CB-CB 4.09Å; F326-C367 HydrophobicContact CD1-CB 4.18Å; F326-C367 HydrophobicContact CD2-CB 3.83Å; F326-C367 HydrophobicContact CE2-CB 4.25Å; F326-C367 HydrophobicContact CG-CB 3.78Å; V363-C367 PolarHBondContact O-N 3.03Å; G364-C367 PolarHBondContact O-N 2.86Å; C367-D369 PolarHBondContact O-N 2.8Å; C367-D369 VanDerWaalsContact O-N 3.08Å; C367-Y370 PolarHBondContact O-N 2.85Å
368	Q	92	Very high	92.8	Very high	49 Å²	49	28.4 Å²	28.4	23%	0.229	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.3	-178.6	66.9	170.3	-35.9	0	0	115.9	G364 E365 I366 Y370 K374 F376	G364-Q368 WeakPolarHBondContact O-CG 3.35Å; G364-Q368 PolarHBondContact O-N 2.95Å; G364-Q368 VanDerWaalsContact O-N 3.08Å; E365-Q368 VanDerWaalsContact O-CG 3.26Å; E365-Q368 WeakPolarHBondContact O-CG 3.43Å; E365-Q368 PolarHBondContact O-NE2 2.96Å; E365-Q368 VanDerWaalsContact O-NE2 3.09Å; I366-Q368 PolarHBondContact O-N 3.09Å; Q368-Y370 VanDerWaalsContact C-N 3.29Å; Q368-K374 PolarHBondContact O-NZ 3.28Å; Q368-F376 HydrophobicContact CB-CE2 3.92Å; Q368-F376 HydrophobicContact CB-CZ 3.51Å
369	D	91	Very high	93	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.053	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.6	177.8	-79.9	-22.5	0	0	0	112.8	T135 Q138 S141 I366 C367 K374	T135-D369 WeakPolarHBondContact CB-OD2 3.46Å; T135-D369 VanDerWaalsContact CG2-OD2 3.32Å; T135-D369 WeakPolarHBondContact CG2-OD2 3.28Å; T135-D369 PolarHBondContact OG1-OD2 3.08Å; Q138-D369 HydrophobicContact CG-CB 4.32Å; Q138-D369 WeakPolarHBondContact CG-OD1 3.11Å; Q138-D369 PolarHBondContact NE2-OD1 3.14Å; S141-D369 WeakPolarHBondContact CB-O 3.29Å; S141-D369 PolarHBondContact OG-O 2.88Å; I366-D369 PolarHBondContact O-N 2.84Å; C367-D369 PolarHBondContact O-N 2.8Å; C367-D369 VanDerWaalsContact O-N 3.08Å; D369-K374 IonicContact OD1-NZ 3.33Å
370	Y	90.9	Very high	93.1	Very high	7 Å²	7	25.2 Å²	25.2	3%	0.027	14%	0.135	C	C	.	.	S	Bend	trans	-107.3	1.3	179.3	-52.8	-80.8	0	0	0	113	F101 F103 V140 I318 I324 I366 C367 Q368	F101-Y370 HydrophobicContact CE2-CE1 4.48Å; F101-Y370 VanDerWaalsContact CE2-OH 3.31Å; F101-Y370 WeakPolarHBondContact CE2-OH 3.28Å; F101-Y370 HydrophobicContact CZ-CE1 4.1Å; F101-Y370 WeakPolarHBondContact CZ-OH 3.37Å; F103-Y370 HydrophobicContact CD2-CD2 4.37Å; F103-Y370 HydrophobicContact CD2-CE1 4.27Å; F103-Y370 AromaticContact CD2-CE2 3.77Å; F103-Y370 HydrophobicContact CD2-CE2 3.77Å; F103-Y370 AromaticContact CD2-CZ 3.71Å; F103-Y370 AromaticContact CE2-CD2 3.82Å; F103-Y370 HydrophobicContact CE2-CD2 3.82Å; F103-Y370 HydrophobicContact CE2-CE1 4.48Å; F103-Y370 AromaticContact CE2-CE2 3.65Å; F103-Y370 HydrophobicContact CE2-CE2 3.65Å; F103-Y370 HydrophobicContact CE2-CG 4.3Å; V140-Y370 HydrophobicContact CG2-CE1 4.1Å; I318-Y370 HydrophobicContact CD1-CD1 4.46Å; I318-Y370 HydrophobicContact CG2-CD1 3.99Å; I318-Y370 HydrophobicContact CG2-CE1 4.42Å; I324-Y370 PolarHBondContact N-O 2.72Å; I366-Y370 HydrophobicContact CG2-CE2 4.19Å; I366-Y370 WeakPolarHBondContact O-CD2 3.47Å; I366-Y370 WeakPolarHBondContact O-CE2 3.31Å; C367-Y370 PolarHBondContact O-N 2.85Å; Q368-Y370 VanDerWaalsContact C-N 3.29Å
371	D	89.3	Confident	93.2	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.027	14%	0.135	C	C	.	.			trans	-105.8	129.7	170.5	-171.4	-45.6	0	0	0	108.7	Q325 D373 K374 F376	Q325-D371 PolarHBondContact NE2-OD2 3.38Å; Q325-D371 PolarHBondContact OE1-OD2 2.84Å; D371-D373 PolarHBondContact OD1-N 2.9Å; D371-D373 VanDerWaalsContact OD1-N 3.09Å; D371-K374 PolarHBondContact OD1-N 2.87Å; D371-F376 HydrophobicContact CB-CE1 3.79Å; D371-F376 HydrophobicContact CB-CZ 4.22Å; D371-F376 WeakPolarHBondContact OD2-CE1 3.43Å
372	S	84.7	Confident	93.4	Very high	81 Å²	81	22.8 Å²	22.8	57%	0.566	12%	0.121	S	C	*	.	S	Bend	trans	-81.2	-35.7	-172.2	75	0	0	0	0	114	Q323	Q323-S372 VanDerWaalsContact CD-OG 3.24Å; Q323-S372 VanDerWaalsContact NE2-CB 3.33Å; Q323-S372 PolarHBondContact NE2-OG 3.29Å; Q323-S372 PolarHBondContact OE1-OG 3.32Å; Q323-S372 VanDerWaalsContact OE1-OG 3.07Å
373	D	89.1	Confident	93.6	Very high	84 Å²	84	22.4 Å²	22.4	45%	0.449	12%	0.118	S	C	.	.	S	Bend	trans	-94.5	-18.1	179.9	60.6	31.3	0	0	0	111.8	D371 M375	D371-D373 PolarHBondContact OD1-N 2.9Å; D371-D373 VanDerWaalsContact OD1-N 3.09Å; D373-M375 HydrophobicContact CB-CG 4.11Å; D373-M375 PolarHBondContact O-N 2.8Å; D373-M375 WeakPolarHBondContact OD1-CB 3.26Å; D373-M375 PolarHBondContact OD1-N 3.41Å
374	K	93.1	Very high	93.8	Very high	65 Å²	65	26.2 Å²	26.2	28%	0.283	13%	0.132	S	C	.	.			trans	58.4	32.5	-178.5	-56.1	172	174.7	-73.3	0	111.3	Q368 D369 D371 F376 G408	Q368-K374 PolarHBondContact O-NZ 3.28Å; D369-K374 IonicContact OD1-NZ 3.33Å; D371-K374 PolarHBondContact OD1-N 2.87Å; K374-F376 HydrophobicContact CB-CE2 4.43Å; K374-F376 HydrophobicContact CB-CZ 4.3Å; K374-G408 WeakPolarHBondContact O-CA 3.4Å; K374-G408 PolarHBondContact O-N 2.79Å
375	M	95.6	Very high	93.9	Very high	51 Å²	51	27.4 Å²	27.4	25%	0.251	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	107.1	177.8	-64.9	-59.5	-60.9	0	0	108.9	D373 P377 E405 A407	D373-M375 HydrophobicContact CB-CG 4.11Å; D373-M375 PolarHBondContact O-N 2.8Å; D373-M375 WeakPolarHBondContact OD1-CB 3.26Å; D373-M375 PolarHBondContact OD1-N 3.41Å; M375-P377 WeakPolarHBondContact O-CD 3.33Å; M375-E405 HydrophobicContact CB-CB 4.07Å; M375-E405 HydrophobicContact CB-CG 4.31Å; M375-E405 HydrophobicContact CE-CB 3.72Å; M375-A407 HydrophobicContact SD-CB 3.98Å
376	F	96.6	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.7	-172.3	-57.1	-58.1	0	0	0	111.4	F326 Q368 D371 K374 A378 C406 G408 I409 V412	F326-F376 HydrophobicContact CB-CD1 3.79Å; F326-F376 HydrophobicContact CB-CE1 3.93Å; F326-F376 HydrophobicContact CD1-CD1 4.04Å; F326-F376 HydrophobicContact CD1-CE1 4.41Å; F326-F376 HydrophobicContact CD1-CG 4.4Å; F326-F376 HydrophobicContact CG-CD1 4.43Å; F326-F376 WeakPolarHBondContact O-CD1 3.42Å; Q368-F376 HydrophobicContact CB-CE2 3.92Å; Q368-F376 HydrophobicContact CB-CZ 3.51Å; D371-F376 HydrophobicContact CB-CE1 3.79Å; D371-F376 HydrophobicContact CB-CZ 4.22Å; D371-F376 WeakPolarHBondContact OD2-CE1 3.43Å; K374-F376 HydrophobicContact CB-CE2 4.43Å; K374-F376 HydrophobicContact CB-CZ 4.3Å; F376-A378 PolarHBondContact O-N 2.83Å; F376-C406 PolarHBondContact N-O 3.05Å; F376-C406 PolarHBondContact O-N 3.08Å; F376-G408 VanDerWaalsContact CD2-C 3.49Å; F376-I409 HydrophobicContact CD2-CD1 3.69Å; F376-I409 HydrophobicContact CD2-CG1 4.35Å; F376-I409 HydrophobicContact CE2-CD1 3.76Å; F376-I409 HydrophobicContact CE2-CG1 4.05Å; F376-I409 HydrophobicContact CG-CD1 4.33Å; F376-I409 HydrophobicContact CZ-CD1 4.49Å; F376-V412 HydrophobicContact CB-CG2 3.88Å; F376-V412 HydrophobicContact CD2-CG2 4.44Å
377	P	97.7	Very high	93.8	Very high	18 Å²	18	30.1 Å²	30.1	12%	0.117	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	128.7	167.6	-22.4	33.9	0	0	0	110.3	T327 V328 M375 F379 P404 E405	T327-P377 WeakPolarHBondContact CA-O 3.31Å; T327-P377 HydrophobicContact CG2-CB 4.16Å; V328-P377 PolarHBondContact N-O 2.84Å; M375-P377 WeakPolarHBondContact O-CD 3.33Å; P377-F379 HydrophobicContact CB-CD2 4.46Å; P377-F379 HydrophobicContact CB-CE2 3.64Å; P377-F379 HydrophobicContact CB-CZ 4.18Å; P377-P404 WeakPolarHBondContact CA-O 3.11Å; P377-P404 HydrophobicContact CB-CG 4.24Å; P377-E405 HydrophobicContact CG-CG 4.29Å
378	A	98.2	Very high	93.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.5	-179.7	0	0	0	0	0	111.3	V328 F376 I397 P404 V412	V328-A378 WeakPolarHBondContact O-CA 3.45Å; F376-A378 PolarHBondContact O-N 2.83Å; A378-I397 HydrophobicContact CB-CD1 3.53Å; A378-I397 HydrophobicContact CB-CG1 3.62Å; A378-I397 PolarHBondContact O-N 3.46Å; A378-P404 PolarHBondContact N-O 2.93Å; A378-P404 VanDerWaalsContact N-O 3.13Å; A378-V412 HydrophobicContact CB-CG1 3.81Å; A378-V412 HydrophobicContact CB-CG2 4.28Å
379	F	98.6	Very high	93.8	Very high	14 Å²	14	39.4 Å²	39.4	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	155	-174.2	-59.1	-79.9	0	0	0	111.9	T327 V328 A329 I330 P377 D394 F395 P404 I434 K437	T327-F379 HydrophobicContact CG2-CD2 3.66Å; T327-F379 HydrophobicContact CG2-CE2 3.74Å; V328-F379 PolarHBondContact O-N 2.9Å; A329-F379 CarbonylContact C-O 3.57Å; A329-F379 VanDerWaalsContact CA-O 3.31Å; A329-F379 WeakPolarHBondContact CA-O 3.34Å; I330-F379 PolarHBondContact N-O 2.81Å; P377-F379 HydrophobicContact CB-CD2 4.46Å; P377-F379 HydrophobicContact CB-CE2 3.64Å; P377-F379 HydrophobicContact CB-CZ 4.18Å; F379-D394 VanDerWaalsContact CD1-O 3.27Å; F379-D394 WeakPolarHBondContact CD1-O 3.37Å; F379-F395 CarbonylContact C-O 3.51Å; F379-F395 WeakPolarHBondContact CA-O 3.44Å; F379-P404 HydrophobicContact CD1-CB 4.44Å; F379-P404 HydrophobicContact CE1-CB 3.62Å; F379-P404 HydrophobicContact CE1-CG 3.98Å; F379-P404 HydrophobicContact CE2-CB 4.47Å; F379-P404 HydrophobicContact CZ-CB 3.65Å; F379-P404 HydrophobicContact CZ-CG 3.61Å; F379-I434 HydrophobicContact CB-CD1 3.66Å; F379-I434 HydrophobicContact CB-CG1 4.49Å; F379-I434 HydrophobicContact CD1-CD1 4.46Å; F379-I434 HydrophobicContact CD2-CD1 3.66Å; F379-I434 HydrophobicContact CE2-CD1 4.41Å; F379-I434 HydrophobicContact CG-CD1 3.67Å; F379-K437 HydrophobicContact CD1-CD 4.27Å; F379-K437 HydrophobicContact CE1-CD 3.78Å; F379-K437 HydrophobicContact CE2-CD 4.29Å; F379-K437 HydrophobicContact CZ-CD 3.78Å
380	G	98.1	Very high	94	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.6	171.5	0	0	0	0	0	110.9	I330 D394 F395	I330-G380 CarbonylContact O-C 3.59Å; I330-G380 VanDerWaalsContact O-CA 3.24Å; I330-G380 WeakPolarHBondContact O-CA 3.32Å; G380-D394 CarbonylContact O-C 3.56Å; G380-D394 WeakPolarHBondContact O-CA 3.46Å; G380-D394 PolarHBondContact O-N 2.88Å; G380-F395 PolarHBondContact N-O 3.39Å; G380-F395 WeakPolarHBondContact O-CD1 3.37Å; G380-F395 WeakPolarHBondContact O-CE1 3.39Å; G380-F395 PolarHBondContact O-N 3.36Å
381	F	97.9	Very high	94.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.7	175.7	63.1	-90.1	0	0	0	112.6	A329 I330 D331 F332 H393 T429 I431 I459	A329-F381 HydrophobicContact CB-CD1 4.26Å; A329-F381 HydrophobicContact CB-CE1 4.19Å; I330-F381 VanDerWaalsContact C-CE1 3.43Å; I330-F381 WeakPolarHBondContact O-CD1 3.38Å; I330-F381 PolarHBondContact O-N 2.94Å; D331-F381 VanDerWaalsContact CA-CZ 3.5Å; D331-F381 HydrophobicContact CB-CD2 4.48Å; D331-F381 HydrophobicContact CB-CE1 4.07Å; D331-F381 HydrophobicContact CB-CE2 3.66Å; D331-F381 HydrophobicContact CB-CZ 3.43Å; D331-F381 VanDerWaalsContact CB-CZ 3.43Å; D331-F381 VanDerWaalsContact N-CE1 3.31Å; F332-F381 PolarHBondContact N-O 3.24Å; F381-H393 VanDerWaalsContact CB-C 3.42Å; F381-H393 HydrophobicContact CB-CB 4.35Å; F381-H393 WeakPolarHBondContact CB-O 3.34Å; F381-T429 HydrophobicContact CE2-CG2 4.07Å; F381-I431 HydrophobicContact CD2-CG2 4.25Å; F381-I431 HydrophobicContact CE2-CG2 3.67Å; F381-I431 HydrophobicContact CZ-CG2 3.84Å; F381-I459 HydrophobicContact CE1-CG2 3.87Å; F381-I459 HydrophobicContact CZ-CG2 3.83Å
382	G	96.8	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	79.6	21.7	174.7	0	0	0	0	0	114.9	S392 Y426 G427	G382-S392 PolarHBondContact N-O 2.72Å; G382-Y426 CarbonylContact O-C 3.55Å; G382-Y426 WeakPolarHBondContact O-CA 3.12Å; G382-Y426 PolarHBondContact O-N 2.64Å; G382-Y426 VanDerWaalsContact O-N 3.1Å; G382-G427 PolarHBondContact O-N 3.41Å
383	A	97.3	Very high	95.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	161.7	177.6	0	0	0	0	0	112.3	F332 V391 S392 F395 L423	F332-A383 HydrophobicContact CB-CB 3.69Å; A383-V391 WeakPolarHBondContact O-CA 3.45Å; A383-S392 PolarHBondContact N-O 3.07Å; A383-S392 PolarHBondContact O-N 2.72Å; A383-F395 HydrophobicContact CB-CE1 3.97Å; A383-F395 HydrophobicContact CB-CZ 4.2Å; A383-L423 HydrophobicContact CB-CB 4.42Å
384	R	97.4	Very high	95.5	Very high	79 Å²	79	41.7 Å²	41.7	30%	0.298	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.3	165.8	-71.7	176	-174.8	-178.8	-2.7	109.7	Y389 T390 V391 Q424 Y426	R384-Y389 HydrophobicContact CB-CD1 4.42Å; R384-Y389 WeakPolarHBondContact CB-O 3.5Å; R384-Y389 WeakPolarHBondContact CD-O 3.14Å; R384-Y389 VanDerWaalsContact CG-O 3.29Å; R384-Y389 WeakPolarHBondContact CG-O 3.35Å; R384-T390 VanDerWaalsContact CA-O 3.27Å; R384-T390 WeakPolarHBondContact CA-O 3.38Å; R384-V391 HydrophobicContact CG-CG2 3.74Å; R384-Q424 HydrophobicContact CB-CB 3.94Å; R384-Q424 PolarHBondContact N-O 2.68Å; R384-Q424 PolarHBondContact O-N 2.81Å; R384-Q424 VanDerWaalsContact O-N 3.13Å; R384-Y426 HydrophobicContact CG-CD1 4.18Å; R384-Y426 HydrophobicContact CG-CG 4.04Å; R384-Y426 PolarHBondContact NH2-OH 3.09Å
385	I	94.9	Very high	95.7	Very high	26 Å²	26	38.7 Å²	38.7	13%	0.133	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.7	-172.6	27.4	170.9	0	0	0	112	Y389 T390 S392 F395 F399 L423	I385-Y389 WeakPolarHBondContact O-CA 3.48Å; I385-Y389 PolarHBondContact O-N 3.22Å; I385-T390 VanDerWaalsContact CG1-O 3.29Å; I385-T390 WeakPolarHBondContact CG1-O 3.3Å; I385-T390 PolarHBondContact N-O 3.44Å; I385-S392 VanDerWaalsContact CD1-CB 3.4Å; I385-F395 HydrophobicContact CD1-CB 3.77Å; I385-F395 HydrophobicContact CD1-CG 4.25Å; I385-F395 HydrophobicContact CG2-CB 4.21Å; I385-F395 HydrophobicContact CG2-CD1 3.94Å; I385-F395 HydrophobicContact CG2-CD2 3.58Å; I385-F395 HydrophobicContact CG2-CE1 4.2Å; I385-F395 HydrophobicContact CG2-CE2 3.86Å; I385-F395 HydrophobicContact CG2-CG 3.63Å; I385-F395 HydrophobicContact CG2-CZ 4.17Å; I385-F399 HydrophobicContact CG2-CE1 4.12Å; I385-L423 HydrophobicContact CG2-CD2 3.51Å
386	P	90	Very high	95.8	Very high	43 Å²	43	36.2 Å²	36.2	28%	0.279	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	160.1	175.4	30.3	-35.8	0	0	0	111.6	Y389 F399 K422	P386-Y389 HydrophobicContact CB-CE1 4.14Å; P386-Y389 HydrophobicContact CB-CE2 4.43Å; P386-F399 HydrophobicContact CG-CE1 4.32Å; P386-K422 HydrophobicContact CG-CB 4.5Å
387	P	90.2	Very high	95.8	Very high	100 Å²	100	36.3 Å²	36.3	65%	0.649	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	cis	-85.3	-22.3	-0.1	28	-28	0	0	0	114.9	Y389	P387-Y389 VanDerWaalsContact C-N 3.34Å; P387-Y389 VanDerWaalsContact O-CD2 3.24Å; P387-Y389 WeakPolarHBondContact O-CD2 3.43Å
388	E	90.8	Very high	95.8	Very high	145 Å²	145	37.9 Å²	37.9	68%	0.678	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-15	-177.6	-66.6	71.5	-153	0	0	113.8	T390	E388-T390 VanDerWaalsContact C-N 3.28Å; E388-T390 HydrophobicContact CB-CG2 4.03Å; E388-T390 PolarHBondContact O-N 3.33Å
389	Y	92.6	Very high	95.7	Very high	98 Å²	98	41.5 Å²	41.5	38%	0.384	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	40.6	-175.5	-63.8	-81.6	0	0	0	112.8	R384 I385 P386 P387 Q424	R384-Y389 HydrophobicContact CB-CD1 4.42Å; R384-Y389 WeakPolarHBondContact CB-O 3.5Å; R384-Y389 WeakPolarHBondContact CD-O 3.14Å; R384-Y389 VanDerWaalsContact CG-O 3.29Å; R384-Y389 WeakPolarHBondContact CG-O 3.35Å; I385-Y389 WeakPolarHBondContact O-CA 3.48Å; I385-Y389 PolarHBondContact O-N 3.22Å; P386-Y389 HydrophobicContact CB-CE1 4.14Å; P386-Y389 HydrophobicContact CB-CE2 4.43Å; P387-Y389 VanDerWaalsContact C-N 3.34Å; P387-Y389 VanDerWaalsContact O-CD2 3.24Å; P387-Y389 WeakPolarHBondContact O-CD2 3.43Å; Y389-Q424 HydrophobicContact CD1-CB 4.31Å; Y389-Q424 VanDerWaalsContact CD1-CD 3.45Å; Y389-Q424 HydrophobicContact CD1-CG 3.83Å; Y389-Q424 HydrophobicContact CE1-CG 3.89Å
390	T	93.5	Very high	95.5	Very high	82 Å²	82	44.1 Å²	44.1	50%	0.503	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	143.1	169.8	51.3	0	0	0	0	110.1	R384 I385 E388 S392	R384-T390 VanDerWaalsContact CA-O 3.27Å; R384-T390 WeakPolarHBondContact CA-O 3.38Å; I385-T390 VanDerWaalsContact CG1-O 3.29Å; I385-T390 WeakPolarHBondContact CG1-O 3.3Å; I385-T390 PolarHBondContact N-O 3.44Å; E388-T390 VanDerWaalsContact C-N 3.28Å; E388-T390 HydrophobicContact CB-CG2 4.03Å; E388-T390 PolarHBondContact O-N 3.33Å; T390-S392 PolarHBondContact O-N 3.1Å
391	V	96.1	Very high	95.3	Very high	60 Å²	60	48.8 Å²	48.8	36%	0.364	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	131.4	175.9	-175.5	0	0	0	0	108.7	A383 R384 Y426	A383-V391 WeakPolarHBondContact O-CA 3.45Å; R384-V391 HydrophobicContact CG-CG2 3.74Å; V391-Y426 HydrophobicContact CB-CD1 4.37Å; V391-Y426 HydrophobicContact CG1-CD1 4.04Å; V391-Y426 HydrophobicContact CG2-CD1 3.39Å; V391-Y426 HydrophobicContact CG2-CE1 3.52Å; V391-Y426 HydrophobicContact CG2-CG 4.47Å
