A0A096N2J9_PAPAN Loading...

Serine/threonine-protein phosphatase 2A 55 kDa regulatory subunit B AlphaSync

AlphaFold DB (Q00005-6), UniProt , Accession A0A096N2J9, Species PAPAN (Papio anubis, Olive baboon), Gene PPP2R2B, Length 432 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.6	Very low	42.2	Very low	216 Å²	216	147.3 Å²	147.3	100%	1.064	75%	0.754	S	S	*	*				0	96.5	0	-82.1	173.7	173.8	0	0	106.5	Y3	M1-Y3 PolarHBondContact O-N 3.14Å
2	N	32.4	Very low	46.2	Very low	169 Å²	169	148.9 Å²	148.9	90%	0.904	75%	0.752	S	S	*	*			trans	-81.3	105	173.8	-75.2	-6.4	0	0	0	106.5
3	Y	29.1	Very low	50	Low	201 Å²	201	139.4 Å²	139.4	79%	0.788	71%	0.71	S	S	*	*			trans	-62	130.8	161	-75.4	-88.4	0	0	0	107	M1	M1-Y3 PolarHBondContact O-N 3.14Å
4	P	35.4	Very low	53.3	Low	109 Å²	109	133.5 Å²	133.5	71%	0.708	68%	0.681	S	S	*	*			trans	-65.3	138.7	176.7	29.2	-33.2	0	0	0	108.9	E6	P4-E6 PolarHBondContact O-N 3.01Å; P4-E6 VanDerWaalsContact O-N 3.12Å
5	D	30.1	Very low	56.2	Low	135 Å²	135	127.6 Å²	127.6	72%	0.722	65%	0.651	S	S	*	*			trans	-48.5	115	178.7	-79.1	-47.6	0	0	0	111.7	N7	D5-N7 PolarHBondContact O-N 3.2Å
6	E	34	Very low	58.8	Low	178 Å²	178	120.7 Å²	120.7	83%	0.832	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-63.3	-7.2	175.4	-80.3	-173.8	148.3	0	0	113.5	P4 T8	P4-E6 PolarHBondContact O-N 3.01Å; P4-E6 VanDerWaalsContact O-N 3.12Å; E6-T8 VanDerWaalsContact C-N 3.25Å; E6-T8 PolarHBondContact O-N 2.92Å; E6-T8 VanDerWaalsContact O-N 3.17Å
7	N	36.8	Very low	61.1	Low	162 Å²	162	113.9 Å²	113.9	87%	0.866	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-78.8	5.8	-173.7	-88	-20	0	0	0	115.9	D5	D5-N7 PolarHBondContact O-N 3.2Å
8	T	41.5	Very low	63.2	Low	122 Å²	122	107.6 Å²	107.6	75%	0.748	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-116.7	-3.5	-180	-15.9	0	0	0	0	114.5	E6	E6-T8 VanDerWaalsContact C-N 3.25Å; E6-T8 PolarHBondContact O-N 2.92Å; E6-T8 VanDerWaalsContact O-N 3.17Å
9	Y	45.8	Very low	65.1	Low	187 Å²	187	102 Å²	102	73%	0.733	52%	0.521	S	S	*	.			trans	-103.1	102.5	176.2	-74.5	-85.4	0	0	0	108.7
10	G	57.9	Low	66.7	Low	36 Å²	36	99.1 Å²	99.1	37%	0.371	51%	0.505	S	S	.	.			trans	-48.8	151	163.5	0	0	0	0	0	110.1	K12	G10-K12 PolarHBondContact O-N 2.79Å
11	N	84.4	Confident	68.2	Low	105 Å²	105	95.1 Å²	95.1	56%	0.561	49%	0.485	S	S	*	.			trans	-50	129.5	-176.9	-174.6	-4.1	0	0	0	109.5	A13 D14	N11-A13 PolarHBondContact O-N 2.81Å; N11-A13 PolarHBondContact OD1-N 3.48Å; N11-D14 WeakPolarHBondContact CB-OD2 3.28Å; N11-D14 WeakPolarHBondContact O-CB 3.25Å; N11-D14 PolarHBondContact O-N 2.84Å
12	K	90.7	Very high	71.1	Confident	167 Å²	167	85.2 Å²	85.2	73%	0.726	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-54.6	-29.1	-176.4	-76	-178.1	178.9	177.1	0	112.2	G10 D14 I15 K33	G10-K12 PolarHBondContact O-N 2.79Å; K12-D14 VanDerWaalsContact C-N 3.28Å; K12-D14 PolarHBondContact O-N 2.88Å; K12-I15 WeakPolarHBondContact O-CB 3.4Å; K12-I15 WeakPolarHBondContact O-CG1 3.19Å; K12-I15 PolarHBondContact O-N 2.93Å; K12-K33 WeakPolarHBondContact O-CB 3.32Å
13	A	95.2	Very high	74.2	Confident	25 Å²	25	82.3 Å²	82.3	21%	0.207	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-61.9	-30	174.4	0	0	0	0	0	113.6	N11 I15 D32 G34 R36	N11-A13 PolarHBondContact O-N 2.81Å; N11-A13 PolarHBondContact OD1-N 3.48Å; A13-I15 VanDerWaalsContact C-N 3.27Å; A13-I15 PolarHBondContact O-N 2.79Å; A13-D32 WeakPolarHBondContact O-CB 3.35Å; A13-D32 VanDerWaalsContact O-CG 3.24Å; A13-G34 PolarHBondContact O-N 3.08Å; A13-R36 PolarHBondContact O-NH2 2.83Å
14	D	96	Very high	77.3	Confident	57 Å²	57	75.6 Å²	75.6	31%	0.305	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-81.9	-0.8	-179.3	-56.2	-34.6	0	0	0	113.5	N11 K12 I16 R36 N422	N11-D14 WeakPolarHBondContact CB-OD2 3.28Å; N11-D14 WeakPolarHBondContact O-CB 3.25Å; N11-D14 PolarHBondContact O-N 2.84Å; K12-D14 VanDerWaalsContact C-N 3.28Å; K12-D14 PolarHBondContact O-N 2.88Å; D14-I16 PolarHBondContact O-N 3.06Å; D14-R36 IonicContact OD1-CZ 2.82Å; D14-R36 VanDerWaalsContact OD1-CZ 3.25Å; D14-R36 IonicContact OD1-NH1 3.66Å; D14-R36 PolarHBondContact OD1-NH1 2.86Å; D14-R36 IonicContact OD1-NH2 2.76Å; D14-R36 PolarHBondContact OD1-NH2 3.12Å; D14-N422 HydrophobicContact CB-CB 4.21Å; D14-N422 WeakPolarHBondContact O-CA 3.49Å; D14-N422 WeakPolarHBondContact O-CB 3.49Å
15	I	97.1	Very high	80.2	Confident	45 Å²	45	70.4 Å²	70.4	23%	0.231	36%	0.363	C	S	.	.			trans	-70.3	118.4	177.5	-63.4	172.5	0	0	0	108.8	K12 A13 S17 D32 K33	K12-I15 WeakPolarHBondContact O-CB 3.4Å; K12-I15 WeakPolarHBondContact O-CG1 3.19Å; K12-I15 PolarHBondContact O-N 2.93Å; A13-I15 VanDerWaalsContact C-N 3.27Å; A13-I15 PolarHBondContact O-N 2.79Å; I15-S17 PolarHBondContact O-N 2.51Å; I15-D32 CarbonylContact O-C 3.57Å; I15-D32 VanDerWaalsContact O-CA 3.29Å; I15-D32 WeakPolarHBondContact O-CA 3.44Å; I15-D32 WeakPolarHBondContact O-CB 3.3Å; I15-K33 HydrophobicContact CB-CD 4.06Å; I15-K33 HydrophobicContact CB-CG 4.01Å; I15-K33 HydrophobicContact CD1-CD 4.33Å; I15-K33 HydrophobicContact CG2-CD 4.3Å; I15-K33 HydrophobicContact CG2-CG 4.3Å; I15-K33 PolarHBondContact O-N 3.06Å
16	I	98	Very high	83.3	Confident	17 Å²	17	67.9 Å²	67.9	9%	0.087	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.4	176.9	-61.2	171.1	0	0	0	108.8	D14 V19 T30 G31 H406 A419 T421 L424	D14-I16 PolarHBondContact O-N 3.06Å; I16-V19 HydrophobicContact CG2-CG2 3.7Å; I16-T30 HydrophobicContact CG2-CG2 4.38Å; I16-G31 WeakPolarHBondContact CA-O 3.37Å; I16-H406 PolarHBondContact O-CD2 3.09Å; I16-A419 HydrophobicContact CB-CB 3.99Å; I16-A419 HydrophobicContact CD1-CB 4.35Å; I16-A419 HydrophobicContact CG2-CB 3.69Å; I16-T421 PolarHBondContact N-O 3.43Å; I16-L424 HydrophobicContact CD1-CB 3.86Å; I16-L424 HydrophobicContact CD1-CD1 4.48Å
17	S	98.1	Very high	86.4	Confident	5 Å²	5	59.4 Å²	59.4	4%	0.035	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	-5.5	-175.7	54.2	0	0	0	0	113.9	I15 G31 D32 I81 H406	I15-S17 PolarHBondContact O-N 2.51Å; S17-G31 PolarHBondContact N-O 2.85Å; S17-G31 PolarHBondContact OG-O 3.13Å; S17-D32 VanDerWaalsContact OG-C 3.27Å; S17-D32 WeakPolarHBondContact OG-CA 3.47Å; S17-D32 PolarHBondContact OG-O 3.18Å; S17-I81 VanDerWaalsContact CB-O 3.29Å; S17-I81 WeakPolarHBondContact CB-O 3.37Å; S17-I81 PolarHBondContact OG-O 3.07Å; S17-H406 PolarHBondContact O-CE1 3.27Å; S17-H406 PolarHBondContact O-ND1 2.82Å; S17-H406 PolarHBondContact O-NE2 3.45Å
18	T	98.5	Very high	89.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	149.9	170.7	-171.9	0	0	0	0	110.3	T30 G31 I81 I84	T18-T30 VanDerWaalsContact O-CA 3.3Å; T18-T30 WeakPolarHBondContact O-CA 3.13Å; T18-G31 PolarHBondContact N-O 3.27Å; T18-G31 PolarHBondContact O-N 2.76Å; T18-I81 HydrophobicContact CG2-CB 4.48Å; T18-I81 HydrophobicContact CG2-CG2 3.85Å; T18-I84 HydrophobicContact CG2-CB 4.26Å; T18-I84 HydrophobicContact CG2-CD1 3.8Å; T18-I84 HydrophobicContact CG2-CG1 3.73Å
19	V	98.6	Very high	92	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	130.6	179.9	-174.8	0	0	0	0	108.3	I16 L28 A29 T30 H406 A408 A417 A419 L424	I16-V19 HydrophobicContact CG2-CG2 3.7Å; V19-L28 HydrophobicContact CG1-CD1 3.65Å; V19-A29 CarbonylContact C-O 3.59Å; V19-A29 WeakPolarHBondContact CA-O 3.27Å; V19-T30 HydrophobicContact CG1-CG2 4.28Å; V19-T30 HydrophobicContact CG2-CG2 4.15Å; V19-H406 HydrophobicContact CG2-CB 4.12Å; V19-A408 HydrophobicContact CB-CB 4.31Å; V19-A408 HydrophobicContact CG1-CB 3.82Å; V19-A417 HydrophobicContact CG1-CB 3.83Å; V19-A419 HydrophobicContact CG2-CB 3.8Å; V19-L424 HydrophobicContact CG1-CD1 4.09Å; V19-L424 HydrophobicContact CG2-CD1 4.12Å
20	E	98.5	Very high	94.6	Very high	44 Å²	44	37.4 Å²	37.4	21%	0.206	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	125	-175.8	-172.5	80.1	156.3	0	0	112	A29 I84 R85 W86	E20-A29 PolarHBondContact N-O 2.99Å; E20-A29 PolarHBondContact O-N 3.19Å; E20-I84 HydrophobicContact CB-CB 4.39Å; E20-I84 HydrophobicContact CB-CG2 4.32Å; E20-R85 WeakPolarHBondContact OE1-CD 3.21Å; E20-R85 IonicContact OE1-CZ 2.79Å; E20-R85 IonicContact OE1-NE 3.05Å; E20-R85 IonicContact OE1-NH1 3.07Å; E20-R85 PolarHBondContact OE1-NH1 3.18Å; E20-R85 IonicContact OE2-NH1 2.92Å; E20-R85 PolarHBondContact OE2-NH1 3.2Å; E20-W86 PolarHBondContact O-NE1 2.9Å; E20-W86 VanDerWaalsContact O-NE1 3.15Å