392	S	96.8	Very high	95.1	Very high	16 Å²	16	56.5 Å²	56.5	11%	0.112	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.5	174.8	177.3	0	0	0	0	111.6	G382 A383 I385 T390 D394 F395	G382-S392 PolarHBondContact N-O 2.72Å; A383-S392 PolarHBondContact N-O 3.07Å; A383-S392 PolarHBondContact O-N 2.72Å; I385-S392 VanDerWaalsContact CD1-CB 3.4Å; T390-S392 PolarHBondContact O-N 3.1Å; S392-D394 PolarHBondContact OG-N 3.38Å; S392-F395 PolarHBondContact OG-N 3.14Å
393	H	96.7	Very high	95.1	Very high	30 Å²	30	59.8 Å²	59.8	14%	0.139	31%	0.308	C	S	.	.	S	Bend	trans	-123.3	12.1	-177.8	-63.9	-71.1	0	0	0	113.1	F381 P428 P433	F381-H393 VanDerWaalsContact CB-C 3.42Å; F381-H393 HydrophobicContact CB-CB 4.35Å; F381-H393 WeakPolarHBondContact CB-O 3.34Å; H393-P428 PolarHBondContact CE1-O 3.43Å; H393-P433 HydrophobicContact CB-CB 4.09Å; H393-P433 HydrophobicContact CB-CG 3.84Å
394	D	96.3	Very high	95.1	Very high	48 Å²	48	61 Å²	61	26%	0.257	32%	0.316	S	S	.	.	S	Bend	trans	-165.1	28.8	-175.5	66.7	-27.9	0	0	0	113.6	F379 G380 S392 P433 I434 K437	F379-D394 VanDerWaalsContact CD1-O 3.27Å; F379-D394 WeakPolarHBondContact CD1-O 3.37Å; G380-D394 CarbonylContact O-C 3.56Å; G380-D394 WeakPolarHBondContact O-CA 3.46Å; G380-D394 PolarHBondContact O-N 2.88Å; S392-D394 PolarHBondContact OG-N 3.38Å; D394-P433 HydrophobicContact CB-CB 4.47Å; D394-I434 HydrophobicContact CB-CD1 4.26Å; D394-K437 HydrophobicContact CB-CD 4.45Å; D394-K437 VanDerWaalsContact CG-NZ 3.31Å; D394-K437 PolarHBondContact O-NZ 2.95Å; D394-K437 WeakPolarHBondContact OD2-CE 3.45Å; D394-K437 IonicContact OD2-NZ 2.73Å; D394-K437 PolarHBondContact OD2-NZ 3.31Å
395	F	97.5	Very high	95	Very high	1 Å²	1	60.5 Å²	60.5	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148.2	-174.9	65.7	-88.8	0	0	0	112.9	F332 F379 G380 A383 I385 S392 I397 E401 L423	F332-F395 HydrophobicContact CD2-CE1 4.49Å; F332-F395 AromaticContact CD2-CZ 3.8Å; F332-F395 HydrophobicContact CD2-CZ 3.8Å; F332-F395 HydrophobicContact CE2-CZ 4.17Å; F332-F395 HydrophobicContact CG-CZ 4.44Å; F379-F395 CarbonylContact C-O 3.51Å; F379-F395 WeakPolarHBondContact CA-O 3.44Å; G380-F395 PolarHBondContact N-O 3.39Å; G380-F395 WeakPolarHBondContact O-CD1 3.37Å; G380-F395 WeakPolarHBondContact O-CE1 3.39Å; G380-F395 PolarHBondContact O-N 3.36Å; A383-F395 HydrophobicContact CB-CE1 3.97Å; A383-F395 HydrophobicContact CB-CZ 4.2Å; I385-F395 HydrophobicContact CD1-CB 3.77Å; I385-F395 HydrophobicContact CD1-CG 4.25Å; I385-F395 HydrophobicContact CG2-CB 4.21Å; I385-F395 HydrophobicContact CG2-CD1 3.94Å; I385-F395 HydrophobicContact CG2-CD2 3.58Å; I385-F395 HydrophobicContact CG2-CE1 4.2Å; I385-F395 HydrophobicContact CG2-CE2 3.86Å; I385-F395 HydrophobicContact CG2-CG 3.63Å; I385-F395 HydrophobicContact CG2-CZ 4.17Å; S392-F395 PolarHBondContact OG-N 3.14Å; F395-I397 HydrophobicContact CE2-CG2 4.19Å; F395-I397 PolarHBondContact O-N 2.92Å; F395-E401 WeakPolarHBondContact CA-OE1 3.32Å; F395-L423 HydrophobicContact CE2-CD1 3.97Å; F395-L423 HydrophobicContact CE2-CD2 3.82Å; F395-L423 HydrophobicContact CZ-CD1 3.68Å; F395-L423 HydrophobicContact CZ-CD2 3.86Å; F395-L423 HydrophobicContact CZ-CG 4.44Å
396	A	97.9	Very high	95.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.8	175.6	0	0	0	0	0	110.8	N398 F399 E401 P404	A396-N398 WeakPolarHBondContact CB-OD1 3.32Å; A396-N398 PolarHBondContact O-N 3.41Å; A396-F399 WeakPolarHBondContact O-CA 3.29Å; A396-F399 PolarHBondContact O-N 2.88Å; A396-E401 PolarHBondContact N-OE1 3.32Å; A396-P404 HydrophobicContact CB-CB 3.82Å
397	I	97.6	Very high	95.4	Very high	2 Å²	2	61 Å²	61	1%	0.01	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.3	-176.1	67.2	172.7	0	0	0	112.9	I330 F332 A378 F395 F399 V412 A415 C419	I330-I397 HydrophobicContact CD1-CD1 4.3Å; F332-I397 HydrophobicContact CE2-CG2 3.96Å; F332-I397 HydrophobicContact CZ-CG2 4.43Å; A378-I397 HydrophobicContact CB-CD1 3.53Å; A378-I397 HydrophobicContact CB-CG1 3.62Å; A378-I397 PolarHBondContact O-N 3.46Å; F395-I397 HydrophobicContact CE2-CG2 4.19Å; F395-I397 PolarHBondContact O-N 2.92Å; I397-F399 PolarHBondContact O-N 3.37Å; I397-V412 HydrophobicContact CD1-CG1 4.25Å; I397-A415 HydrophobicContact CD1-CB 3.91Å; I397-A415 HydrophobicContact CG1-CB 3.86Å; I397-C419 HydrophobicContact CB-CB 4.46Å; I397-C419 WeakPolarHBondContact O-CB 3.37Å
398	N	96.6	Very high	95.7	Very high	50 Å²	50	56.9 Å²	56.9	27%	0.267	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0	171.2	69.1	0.7	0	0	0	112.8	A396 N400 N403 E405 A415	A396-N398 WeakPolarHBondContact CB-OD1 3.32Å; A396-N398 PolarHBondContact O-N 3.41Å; N398-N400 PolarHBondContact O-N 3.41Å; N398-N400 PolarHBondContact OD1-N 2.85Å; N398-N400 PolarHBondContact OD1-O 3.24Å; N398-N403 PolarHBondContact ND2-O 3.4Å; N398-E405 PolarHBondContact ND2-O 2.96Å; N398-A415 HydrophobicContact CB-CB 4.43Å
399	F	95.3	Very high	95.9	Very high	76 Å²	76	50.3 Å²	50.3	33%	0.333	27%	0.273	S	S	.	.	S	Bend	trans	57.5	24.9	-173.4	-57	-67	0	0	0	114.9	I385 P386 A396 I397 C419 K422 L423	I385-F399 HydrophobicContact CG2-CE1 4.12Å; P386-F399 HydrophobicContact CG-CE1 4.32Å; A396-F399 WeakPolarHBondContact O-CA 3.29Å; A396-F399 PolarHBondContact O-N 2.88Å; I397-F399 PolarHBondContact O-N 3.37Å; F399-C419 HydrophobicContact CE2-CB 3.64Å; F399-C419 HydrophobicContact CZ-CB 3.74Å; F399-K422 HydrophobicContact CD2-CD 4.43Å; F399-K422 HydrophobicContact CE2-CB 4.37Å; F399-K422 HydrophobicContact CE2-CD 3.59Å; F399-K422 HydrophobicContact CZ-CB 4.15Å; F399-K422 HydrophobicContact CZ-CD 4.2Å; F399-L423 HydrophobicContact CE1-CD2 4.01Å; F399-L423 HydrophobicContact CZ-CD2 4.03Å
400	N	95.3	Very high	96	Very high	69 Å²	69	51.1 Å²	51.1	37%	0.369	28%	0.281	S	S	.	.			trans	-118.1	90.8	172.4	-174	-2.4	0	0	0	109.3	N398 D402 N403	N398-N400 PolarHBondContact O-N 3.41Å; N398-N400 PolarHBondContact OD1-N 2.85Å; N398-N400 PolarHBondContact OD1-O 3.24Å; N400-D402 PolarHBondContact O-N 3.28Å; N400-D402 PolarHBondContact OD1-N 3.34Å; N400-N403 CarbonylContact O-C 3.57Å; N400-N403 PolarHBondContact O-N 3.36Å; N400-N403 VanDerWaalsContact O-N 3.15Å; N400-N403 VanDerWaalsContact O-O 3.04Å; N400-N403 PolarHBondContact OD1-N 3.17Å
401	E	93	Very high	96.2	Very high	100 Å²	100	47.9 Å²	47.9	47%	0.467	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.1	-179.7	-66.5	-63.2	151.5	0	0	112.9	F395 A396 N403	F395-E401 WeakPolarHBondContact CA-OE1 3.32Å; A396-E401 PolarHBondContact N-OE1 3.32Å; E401-N403 VanDerWaalsContact C-N 3.32Å
402	D	95.1	Very high	96.3	Very high	161 Å²	161	45 Å²	45	86%	0.861	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-25.5	176.3	-65.3	-33.7	0	0	0	111.9	N400	N400-D402 PolarHBondContact O-N 3.28Å; N400-D402 PolarHBondContact OD1-N 3.34Å
403	N	95.9	Very high	96.3	Very high	69 Å²	69	44.8 Å²	44.8	37%	0.369	24%	0.244	S	C	.	.			trans	-145.4	91	175.2	-176.5	11	0	0	0	111.3	N398 N400 E401 E405	N398-N403 PolarHBondContact ND2-O 3.4Å; N400-N403 CarbonylContact O-C 3.57Å; N400-N403 PolarHBondContact O-N 3.36Å; N400-N403 VanDerWaalsContact O-N 3.15Å; N400-N403 VanDerWaalsContact O-O 3.04Å; N400-N403 PolarHBondContact OD1-N 3.17Å; E401-N403 VanDerWaalsContact C-N 3.32Å; N403-E405 PolarHBondContact O-N 3.42Å; N403-E405 VanDerWaalsContact OD1-CB 3.24Å; N403-E405 WeakPolarHBondContact OD1-CB 3.2Å; N403-E405 VanDerWaalsContact OD1-CG 3.31Å; N403-E405 WeakPolarHBondContact OD1-CG 3.26Å; N403-E405 PolarHBondContact OD1-N 3.07Å; N403-E405 VanDerWaalsContact OD1-N 3.16Å
404	P	96.7	Very high	96.4	Very high	25 Å²	25	48.4 Å²	48.4	16%	0.162	26%	0.261	C	S	.	.			trans	-77.2	1.9	-179.2	32.5	-36.1	0	0	0	113.6	P377 A378 F379 A396	P377-P404 WeakPolarHBondContact CA-O 3.11Å; P377-P404 HydrophobicContact CB-CG 4.24Å; A378-P404 PolarHBondContact N-O 2.93Å; A378-P404 VanDerWaalsContact N-O 3.13Å; F379-P404 HydrophobicContact CD1-CB 4.44Å; F379-P404 HydrophobicContact CE1-CB 3.62Å; F379-P404 HydrophobicContact CE1-CG 3.98Å; F379-P404 HydrophobicContact CE2-CB 4.47Å; F379-P404 HydrophobicContact CZ-CB 3.65Å; F379-P404 HydrophobicContact CZ-CG 3.61Å; A396-P404 HydrophobicContact CB-CB 3.82Å
405	E	96.8	Very high	96.5	Very high	70 Å²	70	46.7 Å²	46.7	33%	0.327	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.7	-173.2	-61.3	179.3	163.9	0	0	113	M375 P377 N398 N403	M375-E405 HydrophobicContact CB-CB 4.07Å; M375-E405 HydrophobicContact CB-CG 4.31Å; M375-E405 HydrophobicContact CE-CB 3.72Å; P377-E405 HydrophobicContact CG-CG 4.29Å; N398-E405 PolarHBondContact ND2-O 2.96Å; N403-E405 PolarHBondContact O-N 3.42Å; N403-E405 VanDerWaalsContact OD1-CB 3.24Å; N403-E405 WeakPolarHBondContact OD1-CB 3.2Å; N403-E405 VanDerWaalsContact OD1-CG 3.31Å; N403-E405 WeakPolarHBondContact OD1-CG 3.26Å; N403-E405 PolarHBondContact OD1-N 3.07Å; N403-E405 VanDerWaalsContact OD1-N 3.16Å
406	C	97.4	Very high	96.5	Very high	9 Å²	9	46.8 Å²	46.8	6%	0.061	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.4	175.8	-63.7	0	0	0	0	109.9	F376 G408 V412	F376-C406 PolarHBondContact N-O 3.05Å; F376-C406 PolarHBondContact O-N 3.08Å; C406-G408 PolarHBondContact O-N 3.09Å; C406-G408 VanDerWaalsContact O-N 3.13Å; C406-V412 HydrophobicContact CB-CB 4.43Å; C406-V412 HydrophobicContact CB-CG2 3.69Å
407	A	96.3	Very high	96.4	Very high	69 Å²	69	50.3 Å²	50.3	57%	0.57	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	104.2	-179.3	0	0	0	0	0	111.5	M375 G411	M375-A407 HydrophobicContact SD-CB 3.98Å; A407-G411 WeakPolarHBondContact O-CA 3.41Å; A407-G411 PolarHBondContact O-N 3.2Å; A407-G411 VanDerWaalsContact O-N 3.13Å
408	G	95.4	Very high	96.4	Very high	14 Å²	14	53.2 Å²	53.2	14%	0.144	29%	0.291	C	S	.	.	H	α-helix	trans	69.2	171.8	-177.8	0	0	0	0	0	113.3	K374 F376 C406 Q410 G411 V412	K374-G408 WeakPolarHBondContact O-CA 3.4Å; K374-G408 PolarHBondContact O-N 2.79Å; F376-G408 VanDerWaalsContact CD2-C 3.49Å; C406-G408 PolarHBondContact O-N 3.09Å; C406-G408 VanDerWaalsContact O-N 3.13Å; G408-Q410 PolarHBondContact O-N 3.01Å; G408-G411 PolarHBondContact O-N 2.96Å; G408-V412 PolarHBondContact O-N 3.42Å
409	I	95	Very high	96.4	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-32	174.8	-61.8	-55.7	0	0	0	111.9	F326 L360 V361 G364 F376 G411 V412 V413	F326-I409 HydrophobicContact CD1-CD1 4.18Å; F326-I409 HydrophobicContact CE1-CD1 3.99Å; L360-I409 HydrophobicContact CG-CG2 4.49Å; V361-I409 HydrophobicContact CG2-CG2 4.47Å; G364-I409 WeakPolarHBondContact O-CG1 3.31Å; F376-I409 HydrophobicContact CD2-CD1 3.69Å; F376-I409 HydrophobicContact CD2-CG1 4.35Å; F376-I409 HydrophobicContact CE2-CD1 3.76Å; F376-I409 HydrophobicContact CE2-CG1 4.05Å; F376-I409 HydrophobicContact CG-CD1 4.33Å; F376-I409 HydrophobicContact CZ-CD1 4.49Å; I409-G411 VanDerWaalsContact C-N 3.3Å; I409-G411 PolarHBondContact O-N 2.85Å; I409-V412 PolarHBondContact O-N 3.49Å; I409-V413 HydrophobicContact CG2-CG2 4.48Å; I409-V413 WeakPolarHBondContact O-CG2 3.23Å; I409-V413 PolarHBondContact O-N 3.01Å
410	Q	95.8	Very high	96.4	Very high	116 Å²	116	47.5 Å²	47.5	54%	0.542	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-39.8	173.7	-173.7	55.7	38.1	0	0	111.6	G408 V413 E414	G408-Q410 PolarHBondContact O-N 3.01Å; Q410-V413 PolarHBondContact O-N 3.21Å; Q410-E414 WeakPolarHBondContact CG-OE1 3.42Å; Q410-E414 PolarHBondContact NE2-OE1 2.95Å; Q410-E414 VanDerWaalsContact NE2-OE1 3.09Å; Q410-E414 WeakPolarHBondContact O-CG 3.36Å; Q410-E414 PolarHBondContact O-N 2.86Å
411	G	97.5	Very high	96.5	Very high	13 Å²	13	49.1 Å²	49.1	13%	0.134	28%	0.278	C	S	.	.	H	α-helix	trans	-63.2	-39.5	173.1	0	0	0	0	0	112.9	A407 G408 I409 E414 A415	A407-G411 WeakPolarHBondContact O-CA 3.41Å; A407-G411 PolarHBondContact O-N 3.2Å; A407-G411 VanDerWaalsContact O-N 3.13Å; G408-G411 PolarHBondContact O-N 2.96Å; I409-G411 VanDerWaalsContact C-N 3.3Å; I409-G411 PolarHBondContact O-N 2.85Å; G411-E414 PolarHBondContact O-N 3.29Å; G411-A415 WeakPolarHBondContact O-CB 3.38Å; G411-A415 PolarHBondContact O-N 2.89Å
412	V	97.9	Very high	96.6	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-42.8	175.2	-175.6	0	0	0	0	111	V328 L360 F376 A378 I397 C406 G408 I409 E414 A415 Y416	V328-V412 HydrophobicContact CB-CG1 4.41Å; V328-V412 HydrophobicContact CG1-CG1 4.4Å; V328-V412 HydrophobicContact CG2-CG1 4.45Å; L360-V412 HydrophobicContact CD1-CG1 3.99Å; L360-V412 HydrophobicContact CD2-CB 4.38Å; L360-V412 HydrophobicContact CD2-CG1 3.84Å; L360-V412 HydrophobicContact CG-CG1 4.5Å; F376-V412 HydrophobicContact CB-CG2 3.88Å; F376-V412 HydrophobicContact CD2-CG2 4.44Å; A378-V412 HydrophobicContact CB-CG1 3.81Å; A378-V412 HydrophobicContact CB-CG2 4.28Å; I397-V412 HydrophobicContact CD1-CG1 4.25Å; C406-V412 HydrophobicContact CB-CB 4.43Å; C406-V412 HydrophobicContact CB-CG2 3.69Å; G408-V412 PolarHBondContact O-N 3.42Å; I409-V412 PolarHBondContact O-N 3.49Å; V412-E414 PolarHBondContact O-N 2.83Å; V412-A415 PolarHBondContact O-N 2.94Å; V412-Y416 WeakPolarHBondContact O-CB 3.3Å; V412-Y416 PolarHBondContact O-N 3.25Å
413	V	97.4	Very high	96.6	Very high	11 Å²	11	42.1 Å²	42.1	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-46.1	175.8	167.9	0	0	0	0	111	L357 L360 V361 I409 Q410 Y416 Q417	L357-V413 HydrophobicContact CD2-CB 4.35Å; L357-V413 HydrophobicContact CD2-CG1 3.82Å; L357-V413 HydrophobicContact CD2-CG2 4.05Å; L360-V413 HydrophobicContact CD2-CG2 3.75Å; L360-V413 HydrophobicContact CG-CG2 4.47Å; V361-V413 HydrophobicContact CG2-CG2 3.99Å; I409-V413 HydrophobicContact CG2-CG2 4.48Å; I409-V413 WeakPolarHBondContact O-CG2 3.23Å; I409-V413 PolarHBondContact O-N 3.01Å; Q410-V413 PolarHBondContact O-N 3.21Å; V413-Y416 PolarHBondContact O-N 2.9Å; V413-Q417 VanDerWaalsContact O-CG 3.29Å; V413-Q417 WeakPolarHBondContact O-CG 3.21Å; V413-Q417 PolarHBondContact O-N 3Å
414	E	97.4	Very high	96.7	Very high	106 Å²	106	42.8 Å²	42.8	50%	0.495	24%	0.24	S	C	.	.	H	α-helix	trans	-63.8	-42.7	178	-73.9	168.4	-163.3	0	0	111.9	Q410 G411 V412 Q417 S418	Q410-E414 WeakPolarHBondContact CG-OE1 3.42Å; Q410-E414 PolarHBondContact NE2-OE1 2.95Å; Q410-E414 VanDerWaalsContact NE2-OE1 3.09Å; Q410-E414 WeakPolarHBondContact O-CG 3.36Å; Q410-E414 PolarHBondContact O-N 2.86Å; G411-E414 PolarHBondContact O-N 3.29Å; V412-E414 PolarHBondContact O-N 2.83Å; E414-Q417 PolarHBondContact O-N 2.91Å; E414-S418 WeakPolarHBondContact O-CB 3.24Å; E414-S418 PolarHBondContact O-N 2.89Å
415	A	98.1	Very high	96.7	Very high	13 Å²	13	43.1 Å²	43.1	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-43.8	176.3	0	0	0	0	0	111.7	I397 N398 G411 V412 Q417 S418 C419	I397-A415 HydrophobicContact CD1-CB 3.91Å; I397-A415 HydrophobicContact CG1-CB 3.86Å; N398-A415 HydrophobicContact CB-CB 4.43Å; G411-A415 WeakPolarHBondContact O-CB 3.38Å; G411-A415 PolarHBondContact O-N 2.89Å; V412-A415 PolarHBondContact O-N 2.94Å; A415-Q417 PolarHBondContact O-N 3.05Å; A415-S418 PolarHBondContact O-N 2.86Å; A415-C419 WeakPolarHBondContact O-CB 3.49Å; A415-C419 PolarHBondContact O-N 2.82Å; A415-C419 PolarHBondContact O-SG 2.79Å
416	Y	98.2	Very high	96.6	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-49.9	174.1	167.8	-100.1	0	0	0	111.9	I330 F332 H346 N354 L357 V412 V413 S418 C419 L420	I330-Y416 HydrophobicContact CD1-CD2 3.57Å; I330-Y416 HydrophobicContact CD1-CE2 4.3Å; I330-Y416 HydrophobicContact CD1-CG 4.17Å; I330-Y416 HydrophobicContact CG2-CD2 4.08Å; I330-Y416 HydrophobicContact CG2-CE2 3.86Å; F332-Y416 HydrophobicContact CE1-CD2 4.08Å; F332-Y416 AromaticContact CE1-CE2 3.99Å; F332-Y416 HydrophobicContact CE1-CE2 3.99Å; F332-Y416 AromaticContact CZ-CD2 3.75Å; F332-Y416 HydrophobicContact CZ-CD2 3.75Å; F332-Y416 HydrophobicContact CZ-CE2 4.06Å; H346-Y416 AromaticContact CE1-CE2 3.96Å; H346-Y416 AromaticContact ND1-CE2 3.65Å; H346-Y416 AromaticContact ND1-CZ 3.64Å; H346-Y416 PolarHBondContact ND1-OH 2.65Å; N354-Y416 PolarHBondContact ND2-OH 3.04Å; N354-Y416 VanDerWaalsContact ND2-OH 3.09Å; L357-Y416 HydrophobicContact CD1-CE1 4.23Å; L357-Y416 HydrophobicContact CD2-CD1 3.66Å; L357-Y416 HydrophobicContact CD2-CE1 3.87Å; L357-Y416 HydrophobicContact CG-CD1 4.14Å; L357-Y416 HydrophobicContact CG-CE1 3.8Å; V412-Y416 WeakPolarHBondContact O-CB 3.3Å; V412-Y416 PolarHBondContact O-N 3.25Å; V413-Y416 PolarHBondContact O-N 2.9Å; Y416-S418 VanDerWaalsContact C-N 3.31Å; Y416-S418 PolarHBondContact O-N 2.75Å; Y416-C419 PolarHBondContact O-N 2.84Å; Y416-C419 PolarHBondContact O-SG 2.86Å; Y416-L420 WeakPolarHBondContact O-CB 3.32Å; Y416-L420 PolarHBondContact O-N 2.93Å
417	Q	96.6	Very high	96.4	Very high	75 Å²	75	45.1 Å²	45.1	35%	0.35	25%	0.25	S	C	.	.	H	α-helix	trans	-65	-35.3	179.5	-68.8	176.3	-14	0	0	112.5	I348 V413 E414 A415 P421	I348-Q417 HydrophobicContact CD1-CB 4.12Å; I348-Q417 HydrophobicContact CD1-CG 3.99Å; V413-Q417 VanDerWaalsContact O-CG 3.29Å; V413-Q417 WeakPolarHBondContact O-CG 3.21Å; V413-Q417 PolarHBondContact O-N 3Å; E414-Q417 PolarHBondContact O-N 2.91Å; A415-Q417 PolarHBondContact O-N 3.05Å; Q417-P421 VanDerWaalsContact O-CD 3.27Å; Q417-P421 WeakPolarHBondContact O-CD 3.49Å
418	S	96.5	Very high	96.3	Very high	63 Å²	63	44.7 Å²	44.7	44%	0.441	24%	0.241	S	C	.	.	H	α-helix	trans	-76.4	-31.9	-179.7	-178.9	0	0	0	0	113.6	E414 A415 Y416 K422	E414-S418 WeakPolarHBondContact O-CB 3.24Å; E414-S418 PolarHBondContact O-N 2.89Å; A415-S418 PolarHBondContact O-N 2.86Å; Y416-S418 VanDerWaalsContact C-N 3.31Å; Y416-S418 PolarHBondContact O-N 2.75Å; S418-K422 WeakPolarHBondContact O-CD 3.37Å; S418-K422 WeakPolarHBondContact O-CE 3.23Å; S418-K422 PolarHBondContact O-NZ 2.98Å; S418-K422 VanDerWaalsContact O-NZ 3.09Å; S418-K422 PolarHBondContact OG-NZ 3.35Å
419	C	96.6	Very high	96.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-83.4	-40.4	-177.5	73	0	0	0	0	113	I397 F399 A415 Y416 P421 K422 L423	I397-C419 HydrophobicContact CB-CB 4.46Å; I397-C419 WeakPolarHBondContact O-CB 3.37Å; F399-C419 HydrophobicContact CE2-CB 3.64Å; F399-C419 HydrophobicContact CZ-CB 3.74Å; A415-C419 WeakPolarHBondContact O-CB 3.49Å; A415-C419 PolarHBondContact O-N 2.82Å; A415-C419 PolarHBondContact O-SG 2.79Å; Y416-C419 PolarHBondContact O-N 2.84Å; Y416-C419 PolarHBondContact O-SG 2.86Å; C419-P421 VanDerWaalsContact C-CD 3.46Å; C419-K422 WeakPolarHBondContact O-CA 3.38Å; C419-K422 WeakPolarHBondContact O-CB 3.4Å; C419-K422 PolarHBondContact O-N 3.39Å; C419-L423 WeakPolarHBondContact O-CG 3.28Å; C419-L423 PolarHBondContact O-N 3Å
420	L	96.6	Very high	96.3	Very high	5 Å²	5	46 Å²	46	3%	0.026	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-46.4	-48.1	-175.5	-178	67.4	0	0	0	114.8	F332 P339 H346 I348 Y416 K422 L423 L425	F332-L420 HydrophobicContact CD1-CD1 3.79Å; F332-L420 HydrophobicContact CE1-CB 4.35Å; F332-L420 HydrophobicContact CE1-CD1 3.68Å; P339-L420 HydrophobicContact CB-CD1 4.15Å; P339-L420 HydrophobicContact CB-CD2 3.97Å; P339-L420 HydrophobicContact CB-CG 3.99Å; P339-L420 HydrophobicContact CG-CD1 3.68Å; P339-L420 HydrophobicContact CG-CD2 4.43Å; P339-L420 HydrophobicContact CG-CG 4.02Å; H346-L420 HydrophobicContact CB-CD1 3.84Å; H346-L420 HydrophobicContact CB-CD2 3.97Å; H346-L420 WeakPolarHBondContact O-CD2 3.46Å; I348-L420 HydrophobicContact CD1-CD2 3.76Å; I348-L420 HydrophobicContact CG1-CD2 3.95Å; Y416-L420 WeakPolarHBondContact O-CB 3.32Å; Y416-L420 PolarHBondContact O-N 2.93Å; L420-K422 PolarHBondContact O-N 2.85Å; L420-L423 PolarHBondContact O-N 3.07Å; L420-L425 HydrophobicContact CD1-CD2 4.37Å
421	P	95.3	Very high	96.4	Very high	103 Å²	103	40.5 Å²	40.5	67%	0.669	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-70.8	-12.1	-179.3	28.3	-36.3	0	0	0	114.5	Q417 C419	Q417-P421 VanDerWaalsContact O-CD 3.27Å; Q417-P421 WeakPolarHBondContact O-CD 3.49Å; C419-P421 VanDerWaalsContact C-CD 3.46Å
422	K	95.6	Very high	96.4	Very high	98 Å²	98	40 Å²	40	43%	0.426	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-95.6	-15.1	-179.8	-61.1	160.6	-177.9	156.2	0	112.4	P386 F399 S418 C419 L420	P386-K422 HydrophobicContact CG-CB 4.5Å; F399-K422 HydrophobicContact CD2-CD 4.43Å; F399-K422 HydrophobicContact CE2-CB 4.37Å; F399-K422 HydrophobicContact CE2-CD 3.59Å; F399-K422 HydrophobicContact CZ-CB 4.15Å; F399-K422 HydrophobicContact CZ-CD 4.2Å; S418-K422 WeakPolarHBondContact O-CD 3.37Å; S418-K422 WeakPolarHBondContact O-CE 3.23Å; S418-K422 PolarHBondContact O-NZ 2.98Å; S418-K422 VanDerWaalsContact O-NZ 3.09Å; S418-K422 PolarHBondContact OG-NZ 3.35Å; C419-K422 WeakPolarHBondContact O-CA 3.38Å; C419-K422 WeakPolarHBondContact O-CB 3.4Å; C419-K422 PolarHBondContact O-N 3.39Å; L420-K422 PolarHBondContact O-N 2.85Å
423	L	96.3	Very high	96.4	Very high	17 Å²	17	41.8 Å²	41.8	9%	0.089	23%	0.226	C	C	.	.			trans	-86.7	150.3	-177.2	-62.3	174.8	0	0	0	111.4	F332 A383 I385 F395 F399 C419 L420	F332-L423 HydrophobicContact CB-CD1 4.31Å; F332-L423 HydrophobicContact CD1-CD1 3.53Å; F332-L423 HydrophobicContact CD2-CD1 4.07Å; F332-L423 HydrophobicContact CE1-CD1 3.67Å; F332-L423 HydrophobicContact CE2-CD1 4.19Å; F332-L423 HydrophobicContact CG-CD1 3.73Å; F332-L423 HydrophobicContact CZ-CD1 4Å; A383-L423 HydrophobicContact CB-CB 4.42Å; I385-L423 HydrophobicContact CG2-CD2 3.51Å; F395-L423 HydrophobicContact CE2-CD1 3.97Å; F395-L423 HydrophobicContact CE2-CD2 3.82Å; F395-L423 HydrophobicContact CZ-CD1 3.68Å; F395-L423 HydrophobicContact CZ-CD2 3.86Å; F395-L423 HydrophobicContact CZ-CG 4.44Å; F399-L423 HydrophobicContact CE1-CD2 4.01Å; F399-L423 HydrophobicContact CZ-CD2 4.03Å; C419-L423 WeakPolarHBondContact O-CG 3.28Å; C419-L423 PolarHBondContact O-N 3Å; L420-L423 PolarHBondContact O-N 3.07Å
424	Q	96.9	Very high	96.4	Very high	83 Å²	83	41.2 Å²	41.2	39%	0.388	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.9	162.1	-75.3	177.2	16.1	0	0	108.1	R384 Y389 Y426	R384-Q424 HydrophobicContact CB-CB 3.94Å; R384-Q424 PolarHBondContact N-O 2.68Å; R384-Q424 PolarHBondContact O-N 2.81Å; R384-Q424 VanDerWaalsContact O-N 3.13Å; Y389-Q424 HydrophobicContact CD1-CB 4.31Å; Y389-Q424 VanDerWaalsContact CD1-CD 3.45Å; Y389-Q424 HydrophobicContact CD1-CG 3.83Å; Y389-Q424 HydrophobicContact CE1-CG 3.89Å; Q424-Y426 PolarHBondContact O-N 3.15Å
425	L	96.6	Very high	96.5	Very high	31 Å²	31	36.2 Å²	36.2	16%	0.162	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	131.9	176.6	-53.1	-172	0	0	0	109.9	F332 A334 N336 G337 P339 L420	F332-L425 HydrophobicContact CB-CD2 3.81Å; F332-L425 HydrophobicContact CD1-CD2 4.02Å; F332-L425 HydrophobicContact CG-CD2 4.43Å; F332-L425 WeakPolarHBondContact O-CA 3.49Å; F332-L425 WeakPolarHBondContact O-CB 3.29Å; F332-L425 WeakPolarHBondContact O-CD2 3.4Å; A334-L425 HydrophobicContact CB-CB 4.44Å; N336-L425 HydrophobicContact CB-CD1 4.41Å; G337-L425 VanDerWaalsContact O-CD1 3.24Å; G337-L425 WeakPolarHBondContact O-CD1 3.33Å; P339-L425 HydrophobicContact CG-CD1 3.85Å; P339-L425 HydrophobicContact CG-CG 4.31Å; L420-L425 HydrophobicContact CD1-CD2 4.37Å
426	Y	96	Very high	96.5	Very high	103 Å²	103	40.7 Å²	40.7	40%	0.404	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-145.7	-139.6	-171.1	-164.9	-112.7	0	0	0	111.7	F332 T333 A334 G382 R384 V391 Q424	F332-Y426 PolarHBondContact O-N 3.13Å; T333-Y426 CarbonylContact C-O 3.6Å; T333-Y426 WeakPolarHBondContact CA-O 3.4Å; T333-Y426 WeakPolarHBondContact CB-O 3.42Å; A334-Y426 PolarHBondContact N-O 3.36Å; G382-Y426 CarbonylContact O-C 3.55Å; G382-Y426 WeakPolarHBondContact O-CA 3.12Å; G382-Y426 PolarHBondContact O-N 2.64Å; G382-Y426 VanDerWaalsContact O-N 3.1Å; R384-Y426 HydrophobicContact CG-CD1 4.18Å; R384-Y426 HydrophobicContact CG-CG 4.04Å; R384-Y426 PolarHBondContact NH2-OH 3.09Å; V391-Y426 HydrophobicContact CB-CD1 4.37Å; V391-Y426 HydrophobicContact CG1-CD1 4.04Å; V391-Y426 HydrophobicContact CG2-CD1 3.39Å; V391-Y426 HydrophobicContact CG2-CE1 3.52Å; V391-Y426 HydrophobicContact CG2-CG 4.47Å; Q424-Y426 PolarHBondContact O-N 3.15Å
427	G	92.8	Very high	96.4	Very high	18 Å²	18	43.3 Å²	43.3	19%	0.186	23%	0.229	C	C	.	.			trans	-174.6	179.3	177.6	0	0	0	0	0	111	G382	G382-G427 PolarHBondContact O-N 3.41Å
428	P	94.9	Very high	96.5	Very high	60 Å²	60	40 Å²	40	39%	0.39	21%	0.214	S	C	.	.			cis	-85.3	-179.4	5.7	39.4	-41.7	0	0	0	113.3	H393 N430 T466	H393-P428 PolarHBondContact CE1-O 3.43Å; P428-N430 VanDerWaalsContact C-N 3.32Å; P428-N430 PolarHBondContact O-N 3.43Å; P428-N430 VanDerWaalsContact O-N 3.09Å; P428-T466 HydrophobicContact CB-CG2 3.98Å; P428-T466 WeakPolarHBondContact CB-OG1 3.39Å
429	T	94.2	Very high	96.6	Very high	13 Å²	13	37 Å²	37	8%	0.08	19%	0.193	C	C	.	.			trans	-84.4	72.7	178.8	-47.4	0	0	0	0	110.5	T333 F381 V464 T466	T333-T429 HydrophobicContact CG2-CG2 4.45Å; F381-T429 HydrophobicContact CE2-CG2 4.07Å; T429-V464 WeakPolarHBondContact CB-O 3.49Å; T429-T466 PolarHBondContact N-OG1 3.05Å; T429-T466 VanDerWaalsContact N-OG1 3.07Å; T429-T466 PolarHBondContact O-N 2.75Å; T429-T466 PolarHBondContact O-OG1 2.82Å
430	N	95.9	Very high	96.6	Very high	36 Å²	36	44 Å²	44	19%	0.193	22%	0.224	C	C	.	.			trans	-96.3	122.7	179.3	-71.3	-4.7	0	0	0	111.2	P428 T466 D467	P428-N430 VanDerWaalsContact C-N 3.32Å; P428-N430 PolarHBondContact O-N 3.43Å; P428-N430 VanDerWaalsContact O-N 3.09Å; N430-T466 PolarHBondContact OD1-OG1 3.32Å; N430-D467 VanDerWaalsContact CA-CG 3.43Å; N430-D467 WeakPolarHBondContact CA-OD1 3.44Å; N430-D467 WeakPolarHBondContact CA-OD2 3.31Å; N430-D467 HydrophobicContact CB-CB 4.19Å; N430-D467 VanDerWaalsContact CB-OD2 3.22Å; N430-D467 WeakPolarHBondContact CB-OD2 3.07Å; N430-D467 WeakPolarHBondContact OD1-CB 3.47Å
431	I	96.7	Very high	96.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.			trans	-114.1	-10.8	-179.4	70.1	169.3	0	0	0	113.6	F381 P433 I434 I435 I459 I465 D467 T471 I487	F381-I431 HydrophobicContact CD2-CG2 4.25Å; F381-I431 HydrophobicContact CE2-CG2 3.67Å; F381-I431 HydrophobicContact CZ-CG2 3.84Å; I431-P433 VanDerWaalsContact C-CD 3.41Å; I431-P433 VanDerWaalsContact C-N 3.33Å; I431-I434 HydrophobicContact CB-CG2 4.37Å; I431-I434 WeakPolarHBondContact O-CG2 3.45Å; I431-I434 PolarHBondContact O-N 2.89Å; I431-I435 HydrophobicContact CD1-CD1 4.16Å; I431-I435 HydrophobicContact CG1-CD1 4.17Å; I431-I435 WeakPolarHBondContact O-CG1 3.27Å; I431-I435 PolarHBondContact O-N 3.43Å; I431-I459 HydrophobicContact CB-CD1 4.38Å; I431-I459 HydrophobicContact CD1-CD1 4.11Å; I431-I459 HydrophobicContact CG2-CG2 4.31Å; I431-I465 HydrophobicContact CD1-CD1 3.47Å; I431-I465 VanDerWaalsContact CD1-CD1 3.47Å; I431-I465 HydrophobicContact CD1-CG1 3.89Å; I431-I465 HydrophobicContact CD1-CG2 4.38Å; I431-I465 HydrophobicContact CG1-CD1 4.27Å; I431-I465 HydrophobicContact CG1-CG1 4.28Å; I431-I465 HydrophobicContact CG1-CG2 3.99Å; I431-D467 PolarHBondContact N-OD1 2.89Å; I431-D467 VanDerWaalsContact N-OD1 3.11Å; I431-D467 PolarHBondContact N-OD2 3.21Å; I431-D467 VanDerWaalsContact N-OD2 3.13Å; I431-T471 HydrophobicContact CD1-CG2 3.91Å; I431-T471 HydrophobicContact CG1-CG2 3.9Å; I431-T471 VanDerWaalsContact CG1-OG1 3.31Å; I431-T471 WeakPolarHBondContact CG1-OG1 3.3Å; I431-I487 HydrophobicContact CD1-CD1 4.26Å
432	A	97.8	Very high	96.6	Very high	3 Å²	3	41.4 Å²	41.4	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-56.5	-40.4	175.7	0	0	0	0	0	113	I434 I435 Q436 D467 D470 T471 A474	A432-I434 PolarHBondContact O-N 2.81Å; A432-I435 PolarHBondContact O-N 2.96Å; A432-Q436 WeakPolarHBondContact O-CB 3.4Å; A432-Q436 VanDerWaalsContact O-CG 3.27Å; A432-Q436 WeakPolarHBondContact O-CG 3.39Å; A432-Q436 PolarHBondContact O-N 2.88Å; A432-D467 WeakPolarHBondContact CB-OD2 3.45Å; A432-D467 PolarHBondContact N-OD2 3.02Å; A432-D470 HydrophobicContact CB-CB 3.72Å; A432-T471 PolarHBondContact N-OG1 2.92Å; A432-A474 HydrophobicContact CB-CB 4.44Å
433	P	98.1	Very high	96.6	Very high	37 Å²	37	38.9 Å²	38.9	24%	0.24	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-42.9	179.8	-27.1	37.7	0	0	0	113.5	H393 D394 I431 Q436 K437	H393-P433 HydrophobicContact CB-CB 4.09Å; H393-P433 HydrophobicContact CB-CG 3.84Å; D394-P433 HydrophobicContact CB-CB 4.47Å; I431-P433 VanDerWaalsContact C-CD 3.41Å; I431-P433 VanDerWaalsContact C-N 3.33Å; P433-Q436 PolarHBondContact O-N 3Å; P433-K437 WeakPolarHBondContact O-CB 2.91Å; P433-K437 PolarHBondContact O-N 2.98Å
434	I	98	Very high	96.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-73.3	-35.4	-178.4	-169.3	56.3	0	0	0	112.2	A329 F379 D394 I431 A432 K437 V438 L457 I459	A329-I434 HydrophobicContact CB-CG1 3.65Å; A329-I434 HydrophobicContact CB-CG2 4.29Å; F379-I434 HydrophobicContact CB-CD1 3.66Å; F379-I434 HydrophobicContact CB-CG1 4.49Å; F379-I434 HydrophobicContact CD1-CD1 4.46Å; F379-I434 HydrophobicContact CD2-CD1 3.66Å; F379-I434 HydrophobicContact CE2-CD1 4.41Å; F379-I434 HydrophobicContact CG-CD1 3.67Å; D394-I434 HydrophobicContact CB-CD1 4.26Å; I431-I434 HydrophobicContact CB-CG2 4.37Å; I431-I434 WeakPolarHBondContact O-CG2 3.45Å; I431-I434 PolarHBondContact O-N 2.89Å; A432-I434 PolarHBondContact O-N 2.81Å; I434-K437 HydrophobicContact CD1-CB 4.4Å; I434-K437 HydrophobicContact CD1-CD 4.23Å; I434-K437 PolarHBondContact O-N 2.99Å; I434-V438 PolarHBondContact O-N 3.4Å; I434-L457 HydrophobicContact CG1-CD1 4.15Å; I434-L457 HydrophobicContact CG1-CD2 4.47Å; I434-I459 HydrophobicContact CG2-CD1 4.38Å
435	I	98.5	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-46.9	171.7	-64	169.7	0	0	0	109.9	I431 A432 K437 V438 A439 L457 I459 T471 A474 I475 A478 V485	I431-I435 HydrophobicContact CD1-CD1 4.16Å; I431-I435 HydrophobicContact CG1-CD1 4.17Å; I431-I435 WeakPolarHBondContact O-CG1 3.27Å; I431-I435 PolarHBondContact O-N 3.43Å; A432-I435 PolarHBondContact O-N 2.96Å; I435-K437 VanDerWaalsContact C-N 3.35Å; I435-K437 PolarHBondContact O-N 2.91Å; I435-V438 PolarHBondContact O-N 3.26Å; I435-A439 WeakPolarHBondContact O-CB 3.34Å; I435-A439 PolarHBondContact O-N 3.01Å; I435-L457 HydrophobicContact CB-CD2 4.43Å; I435-L457 HydrophobicContact CG1-CD2 3.96Å; I435-I459 HydrophobicContact CD1-CD1 4.37Å; I435-I459 HydrophobicContact CG1-CD1 4.06Å; I435-T471 HydrophobicContact CD1-CG2 4.16Å; I435-A474 HydrophobicContact CB-CB 4.12Å; I435-A474 HydrophobicContact CG2-CB 3.77Å; I435-I475 HydrophobicContact CD1-CD1 4.49Å; I435-I475 HydrophobicContact CD1-CG1 4.12Å; I435-A478 HydrophobicContact CG2-CB 4.42Å; I435-V485 HydrophobicContact CG2-CG2 4.47Å
436	Q	98.4	Very high	96	Very high	107 Å²	107	41.2 Å²	41.2	50%	0.5	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-38.7	178.8	-72.1	173.7	4.4	0	0	112.5	A432 P433 A439 K440 A474	A432-Q436 WeakPolarHBondContact O-CB 3.4Å; A432-Q436 VanDerWaalsContact O-CG 3.27Å; A432-Q436 WeakPolarHBondContact O-CG 3.39Å; A432-Q436 PolarHBondContact O-N 2.88Å; P433-Q436 PolarHBondContact O-N 3Å; Q436-A439 PolarHBondContact O-N 3.16Å; Q436-K440 PolarHBondContact O-N 3.34Å; Q436-A474 HydrophobicContact CG-CB 3.97Å
437	K	97.4	Very high	95.7	Very high	57 Å²	57	42.3 Å²	42.3	25%	0.248	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-50.6	176.6	177.1	171.2	-73.3	-176.8	0	111.3	F379 D394 P433 I434 I435 K440	F379-K437 HydrophobicContact CD1-CD 4.27Å; F379-K437 HydrophobicContact CE1-CD 3.78Å; F379-K437 HydrophobicContact CE2-CD 4.29Å; F379-K437 HydrophobicContact CZ-CD 3.78Å; D394-K437 HydrophobicContact CB-CD 4.45Å; D394-K437 VanDerWaalsContact CG-NZ 3.31Å; D394-K437 PolarHBondContact O-NZ 2.95Å; D394-K437 WeakPolarHBondContact OD2-CE 3.45Å; D394-K437 IonicContact OD2-NZ 2.73Å; D394-K437 PolarHBondContact OD2-NZ 3.31Å; P433-K437 WeakPolarHBondContact O-CB 2.91Å; P433-K437 PolarHBondContact O-N 2.98Å; I434-K437 HydrophobicContact CD1-CB 4.4Å; I434-K437 HydrophobicContact CD1-CD 4.23Å; I434-K437 PolarHBondContact O-N 2.99Å; I435-K437 VanDerWaalsContact C-N 3.35Å; I435-K437 PolarHBondContact O-N 2.91Å; K437-K440 WeakPolarHBondContact O-CB 3.36Å; K437-K440 PolarHBondContact O-N 3.35Å
438	V	97.9	Very high	95.6	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-72.4	-35.7	179.7	-176.5	0	0	0	0	111.6	T327 I434 I435 K440 S441 A442 F455 L457 M483	T327-V438 HydrophobicContact CG2-CG2 3.76Å; I434-V438 PolarHBondContact O-N 3.4Å; I435-V438 PolarHBondContact O-N 3.26Å; V438-K440 PolarHBondContact O-N 3.19Å; V438-S441 PolarHBondContact O-N 3.18Å; V438-S441 VanDerWaalsContact O-N 3.12Å; V438-A442 PolarHBondContact O-N 3.06Å; V438-F455 HydrophobicContact CG1-CB 4.07Å; V438-F455 HydrophobicContact CG1-CD1 4.28Å; V438-L457 HydrophobicContact CB-CD2 4.49Å; V438-L457 HydrophobicContact CG2-CB 4.45Å; V438-L457 HydrophobicContact CG2-CD1 4.13Å; V438-L457 HydrophobicContact CG2-CD2 4.22Å; V438-L457 HydrophobicContact CG2-CG 4.49Å; V438-M483 HydrophobicContact CB-CE 3.49Å; V438-M483 VanDerWaalsContact CB-CE 3.49Å; V438-M483 HydrophobicContact CB-SD 4.19Å; V438-M483 HydrophobicContact CG1-CE 3.44Å; V438-M483 VanDerWaalsContact CG1-CE 3.44Å; V438-M483 HydrophobicContact CG1-SD 3.93Å; V438-M483 HydrophobicContact CG2-CE 4.48Å