21	F	98.4	Very high	96.5	Very high	16 Å²	16	35.7 Å²	35.7	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	146.6	167.6	-77.4	-78.9	0	0	0	111.1	L27 L28 Y56 W86 A408 W409 H410 I415 A417	F21-L27 WeakPolarHBondContact CA-O 3.35Å; F21-L28 HydrophobicContact CD1-CB 4Å; F21-L28 HydrophobicContact CD1-CD1 3.9Å; F21-L28 HydrophobicContact CD1-CG 4.47Å; F21-L28 HydrophobicContact CD2-CD1 3.94Å; F21-L28 HydrophobicContact CE1-CB 3.87Å; F21-L28 HydrophobicContact CE1-CD1 3.87Å; F21-L28 HydrophobicContact CE1-CD2 4.15Å; F21-L28 HydrophobicContact CE1-CG 4.19Å; F21-L28 HydrophobicContact CE2-CD1 3.91Å; F21-L28 HydrophobicContact CG-CD1 3.94Å; F21-L28 HydrophobicContact CZ-CD1 3.87Å; F21-L28 HydrophobicContact CZ-CD2 4.06Å; F21-L28 HydrophobicContact CZ-CG 4.4Å; F21-Y56 AromaticContact CE1-CE1 3.91Å; F21-Y56 HydrophobicContact CE1-CE1 3.91Å; F21-Y56 HydrophobicContact CE1-CE2 4.49Å; F21-Y56 AromaticContact CE1-CZ 3.74Å; F21-W86 VanDerWaalsContact C-CD1 3.46Å; F21-A408 HydrophobicContact CD2-CB 3.75Å; F21-A408 HydrophobicContact CE2-CB 4.02Å; F21-W409 VanDerWaalsContact CD2-C 3.44Å; F21-W409 WeakPolarHBondContact CD2-O 3.5Å; F21-H410 HydrophobicContact CE2-CB 4.34Å; F21-H410 HydrophobicContact CZ-CB 4.32Å; F21-I415 HydrophobicContact CZ-CG2 4.26Å; F21-A417 HydrophobicContact CE2-CB 3.91Å; F21-A417 HydrophobicContact CZ-CB 4.1Å
22	N	97.7	Very high	97.1	Very high	7 Å²	7	31.2 Å²	31.2	4%	0.037	16%	0.156	C	C	.	.			trans	-71.5	169.6	165.2	78.8	-23.8	0	0	0	110.8	T24 G25 E26 L27 W86	N22-T24 PolarHBondContact ND2-OG1 2.88Å; N22-T24 PolarHBondContact O-N 2.99Å; N22-T24 VanDerWaalsContact O-N 3.17Å; N22-T24 PolarHBondContact OD1-OG1 2.93Å; N22-G25 PolarHBondContact O-N 3.44Å; N22-G25 VanDerWaalsContact OD1-CA 3.31Å; N22-G25 WeakPolarHBondContact OD1-CA 3.33Å; N22-G25 PolarHBondContact OD1-N 3.07Å; N22-E26 PolarHBondContact OD1-N 2.64Å; N22-E26 VanDerWaalsContact OD1-N 3.12Å; N22-L27 HydrophobicContact CB-CB 4.07Å; N22-L27 PolarHBondContact N-O 3.02Å; N22-L27 PolarHBondContact OD1-N 3.39Å; N22-L27 PolarHBondContact OD1-O 3.05Å; N22-W86 VanDerWaalsContact CA-CD1 3.45Å; N22-W86 HydrophobicContact CB-CB 4.31Å; N22-W86 HydrophobicContact CB-CD2 3.6Å; N22-W86 HydrophobicContact CB-CE3 4.06Å; N22-W86 HydrophobicContact CB-CG 3.71Å; N22-W86 HydrophobicContact CB-CZ2 4.28Å
23	H	96.2	Very high	97.5	Very high	109 Å²	109	27.6 Å²	27.6	51%	0.505	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.3	-176.7	-61.6	89.8	0	0	0	114.4	W86 L87 P411	H23-W86 PolarHBondContact CE1-O 2.83Å; H23-W86 VanDerWaalsContact CE1-O 3.31Å; H23-L87 VanDerWaalsContact CE1-C 3.49Å; H23-P411 WeakPolarHBondContact O-CG 3.45Å
24	T	95.2	Very high	97.6	Very high	59 Å²	59	26.6 Å²	26.6	36%	0.362	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.4	177	64	0	0	0	0	112.5	N22 E26	N22-T24 PolarHBondContact ND2-OG1 2.88Å; N22-T24 PolarHBondContact O-N 2.99Å; N22-T24 VanDerWaalsContact O-N 3.17Å; N22-T24 PolarHBondContact OD1-OG1 2.93Å; T24-E26 PolarHBondContact O-N 2.86Å; T24-E26 WeakPolarHBondContact OG1-CB 3.15Å; T24-E26 WeakPolarHBondContact OG1-CG 3.33Å; T24-E26 PolarHBondContact OG1-N 2.72Å; T24-E26 PolarHBondContact OG1-OE2 3.22Å
25	G	96.2	Very high	97.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	77.6	-2.7	-171.2	0	0	0	0	0	114.2	N22 L27 Y56 H410	N22-G25 PolarHBondContact O-N 3.44Å; N22-G25 VanDerWaalsContact OD1-CA 3.31Å; N22-G25 WeakPolarHBondContact OD1-CA 3.33Å; N22-G25 PolarHBondContact OD1-N 3.07Å; G25-L27 VanDerWaalsContact C-N 3.27Å; G25-L27 PolarHBondContact O-N 2.94Å; G25-Y56 PolarHBondContact O-OH 3.18Å; G25-H410 VanDerWaalsContact CA-NE2 3.35Å; G25-H410 WeakPolarHBondContact CA-NE2 3.42Å; G25-H410 PolarHBondContact O-CD2 2.87Å; G25-H410 PolarHBondContact O-NE2 2.91Å
26	E	95.5	Very high	97.8	Very high	83 Å²	83	25.1 Å²	25.1	39%	0.388	12%	0.12	S	C	.	.	S	Bend	trans	-68.7	-28	177.4	-65.7	171	143.1	0	0	112.5	N22 T24 Q41 R42	N22-E26 PolarHBondContact OD1-N 2.64Å; N22-E26 VanDerWaalsContact OD1-N 3.12Å; T24-E26 PolarHBondContact O-N 2.86Å; T24-E26 WeakPolarHBondContact OG1-CB 3.15Å; T24-E26 WeakPolarHBondContact OG1-CG 3.33Å; T24-E26 PolarHBondContact OG1-N 2.72Å; T24-E26 PolarHBondContact OG1-OE2 3.22Å; E26-Q41 WeakPolarHBondContact O-CA 3.38Å; E26-R42 PolarHBondContact O-N 3.35Å
27	L	97.7	Very high	97.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.3	177.5	-56.1	179.9	0	0	0	110.9	F21 N22 G25 I39 F40 Q41 Y59 W86 Y94	F21-L27 WeakPolarHBondContact CA-O 3.35Å; N22-L27 HydrophobicContact CB-CB 4.07Å; N22-L27 PolarHBondContact N-O 3.02Å; N22-L27 PolarHBondContact OD1-N 3.39Å; N22-L27 PolarHBondContact OD1-O 3.05Å; G25-L27 VanDerWaalsContact C-N 3.27Å; G25-L27 PolarHBondContact O-N 2.94Å; L27-I39 HydrophobicContact CB-CG2 4.17Å; L27-I39 HydrophobicContact CD1-CG2 4.38Å; L27-I39 HydrophobicContact CD2-CG2 4.2Å; L27-I39 HydrophobicContact CG-CG2 4.5Å; L27-F40 CarbonylContact C-O 3.59Å; L27-F40 VanDerWaalsContact CA-O 3.27Å; L27-F40 WeakPolarHBondContact CA-O 3.32Å; L27-Q41 HydrophobicContact CD2-CB 3.63Å; L27-Q41 HydrophobicContact CD2-CG 3.77Å; L27-Y59 HydrophobicContact CD2-CD1 4.1Å; L27-Y59 HydrophobicContact CD2-CE1 4.33Å; L27-Y59 HydrophobicContact CD2-CG 4.43Å; L27-W86 HydrophobicContact CB-CH2 3.98Å; L27-W86 HydrophobicContact CB-CZ2 3.93Å; L27-W86 HydrophobicContact CD1-CH2 3.69Å; L27-W86 HydrophobicContact CD1-CZ2 4.47Å; L27-W86 HydrophobicContact CD1-CZ3 4Å; L27-Y94 HydrophobicContact CD1-CD1 3.76Å; L27-Y94 HydrophobicContact CD1-CD2 3.71Å; L27-Y94 HydrophobicContact CD1-CE1 3.92Å; L27-Y94 HydrophobicContact CD1-CE2 3.89Å; L27-Y94 HydrophobicContact CD1-CG 3.65Å
28	L	98.5	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.9	173	176.4	59.9	0	0	0	108.1	V19 F21 I39 F40 Y56 A417 L424 I426	V19-L28 HydrophobicContact CG1-CD1 3.65Å; F21-L28 HydrophobicContact CD1-CB 4Å; F21-L28 HydrophobicContact CD1-CD1 3.9Å; F21-L28 HydrophobicContact CD1-CG 4.47Å; F21-L28 HydrophobicContact CD2-CD1 3.94Å; F21-L28 HydrophobicContact CE1-CB 3.87Å; F21-L28 HydrophobicContact CE1-CD1 3.87Å; F21-L28 HydrophobicContact CE1-CD2 4.15Å; F21-L28 HydrophobicContact CE1-CG 4.19Å; F21-L28 HydrophobicContact CE2-CD1 3.91Å; F21-L28 HydrophobicContact CG-CD1 3.94Å; F21-L28 HydrophobicContact CZ-CD1 3.87Å; F21-L28 HydrophobicContact CZ-CD2 4.06Å; F21-L28 HydrophobicContact CZ-CG 4.4Å; L28-I39 CarbonylContact O-C 3.59Å; L28-I39 WeakPolarHBondContact O-CA 3.42Å; L28-F40 HydrophobicContact CB-CB 4.4Å; L28-F40 PolarHBondContact N-O 2.78Å; L28-F40 WeakPolarHBondContact O-CD2 3.37Å; L28-F40 PolarHBondContact O-N 2.92Å; L28-Y56 HydrophobicContact CB-CD1 3.94Å; L28-Y56 HydrophobicContact CB-CE1 4.07Å; L28-A417 HydrophobicContact CD1-CB 4.05Å; L28-A417 HydrophobicContact CD2-CB 3.76Å; L28-L424 HydrophobicContact CD2-CD2 3.86Å; L28-I426 HydrophobicContact CD2-CD1 3.99Å; L28-I426 HydrophobicContact CD2-CG1 4.4Å
29	A	98.7	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.5	174.8	0	0	0	0	0	111	V19 E20 V38 I39 I84 W86	V19-A29 CarbonylContact C-O 3.59Å; V19-A29 WeakPolarHBondContact CA-O 3.27Å; E20-A29 PolarHBondContact N-O 2.99Å; E20-A29 PolarHBondContact O-N 3.19Å; A29-V38 CarbonylContact C-O 3.53Å; A29-V38 WeakPolarHBondContact CA-O 3.41Å; A29-I39 HydrophobicContact CB-CG1 4.38Å; A29-I84 HydrophobicContact CB-CD1 4.12Å; A29-I84 HydrophobicContact CB-CG2 4.1Å; A29-W86 HydrophobicContact CB-CZ2 3.64Å
30	T	98.8	Very high	97.8	Very high	9 Å²	9	27 Å²	27	6%	0.055	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.1	166	59.9	0	0	0	0	110	I16 T18 V19 V37 V38 F40 L424	I16-T30 HydrophobicContact CG2-CG2 4.38Å; T18-T30 VanDerWaalsContact O-CA 3.3Å; T18-T30 WeakPolarHBondContact O-CA 3.13Å; V19-T30 HydrophobicContact CG1-CG2 4.28Å; V19-T30 HydrophobicContact CG2-CG2 4.15Å; T30-V37 WeakPolarHBondContact O-CA 3.12Å; T30-V38 PolarHBondContact N-O 3.19Å; T30-V38 PolarHBondContact O-N 3.31Å; T30-F40 HydrophobicContact CG2-CE2 4.11Å; T30-L424 HydrophobicContact CG2-CD1 4.04Å; T30-L424 HydrophobicContact CG2-CD2 3.71Å; T30-L424 HydrophobicContact CG2-CG 4.43Å