439	A	98.1	Very high	95.2	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-34.8	173.8	0	0	0	0	0	112	I435 Q436 A442 S443 A478 L481 M483	I435-A439 WeakPolarHBondContact O-CB 3.34Å; I435-A439 PolarHBondContact O-N 3.01Å; Q436-A439 PolarHBondContact O-N 3.16Å; A439-A442 PolarHBondContact O-N 3.08Å; A439-S443 WeakPolarHBondContact O-CB 3.11Å; A439-S443 PolarHBondContact O-N 2.93Å; A439-A478 HydrophobicContact CB-CB 4.39Å; A439-L481 HydrophobicContact CB-CD1 3.81Å; A439-L481 VanDerWaalsContact O-CD1 3.23Å; A439-L481 WeakPolarHBondContact O-CD1 3.26Å; A439-M483 HydrophobicContact CB-SD 4.18Å
440	K	96.6	Very high	95.1	Very high	147 Å²	147	53.7 Å²	53.7	64%	0.639	27%	0.273	S	S	*	.	H	α-helix	trans	-59.8	-48.2	174.2	-173.4	-174.6	173.4	-169.3	0	111.5	Q436 K437 V438 S443 E444	Q436-K440 PolarHBondContact O-N 3.34Å; K437-K440 WeakPolarHBondContact O-CB 3.36Å; K437-K440 PolarHBondContact O-N 3.35Å; V438-K440 PolarHBondContact O-N 3.19Å; K440-S443 WeakPolarHBondContact O-CB 3.15Å; K440-S443 PolarHBondContact O-N 3.32Å; K440-E444 PolarHBondContact O-N 3.21Å
441	S	94.6	Very high	94.9	Very high	53 Å²	53	52 Å²	52	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-62.2	-43.8	175.8	-58.3	0	0	0	0	112	V438 S443 E444 E445	V438-S441 PolarHBondContact O-N 3.18Å; V438-S441 VanDerWaalsContact O-N 3.12Å; S441-S443 VanDerWaalsContact C-N 3.27Å; S441-S443 PolarHBondContact O-N 3.31Å; S441-E444 WeakPolarHBondContact O-CB 3.24Å; S441-E444 PolarHBondContact O-N 3.16Å; S441-E444 VanDerWaalsContact O-N 3.1Å; S441-E445 PolarHBondContact O-N 3.08Å
442	A	96.9	Very high	94.7	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-32.4	176.2	0	0	0	0	0	113	V438 A439 E444 E445 T446 F455 L481 P482 M483	V438-A442 PolarHBondContact O-N 3.06Å; A439-A442 PolarHBondContact O-N 3.08Å; A442-E444 VanDerWaalsContact C-N 3.3Å; A442-E444 PolarHBondContact O-N 3.18Å; A442-E445 PolarHBondContact O-N 3.44Å; A442-T446 PolarHBondContact O-N 3.17Å; A442-T446 PolarHBondContact O-OG1 2.53Å; A442-F455 HydrophobicContact CB-CB 4.34Å; A442-F455 HydrophobicContact CB-CD2 3.62Å; A442-F455 HydrophobicContact CB-CE2 4.15Å; A442-F455 HydrophobicContact CB-CG 4.01Å; A442-L481 HydrophobicContact CB-CB 4.08Å; A442-L481 HydrophobicContact CB-CD1 4.46Å; A442-P482 HydrophobicContact CB-CG 4.22Å; A442-P482 VanDerWaalsContact O-CD 3.28Å; A442-P482 WeakPolarHBondContact O-CD 3.2Å; A442-P482 WeakPolarHBondContact O-CG 3.38Å; A442-M483 HydrophobicContact CB-CB 4.07Å
443	S	96.6	Very high	94.6	Very high	46 Å²	46	56 Å²	56	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-67.2	-30	175	-174.7	0	0	0	0	112.8	A439 K440 S441 T446 N447	A439-S443 WeakPolarHBondContact O-CB 3.11Å; A439-S443 PolarHBondContact O-N 2.93Å; K440-S443 WeakPolarHBondContact O-CB 3.15Å; K440-S443 PolarHBondContact O-N 3.32Å; S441-S443 VanDerWaalsContact C-N 3.27Å; S441-S443 PolarHBondContact O-N 3.31Å; S443-T446 WeakPolarHBondContact O-CB 3.45Å; S443-T446 PolarHBondContact O-N 3.17Å; S443-N447 PolarHBondContact O-ND2 2.69Å
444	E	94.1	Very high	94.5	Very high	121 Å²	121	54.2 Å²	54.2	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-68.3	-42.1	176.6	-67.9	172.8	-173.9	0	0	110.7	K440 S441 A442 T446 N447	K440-E444 PolarHBondContact O-N 3.21Å; S441-E444 WeakPolarHBondContact O-CB 3.24Å; S441-E444 PolarHBondContact O-N 3.16Å; S441-E444 VanDerWaalsContact O-N 3.1Å; A442-E444 VanDerWaalsContact C-N 3.3Å; A442-E444 PolarHBondContact O-N 3.18Å; E444-T446 PolarHBondContact O-N 2.77Å; E444-N447 WeakPolarHBondContact O-CB 3.43Å; E444-N447 PolarHBondContact O-N 3.21Å; E444-N447 VanDerWaalsContact O-N 3.08Å; E444-N447 PolarHBondContact O-ND2 3.24Å
445	E	92.2	Very high	94.5	Very high	12 Å²	12	55 Å²	55	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-31.8	174.9	172.6	60.8	172	0	0	112.4	S441 A442 N447 T448 S452 Q453 F455 P482	S441-E445 PolarHBondContact O-N 3.08Å; A442-E445 PolarHBondContact O-N 3.44Å; E445-N447 PolarHBondContact O-N 3.09Å; E445-T448 PolarHBondContact O-N 3.34Å; E445-T448 PolarHBondContact O-OG1 3.22Å; E445-T448 VanDerWaalsContact OE2-CG2 3.24Å; E445-T448 WeakPolarHBondContact OE2-CG2 3.43Å; E445-T448 PolarHBondContact OE2-OG1 3.28Å; E445-S452 VanDerWaalsContact OE1-CA 3.29Å; E445-S452 WeakPolarHBondContact OE1-CA 3.04Å; E445-S452 WeakPolarHBondContact OE1-CB 3.4Å; E445-S452 PolarHBondContact OE1-N 3.48Å; E445-S452 PolarHBondContact OE1-OG 3.09Å; E445-Q453 HydrophobicContact CG-CB 4.19Å; E445-Q453 WeakPolarHBondContact CG-O 3.32Å; E445-Q453 PolarHBondContact OE1-N 2.95Å; E445-F455 HydrophobicContact CB-CE2 3.97Å; E445-F455 HydrophobicContact CG-CE2 4.48Å; E445-P482 HydrophobicContact CB-CG 4.25Å; E445-P482 HydrophobicContact CG-CG 4.07Å
446	T	90.7	Very high	94.4	Very high	47 Å²	47	55 Å²	55	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-27.2	176.8	-55.4	0	0	0	0	112.4	A442 S443 E444 T448 P482	A442-T446 PolarHBondContact O-N 3.17Å; A442-T446 PolarHBondContact O-OG1 2.53Å; S443-T446 WeakPolarHBondContact O-CB 3.45Å; S443-T446 PolarHBondContact O-N 3.17Å; E444-T446 PolarHBondContact O-N 2.77Å; T446-T448 VanDerWaalsContact C-N 3.34Å; T446-P482 WeakPolarHBondContact OG1-CD 3.49Å
447	N	89.8	Confident	94.4	Very high	125 Å²	125	49.9 Å²	49.9	67%	0.668	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-22.2	179.1	-62.1	-49.4	0	0	0	113.3	S443 E444 E445 K449	S443-N447 PolarHBondContact O-ND2 2.69Å; E444-N447 WeakPolarHBondContact O-CB 3.43Å; E444-N447 PolarHBondContact O-N 3.21Å; E444-N447 VanDerWaalsContact O-N 3.08Å; E444-N447 PolarHBondContact O-ND2 3.24Å; E445-N447 PolarHBondContact O-N 3.09Å; N447-K449 VanDerWaalsContact C-N 3.27Å; N447-K449 PolarHBondContact O-N 2.9Å
448	T	89.6	Confident	94.5	Very high	65 Å²	65	47.1 Å²	47.1	40%	0.399	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-27.4	179.2	72.2	0	0	0	0	111.3	E445 T446 E450	E445-T448 PolarHBondContact O-N 3.34Å; E445-T448 PolarHBondContact O-OG1 3.22Å; E445-T448 VanDerWaalsContact OE2-CG2 3.24Å; E445-T448 WeakPolarHBondContact OE2-CG2 3.43Å; E445-T448 PolarHBondContact OE2-OG1 3.28Å; T446-T448 VanDerWaalsContact C-N 3.34Å; T448-E450 PolarHBondContact O-N 3.43Å; T448-E450 PolarHBondContact OG1-N 3.35Å
449	K	87.4	Confident	94.5	Very high	168 Å²	168	46.9 Å²	46.9	73%	0.73	24%	0.24	S	C	*	.			trans	57.4	20.5	-172.4	-56	-179.8	-179.7	176.3	0	113.2	N447	N447-K449 VanDerWaalsContact C-N 3.27Å; N447-K449 PolarHBondContact O-N 2.9Å
450	E	91.4	Very high	94.5	Very high	97 Å²	97	46.9 Å²	46.9	45%	0.453	24%	0.239	S	C	.	.	S	Bend	trans	-110.9	158.7	176	-66.2	-173.9	169.5	0	0	109.1	T448 S452 K561	T448-E450 PolarHBondContact O-N 3.43Å; T448-E450 PolarHBondContact OG1-N 3.35Å; E450-S452 VanDerWaalsContact C-N 3.34Å; E450-S452 WeakPolarHBondContact CB-OG 3.22Å; E450-S452 PolarHBondContact O-N 3.06Å; E450-K561 WeakPolarHBondContact OE2-CE 3.46Å; E450-K561 IonicContact OE2-NZ 2.66Å; E450-K561 PolarHBondContact OE2-NZ 3.12Å
451	A	92.9	Very high	94.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	21%	0.209	C	C	.	.	S	Bend	trans	-93.8	70.1	169.4	0	0	0	0	0	108.9	Y317 C322 Y553 I558	Y317-A451 HydrophobicContact CD1-CB 3.59Å; Y317-A451 HydrophobicContact CE1-CB 3.88Å; C322-A451 WeakPolarHBondContact CA-O 3.21Å; C322-A451 WeakPolarHBondContact CB-O 3.03Å; A451-Y553 HydrophobicContact CB-CD1 3.8Å; A451-Y553 HydrophobicContact CB-CD2 4.3Å; A451-Y553 HydrophobicContact CB-CE1 3.53Å; A451-Y553 HydrophobicContact CB-CE2 4.05Å; A451-Y553 HydrophobicContact CB-CG 4.18Å; A451-I558 HydrophobicContact CB-CG2 4.01Å
452	S	92.5	Very high	94.3	Very high	21 Å²	21	37.9 Å²	37.9	15%	0.147	19%	0.194	C	C	.	.			trans	-96	-40.6	-177.8	-40.8	0	0	0	0	111.6	C322 Q323 E445 E450 K561	C322-S452 CarbonylContact C-O 3.57Å; C322-S452 WeakPolarHBondContact CA-O 3.38Å; Q323-S452 PolarHBondContact N-O 3.33Å; E445-S452 VanDerWaalsContact OE1-CA 3.29Å; E445-S452 WeakPolarHBondContact OE1-CA 3.04Å; E445-S452 WeakPolarHBondContact OE1-CB 3.4Å; E445-S452 PolarHBondContact OE1-N 3.48Å; E445-S452 PolarHBondContact OE1-OG 3.09Å; E450-S452 VanDerWaalsContact C-N 3.34Å; E450-S452 WeakPolarHBondContact CB-OG 3.22Å; E450-S452 PolarHBondContact O-N 3.06Å; S452-K561 VanDerWaalsContact OG-CE 3.22Å; S452-K561 WeakPolarHBondContact OG-CE 3.39Å; S452-K561 PolarHBondContact OG-NZ 2.84Å
453	Q	94.5	Very high	93.5	Very high	66 Å²	66	38.2 Å²	38.2	31%	0.308	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.1	-174.5	-65	-175.9	-45.7	0	0	111.3	Q323 E445 F455 Y553	Q323-Q453 CarbonylContact O-C 3.46Å; Q323-Q453 WeakPolarHBondContact O-CA 3.39Å; E445-Q453 HydrophobicContact CG-CB 4.19Å; E445-Q453 WeakPolarHBondContact CG-O 3.32Å; E445-Q453 PolarHBondContact OE1-N 2.95Å; Q453-F455 HydrophobicContact CB-CE2 3.92Å; Q453-F455 HydrophobicContact CB-CZ 4.19Å; Q453-Y553 PolarHBondContact O-OH 3.2Å
454	Y	96.8	Very high	92.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131	170	-167.5	-82.5	0	0	0	109.3	Q323 I324 Q325 I456 P482 S484 R518 Q548 V549 Y552 Y553	Q323-Y454 PolarHBondContact O-N 3.35Å; I324-Y454 CarbonylContact C-O 3.52Å; I324-Y454 WeakPolarHBondContact CA-O 3.35Å; Q325-Y454 PolarHBondContact N-O 3Å; Y454-I456 HydrophobicContact CD1-CG1 4.42Å; Y454-P482 HydrophobicContact CD2-CB 3.89Å; Y454-P482 HydrophobicContact CE2-CB 4.32Å; Y454-S484 WeakPolarHBondContact CE1-OG 3.29Å; Y454-S484 PolarHBondContact OH-OG 3.13Å; Y454-S484 VanDerWaalsContact OH-OG 3.11Å; Y454-R518 PolarHBondContact OH-NH1 2.97Å; Y454-R518 VanDerWaalsContact OH-NH1 3.1Å; Y454-Q548 VanDerWaalsContact OH-C 3.31Å; Y454-Q548 PolarHBondContact OH-O 3.36Å; Y454-Q548 VanDerWaalsContact OH-O 3.08Å; Y454-V549 HydrophobicContact CD1-CG2 3.65Å; Y454-V549 HydrophobicContact CD2-CB 4.37Å; Y454-V549 HydrophobicContact CD2-CG1 4.34Å; Y454-V549 HydrophobicContact CD2-CG2 3.88Å; Y454-V549 HydrophobicContact CE1-CG2 3.64Å; Y454-V549 HydrophobicContact CE2-CB 4.23Å; Y454-V549 HydrophobicContact CE2-CG2 3.85Å; Y454-V549 HydrophobicContact CG-CG2 3.76Å; Y454-Y552 HydrophobicContact CE2-CD1 4.4Å; Y454-Y552 HydrophobicContact CE2-CG 4.38Å; Y454-Y553 AromaticContact CD2-CE2 3.83Å; Y454-Y553 HydrophobicContact CD2-CE2 3.83Å
455	F	97.6	Very high	92.5	Very high	15 Å²	15	33.6 Å²	33.6	7%	0.066	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.7	-169.2	-64.7	-99.5	0	0	0	110.9	Q325 V438 A442 E445 Q453 P482 M483 S484	Q325-F455 HydrophobicContact CB-CD1 3.88Å; Q325-F455 HydrophobicContact CB-CE1 4.05Å; Q325-F455 HydrophobicContact CB-CG 4.44Å; Q325-F455 HydrophobicContact CG-CD1 4.37Å; Q325-F455 HydrophobicContact CG-CE1 4.26Å; Q325-F455 WeakPolarHBondContact O-CA 3.2Å; V438-F455 HydrophobicContact CG1-CB 4.07Å; V438-F455 HydrophobicContact CG1-CD1 4.28Å; A442-F455 HydrophobicContact CB-CB 4.34Å; A442-F455 HydrophobicContact CB-CD2 3.62Å; A442-F455 HydrophobicContact CB-CE2 4.15Å; A442-F455 HydrophobicContact CB-CG 4.01Å; E445-F455 HydrophobicContact CB-CE2 3.97Å; E445-F455 HydrophobicContact CG-CE2 4.48Å; Q453-F455 HydrophobicContact CB-CE2 3.92Å; Q453-F455 HydrophobicContact CB-CZ 4.19Å; F455-P482 HydrophobicContact CD2-CG 4.47Å; F455-P482 PolarHBondContact N-O 3.18Å; F455-M483 HydrophobicContact CB-CB 4.29Å; F455-M483 HydrophobicContact CB-CG 4.19Å; F455-M483 CarbonylContact O-C 3.57Å; F455-M483 WeakPolarHBondContact O-CA 3.39Å; F455-S484 PolarHBondContact O-N 2.96Å
456	I	97.3	Very high	92.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	120.6	171.9	-60.7	-178.9	0	0	0	107.9	I324 Q325 F326 T327 Y454 I486 V545	I324-I456 HydrophobicContact CG2-CD1 3.31Å; I324-I456 HydrophobicContact CG2-CG1 3.81Å; Q325-I456 PolarHBondContact O-N 3.43Å; F326-I456 HydrophobicContact CD2-CB 4.14Å; F326-I456 HydrophobicContact CD2-CG2 3.93Å; F326-I456 HydrophobicContact CE2-CG2 4.15Å; T327-I456 PolarHBondContact N-O 2.85Å; Y454-I456 HydrophobicContact CD1-CG1 4.42Å; I456-I486 HydrophobicContact CG2-CD1 3.62Å; I456-I486 HydrophobicContact CG2-CG1 4.21Å; I456-V545 HydrophobicContact CD1-CG1 3.6Å; I456-V545 HydrophobicContact CD1-CG2 4.26Å; I456-V545 HydrophobicContact CG1-CG1 4.46Å
457	L	98.3	Very high	92.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.6	171.2	170.8	58.3	0	0	0	109.5	T327 A329 I434 I435 V438 I459 M483 S484 I486	T327-L457 HydrophobicContact CG2-CD1 3.99Å; T327-L457 WeakPolarHBondContact O-CA 3.27Å; A329-L457 HydrophobicContact CB-CD1 3.86Å; I434-L457 HydrophobicContact CG1-CD1 4.15Å; I434-L457 HydrophobicContact CG1-CD2 4.47Å; I435-L457 HydrophobicContact CB-CD2 4.43Å; I435-L457 HydrophobicContact CG1-CD2 3.96Å; V438-L457 HydrophobicContact CB-CD2 4.49Å; V438-L457 HydrophobicContact CG2-CB 4.45Å; V438-L457 HydrophobicContact CG2-CD1 4.13Å; V438-L457 HydrophobicContact CG2-CD2 4.22Å; V438-L457 HydrophobicContact CG2-CG 4.49Å; L457-I459 HydrophobicContact CD1-CG1 4.2Å; L457-I459 HydrophobicContact CD2-CD1 4.02Å; L457-I459 HydrophobicContact CD2-CG1 4.13Å; L457-I459 HydrophobicContact CG-CD1 4.25Å; L457-I459 HydrophobicContact CG-CG1 3.82Å; L457-M483 HydrophobicContact CB-CE 3.51Å; L457-M483 HydrophobicContact CD2-CE 3.78Å; L457-M483 HydrophobicContact CG-CE 4.31Å; L457-S484 PolarHBondContact N-O 2.79Å; L457-I486 PolarHBondContact O-N 3.35Å
458	L	98.1	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.4	169.5	174.7	65.6	0	0	0	110.1	F326 T327 V328 A329 V363 L460 I486 V488	F326-L458 HydrophobicContact CE2-CB 3.77Å; F326-L458 HydrophobicContact CE2-CD2 4.33Å; F326-L458 HydrophobicContact CZ-CB 3.81Å; F326-L458 HydrophobicContact CZ-CD2 3.64Å; F326-L458 HydrophobicContact CZ-CG 4.36Å; T327-L458 PolarHBondContact O-N 3.43Å; V328-L458 CarbonylContact C-O 3.56Å; A329-L458 PolarHBondContact N-O 2.83Å; V363-L458 HydrophobicContact CB-CD2 4.13Å; V363-L458 HydrophobicContact CG1-CD2 4.19Å; V363-L458 HydrophobicContact CG2-CD2 4.47Å; L458-L460 HydrophobicContact CD1-CD2 3.93Å; L458-L460 HydrophobicContact CD2-CD2 4.07Å; L458-L460 HydrophobicContact CD2-CG 4.5Å; L458-L460 HydrophobicContact CG-CD2 3.95Å; L458-L460 HydrophobicContact CG-CG 4.36Å; L458-I486 CarbonylContact C-O 3.6Å; L458-I486 WeakPolarHBondContact CA-O 3.04Å; L458-I486 HydrophobicContact CD1-CB 4.17Å; L458-I486 HydrophobicContact CD1-CG2 3.62Å; L458-V488 HydrophobicContact CD1-CG2 3.76Å
459	I	98.3	Very high	93.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.3	174.4	-52.6	-177.5	0	0	0	108.7	A329 F381 I431 I434 I435 L457 V485 I486 I487 V488	A329-I459 HydrophobicContact CB-CG1 4.28Å; A329-I459 WeakPolarHBondContact O-CA 3.39Å; F381-I459 HydrophobicContact CE1-CG2 3.87Å; F381-I459 HydrophobicContact CZ-CG2 3.83Å; I431-I459 HydrophobicContact CB-CD1 4.38Å; I431-I459 HydrophobicContact CD1-CD1 4.11Å; I431-I459 HydrophobicContact CG2-CG2 4.31Å; I434-I459 HydrophobicContact CG2-CD1 4.38Å; I435-I459 HydrophobicContact CD1-CD1 4.37Å; I435-I459 HydrophobicContact CG1-CD1 4.06Å; L457-I459 HydrophobicContact CD1-CG1 4.2Å; L457-I459 HydrophobicContact CD2-CD1 4.02Å; L457-I459 HydrophobicContact CD2-CG1 4.13Å; L457-I459 HydrophobicContact CG-CD1 4.25Å; L457-I459 HydrophobicContact CG-CG1 3.82Å; I459-V485 HydrophobicContact CD1-CG1 3.91Å; I459-V485 HydrophobicContact CG1-CG1 4.47Å; I459-I486 PolarHBondContact N-O 2.78Å; I459-I487 HydrophobicContact CB-CG1 4.35Å; I459-I487 HydrophobicContact CD1-CG1 4.46Å; I459-I487 CarbonylContact O-C 3.58Å; I459-I487 WeakPolarHBondContact O-CA 3.27Å; I459-V488 PolarHBondContact O-N 3.12Å
460	L	98	Very high	93.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.7	171.7	-53.7	-178.5	0	0	0	108.3	A329 D331 Y356 A359 L360 L458 V488	A329-L460 PolarHBondContact O-N 3.44Å; D331-L460 WeakPolarHBondContact CB-O 3.36Å; D331-L460 PolarHBondContact N-O 3.03Å; Y356-L460 HydrophobicContact CD1-CB 3.55Å; Y356-L460 HydrophobicContact CD1-CD1 3.99Å; Y356-L460 HydrophobicContact CD1-CG 4.42Å; Y356-L460 HydrophobicContact CE1-CB 3.7Å; A359-L460 HydrophobicContact CB-CD2 3.85Å; L360-L460 HydrophobicContact CB-CD1 4.24Å; L458-L460 HydrophobicContact CD1-CD2 3.93Å; L458-L460 HydrophobicContact CD2-CD2 4.07Å; L458-L460 HydrophobicContact CD2-CG 4.5Å; L458-L460 HydrophobicContact CG-CD2 3.95Å; L458-L460 HydrophobicContact CG-CG 4.36Å; L460-V488 HydrophobicContact CD2-CB 3.66Å; L460-V488 HydrophobicContact CD2-CG1 4.32Å; L460-V488 HydrophobicContact CD2-CG2 4.14Å
461	T	96.1	Very high	93.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	149.2	-177.8	-179.9	0	0	0	0	112.3	D331 G463 I487 V488 G489 V490 M498	D331-T461 WeakPolarHBondContact OD2-CA 3.42Å; D331-T461 WeakPolarHBondContact OD2-CB 3.37Å; D331-T461 PolarHBondContact OD2-OG1 2.84Å; T461-G463 PolarHBondContact OG1-N 2.84Å; T461-G463 PolarHBondContact OG1-O 3.2Å; T461-I487 HydrophobicContact CG2-CG2 4.04Å; T461-V488 PolarHBondContact N-O 3.35Å; T461-G489 CarbonylContact O-C 3.54Å; T461-G489 WeakPolarHBondContact O-CA 3.29Å; T461-V490 PolarHBondContact O-N 2.89Å; T461-M498 HydrophobicContact CG2-CE 3.93Å