31	G	98.6	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	151.6	166.2	0	0	0	0	0	110.1	I16 S17 T18 R36	I16-G31 WeakPolarHBondContact CA-O 3.37Å; S17-G31 PolarHBondContact N-O 2.85Å; S17-G31 PolarHBondContact OG-O 3.13Å; T18-G31 PolarHBondContact N-O 3.27Å; T18-G31 PolarHBondContact O-N 2.76Å; G31-R36 WeakPolarHBondContact CA-O 3.31Å
32	D	98.1	Very high	97.6	Very high	10 Å²	10	28.6 Å²	28.6	5%	0.053	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	174.1	179.2	67.5	27.2	0	0	0	113.9	A13 I15 S17 G34 G35 R36 I81	A13-D32 WeakPolarHBondContact O-CB 3.35Å; A13-D32 VanDerWaalsContact O-CG 3.24Å; I15-D32 CarbonylContact O-C 3.57Å; I15-D32 VanDerWaalsContact O-CA 3.29Å; I15-D32 WeakPolarHBondContact O-CA 3.44Å; I15-D32 WeakPolarHBondContact O-CB 3.3Å; S17-D32 VanDerWaalsContact OG-C 3.27Å; S17-D32 WeakPolarHBondContact OG-CA 3.47Å; S17-D32 PolarHBondContact OG-O 3.18Å; D32-G34 PolarHBondContact O-N 2.9Å; D32-G34 WeakPolarHBondContact OD1-CA 3.36Å; D32-G34 PolarHBondContact OD1-N 3.02Å; D32-G35 PolarHBondContact O-N 2.99Å; D32-G35 PolarHBondContact OD1-N 3.3Å; D32-R36 PolarHBondContact N-O 2.98Å; D32-R36 VanDerWaalsContact N-O 3.16Å; D32-R36 PolarHBondContact OD1-N 2.65Å; D32-R36 IonicContact OD1-NE 2.68Å; D32-R36 WeakPolarHBondContact OD2-CB 3.13Å; D32-R36 IonicContact OD2-CZ 3.25Å; D32-R36 IonicContact OD2-NE 3.59Å; D32-R36 PolarHBondContact OD2-NE 2.78Å; D32-R36 IonicContact OD2-NH2 2.76Å; D32-R36 PolarHBondContact OD2-NH2 2.75Å; D32-I81 PolarHBondContact O-N 2.95Å
33	K	97.8	Very high	97.2	Very high	91 Å²	91	33.8 Å²	33.8	40%	0.396	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.6	176.7	-74.7	-158	175.1	-166.4	0	113.7	K12 I15 G35 K80	K12-K33 WeakPolarHBondContact O-CB 3.32Å; I15-K33 HydrophobicContact CB-CD 4.06Å; I15-K33 HydrophobicContact CB-CG 4.01Å; I15-K33 HydrophobicContact CD1-CD 4.33Å; I15-K33 HydrophobicContact CG2-CD 4.3Å; I15-K33 HydrophobicContact CG2-CG 4.3Å; I15-K33 PolarHBondContact O-N 3.06Å; K33-G35 VanDerWaalsContact C-N 3.26Å; K33-G35 PolarHBondContact O-N 2.96Å; K33-K80 HydrophobicContact CG-CD 4.11Å; K33-K80 HydrophobicContact CG-CG 4.28Å; K33-K80 WeakPolarHBondContact O-CA 3.29Å; K33-K80 PolarHBondContact O-N 3.31Å
34	G	97.7	Very high	96.4	Very high	5 Å²	5	36.4 Å²	36.4	5%	0.052	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	14	176.9	0	0	0	0	0	114	A13 D32 R36 Q63 E79	A13-G34 PolarHBondContact O-N 3.08Å; D32-G34 PolarHBondContact O-N 2.9Å; D32-G34 WeakPolarHBondContact OD1-CA 3.36Å; D32-G34 PolarHBondContact OD1-N 3.02Å; G34-R36 VanDerWaalsContact C-N 3.28Å; G34-R36 PolarHBondContact O-N 2.73Å; G34-Q63 PolarHBondContact O-NE2 2.71Å; G34-E79 VanDerWaalsContact C-CD 3.49Å; G34-E79 WeakPolarHBondContact CA-OE1 3.34Å
35	G	98.2	Very high	95.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	73.9	11.4	175	0	0	0	0	0	115.6	D32 K33 Q63 S64 H65 E79	D32-G35 PolarHBondContact O-N 2.99Å; D32-G35 PolarHBondContact OD1-N 3.3Å; K33-G35 VanDerWaalsContact C-N 3.26Å; K33-G35 PolarHBondContact O-N 2.96Å; G35-Q63 VanDerWaalsContact C-NE2 3.29Å; G35-Q63 PolarHBondContact O-NE2 2.89Å; G35-S64 WeakPolarHBondContact O-CA 3.08Å; G35-S64 WeakPolarHBondContact O-CB 3.42Å; G35-S64 PolarHBondContact O-N 2.84Å; G35-H65 PolarHBondContact O-N 2.9Å; G35-H65 VanDerWaalsContact O-N 3.09Å; G35-E79 WeakPolarHBondContact CA-O 3.22Å
36	R	98.6	Very high	93.5	Very high	71 Å²	71	41.8 Å²	41.8	27%	0.268	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	149.9	178.2	-56.6	167	-59.5	-170.2	-0.3	110.7	A13 D14 G31 D32 G34 F62	A13-R36 PolarHBondContact O-NH2 2.83Å; D14-R36 IonicContact OD1-CZ 2.82Å; D14-R36 VanDerWaalsContact OD1-CZ 3.25Å; D14-R36 IonicContact OD1-NH1 3.66Å; D14-R36 PolarHBondContact OD1-NH1 2.86Å; D14-R36 IonicContact OD1-NH2 2.76Å; D14-R36 PolarHBondContact OD1-NH2 3.12Å; G31-R36 WeakPolarHBondContact CA-O 3.31Å; D32-R36 PolarHBondContact N-O 2.98Å; D32-R36 VanDerWaalsContact N-O 3.16Å; D32-R36 PolarHBondContact OD1-N 2.65Å; D32-R36 IonicContact OD1-NE 2.68Å; D32-R36 WeakPolarHBondContact OD2-CB 3.13Å; D32-R36 IonicContact OD2-CZ 3.25Å; D32-R36 IonicContact OD2-NE 3.59Å; D32-R36 PolarHBondContact OD2-NE 2.78Å; D32-R36 IonicContact OD2-NH2 2.76Å; D32-R36 PolarHBondContact OD2-NH2 2.75Å; G34-R36 VanDerWaalsContact C-N 3.28Å; G34-R36 PolarHBondContact O-N 2.73Å; R36-F62 WeakPolarHBondContact CA-O 3.47Å
37	V	98.8	Very high	91.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.4	167.9	174.7	0	0	0	0	108.3	T30 I39 T61 F62 I81 I84	T30-V37 WeakPolarHBondContact O-CA 3.12Å; V37-I39 HydrophobicContact CG1-CG1 4.19Å; V37-T61 WeakPolarHBondContact O-CA 3.25Å; V37-F62 HydrophobicContact CB-CD1 4.49Å; V37-F62 HydrophobicContact CB-CD2 4.29Å; V37-F62 HydrophobicContact CB-CE1 3.95Å; V37-F62 HydrophobicContact CB-CE2 3.7Å; V37-F62 HydrophobicContact CB-CZ 3.53Å; V37-F62 HydrophobicContact CG1-CE1 3.8Å; V37-F62 HydrophobicContact CG1-CE2 4.22Å; V37-F62 HydrophobicContact CG1-CZ 3.52Å; V37-F62 HydrophobicContact CG2-CE2 4.08Å; V37-F62 HydrophobicContact CG2-CZ 4.2Å; V37-F62 PolarHBondContact N-O 3.37Å; V37-F62 PolarHBondContact O-N 3.15Å; V37-I81 HydrophobicContact CG2-CG1 4.4Å; V37-I84 HydrophobicContact CG1-CD1 4.04Å; V37-I84 HydrophobicContact CG2-CD1 4.01Å
38	V	98.6	Very high	90.1	Very high	26 Å²	26	54.4 Å²	54.4	16%	0.158	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.6	173.9	-173	0	0	0	0	107.8	A29 T30 F40 V58 T61	A29-V38 CarbonylContact C-O 3.53Å; A29-V38 WeakPolarHBondContact CA-O 3.41Å; T30-V38 PolarHBondContact N-O 3.19Å; T30-V38 PolarHBondContact O-N 3.31Å; V38-F40 HydrophobicContact CB-CE2 4.07Å; V38-F40 HydrophobicContact CB-CZ 4.29Å; V38-F40 HydrophobicContact CG1-CD2 4.3Å; V38-F40 HydrophobicContact CG1-CE1 4.1Å; V38-F40 HydrophobicContact CG1-CE2 3.64Å; V38-F40 HydrophobicContact CG1-CZ 3.53Å; V38-V58 HydrophobicContact CG1-CG1 4.36Å; V38-T61 HydrophobicContact CG2-CG2 4.16Å
39	I	98.6	Very high	88.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.3	175.9	-56.9	170.8	0	0	0	107.3	L27 L28 A29 V37 Y59 S60 F62 W86 L96 V109	L27-I39 HydrophobicContact CB-CG2 4.17Å; L27-I39 HydrophobicContact CD1-CG2 4.38Å; L27-I39 HydrophobicContact CD2-CG2 4.2Å; L27-I39 HydrophobicContact CG-CG2 4.5Å; L28-I39 CarbonylContact O-C 3.59Å; L28-I39 WeakPolarHBondContact O-CA 3.42Å; A29-I39 HydrophobicContact CB-CG1 4.38Å; V37-I39 HydrophobicContact CG1-CG1 4.19Å; I39-Y59 HydrophobicContact CB-CD1 4.38Å; I39-Y59 HydrophobicContact CG2-CD1 3.83Å; I39-Y59 WeakPolarHBondContact O-CA 3.22Å; I39-Y59 WeakPolarHBondContact O-CB 3.34Å; I39-Y59 PolarHBondContact O-N 2.92Å; I39-S60 PolarHBondContact N-O 3.14Å; I39-S60 PolarHBondContact O-N 3.43Å; I39-S60 VanDerWaalsContact O-N 3.12Å; I39-F62 HydrophobicContact CD1-CE1 3.87Å; I39-F62 HydrophobicContact CG1-CE1 4.4Å; I39-W86 HydrophobicContact CD1-CH2 3.93Å; I39-W86 HydrophobicContact CG1-CH2 4.27Å; I39-W86 HydrophobicContact CG2-CH2 3.96Å; I39-W86 HydrophobicContact CG2-CZ2 4.23Å; I39-L96 HydrophobicContact CD1-CD2 3.85Å; I39-L96 HydrophobicContact CG1-CD2 4.45Å; I39-V109 HydrophobicContact CD1-CB 4.43Å; I39-V109 HydrophobicContact CD1-CG1 4.23Å; I39-V109 HydrophobicContact CD1-CG2 3.6Å
40	F	98.2	Very high	85.9	Confident	36 Å²	36	63 Å²	63	16%	0.158	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.9	172.2	-53.1	-96.4	0	0	0	109.4	L27 L28 T30 V38 Y56 N57 V58 L424	L27-F40 CarbonylContact C-O 3.59Å; L27-F40 VanDerWaalsContact CA-O 3.27Å; L27-F40 WeakPolarHBondContact CA-O 3.32Å; L28-F40 HydrophobicContact CB-CB 4.4Å; L28-F40 PolarHBondContact N-O 2.78Å; L28-F40 WeakPolarHBondContact O-CD2 3.37Å; L28-F40 PolarHBondContact O-N 2.92Å; T30-F40 HydrophobicContact CG2-CE2 4.11Å; V38-F40 HydrophobicContact CB-CE2 4.07Å; V38-F40 HydrophobicContact CB-CZ 4.29Å; V38-F40 HydrophobicContact CG1-CD2 4.3Å; V38-F40 HydrophobicContact CG1-CE1 4.1Å; V38-F40 HydrophobicContact CG1-CE2 3.64Å; V38-F40 HydrophobicContact CG1-CZ 3.53Å; F40-Y56 HydrophobicContact CB-CD1 4.26Å; F40-N57 CarbonylContact C-O 3.59Å; F40-N57 WeakPolarHBondContact CA-O 3.3Å; F40-V58 HydrophobicContact CD1-CG2 4.02Å; F40-V58 HydrophobicContact CE1-CG2 3.72Å; F40-L424 HydrophobicContact CD2-CD2 4.16Å; F40-L424 HydrophobicContact CE2-CD2 3.79Å; F40-L424 HydrophobicContact CZ-CD2 4.21Å
41	Q	96.6	Very high	83.6	Confident	56 Å²	56	70.6 Å²	70.6	26%	0.262	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.2	173.3	-177.7	178.2	47.8	0	0	109.4	E26 L27 E43 Y56 N57 Y59	E26-Q41 WeakPolarHBondContact O-CA 3.38Å; L27-Q41 HydrophobicContact CD2-CB 3.63Å; L27-Q41 HydrophobicContact CD2-CG 3.77Å; Q41-E43 PolarHBondContact O-N 2.97Å; Q41-Y56 WeakPolarHBondContact O-CA 3.29Å; Q41-N57 PolarHBondContact N-O 2.92Å; Q41-N57 PolarHBondContact O-N 3.22Å; Q41-Y59 HydrophobicContact CB-CD2 3.81Å; Q41-Y59 HydrophobicContact CB-CG 3.78Å; Q41-Y59 HydrophobicContact CG-CD2 4.34Å
42	R	94.5	Very high	81.6	Confident	39 Å²	39	76.5 Å²	76.5	15%	0.147	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.9	172.7	-169.8	176.2	177.3	179.3	-3.2	110	E26 Q44 Y56 E413	E26-R42 PolarHBondContact O-N 3.35Å; R42-Q44 PolarHBondContact O-N 3.5Å; R42-Y56 HydrophobicContact CB-CD1 4.12Å; R42-Y56 HydrophobicContact CB-CE1 3.73Å; R42-Y56 HydrophobicContact CB-CE2 4.15Å; R42-Y56 HydrophobicContact CB-CG 4.48Å; R42-Y56 HydrophobicContact CG-CD2 4.49Å; R42-Y56 HydrophobicContact CG-CE2 4.04Å; R42-E413 IonicContact CZ-OE1 2.62Å; R42-E413 IonicContact CZ-OE2 3.96Å; R42-E413 IonicContact NH1-OE1 3.96Å; R42-E413 PolarHBondContact NH1-OE1 3.19Å; R42-E413 IonicContact NH1-OE2 3.52Å; R42-E413 PolarHBondContact NH1-OE2 2.99Å; R42-E413 IonicContact NH2-OE1 3.92Å; R42-E413 PolarHBondContact NH2-OE1 3.35Å; R42-E413 IonicContact NH2-OE2 3.14Å; R42-E413 PolarHBondContact NH2-OE2 2.76Å
43	E	90.3	Very high	80.4	Confident	115 Å²	115	78.9 Å²	78.9	54%	0.537	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-60.3	129.9	171.8	-167.8	175.5	-162.9	0	0	110.1	Q41 G54 E55	Q41-E43 PolarHBondContact O-N 2.97Å; E43-G54 WeakPolarHBondContact O-CA 3.48Å; E43-E55 WeakPolarHBondContact CB-O 3.49Å; E43-E55 PolarHBondContact N-O 2.82Å
44	Q	79.8	Confident	79.5	Confident	164 Å²	164	75 Å²	75	77%	0.766	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-69.2	141.1	177.9	-67.8	-172.2	-3.5	0	0	110.4	R42 S46	R42-Q44 PolarHBondContact O-N 3.5Å; Q44-S46 PolarHBondContact O-N 2.93Å
45	E	68.5	Low	79.1	Confident	106 Å²	106	80 Å²	80	50%	0.495	38%	0.38	S	S	.	.			trans	-60.6	112.2	176.7	-78.6	-170.1	170.2	0	0	110.5
46	S	61.3	Low	79	Confident	66 Å²	66	81 Å²	81	46%	0.462	38%	0.384	S	S	.	.			trans	-60.3	135.8	167.2	165.6	0	0	0	0	109.4	Q44 N48 Q49	Q44-S46 PolarHBondContact O-N 2.93Å; S46-N48 PolarHBondContact O-N 3.17Å; S46-N48 PolarHBondContact OG-N 2.88Å; S46-Q49 PolarHBondContact O-N 2.97Å
47	K	60.6	Low	78.8	Confident	199 Å²	199	81.6 Å²	81.6	87%	0.865	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-21.5	173.1	-70.5	-174.5	178	-179.9	0	113.4
48	N	60.8	Low	78.7	Confident	150 Å²	150	86.2 Å²	86.2	80%	0.802	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.9	179.4	-68.7	-12	0	0	0	114.4	S46	S46-N48 PolarHBondContact O-N 3.17Å; S46-N48 PolarHBondContact OG-N 2.88Å
49	Q	57.1	Low	78.6	Confident	85 Å²	85	86.1 Å²	86.1	40%	0.397	42%	0.417	S	S	.	.			trans	-138.6	61.9	-179.5	-68.5	-168.1	9.5	0	0	112.5	S46 H51 R52	S46-Q49 PolarHBondContact O-N 2.97Å; Q49-H51 PolarHBondContact O-N 3.12Å; Q49-R52 HydrophobicContact CB-CB 4.36Å; Q49-R52 HydrophobicContact CB-CG 4.38Å; Q49-R52 PolarHBondContact O-N 2.77Å; Q49-R52 VanDerWaalsContact O-N 3.11Å; Q49-R52 VanDerWaalsContact OE1-CZ 3.24Å
50	V	52.2	Low	78.6	Confident	95 Å²	95	86.7 Å²	86.7	58%	0.576	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-3.3	-178.6	-170.9	0	0	0	0	114.6
51	H	52	Low	78.6	Confident	168 Å²	168	88.9 Å²	88.9	78%	0.778	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	15.2	-178.9	-59.7	-34.5	0	0	0	113.7	Q49	Q49-H51 PolarHBondContact O-N 3.12Å
52	R	56.4	Low	78.6	Confident	125 Å²	125	87.1 Å²	87.1	47%	0.472	43%	0.429	S	S	.	.			trans	-111.4	103.5	171.4	-68.5	-151	-166.4	154.9	-5.7	109.7	Q49 G54	Q49-R52 HydrophobicContact CB-CB 4.36Å; Q49-R52 HydrophobicContact CB-CG 4.38Å; Q49-R52 PolarHBondContact O-N 2.77Å; Q49-R52 VanDerWaalsContact O-N 3.11Å; Q49-R52 VanDerWaalsContact OE1-CZ 3.24Å; R52-G54 PolarHBondContact O-N 2.87Å
53	R	71.1	Confident	78.8	Confident	59 Å²	59	88.9 Å²	88.9	22%	0.223	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-56	123.2	161.5	-73.2	-167.6	171.1	-165.4	-4.3	108.6	E413 V431	R53-E413 IonicContact CZ-OE2 3.43Å; R53-E413 IonicContact NE-OE2 2.76Å; R53-E413 PolarHBondContact NE-OE2 2.87Å; R53-E413 IonicContact NH1-OE2 2.97Å; R53-E413 PolarHBondContact NH1-OE2 3.48Å; R53-E413 IonicContact NH2-OE2 3.68Å; R53-E413 PolarHBondContact NH2-OE2 2.81Å; R53-V431 HydrophobicContact CG-CG2 3.94Å
54	G	79.6	Confident	79.2	Confident	9 Å²	9	83.5 Å²	83.5	9%	0.093	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-58.5	145.8	-173.9	0	0	0	0	0	113.7	E43 R52	E43-G54 WeakPolarHBondContact O-CA 3.48Å; R52-G54 PolarHBondContact O-N 2.87Å
55	E	89.7	Confident	80.1	Confident	111 Å²	111	75.7 Å²	75.7	52%	0.519	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-77.1	150.6	173.1	-64.4	-179.5	-175.6	0	0	109.5	E43 R374	E43-E55 WeakPolarHBondContact CB-O 3.49Å; E43-E55 PolarHBondContact N-O 2.82Å; E55-R374 IonicContact OE1-NH2 2.96Å
56	Y	95.3	Very high	81.5	Confident	22 Å²	22	76.9 Å²	76.9	9%	0.086	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.9	176.5	-78.6	-99.2	0	0	0	109.2	F21 G25 L28 F40 Q41 R42 H410 I415 I426	F21-Y56 AromaticContact CE1-CE1 3.91Å; F21-Y56 HydrophobicContact CE1-CE1 3.91Å; F21-Y56 HydrophobicContact CE1-CE2 4.49Å; F21-Y56 AromaticContact CE1-CZ 3.74Å; G25-Y56 PolarHBondContact O-OH 3.18Å; L28-Y56 HydrophobicContact CB-CD1 3.94Å; L28-Y56 HydrophobicContact CB-CE1 4.07Å; F40-Y56 HydrophobicContact CB-CD1 4.26Å; Q41-Y56 WeakPolarHBondContact O-CA 3.29Å; R42-Y56 HydrophobicContact CB-CD1 4.12Å; R42-Y56 HydrophobicContact CB-CE1 3.73Å; R42-Y56 HydrophobicContact CB-CE2 4.15Å; R42-Y56 HydrophobicContact CB-CG 4.48Å; R42-Y56 HydrophobicContact CG-CD2 4.49Å; R42-Y56 HydrophobicContact CG-CE2 4.04Å; Y56-H410 PolarHBondContact OH-CD2 2.69Å; Y56-H410 VanDerWaalsContact OH-CD2 3.28Å; Y56-I415 HydrophobicContact CE2-CD1 4.49Å; Y56-I415 HydrophobicContact CE2-CG2 4.28Å; Y56-I426 HydrophobicContact CD2-CD1 3.87Å; Y56-I426 HydrophobicContact CD2-CG2 4.4Å; Y56-I426 HydrophobicContact CG-CD1 3.9Å
57	N	95.5	Very high	83.1	Confident	82 Å²	82	77.4 Å²	77.4	44%	0.439	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	153	-178.8	-67	-53.4	0	0	0	110.7	F40 Q41 Y59	F40-N57 CarbonylContact C-O 3.59Å; F40-N57 WeakPolarHBondContact CA-O 3.3Å; Q41-N57 PolarHBondContact N-O 2.92Å; Q41-N57 PolarHBondContact O-N 3.22Å; N57-Y59 PolarHBondContact O-N 2.81Å
58	V	96.6	Very high	84.7	Confident	98 Å²	98	71.7 Å²	71.7	59%	0.594	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.3	122.7	177.9	179.4	0	0	0	0	109.5	V38 F40	V38-V58 HydrophobicContact CG1-CG1 4.36Å; F40-V58 HydrophobicContact CD1-CG2 4.02Å; F40-V58 HydrophobicContact CE1-CG2 3.72Å
59	Y	96.7	Very high	86.1	Confident	24 Å²	24	69 Å²	69	9%	0.094	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-40.1	-178.1	174.5	-108.1	0	0	0	111.7	L27 I39 Q41 N57 V109 E111 V149	L27-Y59 HydrophobicContact CD2-CD1 4.1Å; L27-Y59 HydrophobicContact CD2-CE1 4.33Å; L27-Y59 HydrophobicContact CD2-CG 4.43Å; I39-Y59 HydrophobicContact CB-CD1 4.38Å; I39-Y59 HydrophobicContact CG2-CD1 3.83Å; I39-Y59 WeakPolarHBondContact O-CA 3.22Å; I39-Y59 WeakPolarHBondContact O-CB 3.34Å; I39-Y59 PolarHBondContact O-N 2.92Å; Q41-Y59 HydrophobicContact CB-CD2 3.81Å; Q41-Y59 HydrophobicContact CB-CG 3.78Å; Q41-Y59 HydrophobicContact CG-CD2 4.34Å; N57-Y59 PolarHBondContact O-N 2.81Å; Y59-V109 HydrophobicContact CE1-CG1 3.82Å; Y59-E111 HydrophobicContact CE2-CG 4.43Å; Y59-E111 WeakPolarHBondContact OH-CG 3.35Å; Y59-E111 PolarHBondContact OH-OE1 3.4Å; Y59-V149 HydrophobicContact CD1-CG1 4.12Å; Y59-V149 HydrophobicContact CD2-CG2 3.91Å; Y59-V149 HydrophobicContact CE1-CG1 3.6Å; Y59-V149 HydrophobicContact CE1-CG2 4.34Å; Y59-V149 HydrophobicContact CE2-CB 4.49Å; Y59-V149 HydrophobicContact CE2-CG1 4.24Å; Y59-V149 HydrophobicContact CE2-CG2 3.44Å; Y59-V149 VanDerWaalsContact CE2-CG2 3.44Å