462	D	92	Very high	93.9	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.053	14%	0.139	C	C	.	.	S	Bend	trans	-96.7	-2.6	178.4	78.6	-42.7	0	0	0	115.1	D331 S335 N336 L345 Y356 V490 A493	D331-D462 PolarHBondContact OD2-N 2.66Å; S335-D462 VanDerWaalsContact CB-OD2 3.26Å; S335-D462 WeakPolarHBondContact CB-OD2 3.39Å; S335-D462 PolarHBondContact OG-OD1 2.79Å; S335-D462 PolarHBondContact OG-OD2 3.33Å; N336-D462 WeakPolarHBondContact CA-OD2 3.27Å; N336-D462 PolarHBondContact N-OD2 3.24Å; N336-D462 VanDerWaalsContact N-OD2 3.13Å; N336-D462 PolarHBondContact ND2-OD1 3.03Å; N336-D462 VanDerWaalsContact OD1-CB 3.27Å; N336-D462 WeakPolarHBondContact OD1-CB 3.36Å; N336-D462 PolarHBondContact OD1-OD2 2.88Å; L345-D462 HydrophobicContact CD1-CB 3.35Å; Y356-D462 PolarHBondContact OH-N 3.03Å; D462-V490 VanDerWaalsContact CA-O 3.31Å; D462-V490 WeakPolarHBondContact CA-O 3.49Å; D462-A493 WeakPolarHBondContact O-CB 3.47Å
463	G	79.4	Confident	94.2	Very high	7 Å²	7	27 Å²	27	7%	0.072	15%	0.148	C	C	.	.	S	Bend	trans	-168	-177.7	-167.6	0	0	0	0	0	116.6	T461 M498	T461-G463 PolarHBondContact OG1-N 2.84Å; T461-G463 PolarHBondContact OG1-O 3.2Å; G463-M498 WeakPolarHBondContact O-CE 3.35Å
464	V	80.1	Confident	94.3	Very high	67 Å²	67	24 Å²	24	41%	0.406	14%	0.135	S	C	.	.			trans	-60.6	130.1	-168.7	-177	0	0	0	0	111.9	T429 T466 D497	T429-V464 WeakPolarHBondContact CB-O 3.49Å; V464-T466 PolarHBondContact O-N 2.8Å; V464-D497 WeakPolarHBondContact CG1-OD2 3.38Å
465	I	89.1	Confident	94.4	Very high	4 Å²	4	24 Å²	24	2%	0.021	14%	0.135	C	C	.	.			trans	-69.5	122.6	177	-62.3	161.7	0	0	0	109.2	I431 D467 M498 L501	I431-I465 HydrophobicContact CD1-CD1 3.47Å; I431-I465 VanDerWaalsContact CD1-CD1 3.47Å; I431-I465 HydrophobicContact CD1-CG1 3.89Å; I431-I465 HydrophobicContact CD1-CG2 4.38Å; I431-I465 HydrophobicContact CG1-CD1 4.27Å; I431-I465 HydrophobicContact CG1-CG1 4.28Å; I431-I465 HydrophobicContact CG1-CG2 3.99Å; I465-D467 WeakPolarHBondContact CG2-OD1 3.37Å; I465-M498 HydrophobicContact CD1-CG 4.18Å; I465-L501 HydrophobicContact CD1-CD1 3.51Å
466	T	92	Very high	94.3	Very high	80 Å²	80	23.7 Å²	23.7	49%	0.491	13%	0.134	S	C	.	.	S	Bend	trans	-86.2	-27.1	-176.9	44.2	0	0	0	0	113.5	P428 T429 N430 V464	P428-T466 HydrophobicContact CB-CG2 3.98Å; P428-T466 WeakPolarHBondContact CB-OG1 3.39Å; T429-T466 PolarHBondContact N-OG1 3.05Å; T429-T466 VanDerWaalsContact N-OG1 3.07Å; T429-T466 PolarHBondContact O-N 2.75Å; T429-T466 PolarHBondContact O-OG1 2.82Å; N430-T466 PolarHBondContact OD1-OG1 3.32Å; V464-T466 PolarHBondContact O-N 2.8Å
467	D	95.1	Very high	94.3	Very high	13 Å²	13	28.7 Å²	28.7	7%	0.07	16%	0.157	C	C	.	.			trans	-99	42	179.3	64.8	-11.8	0	0	0	112.4	N430 I431 A432 I465 A469 D470 T471	N430-D467 VanDerWaalsContact CA-CG 3.43Å; N430-D467 WeakPolarHBondContact CA-OD1 3.44Å; N430-D467 WeakPolarHBondContact CA-OD2 3.31Å; N430-D467 HydrophobicContact CB-CB 4.19Å; N430-D467 VanDerWaalsContact CB-OD2 3.22Å; N430-D467 WeakPolarHBondContact CB-OD2 3.07Å; N430-D467 WeakPolarHBondContact OD1-CB 3.47Å; I431-D467 PolarHBondContact N-OD1 2.89Å; I431-D467 VanDerWaalsContact N-OD1 3.11Å; I431-D467 PolarHBondContact N-OD2 3.21Å; I431-D467 VanDerWaalsContact N-OD2 3.13Å; A432-D467 WeakPolarHBondContact CB-OD2 3.45Å; A432-D467 PolarHBondContact N-OD2 3.02Å; I465-D467 WeakPolarHBondContact CG2-OD1 3.37Å; D467-A469 PolarHBondContact O-N 3.24Å; D467-A469 VanDerWaalsContact O-N 3.11Å; D467-D470 HydrophobicContact CB-CB 4.33Å; D467-D470 PolarHBondContact O-N 3.32Å; D467-T471 WeakPolarHBondContact O-CB 3.41Å; D467-T471 PolarHBondContact O-N 2.9Å; D467-T471 PolarHBondContact O-OG1 2.95Å; D467-T471 PolarHBondContact OD1-OG1 3.01Å
468	M	93	Very high	94.3	Very high	32 Å²	32	28.7 Å²	28.7	16%	0.158	16%	0.157	C	C	.	.	H	α-helix	trans	-53.5	-37.4	-174.2	-178.7	58.3	89.1	0	0	113.6	R472 D497 L501	M468-R472 WeakPolarHBondContact O-CB 3.41Å; M468-R472 WeakPolarHBondContact O-CG 3.41Å; M468-R472 PolarHBondContact O-N 3.35Å; M468-R472 HydrophobicContact SD-CG 4.11Å; M468-D497 HydrophobicContact CE-CB 3.33Å; M468-D497 VanDerWaalsContact CE-CG 3.46Å; M468-D497 WeakPolarHBondContact CE-O 3.19Å; M468-L501 HydrophobicContact CE-CG 4.44Å; M468-L501 HydrophobicContact SD-CD1 4.49Å; M468-L501 HydrophobicContact SD-CD2 3.8Å; M468-L501 HydrophobicContact SD-CG 4.31Å
469	A	94.7	Very high	94.2	Very high	51 Å²	51	28.7 Å²	28.7	42%	0.421	16%	0.157	S	C	.	.	H	α-helix	trans	-64.3	-47.1	177.8	0	0	0	0	0	112.2	D467 R472 E473 P511	D467-A469 PolarHBondContact O-N 3.24Å; D467-A469 VanDerWaalsContact O-N 3.11Å; A469-R472 PolarHBondContact O-N 3Å; A469-E473 PolarHBondContact O-N 2.87Å; A469-E473 VanDerWaalsContact O-N 3.15Å; A469-P511 HydrophobicContact CB-CG 3.91Å; A469-P511 WeakPolarHBondContact O-CG 3.33Å
470	D	97.1	Very high	94.1	Very high	89 Å²	89	32.5 Å²	32.5	48%	0.476	18%	0.175	S	C	.	.	H	α-helix	trans	-71.5	-36.4	179.7	-60.3	-34.8	0	0	0	111	A432 D467 E473 A474	A432-D470 HydrophobicContact CB-CB 3.72Å; D467-D470 HydrophobicContact CB-CB 4.33Å; D467-D470 PolarHBondContact O-N 3.32Å; D470-E473 PolarHBondContact O-N 3.44Å; D470-A474 WeakPolarHBondContact O-CB 3.33Å; D470-A474 PolarHBondContact O-N 2.71Å
471	T	96.8	Very high	94.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-45.4	174.5	-72.7	0	0	0	0	110.9	I431 A432 I435 D467 E473 A474 I475 L501	I431-T471 HydrophobicContact CD1-CG2 3.91Å; I431-T471 HydrophobicContact CG1-CG2 3.9Å; I431-T471 VanDerWaalsContact CG1-OG1 3.31Å; I431-T471 WeakPolarHBondContact CG1-OG1 3.3Å; A432-T471 PolarHBondContact N-OG1 2.92Å; I435-T471 HydrophobicContact CD1-CG2 4.16Å; D467-T471 WeakPolarHBondContact O-CB 3.41Å; D467-T471 PolarHBondContact O-N 2.9Å; D467-T471 PolarHBondContact O-OG1 2.95Å; D467-T471 PolarHBondContact OD1-OG1 3.01Å; T471-E473 VanDerWaalsContact C-N 3.33Å; T471-E473 PolarHBondContact O-N 2.9Å; T471-A474 PolarHBondContact O-N 3.42Å; T471-I475 HydrophobicContact CG2-CD1 3.74Å; T471-I475 WeakPolarHBondContact O-CG1 3.33Å; T471-I475 PolarHBondContact O-N 3.05Å; T471-L501 HydrophobicContact CG2-CD1 3.91Å; T471-L501 HydrophobicContact CG2-CD2 4.43Å
472	R	96	Very high	94.2	Very high	57 Å²	57	33 Å²	33	22%	0.215	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-40	174.4	-74.5	169.7	59.6	-167	-1.6	112.3	M468 A469 V476 L501 L508 R509 S510	M468-R472 WeakPolarHBondContact O-CB 3.41Å; M468-R472 WeakPolarHBondContact O-CG 3.41Å; M468-R472 PolarHBondContact O-N 3.35Å; M468-R472 HydrophobicContact SD-CG 4.11Å; A469-R472 PolarHBondContact O-N 3Å; R472-V476 WeakPolarHBondContact O-CB 3.42Å; R472-V476 VanDerWaalsContact O-CG2 3.28Å; R472-V476 WeakPolarHBondContact O-CG2 3.36Å; R472-V476 PolarHBondContact O-N 3.36Å; R472-L501 HydrophobicContact CG-CD2 4.11Å; R472-L508 HydrophobicContact CG-CD1 4.15Å; R472-R509 PolarHBondContact NE-O 2.76Å; R472-R509 PolarHBondContact NH2-O 2.63Å; R472-S510 PolarHBondContact NH2-O 3.46Å
473	E	96.9	Very high	94.5	Very high	74 Å²	74	32.5 Å²	32.5	35%	0.346	18%	0.175	S	C	.	.	H	α-helix	trans	-66.1	-42.1	175.8	-173.1	159.5	-161.5	0	0	111.6	A469 D470 T471 V476 H477 K512	A469-E473 PolarHBondContact O-N 2.87Å; A469-E473 VanDerWaalsContact O-N 3.15Å; D470-E473 PolarHBondContact O-N 3.44Å; T471-E473 VanDerWaalsContact C-N 3.33Å; T471-E473 PolarHBondContact O-N 2.9Å; E473-V476 PolarHBondContact O-N 3.49Å; E473-H477 WeakPolarHBondContact O-CB 3.3Å; E473-H477 PolarHBondContact O-N 3.12Å; E473-K512 IonicContact OE1-NZ 3.25Å; E473-K512 PolarHBondContact OE1-NZ 2.85Å
474	A	97.9	Very high	95.3	Very high	4 Å²	4	32.2 Å²	32.2	3%	0.033	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-42.7	176.6	0	0	0	0	0	112.4	A432 I435 Q436 D470 T471 H477 A478	A432-A474 HydrophobicContact CB-CB 4.44Å; I435-A474 HydrophobicContact CB-CB 4.12Å; I435-A474 HydrophobicContact CG2-CB 3.77Å; Q436-A474 HydrophobicContact CG-CB 3.97Å; D470-A474 WeakPolarHBondContact O-CB 3.33Å; D470-A474 PolarHBondContact O-N 2.71Å; T471-A474 PolarHBondContact O-N 3.42Å; A474-H477 PolarHBondContact O-N 3.31Å; A474-A478 VanDerWaalsContact O-CB 3.27Å; A474-A478 WeakPolarHBondContact O-CB 3.41Å; A474-A478 PolarHBondContact O-N 3.24Å
475	I	97.5	Very high	96.2	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-44.9	177.3	-69	162.9	0	0	0	111.1	I435 T471 H477 A478 S479 L501 L508 V516 I520 V521	I435-I475 HydrophobicContact CD1-CD1 4.49Å; I435-I475 HydrophobicContact CD1-CG1 4.12Å; T471-I475 HydrophobicContact CG2-CD1 3.74Å; T471-I475 WeakPolarHBondContact O-CG1 3.33Å; T471-I475 PolarHBondContact O-N 3.05Å; I475-H477 VanDerWaalsContact C-N 3.3Å; I475-H477 PolarHBondContact O-N 3.3Å; I475-A478 PolarHBondContact O-N 3.43Å; I475-S479 PolarHBondContact O-N 2.82Å; I475-L501 HydrophobicContact CD1-CB 4.45Å; I475-L501 HydrophobicContact CD1-CD1 4.09Å; I475-L501 HydrophobicContact CD1-CD2 3.79Å; I475-L501 HydrophobicContact CD1-CG 4.34Å; I475-L508 HydrophobicContact CB-CD2 4.14Å; I475-L508 HydrophobicContact CD1-CD2 4.23Å; I475-L508 HydrophobicContact CG2-CD2 3.6Å; I475-V516 HydrophobicContact CG2-CG1 4.12Å; I475-I520 HydrophobicContact CG2-CD1 4.04Å; I475-I520 HydrophobicContact CG2-CG1 4.02Å; I475-V521 HydrophobicContact CD1-CG2 3.95Å; I475-V521 HydrophobicContact CG1-CG2 4.19Å; I475-V521 HydrophobicContact CG2-CG2 3.75Å
476	V	96.9	Very high	96.5	Very high	7 Å²	7	28.8 Å²	28.8	4%	0.042	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-42.9	176.4	170.1	0	0	0	0	111	R472 E473 S479 H480 E514 V516	R472-V476 WeakPolarHBondContact O-CB 3.42Å; R472-V476 VanDerWaalsContact O-CG2 3.28Å; R472-V476 WeakPolarHBondContact O-CG2 3.36Å; R472-V476 PolarHBondContact O-N 3.36Å; E473-V476 PolarHBondContact O-N 3.49Å; V476-S479 PolarHBondContact O-N 3.49Å; V476-S479 PolarHBondContact O-OG 3.1Å; V476-H480 PolarHBondContact O-CE1 3.45Å; V476-H480 PolarHBondContact O-ND1 3.41Å; V476-E514 HydrophobicContact CG1-CB 4.4Å; V476-V516 HydrophobicContact CB-CG1 4.49Å; V476-V516 HydrophobicContact CG2-CG1 3.7Å
477	H	96.9	Very high	96.8	Very high	106 Å²	106	25 Å²	25	49%	0.491	13%	0.128	S	C	.	.	H	α-helix	trans	-62.1	-51.2	173.2	177.9	-105.4	0	0	0	111.9	E473 A474 I475 S479 H480	E473-H477 WeakPolarHBondContact O-CB 3.3Å; E473-H477 PolarHBondContact O-N 3.12Å; A474-H477 PolarHBondContact O-N 3.31Å; I475-H477 VanDerWaalsContact C-N 3.3Å; I475-H477 PolarHBondContact O-N 3.3Å; H477-S479 PolarHBondContact O-N 3.47Å; H477-H480 WeakPolarHBondContact O-CB 3.42Å; H477-H480 PolarHBondContact O-N 3.47Å; H477-H480 VanDerWaalsContact O-N 3.11Å; H477-H480 PolarHBondContact O-ND1 3.01Å
478	A	97.9	Very high	96.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-26.5	-179.6	0	0	0	0	0	113.4	I435 A439 A474 I475 H480 L481 M483 I520	I435-A478 HydrophobicContact CG2-CB 4.42Å; A439-A478 HydrophobicContact CB-CB 4.39Å; A474-A478 VanDerWaalsContact O-CB 3.27Å; A474-A478 WeakPolarHBondContact O-CB 3.41Å; A474-A478 PolarHBondContact O-N 3.24Å; I475-A478 PolarHBondContact O-N 3.43Å; A478-H480 PolarHBondContact O-N 2.78Å; A478-L481 WeakPolarHBondContact O-CB 3.32Å; A478-L481 PolarHBondContact O-N 2.67Å; A478-M483 HydrophobicContact CB-SD 4.32Å; A478-I520 HydrophobicContact CB-CD1 3.67Å
479	S	96.8	Very high	97	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.4	176.6	76.8	0	0	0	0	113.4	I475 V476 H477 L517 R518	I475-S479 PolarHBondContact O-N 2.82Å; V476-S479 PolarHBondContact O-N 3.49Å; V476-S479 PolarHBondContact O-OG 3.1Å; H477-S479 PolarHBondContact O-N 3.47Å; S479-L517 PolarHBondContact OG-N 2.86Å; S479-R518 WeakPolarHBondContact O-CD 3.16Å; S479-R518 WeakPolarHBondContact O-CG 3.37Å; S479-R518 PolarHBondContact O-NE 2.85Å
480	H	96.5	Very high	97	Very high	80 Å²	80	20.4 Å²	20.4	37%	0.37	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.6	177.2	-63.5	80.3	0	0	0	114.5	V476 H477 A478	V476-H480 PolarHBondContact O-CE1 3.45Å; V476-H480 PolarHBondContact O-ND1 3.41Å; H477-H480 WeakPolarHBondContact O-CB 3.42Å; H477-H480 PolarHBondContact O-N 3.47Å; H477-H480 VanDerWaalsContact O-N 3.11Å; H477-H480 PolarHBondContact O-ND1 3.01Å; A478-H480 PolarHBondContact O-N 2.78Å
481	L	97.9	Very high	96.8	Very high	11 Å²	11	16.2 Å²	16.2	6%	0.058	8%	0.075	C	C	.	.	S	Bend	trans	-112.5	165.1	-169.4	-55.3	-178	0	0	0	111.4	A439 A442 A478 M483 R518 Y552	A439-L481 HydrophobicContact CB-CD1 3.81Å; A439-L481 VanDerWaalsContact O-CD1 3.23Å; A439-L481 WeakPolarHBondContact O-CD1 3.26Å; A442-L481 HydrophobicContact CB-CB 4.08Å; A442-L481 HydrophobicContact CB-CD1 4.46Å; A478-L481 WeakPolarHBondContact O-CB 3.32Å; A478-L481 PolarHBondContact O-N 2.67Å; L481-M483 PolarHBondContact O-N 2.94Å; L481-R518 PolarHBondContact O-NH2 2.81Å; L481-Y552 VanDerWaalsContact O-CD2 3.32Å; L481-Y552 WeakPolarHBondContact O-CD2 3.44Å; L481-Y552 WeakPolarHBondContact O-CE2 3.09Å
482	P	97.5	Very high	96.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-76.7	66.8	176.5	30.2	-32.9	0	0	0	111.5	A442 E445 T446 Y454 F455 Y552	A442-P482 HydrophobicContact CB-CG 4.22Å; A442-P482 VanDerWaalsContact O-CD 3.28Å; A442-P482 WeakPolarHBondContact O-CD 3.2Å; A442-P482 WeakPolarHBondContact O-CG 3.38Å; E445-P482 HydrophobicContact CB-CG 4.25Å; E445-P482 HydrophobicContact CG-CG 4.07Å; T446-P482 WeakPolarHBondContact OG1-CD 3.49Å; Y454-P482 HydrophobicContact CD2-CB 3.89Å; Y454-P482 HydrophobicContact CE2-CB 4.32Å; F455-P482 HydrophobicContact CD2-CG 4.47Å; F455-P482 PolarHBondContact N-O 3.18Å; P482-Y552 HydrophobicContact CB-CD1 3.86Å; P482-Y552 HydrophobicContact CB-CE1 3.46Å; P482-Y552 VanDerWaalsContact CB-CE1 3.46Å; P482-Y552 HydrophobicContact CB-CE2 4.46Å; P482-Y552 WeakPolarHBondContact CD-OH 3.29Å; P482-Y552 HydrophobicContact CG-CE1 4.23Å
483	M	97.5	Very high	96.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.9	-171.3	-177.4	179.4	-178.9	0	0	113.7	V438 A439 A442 F455 L457 A478 L481 V485 R518	V438-M483 HydrophobicContact CB-CE 3.49Å; V438-M483 VanDerWaalsContact CB-CE 3.49Å; V438-M483 HydrophobicContact CB-SD 4.19Å; V438-M483 HydrophobicContact CG1-CE 3.44Å; V438-M483 VanDerWaalsContact CG1-CE 3.44Å; V438-M483 HydrophobicContact CG1-SD 3.93Å; V438-M483 HydrophobicContact CG2-CE 4.48Å; A439-M483 HydrophobicContact CB-SD 4.18Å; A442-M483 HydrophobicContact CB-CB 4.07Å; F455-M483 HydrophobicContact CB-CB 4.29Å; F455-M483 HydrophobicContact CB-CG 4.19Å; F455-M483 CarbonylContact O-C 3.57Å; F455-M483 WeakPolarHBondContact O-CA 3.39Å; L457-M483 HydrophobicContact CB-CE 3.51Å; L457-M483 HydrophobicContact CD2-CE 3.78Å; L457-M483 HydrophobicContact CG-CE 4.31Å; A478-M483 HydrophobicContact CB-SD 4.32Å; L481-M483 PolarHBondContact O-N 2.94Å; M483-V485 HydrophobicContact CE-CG2 4Å; M483-R518 PolarHBondContact O-NH1 3.33Å; M483-R518 PolarHBondContact O-NH2 2.74Å
484	S	97.7	Very high	95.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.6	166	-65.4	0	0	0	0	110.9	Y454 F455 L457 Q548	Y454-S484 WeakPolarHBondContact CE1-OG 3.29Å; Y454-S484 PolarHBondContact OH-OG 3.13Å; Y454-S484 VanDerWaalsContact OH-OG 3.11Å; F455-S484 PolarHBondContact O-N 2.96Å; L457-S484 PolarHBondContact N-O 2.79Å; S484-Q548 PolarHBondContact OG-OE1 2.99Å
485	V	97.8	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123	174.2	-178.5	0	0	0	0	107.9	I435 I459 M483 I487 I520 V521 Q522	I435-V485 HydrophobicContact CG2-CG2 4.47Å; I459-V485 HydrophobicContact CD1-CG1 3.91Å; I459-V485 HydrophobicContact CG1-CG1 4.47Å; M483-V485 HydrophobicContact CE-CG2 4Å; V485-I487 HydrophobicContact CG1-CD1 4.47Å; V485-I487 HydrophobicContact CG1-CG1 4.09Å; V485-I520 HydrophobicContact CG2-CD1 4.33Å; V485-I520 PolarHBondContact N-O 3.03Å; V485-V521 HydrophobicContact CB-CG2 4.39Å; V485-V521 CarbonylContact O-C 3.5Å; V485-V521 WeakPolarHBondContact O-CA 3.4Å; V485-Q522 PolarHBondContact O-N 3.03Å
486	I	97.1	Very high	95	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.6	178	-64.5	178.1	0	0	0	107.2	I456 L457 L458 I459 V488 Q522 V541 L542 V545	I456-I486 HydrophobicContact CG2-CD1 3.62Å; I456-I486 HydrophobicContact CG2-CG1 4.21Å; L457-I486 PolarHBondContact O-N 3.35Å; L458-I486 CarbonylContact C-O 3.6Å; L458-I486 WeakPolarHBondContact CA-O 3.04Å; L458-I486 HydrophobicContact CD1-CB 4.17Å; L458-I486 HydrophobicContact CD1-CG2 3.62Å; I459-I486 PolarHBondContact N-O 2.78Å; I486-V488 HydrophobicContact CG2-CG2 4.38Å; I486-Q522 CarbonylContact C-O 3.49Å; I486-Q522 WeakPolarHBondContact CA-O 3.46Å; I486-Q522 HydrophobicContact CG1-CB 4.49Å; I486-V541 HydrophobicContact CD1-CG1 4.28Å; I486-V541 HydrophobicContact CG2-CG1 3.32Å; I486-L542 HydrophobicContact CD1-CD2 3.9Å; I486-V545 HydrophobicContact CD1-CG2 3.92Å