60	S	97.5	Very high	87.4	Confident	11 Å²	11	66.9 Å²	66.9	8%	0.077	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	144.8	176.1	-179.7	0	0	0	0	110.6	I39	I39-S60 PolarHBondContact N-O 3.14Å; I39-S60 PolarHBondContact O-N 3.43Å; I39-S60 VanDerWaalsContact O-N 3.12Å
61	T	97.9	Very high	89	Confident	82 Å²	82	71.5 Å²	71.5	50%	0.503	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133	172.1	-59.4	0	0	0	0	109	V37 V38	V37-T61 WeakPolarHBondContact O-CA 3.25Å; V38-T61 HydrophobicContact CG2-CG2 4.16Å
62	F	98.4	Very high	90.5	Very high	20 Å²	20	71.6 Å²	71.6	9%	0.088	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.3	177.1	57.5	-86.1	0	0	0	111.9	R36 V37 I39 S64 L96 W107 V109 A151	R36-F62 WeakPolarHBondContact CA-O 3.47Å; V37-F62 HydrophobicContact CB-CD1 4.49Å; V37-F62 HydrophobicContact CB-CD2 4.29Å; V37-F62 HydrophobicContact CB-CE1 3.95Å; V37-F62 HydrophobicContact CB-CE2 3.7Å; V37-F62 HydrophobicContact CB-CZ 3.53Å; V37-F62 HydrophobicContact CG1-CE1 3.8Å; V37-F62 HydrophobicContact CG1-CE2 4.22Å; V37-F62 HydrophobicContact CG1-CZ 3.52Å; V37-F62 HydrophobicContact CG2-CE2 4.08Å; V37-F62 HydrophobicContact CG2-CZ 4.2Å; V37-F62 PolarHBondContact N-O 3.37Å; V37-F62 PolarHBondContact O-N 3.15Å; I39-F62 HydrophobicContact CD1-CE1 3.87Å; I39-F62 HydrophobicContact CG1-CE1 4.4Å; F62-S64 PolarHBondContact O-N 3.07Å; F62-L96 HydrophobicContact CZ-CD1 4.45Å; F62-W107 AromaticContact CD2-CD2 3.85Å; F62-W107 HydrophobicContact CD2-CD2 3.85Å; F62-W107 AromaticContact CD2-CE3 3.56Å; F62-W107 HydrophobicContact CD2-CE3 3.56Å; F62-W107 AromaticContact CD2-CH2 3.87Å; F62-W107 HydrophobicContact CD2-CH2 3.87Å; F62-W107 HydrophobicContact CD2-CZ2 4.17Å; F62-W107 AromaticContact CD2-CZ3 3.54Å; F62-W107 HydrophobicContact CD2-CZ3 3.54Å; F62-W107 HydrophobicContact CE2-CB 4.37Å; F62-W107 AromaticContact CE2-CD2 3.32Å; F62-W107 HydrophobicContact CE2-CD2 3.32Å; F62-W107 AromaticContact CE2-CE2 3.68Å; F62-W107 AromaticContact CE2-CE3 3.48Å; F62-W107 HydrophobicContact CE2-CE3 3.48Å; F62-W107 VanDerWaalsContact CE2-CE3 3.48Å; F62-W107 AromaticContact CE2-CG 3.69Å; F62-W107 HydrophobicContact CE2-CG 3.69Å; F62-W107 HydrophobicContact CE2-CH2 4.3Å; F62-W107 HydrophobicContact CE2-CZ2 4.2Å; F62-W107 AromaticContact CE2-CZ3 3.94Å; F62-W107 HydrophobicContact CE2-CZ3 3.94Å; F62-W107 HydrophobicContact CG-CE3 4.37Å; F62-W107 HydrophobicContact CG-CZ3 4.3Å; F62-W107 HydrophobicContact CZ-CB 4.28Å; F62-W107 HydrophobicContact CZ-CD2 4.08Å; F62-W107 HydrophobicContact CZ-CE3 4.23Å; F62-W107 HydrophobicContact CZ-CG 4.06Å; F62-V109 HydrophobicContact CE1-CG2 4.45Å; F62-A151 HydrophobicContact CB-CB 4.02Å; F62-A151 HydrophobicContact CD1-CB 3.27Å; F62-A151 HydrophobicContact CD2-CB 4.39Å; F62-A151 HydrophobicContact CE1-CB 3.73Å; F62-A151 HydrophobicContact CG-CB 3.65Å; F62-A151 HydrophobicContact CZ-CB 4.44Å
63	Q	98.4	Very high	91.8	Very high	76 Å²	76	71.2 Å²	71.2	36%	0.355	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	113.8	169.9	-166.7	66.7	39	0	0	108.4	G34 G35 H65 E66 W107	G34-Q63 PolarHBondContact O-NE2 2.71Å; G35-Q63 VanDerWaalsContact C-NE2 3.29Å; G35-Q63 PolarHBondContact O-NE2 2.89Å; Q63-H65 PolarHBondContact NE2-O 2.87Å; Q63-E66 HydrophobicContact CG-CG 3.93Å; Q63-W107 VanDerWaalsContact O-CH2 3.29Å; Q63-W107 WeakPolarHBondContact O-CH2 3.31Å
64	S	98.7	Very high	92.6	Very high	2 Å²	2	73 Å²	73	1%	0.014	37%	0.371	C	S	.	.			trans	-86.6	-50.1	-179.4	173.1	0	0	0	0	111.5	G35 F62 S98 K105 W107	G35-S64 WeakPolarHBondContact O-CA 3.08Å; G35-S64 WeakPolarHBondContact O-CB 3.42Å; G35-S64 PolarHBondContact O-N 2.84Å; F62-S64 PolarHBondContact O-N 3.07Å; S64-S98 WeakPolarHBondContact OG-CB 3.23Å; S64-S98 PolarHBondContact OG-OG 3.16Å; S64-K105 VanDerWaalsContact O-CD 3.27Å; S64-K105 WeakPolarHBondContact O-CD 3.23Å; S64-K105 WeakPolarHBondContact O-CE 3.35Å; S64-K105 PolarHBondContact O-NZ 3.36Å; S64-W107 VanDerWaalsContact CA-CZ2 3.45Å; S64-W107 WeakPolarHBondContact O-CZ2 3.39Å; S64-W107 PolarHBondContact OG-NE1 3.38Å
65	H	98.3	Very high	93	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.383	C	S	.	.			trans	-127.6	148.8	-178.7	-70	72.3	0	0	0	109.2	G35 Q63 E79 I81 T103	G35-H65 PolarHBondContact O-N 2.9Å; G35-H65 VanDerWaalsContact O-N 3.09Å; Q63-H65 PolarHBondContact NE2-O 2.87Å; H65-E79 HydrophobicContact CB-CB 4.32Å; H65-E79 WeakPolarHBondContact CB-O 3.26Å; H65-I81 HydrophobicContact CB-CD1 4.12Å; H65-I81 WeakPolarHBondContact ND1-CD1 3.49Å; H65-T103 PolarHBondContact NE2-O 3.01Å
66	E	97.1	Very high	93.1	Very high	130 Å²	130	76.8 Å²	76.8	61%	0.607	39%	0.388	S	S	*	.			trans	-120.2	161.5	172.7	-66.9	-177.6	166.3	0	0	106.9	Q63 E68	Q63-E66 HydrophobicContact CG-CG 3.93Å; E66-E68 PolarHBondContact O-N 3.11Å
67	P	95.6	Very high	93	Very high	77 Å²	77	76.5 Å²	76.5	50%	0.5	39%	0.388	S	S	.	.			trans	-67.2	128.9	-177.9	-15.8	33.3	0	0	0	108.3	E79	P67-E79 WeakPolarHBondContact CD-OE2 3.34Å; P67-E79 HydrophobicContact CG-CB 4.29Å; P67-E79 HydrophobicContact CG-CG 4.2Å; P67-E79 VanDerWaalsContact CG-OE2 3.29Å; P67-E79 WeakPolarHBondContact CG-OE2 3.37Å
68	E	93.3	Very high	93	Very high	80 Å²	80	77.6 Å²	77.6	37%	0.374	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	157.9	176.9	-70.8	174.6	-165.8	0	0	109	E66 I77	E66-E68 PolarHBondContact O-N 3.11Å; E68-I77 HydrophobicContact CB-CB 4.05Å; E68-I77 HydrophobicContact CB-CD1 4.22Å; E68-I77 PolarHBondContact N-O 2.9Å; E68-I77 VanDerWaalsContact N-O 3.1Å; E68-I77 PolarHBondContact O-N 3.18Å
69	F	90.3	Very high	93.1	Very high	93 Å²	93	75.2 Å²	75.2	41%	0.408	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.8	176.3	-165.2	-93.2	0	0	0	110	Y71 E76	F69-Y71 AromaticContact CD1-CD1 3.56Å; F69-Y71 HydrophobicContact CD1-CD1 3.56Å; F69-Y71 HydrophobicContact CD1-CD2 4.32Å; F69-Y71 AromaticContact CD1-CE1 3.72Å; F69-Y71 HydrophobicContact CD1-CE1 3.72Å; F69-Y71 HydrophobicContact CD1-CE2 4.46Å; F69-Y71 AromaticContact CD1-CG 3.88Å; F69-Y71 HydrophobicContact CD1-CG 3.88Å; F69-Y71 AromaticContact CE1-CD1 3.89Å; F69-Y71 HydrophobicContact CE1-CD1 3.89Å; F69-Y71 HydrophobicContact CE1-CE1 4.3Å; F69-Y71 HydrophobicContact CE1-CG 4.4Å; F69-Y71 WeakPolarHBondContact O-CD2 3.43Å; F69-Y71 PolarHBondContact O-N 3.41Å; F69-E76 HydrophobicContact CD2-CB 4.08Å; F69-E76 HydrophobicContact CE2-CB 4.29Å
70	D	84.4	Confident	93.1	Very high	41 Å²	41	76.7 Å²	76.7	22%	0.219	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	95.2	170.8	-175.3	-20.3	0	0	0	108.6	L72 K73 S74 L75 I77	D70-L72 PolarHBondContact O-N 3.42Å; D70-L72 WeakPolarHBondContact OD1-CB 3.18Å; D70-L72 PolarHBondContact OD1-N 3.39Å; D70-K73 HydrophobicContact CB-CB 4.35Å; D70-K73 CarbonylContact O-C 3.56Å; D70-K73 PolarHBondContact O-N 3.26Å; D70-K73 PolarHBondContact OD1-N 3.15Å; D70-K73 VanDerWaalsContact OD2-CD 3.29Å; D70-K73 WeakPolarHBondContact OD2-CD 3.39Å; D70-K73 WeakPolarHBondContact OD2-CG 3.33Å; D70-K73 IonicContact OD2-NZ 2.77Å; D70-S74 WeakPolarHBondContact O-CA 3.3Å; D70-S74 PolarHBondContact O-N 3.17Å; D70-L75 HydrophobicContact CB-CB 4.44Å; D70-L75 PolarHBondContact N-O 3.14Å; D70-L75 PolarHBondContact O-N 2.8Å; D70-L75 VanDerWaalsContact O-N 3.09Å; D70-I77 HydrophobicContact CB-CD1 4.35Å
71	Y	86	Confident	93.2	Very high	192 Å²	192	76.2 Å²	76.2	75%	0.753	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.8	179	-65.1	-80.6	0	0	0	113.8	F69	F69-Y71 AromaticContact CD1-CD1 3.56Å; F69-Y71 HydrophobicContact CD1-CD1 3.56Å; F69-Y71 HydrophobicContact CD1-CD2 4.32Å; F69-Y71 AromaticContact CD1-CE1 3.72Å; F69-Y71 HydrophobicContact CD1-CE1 3.72Å; F69-Y71 HydrophobicContact CD1-CE2 4.46Å; F69-Y71 AromaticContact CD1-CG 3.88Å; F69-Y71 HydrophobicContact CD1-CG 3.88Å; F69-Y71 AromaticContact CE1-CD1 3.89Å; F69-Y71 HydrophobicContact CE1-CD1 3.89Å; F69-Y71 HydrophobicContact CE1-CE1 4.3Å; F69-Y71 HydrophobicContact CE1-CG 4.4Å; F69-Y71 WeakPolarHBondContact O-CD2 3.43Å; F69-Y71 PolarHBondContact O-N 3.41Å
72	L	84.6	Confident	93.2	Very high	170 Å²	170	73 Å²	73	89%	0.89	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-33.9	-179.5	-64.9	173	0	0	0	111	D70	D70-L72 PolarHBondContact O-N 3.42Å; D70-L72 WeakPolarHBondContact OD1-CB 3.18Å; D70-L72 PolarHBondContact OD1-N 3.39Å
73	K	82.9	Confident	93.2	Very high	117 Å²	117	73.4 Å²	73.4	51%	0.509	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-4	177.6	-62.8	-176.2	-171.2	163	0	113.8	D70 L75	D70-K73 HydrophobicContact CB-CB 4.35Å; D70-K73 CarbonylContact O-C 3.56Å; D70-K73 PolarHBondContact O-N 3.26Å; D70-K73 PolarHBondContact OD1-N 3.15Å; D70-K73 VanDerWaalsContact OD2-CD 3.29Å; D70-K73 WeakPolarHBondContact OD2-CD 3.39Å; D70-K73 WeakPolarHBondContact OD2-CG 3.33Å; D70-K73 IonicContact OD2-NZ 2.77Å; K73-L75 HydrophobicContact CB-CB 4.1Å; K73-L75 PolarHBondContact O-N 3.21Å
74	S	88.5	Confident	93.2	Very high	96 Å²	96	69.8 Å²	69.8	67%	0.671	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	43.9	-170.8	-61.6	0	0	0	0	112	D70	D70-S74 WeakPolarHBondContact O-CA 3.3Å; D70-S74 PolarHBondContact O-N 3.17Å
75	L	88.1	Confident	93.2	Very high	66 Å²	66	71.1 Å²	71.1	35%	0.346	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.3	-173.8	-176.5	68.7	0	0	0	110	D70 K73	D70-L75 HydrophobicContact CB-CB 4.44Å; D70-L75 PolarHBondContact N-O 3.14Å; D70-L75 PolarHBondContact O-N 2.8Å; D70-L75 VanDerWaalsContact O-N 3.09Å; K73-L75 HydrophobicContact CB-CB 4.1Å; K73-L75 PolarHBondContact O-N 3.21Å
76	E	91.7	Very high	93.2	Very high	134 Å²	134	71.6 Å²	71.6	63%	0.626	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	132.4	167.4	-172.7	174	-177.7	0	0	109.6	F69	F69-E76 HydrophobicContact CD2-CB 4.08Å; F69-E76 HydrophobicContact CE2-CB 4.29Å
77	I	92.8	Very high	93.2	Very high	16 Å²	16	66.6 Å²	66.6	8%	0.082	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.4	175.4	-59	170.4	0	0	0	106.4	E68 D70 N100 K102	E68-I77 HydrophobicContact CB-CB 4.05Å; E68-I77 HydrophobicContact CB-CD1 4.22Å; E68-I77 PolarHBondContact N-O 2.9Å; E68-I77 VanDerWaalsContact N-O 3.1Å; E68-I77 PolarHBondContact O-N 3.18Å; D70-I77 HydrophobicContact CB-CD1 4.35Å; I77-N100 WeakPolarHBondContact CG2-ND2 3.44Å; I77-K102 HydrophobicContact CD1-CB 4.25Å; I77-K102 HydrophobicContact CD1-CG 3.85Å; I77-K102 HydrophobicContact CG1-CG 3.96Å; I77-K102 HydrophobicContact CG2-CB 4.09Å; I77-K102 HydrophobicContact CG2-CG 3.85Å
78	E	95.6	Very high	93.2	Very high	105 Å²	105	64.4 Å²	64.4	49%	0.491	31%	0.31	S	S	.	.			trans	-60	144.2	178	-67.2	-173.9	-156.3	0	0	111.4	K80 N100	E78-K80 HydrophobicContact CB-CB 4.31Å; E78-K80 PolarHBondContact O-N 2.83Å; E78-N100 PolarHBondContact O-ND2 3.12Å
79	E	97.8	Very high	93.1	Very high	47 Å²	47	65 Å²	65	22%	0.22	31%	0.313	C	S	.	.			trans	-76.6	-12	174.1	61.8	-173.7	179.8	0	0	113.2	G34 G35 H65 P67 I81	G34-E79 VanDerWaalsContact C-CD 3.49Å; G34-E79 WeakPolarHBondContact CA-OE1 3.34Å; G35-E79 WeakPolarHBondContact CA-O 3.22Å; H65-E79 HydrophobicContact CB-CB 4.32Å; H65-E79 WeakPolarHBondContact CB-O 3.26Å; P67-E79 WeakPolarHBondContact CD-OE2 3.34Å; P67-E79 HydrophobicContact CG-CB 4.29Å; P67-E79 HydrophobicContact CG-CG 4.2Å; P67-E79 VanDerWaalsContact CG-OE2 3.29Å; P67-E79 WeakPolarHBondContact CG-OE2 3.37Å; E79-I81 PolarHBondContact O-N 3.28Å
80	K	98.1	Very high	93	Very high	56 Å²	56	67.2 Å²	67.2	24%	0.243	33%	0.325	C	S	.	.			trans	-46.6	127.3	-178.9	168.6	176.6	162.2	-88.6	0	112.1	K33 E78 N82 N100	K33-K80 HydrophobicContact CG-CD 4.11Å; K33-K80 HydrophobicContact CG-CG 4.28Å; K33-K80 WeakPolarHBondContact O-CA 3.29Å; K33-K80 PolarHBondContact O-N 3.31Å; E78-K80 HydrophobicContact CB-CB 4.31Å; E78-K80 PolarHBondContact O-N 2.83Å; K80-N82 PolarHBondContact NZ-OD1 3.07Å; K80-N82 PolarHBondContact O-N 3.18Å; K80-N100 WeakPolarHBondContact O-CA 3.42Å; K80-N100 VanDerWaalsContact O-CB 3.28Å; K80-N100 WeakPolarHBondContact O-CB 3.42Å
81	I	98.6	Very high	93.4	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.336	C	S	.	.			trans	-78.8	111.9	176.3	-50.7	-56	0	0	0	109.4	S17 T18 D32 V37 H65 E79 I84 T99	S17-I81 VanDerWaalsContact CB-O 3.29Å; S17-I81 WeakPolarHBondContact CB-O 3.37Å; S17-I81 PolarHBondContact OG-O 3.07Å; T18-I81 HydrophobicContact CG2-CB 4.48Å; T18-I81 HydrophobicContact CG2-CG2 3.85Å; D32-I81 PolarHBondContact O-N 2.95Å; V37-I81 HydrophobicContact CG2-CG1 4.4Å; H65-I81 HydrophobicContact CB-CD1 4.12Å; H65-I81 WeakPolarHBondContact ND1-CD1 3.49Å; E79-I81 PolarHBondContact O-N 3.28Å; I81-I84 HydrophobicContact CG2-CD1 4.27Å; I81-I84 HydrophobicContact CG2-CG1 3.88Å; I81-T99 CarbonylContact C-O 3.52Å
82	N	98.1	Very high	93.8	Very high	14 Å²	14	64.2 Å²	64.2	8%	0.075	33%	0.334	C	S	.	.			trans	-79	-42.5	-179.1	-72.2	-13	0	0	0	112.8	K80 T99 D101 I165	K80-N82 PolarHBondContact NZ-OD1 3.07Å; K80-N82 PolarHBondContact O-N 3.18Å; N82-T99 HydrophobicContact CB-CG2 4.25Å; N82-T99 PolarHBondContact N-O 3.04Å; N82-D101 PolarHBondContact ND2-N 2.76Å; N82-D101 PolarHBondContact ND2-OD1 2.94Å; N82-I165 PolarHBondContact ND2-O 3.36Å
83	K	98.5	Very high	94.4	Very high	30 Å²	30	56.3 Å²	56.3	13%	0.13	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.5	-178.3	-68.4	-63.8	180	-123.1	0	111	T99 I168 E332	K83-T99 HydrophobicContact CB-CG2 3.94Å; K83-T99 PolarHBondContact O-N 2.85Å; K83-T99 VanDerWaalsContact O-N 3.11Å; K83-I168 HydrophobicContact CB-CD1 4.15Å; K83-I168 HydrophobicContact CB-CG1 3.72Å; K83-E332 IonicContact NZ-OE1 2.72Å; K83-E332 PolarHBondContact NZ-OE1 2.78Å
84	I	98.7	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.7	166.5	-67.4	169.6	0	0	0	108.1	T18 E20 A29 V37 I81 L96 L97	T18-I84 HydrophobicContact CG2-CB 4.26Å; T18-I84 HydrophobicContact CG2-CD1 3.8Å; T18-I84 HydrophobicContact CG2-CG1 3.73Å; E20-I84 HydrophobicContact CB-CB 4.39Å; E20-I84 HydrophobicContact CB-CG2 4.32Å; A29-I84 HydrophobicContact CB-CD1 4.12Å; A29-I84 HydrophobicContact CB-CG2 4.1Å; V37-I84 HydrophobicContact CG1-CD1 4.04Å; V37-I84 HydrophobicContact CG2-CD1 4.01Å; I81-I84 HydrophobicContact CG2-CD1 4.27Å; I81-I84 HydrophobicContact CG2-CG1 3.88Å; I84-L96 HydrophobicContact CG2-CB 4.44Å; I84-L96 HydrophobicContact CG2-CD1 4.34Å; I84-L97 CarbonylContact C-O 3.57Å; I84-L97 VanDerWaalsContact CA-O 3.28Å; I84-L97 WeakPolarHBondContact CA-O 3.49Å
85	R	98.5	Very high	95.5	Very high	30 Å²	30	49 Å²	49	11%	0.113	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.4	169.4	-70.4	-67.7	176.6	-118.7	-9.8	109.7	E20 L96 L97 I168 V170	E20-R85 WeakPolarHBondContact OE1-CD 3.21Å; E20-R85 IonicContact OE1-CZ 2.79Å; E20-R85 IonicContact OE1-NE 3.05Å; E20-R85 IonicContact OE1-NH1 3.07Å; E20-R85 PolarHBondContact OE1-NH1 3.18Å; E20-R85 IonicContact OE2-NH1 2.92Å; E20-R85 PolarHBondContact OE2-NH1 3.2Å; R85-L96 CarbonylContact O-C 3.54Å; R85-L96 WeakPolarHBondContact O-CA 3.5Å; R85-L97 PolarHBondContact N-O 3.04Å; R85-L97 PolarHBondContact O-N 2.89Å; R85-I168 HydrophobicContact CB-CD1 4.23Å; R85-I168 HydrophobicContact CG-CD1 4.08Å; R85-I168 HydrophobicContact CG-CG1 3.89Å; R85-I168 WeakPolarHBondContact CG-O 3.38Å; R85-I168 PolarHBondContact NE-O 3.01Å; R85-V170 HydrophobicContact CB-CG2 4.3Å
86	W	98.3	Very high	96	Very high	10 Å²	10	45.9 Å²	45.9	4%	0.038	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	145.4	173.4	-67.9	93.1	0	0	0	110.5	E20 F21 N22 H23 L27 A29 I39 L96	E20-W86 PolarHBondContact O-NE1 2.9Å; E20-W86 VanDerWaalsContact O-NE1 3.15Å; F21-W86 VanDerWaalsContact C-CD1 3.46Å; N22-W86 VanDerWaalsContact CA-CD1 3.45Å; N22-W86 HydrophobicContact CB-CB 4.31Å; N22-W86 HydrophobicContact CB-CD2 3.6Å; N22-W86 HydrophobicContact CB-CE3 4.06Å; N22-W86 HydrophobicContact CB-CG 3.71Å; N22-W86 HydrophobicContact CB-CZ2 4.28Å; H23-W86 PolarHBondContact CE1-O 2.83Å; H23-W86 VanDerWaalsContact CE1-O 3.31Å; L27-W86 HydrophobicContact CB-CH2 3.98Å; L27-W86 HydrophobicContact CB-CZ2 3.93Å; L27-W86 HydrophobicContact CD1-CH2 3.69Å; L27-W86 HydrophobicContact CD1-CZ2 4.47Å; L27-W86 HydrophobicContact CD1-CZ3 4Å; A29-W86 HydrophobicContact CB-CZ2 3.64Å; I39-W86 HydrophobicContact CD1-CH2 3.93Å; I39-W86 HydrophobicContact CG1-CH2 4.27Å; I39-W86 HydrophobicContact CG2-CH2 3.96Å; I39-W86 HydrophobicContact CG2-CZ2 4.23Å; W86-L96 HydrophobicContact CD2-CB 4.12Å; W86-L96 HydrophobicContact CE3-CB 3.86Å; W86-L96 HydrophobicContact CE3-CD2 4.2Å; W86-L96 HydrophobicContact CH2-CD2 3.8Å; W86-L96 HydrophobicContact CZ2-CD2 4.16Å; W86-L96 HydrophobicContact CZ3-CB 4.27Å; W86-L96 HydrophobicContact CZ3-CD2 3.8Å