487	I	96.3	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.1	179.7	-53.3	178.1	0	0	0	108.6	I431 I459 T461 V485 M498 L501 V521 Q522 F523 V524	I431-I487 HydrophobicContact CD1-CD1 4.26Å; I459-I487 HydrophobicContact CB-CG1 4.35Å; I459-I487 HydrophobicContact CD1-CG1 4.46Å; I459-I487 CarbonylContact O-C 3.58Å; I459-I487 WeakPolarHBondContact O-CA 3.27Å; T461-I487 HydrophobicContact CG2-CG2 4.04Å; V485-I487 HydrophobicContact CG1-CD1 4.47Å; V485-I487 HydrophobicContact CG1-CG1 4.09Å; I487-M498 HydrophobicContact CG2-CG 4.18Å; I487-L501 HydrophobicContact CD1-CD1 4.08Å; I487-V521 HydrophobicContact CD1-CG1 4.15Å; I487-Q522 PolarHBondContact N-O 2.88Å; I487-F523 HydrophobicContact CB-CD2 4.04Å; I487-F523 HydrophobicContact CG2-CD2 3.93Å; I487-F523 HydrophobicContact CG2-CE2 4.36Å; I487-F523 WeakPolarHBondContact O-CA 3.44Å; I487-F523 WeakPolarHBondContact O-CD2 3.4Å; I487-V524 PolarHBondContact O-N 2.65Å
488	V	96.8	Very high	94	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.4	173.5	-179	0	0	0	0	109.6	A359 L458 I459 L460 T461 I486 V490 V524 F526 V541	A359-V488 HydrophobicContact CB-CG1 4.03Å; L458-V488 HydrophobicContact CD1-CG2 3.76Å; I459-V488 PolarHBondContact O-N 3.12Å; L460-V488 HydrophobicContact CD2-CB 3.66Å; L460-V488 HydrophobicContact CD2-CG1 4.32Å; L460-V488 HydrophobicContact CD2-CG2 4.14Å; T461-V488 PolarHBondContact N-O 3.35Å; I486-V488 HydrophobicContact CG2-CG2 4.38Å; V488-V490 PolarHBondContact O-N 3.24Å; V488-V524 VanDerWaalsContact CA-O 3.3Å; V488-V524 WeakPolarHBondContact CA-O 3.28Å; V488-F526 HydrophobicContact CG1-CB 4.06Å; V488-F526 HydrophobicContact CG1-CD2 4.46Å; V488-V541 HydrophobicContact CG2-CG1 4.28Å; V488-V541 HydrophobicContact CG2-CG2 3.94Å
489	G	96.3	Very high	93.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	113.2	178.7	0	0	0	0	0	111.9	T461 F495 V524 F526	T461-G489 CarbonylContact O-C 3.54Å; T461-G489 WeakPolarHBondContact O-CA 3.29Å; G489-F495 VanDerWaalsContact CA-CZ 3.42Å; G489-V524 PolarHBondContact N-O 3.5Å; G489-F526 VanDerWaalsContact O-CB 3.28Å; G489-F526 WeakPolarHBondContact O-CB 3.37Å; G489-F526 PolarHBondContact O-N 3.35Å
490	V	95.6	Very high	93.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.			trans	-94	145.5	-179.8	174.8	0	0	0	0	111	L345 E355 Y356 T461 D462 V488 F495	L345-V490 HydrophobicContact CD1-CG1 4.38Å; L345-V490 HydrophobicContact CD2-CG1 4.43Å; E355-V490 HydrophobicContact CB-CG1 3.47Å; E355-V490 VanDerWaalsContact CB-CG1 3.47Å; E355-V490 HydrophobicContact CB-CG2 4.44Å; E355-V490 HydrophobicContact CG-CG1 4.41Å; Y356-V490 HydrophobicContact CD1-CG2 4.27Å; Y356-V490 HydrophobicContact CD2-CG1 4.01Å; Y356-V490 HydrophobicContact CE1-CG2 4.23Å; Y356-V490 HydrophobicContact CE2-CB 4.28Å; Y356-V490 HydrophobicContact CE2-CG1 3.79Å; Y356-V490 HydrophobicContact CG-CG2 4.43Å; T461-V490 PolarHBondContact O-N 2.89Å; D462-V490 VanDerWaalsContact CA-O 3.31Å; D462-V490 WeakPolarHBondContact CA-O 3.49Å; V488-V490 PolarHBondContact O-N 3.24Å; V490-F495 WeakPolarHBondContact O-CZ 3.38Å
491	G	93.3	Very high	92.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.01	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	-153.7	178.8	0	0	0	0	0	114	E355 R527	E355-G491 PolarHBondContact OE2-N 3.4Å; G491-R527 PolarHBondContact O-NE 2.94Å; G491-R527 PolarHBondContact O-NH2 3.22Å; G491-R527 VanDerWaalsContact O-NH2 3.15Å
492	N	90.2	Very high	92.1	Very high	124 Å²	124	28.9 Å²	28.9	66%	0.663	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.1	15.5	-163.5	-64.4	-33.6	0	0	0	114.5
493	A	89.7	Confident	91.1	Very high	36 Å²	36	29.7 Å²	29.7	30%	0.298	17%	0.168	S	C	.	.	S	Bend	trans	-64.1	177.6	178.8	0	0	0	0	0	113.9	D462 F495 R527	D462-A493 WeakPolarHBondContact O-CB 3.47Å; A493-F495 HydrophobicContact CB-CE1 4.14Å; A493-R527 VanDerWaalsContact N-NH2 3.18Å; A493-R527 PolarHBondContact O-NH1 3.24Å; A493-R527 PolarHBondContact O-NH2 2.87Å
494	D	88.6	Confident	90.1	Very high	102 Å²	102	35.2 Å²	35.2	55%	0.545	20%	0.197	S	C	.	.			trans	-79.9	128.8	167.3	-172.2	-2.7	0	0	0	109.4	S496	D494-S496 WeakPolarHBondContact OD1-CB 3.45Å; D494-S496 PolarHBondContact OD1-N 2.87Å; D494-S496 PolarHBondContact OD1-OG 3.09Å
495	F	90	Very high	88.9	Confident	12 Å²	12	42.6 Å²	42.6	5%	0.053	24%	0.237	C	C	.	.			trans	-114.5	15.9	-178.3	-62.7	-41.1	0	0	0	113.3	G489 V490 A493 D497 M498 Q499 F523 P525	G489-F495 VanDerWaalsContact CA-CZ 3.42Å; V490-F495 WeakPolarHBondContact O-CZ 3.38Å; A493-F495 HydrophobicContact CB-CE1 4.14Å; F495-D497 PolarHBondContact O-N 3.31Å; F495-M498 HydrophobicContact CB-SD 4.06Å; F495-M498 HydrophobicContact CD1-CE 3.57Å; F495-M498 HydrophobicContact CD1-SD 3.78Å; F495-M498 HydrophobicContact CE1-CE 4.02Å; F495-M498 HydrophobicContact CG-SD 4.36Å; F495-M498 PolarHBondContact O-N 3.07Å; F495-Q499 WeakPolarHBondContact O-CG 3.49Å; F495-Q499 PolarHBondContact O-N 2.86Å; F495-F523 HydrophobicContact CB-CE1 3.85Å; F495-F523 HydrophobicContact CB-CE2 4.41Å; F495-F523 HydrophobicContact CB-CZ 3.46Å; F495-F523 VanDerWaalsContact CB-CZ 3.46Å; F495-F523 HydrophobicContact CD1-CZ 4.32Å; F495-F523 HydrophobicContact CD2-CE1 4.5Å; F495-F523 AromaticContact CD2-CZ 3.68Å; F495-F523 HydrophobicContact CD2-CZ 3.68Å; F495-F523 HydrophobicContact CE2-CZ 4.41Å; F495-F523 HydrophobicContact CG-CE1 4.43Å; F495-F523 HydrophobicContact CG-CE2 4.38Å; F495-F523 AromaticContact CG-CZ 3.61Å; F495-F523 HydrophobicContact CG-CZ 3.61Å; F495-P525 HydrophobicContact CD2-CB 3.85Å; F495-P525 HydrophobicContact CE2-CB 4Å
496	S	88	Confident	87.9	Confident	62 Å²	62	44.7 Å²	44.7	43%	0.434	26%	0.258	S	S	.	.	H	α-helix	trans	-53.4	-38.2	178.1	-59	0	0	0	0	112.3	D494 Q499 M500	D494-S496 WeakPolarHBondContact OD1-CB 3.45Å; D494-S496 PolarHBondContact OD1-N 2.87Å; D494-S496 PolarHBondContact OD1-OG 3.09Å; S496-Q499 PolarHBondContact O-N 2.93Å; S496-M500 PolarHBondContact O-N 3.25Å; S496-M500 VanDerWaalsContact O-N 3.08Å
497	D	85.4	Confident	87.4	Confident	53 Å²	53	50.2 Å²	50.2	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-40.2	177.2	-86.9	11.2	0	0	0	112.8	V464 M468 F495 M500 L501	V464-D497 WeakPolarHBondContact CG1-OD2 3.38Å; M468-D497 HydrophobicContact CE-CB 3.33Å; M468-D497 VanDerWaalsContact CE-CG 3.46Å; M468-D497 WeakPolarHBondContact CE-O 3.19Å; F495-D497 PolarHBondContact O-N 3.31Å; D497-M500 WeakPolarHBondContact O-CB 3.24Å; D497-M500 PolarHBondContact O-N 3.16Å; D497-L501 PolarHBondContact O-N 3.17Å
498	M	88.1	Confident	87.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-74.8	-35.4	178.5	-59.3	78.2	155.8	0	0	111.9	T461 G463 I465 I487 F495 M500 L501 D502 F523	T461-M498 HydrophobicContact CG2-CE 3.93Å; G463-M498 WeakPolarHBondContact O-CE 3.35Å; I465-M498 HydrophobicContact CD1-CG 4.18Å; I487-M498 HydrophobicContact CG2-CG 4.18Å; F495-M498 HydrophobicContact CB-SD 4.06Å; F495-M498 HydrophobicContact CD1-CE 3.57Å; F495-M498 HydrophobicContact CD1-SD 3.78Å; F495-M498 HydrophobicContact CE1-CE 4.02Å; F495-M498 HydrophobicContact CG-SD 4.36Å; F495-M498 PolarHBondContact O-N 3.07Å; M498-M500 PolarHBondContact O-N 2.98Å; M498-L501 WeakPolarHBondContact O-CB 3.17Å; M498-L501 PolarHBondContact O-N 3.44Å; M498-D502 PolarHBondContact O-N 3.31Å; M498-F523 HydrophobicContact CB-CB 4.35Å; M498-F523 HydrophobicContact CB-CD1 3.97Å; M498-F523 HydrophobicContact CB-CD2 3.33Å; M498-F523 HydrophobicContact CB-CE1 4.11Å; M498-F523 HydrophobicContact CB-CE2 3.5Å; M498-F523 VanDerWaalsContact CB-CE2 3.5Å; M498-F523 HydrophobicContact CB-CG 3.59Å; M498-F523 HydrophobicContact CB-CZ 3.91Å; M498-F523 HydrophobicContact CG-CD2 3.99Å; M498-F523 HydrophobicContact CG-CE2 3.86Å; M498-F523 HydrophobicContact CG-CZ 4.47Å
499	Q	87.3	Confident	86.9	Confident	97 Å²	97	56 Å²	56	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-36.2	172.7	-69.6	175.2	-24.8	0	0	111.3	F495 S496 L501 D502 F523	F495-Q499 WeakPolarHBondContact O-CG 3.49Å; F495-Q499 PolarHBondContact O-N 2.86Å; S496-Q499 PolarHBondContact O-N 2.93Å; Q499-L501 PolarHBondContact O-N 2.78Å; Q499-D502 WeakPolarHBondContact O-CB 3.31Å; Q499-D502 PolarHBondContact O-N 3.33Å; Q499-F523 HydrophobicContact CG-CD1 3.85Å; Q499-F523 HydrophobicContact CG-CE1 3.86Å
500	M	87.2	Confident	86.8	Confident	103 Å²	103	56.1 Å²	56.1	51%	0.507	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-28.3	173.4	-175.5	-178.7	178.6	0	0	112.9	S496 D497 M498	S496-M500 PolarHBondContact O-N 3.25Å; S496-M500 VanDerWaalsContact O-N 3.08Å; D497-M500 WeakPolarHBondContact O-CB 3.24Å; D497-M500 PolarHBondContact O-N 3.16Å; M498-M500 PolarHBondContact O-N 2.98Å
501	L	88.9	Confident	86.6	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-80.1	-25.2	-180	-63.2	179	0	0	0	113.3	I465 M468 T471 R472 I475 I487 D497 M498 Q499 G503 L508 V521	I465-L501 HydrophobicContact CD1-CD1 3.51Å; M468-L501 HydrophobicContact CE-CG 4.44Å; M468-L501 HydrophobicContact SD-CD1 4.49Å; M468-L501 HydrophobicContact SD-CD2 3.8Å; M468-L501 HydrophobicContact SD-CG 4.31Å; T471-L501 HydrophobicContact CG2-CD1 3.91Å; T471-L501 HydrophobicContact CG2-CD2 4.43Å; R472-L501 HydrophobicContact CG-CD2 4.11Å; I475-L501 HydrophobicContact CD1-CB 4.45Å; I475-L501 HydrophobicContact CD1-CD1 4.09Å; I475-L501 HydrophobicContact CD1-CD2 3.79Å; I475-L501 HydrophobicContact CD1-CG 4.34Å; I487-L501 HydrophobicContact CD1-CD1 4.08Å; D497-L501 PolarHBondContact O-N 3.17Å; M498-L501 WeakPolarHBondContact O-CB 3.17Å; M498-L501 PolarHBondContact O-N 3.44Å; Q499-L501 PolarHBondContact O-N 2.78Å; L501-G503 PolarHBondContact O-N 3.34Å; L501-G503 VanDerWaalsContact O-N 3.12Å; L501-L508 HydrophobicContact CD2-CD1 4.05Å; L501-L508 HydrophobicContact CD2-CD2 4.05Å; L501-V521 HydrophobicContact CB-CG1 4.06Å; L501-V521 WeakPolarHBondContact O-CB 3.27Å
502	D	84.8	Confident	86.5	Confident	15 Å²	15	66.5 Å²	66.5	8%	0.08	36%	0.361	C	S	.	.	S	Bend	trans	-67.8	-3.6	-173.3	-152.8	20.5	0	0	0	114.8	M498 Q499 D504 Q522 F523	M498-D502 PolarHBondContact O-N 3.31Å; Q499-D502 WeakPolarHBondContact O-CB 3.31Å; Q499-D502 PolarHBondContact O-N 3.33Å; D502-D504 PolarHBondContact O-N 3.46Å; D502-Q522 WeakPolarHBondContact OD1-CA 3.2Å; D502-Q522 PolarHBondContact OD1-NE2 2.72Å; D502-F523 HydrophobicContact CB-CB 4.03Å; D502-F523 VanDerWaalsContact CG-N 3.34Å; D502-F523 PolarHBondContact OD1-N 2.84Å
503	G	76.8	Confident	86.6	Confident	18 Å²	18	62.3 Å²	62.3	19%	0.186	35%	0.348	C	S	.	.	S	Bend	trans	70.7	-20.6	173.7	0	0	0	0	0	116.7	L501 D505 G506	L501-G503 PolarHBondContact O-N 3.34Å; L501-G503 VanDerWaalsContact O-N 3.12Å; G503-D505 VanDerWaalsContact C-N 3.33Å; G503-D505 PolarHBondContact O-N 3.3Å; G503-G506 CarbonylContact O-C 3.58Å; G503-G506 PolarHBondContact O-N 2.87Å
504	D	76.8	Confident	86.8	Confident	115 Å²	115	65.9 Å²	65.9	62%	0.615	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-39	-177.8	-89.5	-15.7	0	0	0	114	D502 G506	D502-D504 PolarHBondContact O-N 3.46Å; D504-G506 VanDerWaalsContact C-N 3.35Å
505	D	72.3	Confident	87.1	Confident	156 Å²	156	63.9 Å²	63.9	83%	0.834	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	4.2	-179.1	-74.8	-39.3	0	0	0	113.4	G503	G503-D505 VanDerWaalsContact C-N 3.33Å; G503-D505 PolarHBondContact O-N 3.3Å
506	G	76.8	Confident	87.3	Confident	43 Å²	43	64.5 Å²	64.5	44%	0.443	36%	0.355	S	S	.	.	S	Bend	trans	146.2	169.7	174.4	0	0	0	0	0	114.9	G503 D504 L508	G503-G506 CarbonylContact O-C 3.58Å; G503-G506 PolarHBondContact O-N 2.87Å; D504-G506 VanDerWaalsContact C-N 3.35Å; G506-L508 PolarHBondContact O-N 2.82Å; G506-L508 VanDerWaalsContact O-N 3.08Å
507	I	86.2	Confident	87.5	Confident	117 Å²	117	66.4 Å²	66.4	60%	0.6	36%	0.36	S	S	*	.			trans	-67.8	111.5	-176.5	-58.3	173.9	0	0	0	110.5	P515 V516	I507-P515 HydrophobicContact CG2-CB 3.53Å; I507-V516 HydrophobicContact CG2-CG2 4.1Å
508	L	90.8	Very high	87.9	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	35%	0.352	C	S	.	.			trans	-58.8	137.7	172.1	-171.9	69.7	0	0	0	110.5	R472 I475 L501 G506 P515 V516	R472-L508 HydrophobicContact CG-CD1 4.15Å; I475-L508 HydrophobicContact CB-CD2 4.14Å; I475-L508 HydrophobicContact CD1-CD2 4.23Å; I475-L508 HydrophobicContact CG2-CD2 3.6Å; L501-L508 HydrophobicContact CD2-CD1 4.05Å; L501-L508 HydrophobicContact CD2-CD2 4.05Å; G506-L508 PolarHBondContact O-N 2.82Å; G506-L508 VanDerWaalsContact O-N 3.08Å; L508-P515 WeakPolarHBondContact O-CA 3.33Å; L508-V516 HydrophobicContact CB-CG1 3.92Å; L508-V516 HydrophobicContact CB-CG2 4.25Å; L508-V516 HydrophobicContact CD2-CG1 4.13Å; L508-V516 HydrophobicContact CG-CG1 4.33Å; L508-V516 PolarHBondContact O-N 2.94Å
509	R	92.4	Very high	88.1	Confident	113 Å²	113	67.9 Å²	67.9	43%	0.426	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-126.1	151	179.4	-68.4	176.7	-179.8	-83.7	-5.7	111.2	R472 G513 E514 P515	R472-R509 PolarHBondContact NE-O 2.76Å; R472-R509 PolarHBondContact NH2-O 2.63Å; R509-G513 PolarHBondContact NH1-O 3.04Å; R509-E514 CarbonylContact C-O 3.54Å; R509-E514 WeakPolarHBondContact CA-O 3.29Å; R509-P515 HydrophobicContact CG-CB 4.33Å
510	S	93	Very high	88.5	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	35%	0.345	C	S	.	.			trans	-68.1	165.8	168.5	73.7	0	0	0	0	110.5	R472 K512 G513 E514	R472-S510 PolarHBondContact NH2-O 3.46Å; S510-K512 PolarHBondContact O-N 2.75Å; S510-K512 VanDerWaalsContact O-N 3.12Å; S510-K512 PolarHBondContact OG-N 2.87Å; S510-G513 PolarHBondContact O-N 2.81Å; S510-E514 PolarHBondContact N-O 3.29Å; S510-E514 WeakPolarHBondContact OG-CB 3.39Å; S510-E514 PolarHBondContact OG-N 2.84Å
511	P	91.4	Very high	88.9	Confident	71 Å²	71	58.4 Å²	58.4	46%	0.461	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23	170.1	-26.2	35.8	0	0	0	113.7	A469 G513	A469-P511 HydrophobicContact CB-CG 3.91Å; A469-P511 WeakPolarHBondContact O-CG 3.33Å; P511-G513 VanDerWaalsContact C-N 3.31Å
512	K	92.8	Very high	89.2	Confident	147 Å²	147	59 Å²	59	64%	0.639	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-4	176.3	-62.4	166.6	-176.8	155.8	0	113.2	E473 S510	E473-K512 IonicContact OE1-NZ 3.25Å; E473-K512 PolarHBondContact OE1-NZ 2.85Å; S510-K512 PolarHBondContact O-N 2.75Å; S510-K512 VanDerWaalsContact O-N 3.12Å; S510-K512 PolarHBondContact OG-N 2.87Å
513	G	91.9	Very high	89.7	Confident	37 Å²	37	58.8 Å²	58.8	38%	0.381	32%	0.322	S	S	.	.	S	Bend	trans	90.5	0.2	178.6	0	0	0	0	0	115.1	R509 S510 P511	R509-G513 PolarHBondContact NH1-O 3.04Å; S510-G513 PolarHBondContact O-N 2.81Å; P511-G513 VanDerWaalsContact C-N 3.31Å
514	E	94	Very high	90.6	Very high	111 Å²	111	58 Å²	58	52%	0.519	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-72.2	126.9	178.9	-61.9	175.6	154.5	0	0	110.1	V476 R509 S510	V476-E514 HydrophobicContact CG1-CB 4.4Å; R509-E514 CarbonylContact C-O 3.54Å; R509-E514 WeakPolarHBondContact CA-O 3.29Å; S510-E514 PolarHBondContact N-O 3.29Å; S510-E514 WeakPolarHBondContact OG-CB 3.39Å; S510-E514 PolarHBondContact OG-N 2.84Å
515	P	94.4	Very high	91.4	Very high	60 Å²	60	53.4 Å²	53.4	39%	0.39	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-75.7	154.5	178.2	32.1	-33.3	0	0	0	111.9	I507 L508 R509	I507-P515 HydrophobicContact CG2-CB 3.53Å; L508-P515 WeakPolarHBondContact O-CA 3.33Å; R509-P515 HydrophobicContact CG-CB 4.33Å
516	V	94.1	Very high	92.5	Very high	24 Å²	24	46.5 Å²	46.5	15%	0.145	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-57.3	144.1	163.1	-68.2	0	0	0	0	110.4	I475 V476 I507 L508	I475-V516 HydrophobicContact CG2-CG1 4.12Å; V476-V516 HydrophobicContact CB-CG1 4.49Å; V476-V516 HydrophobicContact CG2-CG1 3.7Å; I507-V516 HydrophobicContact CG2-CG2 4.1Å; L508-V516 HydrophobicContact CB-CG1 3.92Å; L508-V516 HydrophobicContact CB-CG2 4.25Å; L508-V516 HydrophobicContact CD2-CG1 4.13Å; L508-V516 HydrophobicContact CG-CG1 4.33Å; L508-V516 PolarHBondContact O-N 2.94Å
517	L	92.9	Very high	93.3	Very high	103 Å²	103	48.3 Å²	48.3	54%	0.539	25%	0.246	S	C	.	.	S	Bend	trans	-74.5	-34.2	177.9	-178.3	64.7	0	0	0	112	S479	S479-L517 PolarHBondContact OG-N 2.86Å