87	L	97.8	Very high	96.3	Very high	25 Å²	25	39.5 Å²	39.5	13%	0.131	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-87.8	150	163.2	-81.7	70.5	0	0	0	108.8	H23 F95 L97 L106 V170 F190	H23-L87 VanDerWaalsContact CE1-C 3.49Å; L87-F95 HydrophobicContact CB-CB 3.92Å; L87-F95 HydrophobicContact CD2-CB 4.19Å; L87-F95 HydrophobicContact CG-CB 4.46Å; L87-F95 PolarHBondContact N-O 2.82Å; L87-L97 HydrophobicContact CD1-CD2 4.49Å; L87-L97 HydrophobicContact CD1-CG 3.87Å; L87-L106 HydrophobicContact CD1-CD1 3.86Å; L87-L106 HydrophobicContact CD2-CD1 3.96Å; L87-V170 HydrophobicContact CD1-CG2 4.19Å; L87-V170 HydrophobicContact CG-CG2 4.4Å; L87-F190 HydrophobicContact CD1-CE1 4.09Å; L87-F190 HydrophobicContact CD1-CZ 4.41Å; L87-F190 HydrophobicContact CD2-CD1 4.03Å; L87-F190 HydrophobicContact CD2-CD2 4.35Å; L87-F190 HydrophobicContact CD2-CE1 3.8Å; L87-F190 HydrophobicContact CD2-CE2 4.17Å; L87-F190 HydrophobicContact CD2-CG 4.3Å; L87-F190 HydrophobicContact CD2-CZ 3.89Å; L87-F190 HydrophobicContact CG-CE1 4.09Å; L87-F190 HydrophobicContact CG-CZ 4.02Å
88	P	94.1	Very high	96.6	Very high	31 Å²	31	38.7 Å²	38.7	20%	0.201	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-59	139.4	170.1	-25.8	37.1	0	0	0	111.5	Q90 Y174	P88-Q90 PolarHBondContact O-N 2.87Å; P88-Y174 HydrophobicContact CB-CD1 3.77Å; P88-Y174 HydrophobicContact CB-CE1 3.37Å; P88-Y174 HydrophobicContact CG-CD1 3.68Å; P88-Y174 HydrophobicContact CG-CE1 3.37Å
89	Q	91.5	Very high	96.8	Very high	91 Å²	91	33.7 Å²	33.7	43%	0.425	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-71.9	119.8	-175.2	-173.6	175.2	3.1	0	0	111.1	N91 Y94	Q89-N91 WeakPolarHBondContact CG-O 3.39Å; Q89-N91 PolarHBondContact NE2-O 3.03Å; Q89-Y94 HydrophobicContact CG-CD1 4.48Å
90	Q	88.7	Confident	96.8	Very high	140 Å²	140	31.5 Å²	31.5	65%	0.654	17%	0.165	S	C	*	.			trans	-103.2	-20.6	178.1	-67.1	-176.6	-16.7	0	0	113.5	P88	P88-Q90 PolarHBondContact O-N 2.87Å
91	N	93	Very high	96.7	Very high	84 Å²	84	30 Å²	30	45%	0.449	16%	0.159	S	C	.	.	S	Bend	trans	-152.3	-168.8	-179.5	58.2	53.4	0	0	0	109.8	Q89 A93	Q89-N91 WeakPolarHBondContact CG-O 3.39Å; Q89-N91 PolarHBondContact NE2-O 3.03Å; N91-A93 PolarHBondContact O-N 2.83Å; N91-A93 WeakPolarHBondContact OD1-CA 3.15Å; N91-A93 WeakPolarHBondContact OD1-CB 3.36Å; N91-A93 PolarHBondContact OD1-N 3.43Å; N91-A93 PolarHBondContact OD1-O 3.29Å
92	A	94.5	Very high	96.6	Very high	87 Å²	87	31.2 Å²	31.2	72%	0.719	17%	0.165	S	C	*	.	S	Bend	trans	-63.3	-19.8	-179.4	0	0	0	0	0	114
93	A	96.3	Very high	96.5	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.033	16%	0.162	C	C	.	.	S	Bend	trans	-87.6	147.4	175.8	0	0	0	0	0	111.5	N91 F95 K108 V109	N91-A93 PolarHBondContact O-N 2.83Å; N91-A93 WeakPolarHBondContact OD1-CA 3.15Å; N91-A93 WeakPolarHBondContact OD1-CB 3.36Å; N91-A93 PolarHBondContact OD1-N 3.43Å; N91-A93 PolarHBondContact OD1-O 3.29Å; A93-F95 HydrophobicContact CB-CE2 3.95Å; A93-F95 HydrophobicContact CB-CZ 4.3Å; A93-K108 HydrophobicContact CB-CD 4.31Å; A93-K108 VanDerWaalsContact CB-CE 3.49Å; A93-K108 HydrophobicContact CB-CG 3.93Å; A93-V109 WeakPolarHBondContact CA-O 3.08Å
94	Y	97.6	Very high	96.5	Very high	27 Å²	27	29.3 Å²	29.3	11%	0.106	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	148.5	171.6	-53.1	-81.3	0	0	0	110.3	L27 Q89 K108 V109	L27-Y94 HydrophobicContact CD1-CD1 3.76Å; L27-Y94 HydrophobicContact CD1-CD2 3.71Å; L27-Y94 HydrophobicContact CD1-CE1 3.92Å; L27-Y94 HydrophobicContact CD1-CE2 3.89Å; L27-Y94 HydrophobicContact CD1-CG 3.65Å; Q89-Y94 HydrophobicContact CG-CD1 4.48Å; Y94-K108 WeakPolarHBondContact O-CA 3.38Å; Y94-V109 PolarHBondContact N-O 2.81Å; Y94-V109 PolarHBondContact O-N 3.05Å
95	F	98	Very high	96.5	Very high	32 Å²	32	30.7 Å²	30.7	14%	0.14	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139	179.2	-66.1	-95.1	0	0	0	109.8	L87 A93 L106 W107 K108 R154	L87-F95 HydrophobicContact CB-CB 3.92Å; L87-F95 HydrophobicContact CD2-CB 4.19Å; L87-F95 HydrophobicContact CG-CB 4.46Å; L87-F95 PolarHBondContact N-O 2.82Å; A93-F95 HydrophobicContact CB-CE2 3.95Å; A93-F95 HydrophobicContact CB-CZ 4.3Å; F95-L106 HydrophobicContact CB-CD1 4.25Å; F95-L106 HydrophobicContact CD1-CD1 4.4Å; F95-W107 VanDerWaalsContact CA-O 3.28Å; F95-W107 WeakPolarHBondContact CA-O 3.45Å; F95-K108 HydrophobicContact CD1-CB 3.97Å; F95-K108 HydrophobicContact CD1-CG 4.38Å; F95-K108 HydrophobicContact CE1-CB 3.66Å; F95-K108 HydrophobicContact CE1-CD 4.12Å; F95-K108 HydrophobicContact CE1-CG 3.78Å; F95-K108 HydrophobicContact CZ-CB 4.33Å; F95-K108 HydrophobicContact CZ-CD 4.09Å; F95-K108 HydrophobicContact CZ-CG 3.93Å; F95-R154 HydrophobicContact CE1-CG 4.49Å
96	L	98.4	Very high	96.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	147.3	175	65.4	86.6	0	0	0	110.6	I39 F62 I84 R85 W86 W107	I39-L96 HydrophobicContact CD1-CD2 3.85Å; I39-L96 HydrophobicContact CG1-CD2 4.45Å; F62-L96 HydrophobicContact CZ-CD1 4.45Å; I84-L96 HydrophobicContact CG2-CB 4.44Å; I84-L96 HydrophobicContact CG2-CD1 4.34Å; R85-L96 CarbonylContact O-C 3.54Å; R85-L96 WeakPolarHBondContact O-CA 3.5Å; W86-L96 HydrophobicContact CD2-CB 4.12Å; W86-L96 HydrophobicContact CE3-CB 3.86Å; W86-L96 HydrophobicContact CE3-CD2 4.2Å; W86-L96 HydrophobicContact CH2-CD2 3.8Å; W86-L96 HydrophobicContact CZ2-CD2 4.16Å; W86-L96 HydrophobicContact CZ3-CB 4.27Å; W86-L96 HydrophobicContact CZ3-CD2 3.8Å; L96-W107 HydrophobicContact CD1-CB 3.97Å; L96-W107 HydrophobicContact CD1-CG 4.26Å; L96-W107 HydrophobicContact CG-CB 4.12Å; L96-W107 PolarHBondContact N-O 3.21Å; L96-W107 VanDerWaalsContact N-O 3.12Å; L96-W107 PolarHBondContact O-N 2.76Å
97	L	98.7	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.9	163.3	-65.3	177.7	0	0	0	109.2	I84 R85 L87 V104 K105 L106 F157 I168 V170 Y177 F190	I84-L97 CarbonylContact C-O 3.57Å; I84-L97 VanDerWaalsContact CA-O 3.28Å; I84-L97 WeakPolarHBondContact CA-O 3.49Å; R85-L97 PolarHBondContact N-O 3.04Å; R85-L97 PolarHBondContact O-N 2.89Å; L87-L97 HydrophobicContact CD1-CD2 4.49Å; L87-L97 HydrophobicContact CD1-CG 3.87Å; L97-V104 HydrophobicContact CB-CG1 4.18Å; L97-V104 HydrophobicContact CD1-CG1 4.39Å; L97-V104 HydrophobicContact CD2-CG1 3.95Å; L97-V104 HydrophobicContact CG-CG1 4.4Å; L97-K105 WeakPolarHBondContact CA-O 3.42Å; L97-L106 HydrophobicContact CD2-CB 4Å; L97-L106 HydrophobicContact CD2-CD1 3.93Å; L97-F157 HydrophobicContact CD2-CE2 4.31Å; L97-I168 HydrophobicContact CB-CD1 3.74Å; L97-V170 HydrophobicContact CD1-CG2 4.2Å; L97-Y177 HydrophobicContact CD1-CD1 4.1Å; L97-Y177 HydrophobicContact CD1-CD2 3.6Å; L97-Y177 HydrophobicContact CD1-CE1 4.43Å; L97-Y177 HydrophobicContact CD1-CE2 4.01Å; L97-Y177 HydrophobicContact CD1-CG 3.67Å; L97-F190 HydrophobicContact CD1-CE1 4.06Å; L97-F190 HydrophobicContact CD2-CE1 4.34Å; L97-F190 HydrophobicContact CG-CE1 4.39Å
98	S	98.8	Very high	96.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.7	163.7	61	0	0	0	0	109.3	S64 V104 K105 W107	S64-S98 WeakPolarHBondContact OG-CB 3.23Å; S64-S98 PolarHBondContact OG-OG 3.16Å; S98-V104 CarbonylContact O-C 3.52Å; S98-V104 WeakPolarHBondContact O-CA 3.3Å; S98-K105 PolarHBondContact N-O 3.44Å; S98-K105 PolarHBondContact O-N 3.34Å; S98-W107 VanDerWaalsContact OG-CD1 3.29Å; S98-W107 PolarHBondContact OG-NE1 3.14Å; S98-W107 VanDerWaalsContact OG-NE1 3.07Å
99	T	98.7	Very high	96.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	143.6	177.2	-168.4	0	0	0	0	111.3	I81 N82 K83 T103 I165 I168	I81-T99 CarbonylContact C-O 3.52Å; N82-T99 HydrophobicContact CB-CG2 4.25Å; N82-T99 PolarHBondContact N-O 3.04Å; K83-T99 HydrophobicContact CB-CG2 3.94Å; K83-T99 PolarHBondContact O-N 2.85Å; K83-T99 VanDerWaalsContact O-N 3.11Å; T99-T103 WeakPolarHBondContact CA-O 3.4Å; T99-T103 PolarHBondContact OG1-O 2.87Å; T99-I165 HydrophobicContact CG2-CG2 4.05Å; T99-I168 HydrophobicContact CG2-CD1 3.98Å; T99-I168 HydrophobicContact CG2-CG1 4.06Å; T99-I168 HydrophobicContact CG2-CG2 3.97Å