518	R	93.2	Very high	93.7	Very high	26 Å²	26	48.2 Å²	48.2	10%	0.098	25%	0.247	C	C	.	.	S	Bend	trans	-152.4	157.6	-179.6	60.9	-176.4	-178	87.3	14.1	108	Y454 S479 L481 M483 I520 Q548	Y454-R518 PolarHBondContact OH-NH1 2.97Å; Y454-R518 VanDerWaalsContact OH-NH1 3.1Å; S479-R518 WeakPolarHBondContact O-CD 3.16Å; S479-R518 WeakPolarHBondContact O-CG 3.37Å; S479-R518 PolarHBondContact O-NE 2.85Å; L481-R518 PolarHBondContact O-NH2 2.81Å; M483-R518 PolarHBondContact O-NH1 3.33Å; M483-R518 PolarHBondContact O-NH2 2.74Å; R518-I520 HydrophobicContact CG-CG2 3.79Å; R518-I520 VanDerWaalsContact NH1-CG2 3.28Å; R518-Q548 PolarHBondContact NH1-O 3.22Å
519	D	92.6	Very high	93.8	Very high	57 Å²	57	49.6 Å²	49.6	31%	0.305	25%	0.253	S	S	.	.			trans	-71.4	137.2	170	-153.3	-16.5	0	0	0	110.5	V521	D519-V521 PolarHBondContact OD1-N 3.08Å
520	I	95.6	Very high	93.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.248	C	C	.	.			trans	-139.4	-7.6	-177.9	74.5	172.4	0	0	0	112.8	I475 A478 V485 R518	I475-I520 HydrophobicContact CG2-CD1 4.04Å; I475-I520 HydrophobicContact CG2-CG1 4.02Å; A478-I520 HydrophobicContact CB-CD1 3.67Å; V485-I520 HydrophobicContact CG2-CD1 4.33Å; V485-I520 PolarHBondContact N-O 3.03Å; R518-I520 HydrophobicContact CG-CG2 3.79Å; R518-I520 VanDerWaalsContact NH1-CG2 3.28Å
521	V	95.9	Very high	93	Very high	1 Å²	1	57 Å²	57	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.3	-172.9	-178.4	0	0	0	0	107.6	I475 V485 I487 L501 D519	I475-V521 HydrophobicContact CD1-CG2 3.95Å; I475-V521 HydrophobicContact CG1-CG2 4.19Å; I475-V521 HydrophobicContact CG2-CG2 3.75Å; V485-V521 HydrophobicContact CB-CG2 4.39Å; V485-V521 CarbonylContact O-C 3.5Å; V485-V521 WeakPolarHBondContact O-CA 3.4Å; I487-V521 HydrophobicContact CD1-CG1 4.15Å; L501-V521 HydrophobicContact CB-CG1 4.06Å; L501-V521 WeakPolarHBondContact O-CB 3.27Å; D519-V521 PolarHBondContact OD1-N 3.08Å
522	Q	95.3	Very high	92.7	Very high	14 Å²	14	55.9 Å²	55.9	7%	0.065	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.1	164.1	-179.9	78	84.4	0	0	109	V485 I486 I487 D502 V524 E544	V485-Q522 PolarHBondContact O-N 3.03Å; I486-Q522 CarbonylContact C-O 3.49Å; I486-Q522 WeakPolarHBondContact CA-O 3.46Å; I486-Q522 HydrophobicContact CG1-CB 4.49Å; I487-Q522 PolarHBondContact N-O 2.88Å; D502-Q522 WeakPolarHBondContact OD1-CA 3.2Å; D502-Q522 PolarHBondContact OD1-NE2 2.72Å; Q522-V524 HydrophobicContact CG-CG2 4Å; Q522-E544 PolarHBondContact NE2-OE1 3.42Å; Q522-E544 PolarHBondContact OE1-OE1 2.95Å; Q522-E544 VanDerWaalsContact OE1-OE1 3.13Å
523	F	94.6	Very high	92.3	Very high	9 Å²	9	52 Å²	52	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129	171.8	174.8	-112.1	0	0	0	112.4	I487 F495 M498 Q499 D502 P525	I487-F523 HydrophobicContact CB-CD2 4.04Å; I487-F523 HydrophobicContact CG2-CD2 3.93Å; I487-F523 HydrophobicContact CG2-CE2 4.36Å; I487-F523 WeakPolarHBondContact O-CA 3.44Å; I487-F523 WeakPolarHBondContact O-CD2 3.4Å; F495-F523 HydrophobicContact CB-CE1 3.85Å; F495-F523 HydrophobicContact CB-CE2 4.41Å; F495-F523 HydrophobicContact CB-CZ 3.46Å; F495-F523 VanDerWaalsContact CB-CZ 3.46Å; F495-F523 HydrophobicContact CD1-CZ 4.32Å; F495-F523 HydrophobicContact CD2-CE1 4.5Å; F495-F523 AromaticContact CD2-CZ 3.68Å; F495-F523 HydrophobicContact CD2-CZ 3.68Å; F495-F523 HydrophobicContact CE2-CZ 4.41Å; F495-F523 HydrophobicContact CG-CE1 4.43Å; F495-F523 HydrophobicContact CG-CE2 4.38Å; F495-F523 AromaticContact CG-CZ 3.61Å; F495-F523 HydrophobicContact CG-CZ 3.61Å; M498-F523 HydrophobicContact CB-CB 4.35Å; M498-F523 HydrophobicContact CB-CD1 3.97Å; M498-F523 HydrophobicContact CB-CD2 3.33Å; M498-F523 HydrophobicContact CB-CE1 4.11Å; M498-F523 HydrophobicContact CB-CE2 3.5Å; M498-F523 VanDerWaalsContact CB-CE2 3.5Å; M498-F523 HydrophobicContact CB-CG 3.59Å; M498-F523 HydrophobicContact CB-CZ 3.91Å; M498-F523 HydrophobicContact CG-CD2 3.99Å; M498-F523 HydrophobicContact CG-CE2 3.86Å; M498-F523 HydrophobicContact CG-CZ 4.47Å; Q499-F523 HydrophobicContact CG-CD1 3.85Å; Q499-F523 HydrophobicContact CG-CE1 3.86Å; D502-F523 HydrophobicContact CB-CB 4.03Å; D502-F523 VanDerWaalsContact CG-N 3.34Å; D502-F523 PolarHBondContact OD1-N 2.84Å; F523-P525 HydrophobicContact CE1-CB 4.2Å; F523-P525 HydrophobicContact CE1-CG 4.24Å; F523-P525 HydrophobicContact CZ-CB 3.95Å; F523-P525 HydrophobicContact CZ-CG 4.46Å
524	V	94.8	Very high	92	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	117	175.8	-174.9	0	0	0	0	111.3	I487 V488 G489 Q522 F526 F529 L537 V541	I487-V524 PolarHBondContact O-N 2.65Å; V488-V524 VanDerWaalsContact CA-O 3.3Å; V488-V524 WeakPolarHBondContact CA-O 3.28Å; G489-V524 PolarHBondContact N-O 3.5Å; Q522-V524 HydrophobicContact CG-CG2 4Å; V524-F526 PolarHBondContact O-N 3.4Å; V524-F529 HydrophobicContact CG1-CD2 4.11Å; V524-F529 HydrophobicContact CG1-CE2 3.44Å; V524-F529 VanDerWaalsContact CG1-CE2 3.44Å; V524-F529 HydrophobicContact CG1-CZ 4.21Å; V524-L537 HydrophobicContact CG1-CD1 4.01Å; V524-V541 HydrophobicContact CB-CG2 3.82Å; V524-V541 HydrophobicContact CG1-CG2 4Å; V524-V541 HydrophobicContact CG2-CB 4.38Å; V524-V541 HydrophobicContact CG2-CG2 3.77Å
525	P	95.1	Very high	91.5	Very high	20 Å²	20	51.8 Å²	51.8	13%	0.13	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.9	173.6	31.2	-34.1	0	0	0	110.5	F495 F523 R527 N528	F495-P525 HydrophobicContact CD2-CB 3.85Å; F495-P525 HydrophobicContact CE2-CB 4Å; F523-P525 HydrophobicContact CE1-CB 4.2Å; F523-P525 HydrophobicContact CE1-CG 4.24Å; F523-P525 HydrophobicContact CZ-CB 3.95Å; F523-P525 HydrophobicContact CZ-CG 4.46Å; P525-R527 HydrophobicContact CB-CG 4.32Å; P525-R527 PolarHBondContact O-N 3.05Å; P525-N528 WeakPolarHBondContact CG-ND2 3.32Å; P525-N528 PolarHBondContact O-N 3.13Å; P525-N528 VanDerWaalsContact O-N 3.12Å
526	F	95.2	Very high	91.2	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.044	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-55.5	-30.3	-179.4	-174.5	-87	0	0	0	112.5	E355 K358 A359 V488 G489 V524 N528 F529 K530 L537	E355-F526 HydrophobicContact CB-CD1 3.87Å; E355-F526 HydrophobicContact CB-CE1 3.88Å; E355-F526 HydrophobicContact CB-CG 4.39Å; E355-F526 HydrophobicContact CB-CZ 4.36Å; E355-F526 HydrophobicContact CG-CD1 3.73Å; E355-F526 HydrophobicContact CG-CE1 3.55Å; E355-F526 HydrophobicContact CG-CZ 4.38Å; E355-F526 WeakPolarHBondContact OE2-CD1 3.38Å; K358-F526 HydrophobicContact CB-CE2 3.79Å; K358-F526 HydrophobicContact CB-CZ 3.68Å; K358-F526 HydrophobicContact CD-CZ 3.82Å; K358-F526 HydrophobicContact CG-CZ 4.41Å; A359-F526 HydrophobicContact CB-CD2 4.07Å; A359-F526 HydrophobicContact CB-CE2 4.29Å; V488-F526 HydrophobicContact CG1-CB 4.06Å; V488-F526 HydrophobicContact CG1-CD2 4.46Å; G489-F526 VanDerWaalsContact O-CB 3.28Å; G489-F526 WeakPolarHBondContact O-CB 3.37Å; G489-F526 PolarHBondContact O-N 3.35Å; V524-F526 PolarHBondContact O-N 3.4Å; F526-N528 PolarHBondContact O-N 3.18Å; F526-F529 PolarHBondContact O-N 3.23Å; F526-K530 HydrophobicContact CD1-CG 4.34Å; F526-K530 HydrophobicContact CE1-CG 4.24Å; F526-L537 HydrophobicContact CD2-CD1 4.3Å; F526-L537 HydrophobicContact CD2-CD2 3.58Å; F526-L537 HydrophobicContact CE2-CD2 3.5Å
527	R	93.9	Very high	91.1	Very high	81 Å²	81	49.5 Å²	49.5	31%	0.306	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-55.7	-27.3	-179.6	76.3	-177.3	66.7	168.9	9.3	113.8	G491 A493 P525 F529	G491-R527 PolarHBondContact O-NE 2.94Å; G491-R527 PolarHBondContact O-NH2 3.22Å; G491-R527 VanDerWaalsContact O-NH2 3.15Å; A493-R527 VanDerWaalsContact N-NH2 3.18Å; A493-R527 PolarHBondContact O-NH1 3.24Å; A493-R527 PolarHBondContact O-NH2 2.87Å; P525-R527 HydrophobicContact CB-CG 4.32Å; P525-R527 PolarHBondContact O-N 3.05Å; R527-F529 PolarHBondContact O-N 2.79Å
528	N	93.3	Very high	91	Very high	115 Å²	115	44.6 Å²	44.6	62%	0.615	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-71.8	-13.6	178	-67.5	0.1	0	0	0	112.6	P525 F526	P525-N528 WeakPolarHBondContact CG-ND2 3.32Å; P525-N528 PolarHBondContact O-N 3.13Å; P525-N528 VanDerWaalsContact O-N 3.12Å; F526-N528 PolarHBondContact O-N 3.18Å
529	F	93.3	Very high	90.8	Very high	39 Å²	39	46 Å²	46	17%	0.171	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-120.8	9.3	-172.7	-58.2	-87.7	0	0	0	113.6	V524 F526 R527 H531 A532 A536 L537 S540	V524-F529 HydrophobicContact CG1-CD2 4.11Å; V524-F529 HydrophobicContact CG1-CE2 3.44Å; V524-F529 VanDerWaalsContact CG1-CE2 3.44Å; V524-F529 HydrophobicContact CG1-CZ 4.21Å; F526-F529 PolarHBondContact O-N 3.23Å; R527-F529 PolarHBondContact O-N 2.79Å; F529-H531 PolarHBondContact O-N 3.44Å; F529-A532 HydrophobicContact CB-CB 4.07Å; F529-A532 HydrophobicContact CD1-CB 4.03Å; F529-A532 PolarHBondContact O-N 2.89Å; F529-A536 HydrophobicContact CD1-CB 4.18Å; F529-A536 HydrophobicContact CE1-CB 4.44Å; F529-A536 WeakPolarHBondContact CE1-O 3.47Å; F529-L537 HydrophobicContact CB-CB 4.12Å; F529-L537 HydrophobicContact CB-CD1 4.25Å; F529-L537 HydrophobicContact CD1-CB 4.25Å; F529-L537 HydrophobicContact CD2-CD1 3.71Å; F529-L537 HydrophobicContact CE2-CD1 4.25Å; F529-L537 HydrophobicContact CG-CB 4.09Å; F529-L537 HydrophobicContact CG-CD1 3.97Å; F529-S540 VanDerWaalsContact CZ-CB 3.49Å
530	K	84.2	Confident	90.7	Very high	78 Å²	78	45.3 Å²	45.3	34%	0.339	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.1	-177.4	-69.3	-170.8	-168.7	-141.4	0	114.3	E355 F526	E355-K530 VanDerWaalsContact OE1-CE 3.22Å; E355-K530 WeakPolarHBondContact OE1-CE 3.4Å; E355-K530 IonicContact OE1-NZ 3.07Å; E355-K530 PolarHBondContact OE1-NZ 3.26Å; F526-K530 HydrophobicContact CD1-CG 4.34Å; F526-K530 HydrophobicContact CE1-CG 4.24Å
531	H	84.8	Confident	90.6	Very high	193 Å²	193	45.3 Å²	45.3	89%	0.894	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	5.6	179.2	-55.1	-55.5	0	0	0	113.1	F529	F529-H531 PolarHBondContact O-N 3.44Å
532	A	85.9	Confident	90.5	Very high	46 Å²	46	45.2 Å²	45.2	38%	0.38	25%	0.252	S	S	.	.	S	Bend	trans	-88.7	167	177.8	0	0	0	0	0	110.7	F529 A536	F529-A532 HydrophobicContact CB-CB 4.07Å; F529-A532 HydrophobicContact CD1-CB 4.03Å; F529-A532 PolarHBondContact O-N 2.89Å; A532-A536 HydrophobicContact CB-CB 3.92Å
533	S	84.1	Confident	90.2	Very high	67 Å²	67	47.1 Å²	47.1	47%	0.469	27%	0.271	S	S	.	.			trans	-69.3	152.7	171.1	62.3	0	0	0	0	110.5	A535 A536 L537	S533-A535 PolarHBondContact O-N 3.49Å; S533-A536 WeakPolarHBondContact O-CB 3.45Å; S533-A536 PolarHBondContact O-N 3.01Å; S533-A536 PolarHBondContact OG-N 3.24Å; S533-L537 PolarHBondContact O-N 3.41Å
534	P	84.3	Confident	90	Very high	93 Å²	93	48.6 Å²	48.6	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-53.3	-35.4	171.5	-27.9	35.8	0	0	0	113.1	A362 A536 L537 A538	A362-P534 HydrophobicContact CB-CB 4.03Å; P534-A536 VanDerWaalsContact C-N 3.31Å; P534-A536 PolarHBondContact O-N 3.16Å; P534-L537 PolarHBondContact O-N 3.28Å; P534-A538 PolarHBondContact O-N 2.91Å
535	A	84.3	Confident	90	Very high	49 Å²	49	48.6 Å²	48.6	41%	0.405	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-36.3	175.5	0	0	0	0	0	112.8	S533 A538 K539	S533-A535 PolarHBondContact O-N 3.49Å; A535-A538 PolarHBondContact O-N 3.49Å; A535-K539 WeakPolarHBondContact O-CB 3.32Å; A535-K539 PolarHBondContact O-N 3.4Å
536	A	88.4	Confident	89.9	Confident	33 Å²	33	48 Å²	48	27%	0.273	27%	0.273	S	S	.	.	H	α-helix	trans	-68.1	-38.3	177.8	0	0	0	0	0	112.4	F529 A532 S533 P534 S540	F529-A536 HydrophobicContact CD1-CB 4.18Å; F529-A536 HydrophobicContact CE1-CB 4.44Å; F529-A536 WeakPolarHBondContact CE1-O 3.47Å; A532-A536 HydrophobicContact CB-CB 3.92Å; S533-A536 WeakPolarHBondContact O-CB 3.45Å; S533-A536 PolarHBondContact O-N 3.01Å; S533-A536 PolarHBondContact OG-N 3.24Å; P534-A536 VanDerWaalsContact C-N 3.31Å; P534-A536 PolarHBondContact O-N 3.16Å; A536-S540 PolarHBondContact O-N 2.92Å
537	L	91.1	Very high	89.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-53.6	173	173.4	65.9	0	0	0	110.2	A359 A362 V524 F526 F529 S533 P534 K539 S540 V541	A359-L537 HydrophobicContact CB-CD2 4.29Å; A362-L537 HydrophobicContact CB-CD2 4.09Å; V524-L537 HydrophobicContact CG1-CD1 4.01Å; F526-L537 HydrophobicContact CD2-CD1 4.3Å; F526-L537 HydrophobicContact CD2-CD2 3.58Å; F526-L537 HydrophobicContact CE2-CD2 3.5Å; F529-L537 HydrophobicContact CB-CB 4.12Å; F529-L537 HydrophobicContact CB-CD1 4.25Å; F529-L537 HydrophobicContact CD1-CB 4.25Å; F529-L537 HydrophobicContact CD2-CD1 3.71Å; F529-L537 HydrophobicContact CE2-CD1 4.25Å; F529-L537 HydrophobicContact CG-CB 4.09Å; F529-L537 HydrophobicContact CG-CD1 3.97Å; S533-L537 PolarHBondContact O-N 3.41Å; P534-L537 PolarHBondContact O-N 3.28Å; L537-K539 PolarHBondContact O-N 2.99Å; L537-S540 PolarHBondContact O-N 3.38Å; L537-V541 HydrophobicContact CD1-CG2 3.79Å; L537-V541 HydrophobicContact CG-CG2 4.1Å; L537-V541 WeakPolarHBondContact O-CB 3.25Å; L537-V541 VanDerWaalsContact O-CG2 3.24Å; L537-V541 WeakPolarHBondContact O-CG2 3.3Å; L537-V541 PolarHBondContact O-N 2.89Å
538	A	91.2	Very high	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-37.5	-178.2	0	0	0	0	0	112.4	I366 P534 A535 S540 V541 L542	I366-A538 HydrophobicContact CD1-CB 3.26Å; P534-A538 PolarHBondContact O-N 2.91Å; A535-A538 PolarHBondContact O-N 3.49Å; A538-S540 PolarHBondContact O-N 3.13Å; A538-V541 PolarHBondContact O-N 2.83Å; A538-L542 WeakPolarHBondContact O-CB 3.28Å; A538-L542 PolarHBondContact O-N 3.36Å
539	K	89.7	Confident	90	Very high	55 Å²	55	43 Å²	43	24%	0.239	25%	0.253	C	S	.	.	H	α-helix	trans	-57.2	-45.5	173.4	174.9	157	-174.9	169.5	0	114.1	S38 E104 A535 L537 V541 A543	S38-K539 PolarHBondContact OG-NZ 3.41Å; E104-K539 HydrophobicContact CB-CB 4.42Å; E104-K539 HydrophobicContact CG-CB 3.81Å; E104-K539 HydrophobicContact CG-CD 4.24Å; E104-K539 HydrophobicContact CG-CG 3.85Å; A535-K539 WeakPolarHBondContact O-CB 3.32Å; A535-K539 PolarHBondContact O-N 3.4Å; L537-K539 PolarHBondContact O-N 2.99Å; K539-V541 VanDerWaalsContact C-N 3.34Å; K539-A543 WeakPolarHBondContact O-CB 3.18Å; K539-A543 PolarHBondContact O-N 3.4Å
540	S	90.8	Very high	90	Very high	43 Å²	43	42.1 Å²	42.1	30%	0.301	25%	0.251	S	S	.	.	H	α-helix	trans	-70	-35.5	176	-165.1	0	0	0	0	111.9	F529 A536 L537 A538	F529-S540 VanDerWaalsContact CZ-CB 3.49Å; A536-S540 PolarHBondContact O-N 2.92Å; L537-S540 PolarHBondContact O-N 3.38Å; A538-S540 PolarHBondContact O-N 3.13Å
541	V	92.6	Very high	90.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-74.7	-34.7	-174.3	172.6	0	0	0	0	112.7	V363 I486 V488 V524 L537 A538 K539	V363-V541 HydrophobicContact CG1-CG1 4.2Å; V363-V541 HydrophobicContact CG2-CB 4.11Å; V363-V541 HydrophobicContact CG2-CG1 3.61Å; V363-V541 HydrophobicContact CG2-CG2 4.35Å; I486-V541 HydrophobicContact CD1-CG1 4.28Å; I486-V541 HydrophobicContact CG2-CG1 3.32Å; V488-V541 HydrophobicContact CG2-CG1 4.28Å; V488-V541 HydrophobicContact CG2-CG2 3.94Å; V524-V541 HydrophobicContact CB-CG2 3.82Å; V524-V541 HydrophobicContact CG1-CG2 4Å; V524-V541 HydrophobicContact CG2-CB 4.38Å; V524-V541 HydrophobicContact CG2-CG2 3.77Å; L537-V541 HydrophobicContact CD1-CG2 3.79Å; L537-V541 HydrophobicContact CG-CG2 4.1Å; L537-V541 WeakPolarHBondContact O-CB 3.25Å; L537-V541 VanDerWaalsContact O-CG2 3.24Å; L537-V541 WeakPolarHBondContact O-CG2 3.3Å; L537-V541 PolarHBondContact O-N 2.89Å; A538-V541 PolarHBondContact O-N 2.83Å; K539-V541 VanDerWaalsContact C-N 3.34Å
542	L	93.4	Very high	90.9	Very high	0 Å²	0	34 Å²	34	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-102.6	3.3	-175	-66.9	175.6	0	0	0	113.3	F103 E104 V363 I366 I486 A538 E544 V545 P546	F103-L542 HydrophobicContact CD1-CB 4.1Å; F103-L542 HydrophobicContact CE1-CB 3.81Å; F103-L542 HydrophobicContact CE1-CD1 4.33Å; F103-L542 HydrophobicContact CE1-CD2 4.08Å; F103-L542 HydrophobicContact CE1-CG 4.3Å; E104-L542 HydrophobicContact CB-CB 4.05Å; V363-L542 HydrophobicContact CG1-CD1 4.5Å; V363-L542 HydrophobicContact CG1-CD2 4.07Å; V363-L542 HydrophobicContact CG1-CG 4.37Å; I366-L542 HydrophobicContact CB-CD1 3.94Å; I366-L542 HydrophobicContact CD1-CD1 3.93Å; I366-L542 HydrophobicContact CG2-CD1 3.63Å; I486-L542 HydrophobicContact CD1-CD2 3.9Å; A538-L542 WeakPolarHBondContact O-CB 3.28Å; A538-L542 PolarHBondContact O-N 3.36Å; L542-E544 VanDerWaalsContact C-N 3.31Å; L542-E544 PolarHBondContact O-N 2.83Å; L542-V545 HydrophobicContact CD2-CG2 4.22Å; L542-V545 PolarHBondContact O-N 3.06Å; L542-P546 WeakPolarHBondContact O-CD 3.31Å
543	A	88.6	Confident	91.3	Very high	54 Å²	54	31.9 Å²	31.9	45%	0.446	20%	0.2	S	C	.	.	S	Bend	trans	-55.8	-42.2	-171	0	0	0	0	0	113.4	K539	K539-A543 WeakPolarHBondContact O-CB 3.18Å; K539-A543 PolarHBondContact O-N 3.4Å
544	E	91.1	Very high	91.7	Very high	40 Å²	40	30 Å²	30	19%	0.187	18%	0.184	C	C	.	.	S	Bend	trans	-90.8	-19	-172.9	-71.6	-179.6	-160.8	0	0	114.6	Q522 L542 N547 Q548	Q522-E544 PolarHBondContact NE2-OE1 3.42Å; Q522-E544 PolarHBondContact OE1-OE1 2.95Å; Q522-E544 VanDerWaalsContact OE1-OE1 3.13Å; L542-E544 VanDerWaalsContact C-N 3.31Å; L542-E544 PolarHBondContact O-N 2.83Å; E544-N547 PolarHBondContact O-N 3.13Å; E544-Q548 HydrophobicContact CB-CG 4.24Å; E544-Q548 WeakPolarHBondContact O-CG 3.25Å; E544-Q548 PolarHBondContact O-N 2.94Å; E544-Q548 PolarHBondContact OE2-NE2 3.21Å
545	V	94.5	Very high	91.9	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-52.7	-46.1	-173.6	171.7	0	0	0	0	112.4	F103 I456 I486 L542 N547 Q548 V549	F103-V545 HydrophobicContact CE1-CB 3.73Å; F103-V545 HydrophobicContact CE1-CG1 3.74Å; F103-V545 HydrophobicContact CE1-CG2 4.43Å; F103-V545 HydrophobicContact CZ-CB 4.35Å; F103-V545 HydrophobicContact CZ-CG1 3.85Å; I456-V545 HydrophobicContact CD1-CG1 3.6Å; I456-V545 HydrophobicContact CD1-CG2 4.26Å; I456-V545 HydrophobicContact CG1-CG1 4.46Å; I486-V545 HydrophobicContact CD1-CG2 3.92Å; L542-V545 HydrophobicContact CD2-CG2 4.22Å; L542-V545 PolarHBondContact O-N 3.06Å; V545-N547 VanDerWaalsContact C-N 3.3Å; V545-N547 PolarHBondContact O-N 2.78Å; V545-Q548 PolarHBondContact O-N 2.83Å; V545-V549 HydrophobicContact CG1-CG2 4.33Å; V545-V549 VanDerWaalsContact O-CG2 3.3Å; V545-V549 WeakPolarHBondContact O-CG2 3.29Å; V545-V549 PolarHBondContact O-N 3.48Å
546	P	94.1	Very high	92.2	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.039	19%	0.191	C	C	.	.	H	α-helix	trans	-56.3	-42.6	177.8	-27.5	37.2	0	0	0	113.4	L41 F103 F314 L542 V550	L41-P546 HydrophobicContact CD1-CB 3.96Å; L41-P546 HydrophobicContact CD1-CG 4.37Å; L41-P546 HydrophobicContact CD2-CB 4.1Å; L41-P546 HydrophobicContact CD2-CG 4.24Å; F103-P546 HydrophobicContact CB-CG 3.94Å; F103-P546 HydrophobicContact CD1-CG 3.62Å; F103-P546 HydrophobicContact CE1-CG 4.37Å; F103-P546 HydrophobicContact CG-CG 3.89Å; F314-P546 HydrophobicContact CB-CB 3.94Å; F314-P546 HydrophobicContact CD1-CB 4.24Å; F314-P546 HydrophobicContact CD2-CB 4.04Å; F314-P546 HydrophobicContact CG-CB 3.8Å; F314-P546 HydrophobicContact CG-CG 4.48Å; L542-P546 WeakPolarHBondContact O-CD 3.31Å; P546-V550 VanDerWaalsContact O-CG2 3.25Å; P546-V550 WeakPolarHBondContact O-CG2 3.42Å; P546-V550 PolarHBondContact O-N 2.89Å; P546-V550 VanDerWaalsContact O-N 3.15Å
547	N	92.3	Very high	92.3	Very high	98 Å²	98	32.6 Å²	32.6	52%	0.524	21%	0.207	S	C	.	.	H	α-helix	trans	-70	-43.4	178.6	-68.7	-26.5	0	0	0	111	E544 V545 V549 V550 D551	E544-N547 PolarHBondContact O-N 3.13Å; V545-N547 VanDerWaalsContact C-N 3.3Å; V545-N547 PolarHBondContact O-N 2.78Å; N547-V549 PolarHBondContact O-N 3.09Å; N547-V550 PolarHBondContact O-N 2.91Å; N547-V550 VanDerWaalsContact O-N 3.13Å; N547-D551 WeakPolarHBondContact O-CB 3.38Å; N547-D551 VanDerWaalsContact O-CG 3.28Å; N547-D551 PolarHBondContact O-N 3.01Å
548	Q	95.5	Very high	92.3	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-31.9	178.8	-65.8	176	-2.8	0	0	112.6	Y454 S484 R518 E544 V545 Y552	Y454-Q548 VanDerWaalsContact OH-C 3.31Å; Y454-Q548 PolarHBondContact OH-O 3.36Å; Y454-Q548 VanDerWaalsContact OH-O 3.08Å; S484-Q548 PolarHBondContact OG-OE1 2.99Å; R518-Q548 PolarHBondContact NH1-O 3.22Å; E544-Q548 HydrophobicContact CB-CG 4.24Å; E544-Q548 WeakPolarHBondContact O-CG 3.25Å; E544-Q548 PolarHBondContact O-N 2.94Å; E544-Q548 PolarHBondContact OE2-NE2 3.21Å; V545-Q548 PolarHBondContact O-N 2.83Å; Q548-Y552 PolarHBondContact O-N 3.02Å
549	V	95.9	Very high	92.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-51.1	172.1	172.2	0	0	0	0	111.2	F314 Y317 Y454 V545 N547 D551 Y552 Y553	F314-V549 HydrophobicContact CD2-CB 4.02Å; F314-V549 HydrophobicContact CD2-CG1 4.04Å; F314-V549 HydrophobicContact CD2-CG2 4.27Å; F314-V549 HydrophobicContact CE2-CB 4.35Å; F314-V549 HydrophobicContact CE2-CG1 4.4Å; F314-V549 HydrophobicContact CE2-CG2 4.11Å; Y317-V549 HydrophobicContact CD2-CG1 4.47Å; Y454-V549 HydrophobicContact CD1-CG2 3.65Å; Y454-V549 HydrophobicContact CD2-CB 4.37Å; Y454-V549 HydrophobicContact CD2-CG1 4.34Å; Y454-V549 HydrophobicContact CD2-CG2 3.88Å; Y454-V549 HydrophobicContact CE1-CG2 3.64Å; Y454-V549 HydrophobicContact CE2-CB 4.23Å; Y454-V549 HydrophobicContact CE2-CG2 3.85Å; Y454-V549 HydrophobicContact CG-CG2 3.76Å; V545-V549 HydrophobicContact CG1-CG2 4.33Å; V545-V549 VanDerWaalsContact O-CG2 3.3Å; V545-V549 WeakPolarHBondContact O-CG2 3.29Å; V545-V549 PolarHBondContact O-N 3.48Å; N547-V549 PolarHBondContact O-N 3.09Å; V549-D551 PolarHBondContact O-N 2.83Å; V549-Y552 PolarHBondContact O-N 2.85Å; V549-Y553 HydrophobicContact CG1-CD2 3.83Å; V549-Y553 HydrophobicContact CG1-CE2 3.98Å; V549-Y553 WeakPolarHBondContact O-CD2 3.24Å; V549-Y553 PolarHBondContact O-N 2.86Å; V549-Y553 VanDerWaalsContact O-N 3.1Å
550	V	93.1	Very high	92.3	Very high	20 Å²	20	39.3 Å²	39.3	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-45	-179.4	165.9	0	0	0	0	110.9	F314 P546 N547 Y552 N554	F314-V550 HydrophobicContact CB-CG2 4.06Å; P546-V550 VanDerWaalsContact O-CG2 3.25Å; P546-V550 WeakPolarHBondContact O-CG2 3.42Å; P546-V550 PolarHBondContact O-N 2.89Å; P546-V550 VanDerWaalsContact O-N 3.15Å; N547-V550 PolarHBondContact O-N 2.91Å; N547-V550 VanDerWaalsContact O-N 3.13Å; V550-Y552 PolarHBondContact O-N 3.05Å; V550-N554 WeakPolarHBondContact O-CB 3.25Å; V550-N554 WeakPolarHBondContact CG1-ND2 3.34Å; V550-N554 VanDerWaalsContact O-ND2 3.08Å; V550-N554 PolarHBondContact O-N 2.9Å; V550-N554 PolarHBondContact O-ND2 2.79Å
551	D	92.6	Very high	92.1	Very high	94 Å²	94	41.1 Å²	41.1	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-42.3	-179.9	-76.1	-16.8	0	0	0	111.7	N547 V549 G555	N547-D551 WeakPolarHBondContact O-CB 3.38Å; N547-D551 VanDerWaalsContact O-CG 3.28Å; N547-D551 PolarHBondContact O-N 3.01Å; V549-D551 PolarHBondContact O-N 2.83Å; D551-G555 VanDerWaalsContact O-CA 3.32Å; D551-G555 WeakPolarHBondContact O-CA 3.37Å; D551-G555 PolarHBondContact O-N 3.44Å
552	Y	95.7	Very high	90.8	Very high	8 Å²	8	46.1 Å²	46.1	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-58.8	176.7	175.5	-97.5	0	0	0	111.5	Y454 L481 P482 Q548 V549 V550 G555 K556	Y454-Y552 HydrophobicContact CE2-CD1 4.4Å; Y454-Y552 HydrophobicContact CE2-CG 4.38Å; L481-Y552 VanDerWaalsContact O-CD2 3.32Å; L481-Y552 WeakPolarHBondContact O-CD2 3.44Å; L481-Y552 WeakPolarHBondContact O-CE2 3.09Å; P482-Y552 HydrophobicContact CB-CD1 3.86Å; P482-Y552 HydrophobicContact CB-CE1 3.46Å; P482-Y552 VanDerWaalsContact CB-CE1 3.46Å; P482-Y552 HydrophobicContact CB-CE2 4.46Å; P482-Y552 WeakPolarHBondContact CD-OH 3.29Å; P482-Y552 HydrophobicContact CG-CE1 4.23Å; Q548-Y552 PolarHBondContact O-N 3.02Å; V549-Y552 PolarHBondContact O-N 2.85Å; V550-Y552 PolarHBondContact O-N 3.05Å; Y552-G555 PolarHBondContact O-N 2.85Å; Y552-K556 WeakPolarHBondContact O-CG 3.26Å; Y552-K556 PolarHBondContact O-N 3.31Å; Y552-K556 VanDerWaalsContact O-CG 3.29Å; Y552-K556 HydrophobicContact CE2-CG 4.1Å; Y552-K556 HydrophobicContact CD2-CG 4.46Å
553	Y	94.9	Very high	88.8	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-43.3	-170.9	-72.9	-60.1	0	0	0	112.7	Y317 A451 Q453 Y454 V549 G555 K556 G557 I558	Y317-Y553 AromaticContact CD1-CD2 3.86Å; Y317-Y553 HydrophobicContact CD1-CD2 3.86Å; Y317-Y553 HydrophobicContact CD1-CE2 4.42Å; Y317-Y553 HydrophobicContact CD1-CG 4.14Å; Y317-Y553 HydrophobicContact CD2-CD2 4.39Å; Y317-Y553 VanDerWaalsContact CE1-CB 3.41Å; Y317-Y553 HydrophobicContact CE1-CD1 4.47Å; Y317-Y553 AromaticContact CE1-CD2 3.89Å; Y317-Y553 HydrophobicContact CE1-CD2 3.89Å; Y317-Y553 AromaticContact CE1-CG 3.71Å; Y317-Y553 HydrophobicContact CE1-CG 3.71Å; Y317-Y553 HydrophobicContact CE2-CD2 4.43Å; Y317-Y553 HydrophobicContact CG-CD2 4.14Å; Y317-Y553 AromaticContact CZ-CG 3.99Å; Y317-Y553 WeakPolarHBondContact OH-CB 3.2Å; A451-Y553 HydrophobicContact CB-CD1 3.8Å; A451-Y553 HydrophobicContact CB-CD2 4.3Å; A451-Y553 HydrophobicContact CB-CE1 3.53Å; A451-Y553 HydrophobicContact CB-CE2 4.05Å; A451-Y553 HydrophobicContact CB-CG 4.18Å; Q453-Y553 PolarHBondContact O-OH 3.2Å; Y454-Y553 AromaticContact CD2-CE2 3.83Å; Y454-Y553 HydrophobicContact CD2-CE2 3.83Å; V549-Y553 HydrophobicContact CG1-CD2 3.83Å; V549-Y553 HydrophobicContact CG1-CE2 3.98Å; V549-Y553 WeakPolarHBondContact O-CD2 3.24Å; V549-Y553 PolarHBondContact O-N 2.86Å; V549-Y553 VanDerWaalsContact O-N 3.1Å; Y553-G555 VanDerWaalsContact C-N 3.33Å; Y553-G555 PolarHBondContact O-N 3.15Å; Y553-K556 CarbonylContact O-C 3.56Å; Y553-K556 PolarHBondContact O-N 3.33Å; Y553-G557 PolarHBondContact O-N 3.19Å; Y553-I558 PolarHBondContact O-N 2.97Å; Y553-I558 HydrophobicContact CE1-CG2 4.33Å; Y553-I558 HydrophobicContact CD1-CD1 4.14Å; Y553-I558 HydrophobicContact CD1-CB 3.93Å; Y553-I558 HydrophobicContact CD1-CG2 3.82Å
554	N	91	Very high	86.6	Confident	28 Å²	28	48.9 Å²	48.9	15%	0.15	29%	0.291	C	S	.	.	H	α-helix	trans	-66.2	-38.3	174.8	-70.8	-61.2	0	0	0	111	M311 H312 Y317 V550 K556 G557	M311-N554 HydrophobicContact CE-CB 3.86Å; M311-N554 HydrophobicContact SD-CB 4.17Å; H312-N554 PolarHBondContact N-OD1 3.2Å; H312-N554 VanDerWaalsContact N-OD1 3.1Å; H312-N554 PolarHBondContact O-ND2 3.31Å; Y317-N554 PolarHBondContact OH-N 2.64Å; Y317-N554 PolarHBondContact OH-OD1 3.11Å; V550-N554 WeakPolarHBondContact O-CB 3.25Å; V550-N554 WeakPolarHBondContact CG1-ND2 3.34Å; V550-N554 VanDerWaalsContact O-ND2 3.08Å; V550-N554 PolarHBondContact O-N 2.9Å; V550-N554 PolarHBondContact O-ND2 2.79Å; N554-K556 VanDerWaalsContact C-N 3.28Å; N554-K556 PolarHBondContact O-N 3.42Å; N554-G557 PolarHBondContact O-N 2.84Å
555	G	89.1	Confident	83.9	Confident	68 Å²	68	55.8 Å²	55.8	70%	0.701	32%	0.323	S	S	*	.	H	α-helix	trans	-61.7	-33.4	176.1	0	0	0	0	0	113.4	D551 Y552 Y553	D551-G555 VanDerWaalsContact O-CA 3.32Å; D551-G555 WeakPolarHBondContact O-CA 3.37Å; D551-G555 PolarHBondContact O-N 3.44Å; Y552-G555 PolarHBondContact O-N 2.85Å; Y553-G555 VanDerWaalsContact C-N 3.33Å; Y553-G555 PolarHBondContact O-N 3.15Å
556	K	90.9	Very high	81.2	Confident	103 Å²	103	62.1 Å²	62.1	45%	0.448	35%	0.354	S	S	.	.	H	α-helix	trans	-85.6	-5.9	172.7	-63.9	-67.3	-175.2	175.8	0	113.7	Y552 Y553 N554 I558	Y552-K556 WeakPolarHBondContact O-CG 3.26Å; Y552-K556 PolarHBondContact O-N 3.31Å; Y552-K556 VanDerWaalsContact O-CG 3.29Å; Y552-K556 HydrophobicContact CE2-CG 4.1Å; Y552-K556 HydrophobicContact CD2-CG 4.46Å; Y553-K556 CarbonylContact O-C 3.56Å; Y553-K556 PolarHBondContact O-N 3.33Å; N554-K556 VanDerWaalsContact C-N 3.28Å; N554-K556 PolarHBondContact O-N 3.42Å; K556-I558 HydrophobicContact CB-CD1 3.79Å; K556-I558 HydrophobicContact CB-CG1 3.84Å; K556-I558 HydrophobicContact CG-CD1 4.48Å; K556-I558 PolarHBondContact O-N 3.09Å
557	G	89.5	Confident	78.3	Confident	58 Å²	58	68.7 Å²	68.7	60%	0.598	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	21.6	-174.5	0	0	0	0	0	113.8	Y553 N554	Y553-G557 PolarHBondContact O-N 3.19Å; N554-G557 PolarHBondContact O-N 2.84Å
558	I	92.4	Very high	75.2	Confident	28 Å²	28	72.4 Å²	72.4	14%	0.144	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-83.4	126.6	177.1	-61.8	171.4	0	0	0	108	Y317 A451 Y553 K556	Y317-I558 PolarHBondContact OH-O 3.02Å; A451-I558 HydrophobicContact CB-CG2 4.01Å; Y553-I558 PolarHBondContact O-N 2.97Å; Y553-I558 HydrophobicContact CE1-CG2 4.33Å; Y553-I558 HydrophobicContact CD1-CD1 4.14Å; Y553-I558 HydrophobicContact CD1-CB 3.93Å; Y553-I558 HydrophobicContact CD1-CG2 3.82Å; K556-I558 HydrophobicContact CB-CD1 3.79Å; K556-I558 HydrophobicContact CB-CG1 3.84Å; K556-I558 HydrophobicContact CG-CD1 4.48Å; K556-I558 PolarHBondContact O-N 3.09Å
559	K	91.6	Very high	72.1	Confident	154 Å²	154	77 Å²	77	67%	0.67	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-93.2	149	-177.8	-61.6	178.8	-176.9	174.6	0	110.4
560	P	89.9	Confident	69.1	Low	18 Å²	18	81.1 Å²	81.1	12%	0.117	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-52.7	146.3	164.9	-19.3	27.6	0	0	0	110.6	H312 D316 Y317 C562	H312-P560 HydrophobicContact CB-CG 3.67Å; H312-P560 WeakPolarHBondContact CD2-CD 3.27Å; D316-P560 HydrophobicContact CB-CB 4.48Å; D316-P560 HydrophobicContact CB-CG 3.8Å; D316-P560 WeakPolarHBondContact O-CB 3.28Å; Y317-P560 HydrophobicContact CD1-CB 4.01Å; Y317-P560 HydrophobicContact CD1-CG 3.66Å; Y317-P560 HydrophobicContact CD2-CG 4.48Å; Y317-P560 HydrophobicContact CE1-CB 4.33Å; Y317-P560 VanDerWaalsContact CE1-CD 3.47Å; Y317-P560 HydrophobicContact CE1-CG 3.65Å; Y317-P560 HydrophobicContact CE2-CG 4.45Å; Y317-P560 HydrophobicContact CG-CG 4.08Å; P560-C562 PolarHBondContact O-N 3.42Å
561	K	85.7	Confident	66.1	Low	81 Å²	81	91.2 Å²	91.2	35%	0.352	49%	0.491	S	S	.	.			trans	-66.5	107.4	173	-57.4	179.5	-178	-169.7	0	107.6	G320 E450 S452 S563	G320-K561 WeakPolarHBondContact CA-O 3.48Å; G320-K561 WeakPolarHBondContact O-CB 3.29Å; E450-K561 WeakPolarHBondContact OE2-CE 3.46Å; E450-K561 IonicContact OE2-NZ 2.66Å; E450-K561 PolarHBondContact OE2-NZ 3.12Å; S452-K561 VanDerWaalsContact OG-CE 3.22Å; S452-K561 WeakPolarHBondContact OG-CE 3.39Å; S452-K561 PolarHBondContact OG-NZ 2.84Å; K561-S563 PolarHBondContact O-N 3.34Å; K561-S563 VanDerWaalsContact O-N 3.16Å
562	C	65.5	Low	63.1	Low	104 Å²	104	92.9 Å²	92.9	70%	0.703	51%	0.505	S	S	*	.			trans	-66.5	115.8	174.6	-168.5	0	0	0	0	107.3	P560 S564	P560-C562 PolarHBondContact O-N 3.42Å; C562-S564 PolarHBondContact O-N 2.9Å; C562-S564 PolarHBondContact O-OG 3.38Å; C562-S564 PolarHBondContact SG-OG 3.36Å; C562-S564 VanDerWaalsContact SG-OG 3.39Å
563	S	51	Low	60.2	Low	45 Å²	45	101 Å²	101	32%	0.315	55%	0.547	S	S	.	.			trans	-74.3	47.1	174.7	77.1	0	0	0	0	111.3	R143 K561 E565 M566	R143-S563 PolarHBondContact NH1-OG 3.27Å; K561-S563 PolarHBondContact O-N 3.34Å; K561-S563 VanDerWaalsContact O-N 3.16Å; S563-E565 PolarHBondContact O-N 3.11Å; S563-M566 PolarHBondContact O-N 3.25Å
564	S	42.1	Very low	56.8	Low	68 Å²	68	105 Å²	105	48%	0.476	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-61.9	-19.9	174.3	3.9	0	0	0	0	111.8	C562 M566 Y567	C562-S564 PolarHBondContact O-N 2.9Å; C562-S564 PolarHBondContact O-OG 3.38Å; C562-S564 PolarHBondContact SG-OG 3.36Å; C562-S564 VanDerWaalsContact SG-OG 3.39Å; S564-M566 PolarHBondContact O-N 2.59Å; S564-Y567 PolarHBondContact O-N 3.43Å
565	E	34	Very low	54.2	Low	185 Å²	185	113.3 Å²	113.3	86%	0.864	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-70.1	-10.9	177.7	-68.6	-170	160.2	0	0	114.5	S563	S563-E565 PolarHBondContact O-N 3.11Å
566	M	38.6	Very low	52.5	Low	134 Å²	134	115.6 Å²	115.6	66%	0.66	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-95.8	-16.3	173.3	-78.3	-164.2	-179.2	0	0	114.7	S563 S564 S569	S563-M566 PolarHBondContact O-N 3.25Å; S564-M566 PolarHBondContact O-N 2.59Å; M566-S569 PolarHBondContact O-OG 2.75Å
567	Y	32.9	Very low	50.4	Low	144 Å²	144	116.3 Å²	116.3	57%	0.565	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-79.2	-17.4	-178.6	-89.6	-86.4	0	0	0	113.9	S564	S564-Y567 PolarHBondContact O-N 3.43Å
568	E	27.4	Very low	48.3	Very low	175 Å²	175	119.5 Å²	119.5	82%	0.818	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-80.1	-15.2	178.6	-77.9	-172.3	155.4	0	0	114.2	S570	E568-S570 PolarHBondContact O-N 3.12Å
569	S	29.8	Very low	45.7	Very low	101 Å²	101	124.9 Å²	124.9	71%	0.706	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-84.9	-2.9	-178.3	71.6	0	0	0	0	115.5	M566	M566-S569 PolarHBondContact O-OG 2.75Å
570	S	32.4	Very low	42.8	Very low	87 Å²	87	123.1 Å²	123.1	61%	0.608	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-114.9	7.4	-176.2	45.5	0	0	0	0	115	E568	E568-S570 PolarHBondContact O-N 3.12Å
571	R	30.6	Very low	39.7	Very low	231 Å²	231	130.1 Å²	130.1	87%	0.872	71%	0.713	S	S	*	*			trans	-100.2	58.6	170.6	-78.9	-172	176.3	-179.7	1	112.8
572	T	30.5	Very low	36.4	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	74%	0.739	S	S	*	*			trans	-147	64.7	155.5	29.4	0	0	0	0	109.8
573	L	34	Very low	34.1	Very low	177 Å²	177	135.8 Å²	135.8	93%	0.927	74%	0.741	S	S	*	*			trans	-128	85	151.4	-77.1	165.5	0	0	0	106.5
574	A	24.7	Very low	32.7	Very low	87 Å²	87	143.4 Å²	143.4	72%	0.719	78%	0.777	S	S	*	*			trans	-79.1	161.2	159.4	0	0	0	0	0	108.3
575	P	35.7	Very low	31.9	Very low	202 Å²	202	150.3 Å²	150.3	100%	1.312	80%	0.804	S	S	*	*			trans	-62.1	0	-137.5	25.2	-34.6	0	0	0	116.9

Retrieved 575 of 575 residues in 215.1 ms (Link to these results)

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