100	N	97.9	Very high	97	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.			trans	-100.9	-155.6	157.8	72	-11.1	0	0	0	108.8	I77 E78 K80 K102 T103	I77-N100 WeakPolarHBondContact CG2-ND2 3.44Å; E78-N100 PolarHBondContact O-ND2 3.12Å; K80-N100 WeakPolarHBondContact O-CA 3.42Å; K80-N100 VanDerWaalsContact O-CB 3.28Å; K80-N100 WeakPolarHBondContact O-CB 3.42Å; N100-K102 VanDerWaalsContact C-N 3.29Å; N100-K102 PolarHBondContact O-N 2.95Å; N100-K102 PolarHBondContact OD1-N 3.12Å; N100-K102 VanDerWaalsContact OD1-N 3.13Å; N100-T103 PolarHBondContact N-O 3.01Å; N100-T103 PolarHBondContact OD1-N 2.79Å; N100-T103 PolarHBondContact OD1-O 2.72Å
101	D	96.6	Very high	97.3	Very high	25 Å²	25	24.6 Å²	24.6	13%	0.134	13%	0.133	C	C	.	.	S	Bend	trans	-67.3	-20.8	-178	-77.7	-3.5	0	0	0	115.3	N82 H164 I165	N82-D101 PolarHBondContact ND2-N 2.76Å; N82-D101 PolarHBondContact ND2-OD1 2.94Å; D101-H164 HydrophobicContact CB-CB 4.47Å; D101-H164 IonicContact OD1-ND1 2.97Å; D101-H164 IonicContact OD2-CE1 4Å; D101-H164 PolarHBondContact OD2-CE1 3.02Å; D101-H164 IonicContact OD2-CG 3.25Å; D101-H164 IonicContact OD2-ND1 3.78Å; D101-H164 PolarHBondContact OD2-ND1 2.84Å; D101-I165 WeakPolarHBondContact O-CG1 3.41Å; D101-I165 PolarHBondContact O-N 3.24Å
102	K	95.9	Very high	97.3	Very high	25 Å²	25	24.9 Å²	24.9	11%	0.109	13%	0.128	C	C	.	.	S	Bend	trans	-132.6	-24	-170.3	-62.6	-62.4	175.8	-160.4	0	114.9	I77 N100 T162 Y163	I77-K102 HydrophobicContact CD1-CB 4.25Å; I77-K102 HydrophobicContact CD1-CG 3.85Å; I77-K102 HydrophobicContact CG1-CG 3.96Å; I77-K102 HydrophobicContact CG2-CB 4.09Å; I77-K102 HydrophobicContact CG2-CG 3.85Å; N100-K102 VanDerWaalsContact C-N 3.29Å; N100-K102 PolarHBondContact O-N 2.95Å; N100-K102 PolarHBondContact OD1-N 3.12Å; N100-K102 VanDerWaalsContact OD1-N 3.13Å; K102-T162 PolarHBondContact NZ-O 3.42Å; K102-Y163 PolarHBondContact NZ-O 2.77Å
103	T	96.9	Very high	97.3	Very high	4 Å²	4	24.6 Å²	24.6	3%	0.025	12%	0.115	C	C	.	.			trans	-133.1	126.6	-166.9	-58.5	0	0	0	0	110.7	H65 T99 N100 K105 V156 A158	H65-T103 PolarHBondContact NE2-O 3.01Å; T99-T103 WeakPolarHBondContact CA-O 3.4Å; T99-T103 PolarHBondContact OG1-O 2.87Å; N100-T103 PolarHBondContact N-O 3.01Å; N100-T103 PolarHBondContact OD1-N 2.79Å; N100-T103 PolarHBondContact OD1-O 2.72Å; T103-K105 HydrophobicContact CG2-CG 4.24Å; T103-V156 HydrophobicContact CG2-CG1 3.46Å; T103-V156 VanDerWaalsContact CG2-CG1 3.46Å; T103-A158 HydrophobicContact CG2-CB 4.12Å
104	V	98.6	Very high	97.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138	169.7	-171.3	0	0	0	0	108.7	L97 S98 F157 I165 I168 Y177	L97-V104 HydrophobicContact CB-CG1 4.18Å; L97-V104 HydrophobicContact CD1-CG1 4.39Å; L97-V104 HydrophobicContact CD2-CG1 3.95Å; L97-V104 HydrophobicContact CG-CG1 4.4Å; S98-V104 CarbonylContact O-C 3.52Å; S98-V104 WeakPolarHBondContact O-CA 3.3Å; V104-F157 HydrophobicContact CB-CB 4.22Å; V104-F157 HydrophobicContact CB-CD2 4.26Å; V104-F157 HydrophobicContact CG1-CD2 4.37Å; V104-F157 PolarHBondContact N-O 2.97Å; V104-F157 PolarHBondContact O-N 2.75Å; V104-I165 HydrophobicContact CG2-CD1 4.17Å; V104-I168 HydrophobicContact CG1-CG2 4.39Å; V104-I168 HydrophobicContact CG2-CG2 3.93Å; V104-Y177 HydrophobicContact CG1-CE2 4.09Å; V104-Y177 HydrophobicContact CG2-CE2 4.38Å
105	K	98.6	Very high	97	Very high	29 Å²	29	33.8 Å²	33.8	13%	0.126	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.9	175.5	-64.2	-175.5	-174.9	178.1	0	110.3	S64 L97 S98 T103 W107 R155 V156	S64-K105 VanDerWaalsContact O-CD 3.27Å; S64-K105 WeakPolarHBondContact O-CD 3.23Å; S64-K105 WeakPolarHBondContact O-CE 3.35Å; S64-K105 PolarHBondContact O-NZ 3.36Å; L97-K105 WeakPolarHBondContact CA-O 3.42Å; S98-K105 PolarHBondContact N-O 3.44Å; S98-K105 PolarHBondContact O-N 3.34Å; T103-K105 HydrophobicContact CG2-CG 4.24Å; K105-W107 HydrophobicContact CD-CZ2 4.07Å; K105-R155 WeakPolarHBondContact CA-O 3.28Å; K105-V156 HydrophobicContact CD-CG2 4.49Å; K105-V156 HydrophobicContact CG-CG1 4.26Å; K105-V156 HydrophobicContact CG-CG2 4.2Å
106	L	98.6	Very high	96.7	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.042	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.3	169.2	178.6	64.2	0	0	0	108.9	L87 F95 L97 R154 R155 F157	L87-L106 HydrophobicContact CD1-CD1 3.86Å; L87-L106 HydrophobicContact CD2-CD1 3.96Å; F95-L106 HydrophobicContact CB-CD1 4.25Å; F95-L106 HydrophobicContact CD1-CD1 4.4Å; L97-L106 HydrophobicContact CD2-CB 4Å; L97-L106 HydrophobicContact CD2-CD1 3.93Å; L106-R154 HydrophobicContact CD2-CB 4.34Å; L106-R154 HydrophobicContact CG-CB 4.31Å; L106-R154 PolarHBondContact O-N 2.97Å; L106-R155 HydrophobicContact CB-CB 3.96Å; L106-R155 HydrophobicContact CB-CG 4.47Å; L106-R155 HydrophobicContact CD2-CB 4.47Å; L106-R155 HydrophobicContact CD2-CG 4.1Å; L106-R155 PolarHBondContact N-O 2.83Å; L106-R155 PolarHBondContact O-N 3.46Å; L106-F157 HydrophobicContact CB-CE2 4.04Å
107	W	98.6	Very high	96.3	Very high	14 Å²	14	36.3 Å²	36.3	5%	0.053	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.7	177.7	-68.6	88.3	0	0	0	110.7	F62 Q63 S64 F95 L96 S98 K105 T152 P153	F62-W107 AromaticContact CD2-CD2 3.85Å; F62-W107 HydrophobicContact CD2-CD2 3.85Å; F62-W107 AromaticContact CD2-CE3 3.56Å; F62-W107 HydrophobicContact CD2-CE3 3.56Å; F62-W107 AromaticContact CD2-CH2 3.87Å; F62-W107 HydrophobicContact CD2-CH2 3.87Å; F62-W107 HydrophobicContact CD2-CZ2 4.17Å; F62-W107 AromaticContact CD2-CZ3 3.54Å; F62-W107 HydrophobicContact CD2-CZ3 3.54Å; F62-W107 HydrophobicContact CE2-CB 4.37Å; F62-W107 AromaticContact CE2-CD2 3.32Å; F62-W107 HydrophobicContact CE2-CD2 3.32Å; F62-W107 AromaticContact CE2-CE2 3.68Å; F62-W107 AromaticContact CE2-CE3 3.48Å; F62-W107 HydrophobicContact CE2-CE3 3.48Å; F62-W107 VanDerWaalsContact CE2-CE3 3.48Å; F62-W107 AromaticContact CE2-CG 3.69Å; F62-W107 HydrophobicContact CE2-CG 3.69Å; F62-W107 HydrophobicContact CE2-CH2 4.3Å; F62-W107 HydrophobicContact CE2-CZ2 4.2Å; F62-W107 AromaticContact CE2-CZ3 3.94Å; F62-W107 HydrophobicContact CE2-CZ3 3.94Å; F62-W107 HydrophobicContact CG-CE3 4.37Å; F62-W107 HydrophobicContact CG-CZ3 4.3Å; F62-W107 HydrophobicContact CZ-CB 4.28Å; F62-W107 HydrophobicContact CZ-CD2 4.08Å; F62-W107 HydrophobicContact CZ-CE3 4.23Å; F62-W107 HydrophobicContact CZ-CG 4.06Å; Q63-W107 VanDerWaalsContact O-CH2 3.29Å; Q63-W107 WeakPolarHBondContact O-CH2 3.31Å; S64-W107 VanDerWaalsContact CA-CZ2 3.45Å; S64-W107 WeakPolarHBondContact O-CZ2 3.39Å; S64-W107 PolarHBondContact OG-NE1 3.38Å; F95-W107 VanDerWaalsContact CA-O 3.28Å; F95-W107 WeakPolarHBondContact CA-O 3.45Å; L96-W107 HydrophobicContact CD1-CB 3.97Å; L96-W107 HydrophobicContact CD1-CG 4.26Å; L96-W107 HydrophobicContact CG-CB 4.12Å; L96-W107 PolarHBondContact N-O 3.21Å; L96-W107 VanDerWaalsContact N-O 3.12Å; L96-W107 PolarHBondContact O-N 2.76Å; S98-W107 VanDerWaalsContact OG-CD1 3.29Å; S98-W107 PolarHBondContact OG-NE1 3.14Å; S98-W107 VanDerWaalsContact OG-NE1 3.07Å; K105-W107 HydrophobicContact CD-CZ2 4.07Å; W107-T152 WeakPolarHBondContact CA-O 3.02Å; W107-T152 VanDerWaalsContact CE3-C 3.48Å; W107-P153 HydrophobicContact CD2-CB 4.3Å; W107-P153 HydrophobicContact CE3-CB 4.1Å; W107-P153 HydrophobicContact CH2-CB 3.75Å; W107-P153 HydrophobicContact CH2-CG 3.92Å; W107-P153 HydrophobicContact CZ2-CB 3.91Å; W107-P153 HydrophobicContact CZ3-CB 3.87Å; W107-P153 VanDerWaalsContact CZ3-CD 3.41Å; W107-P153 HydrophobicContact CZ3-CG 3.96Å
108	K	97.9	Very high	95.9	Very high	66 Å²	66	38.1 Å²	38.1	29%	0.287	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126	167.6	174.9	-174.6	175.8	-168.8	0	108.8	A93 Y94 F95 A151 T152 R154	A93-K108 HydrophobicContact CB-CD 4.31Å; A93-K108 VanDerWaalsContact CB-CE 3.49Å; A93-K108 HydrophobicContact CB-CG 3.93Å; Y94-K108 WeakPolarHBondContact O-CA 3.38Å; F95-K108 HydrophobicContact CD1-CB 3.97Å; F95-K108 HydrophobicContact CD1-CG 4.38Å; F95-K108 HydrophobicContact CE1-CB 3.66Å; F95-K108 HydrophobicContact CE1-CD 4.12Å; F95-K108 HydrophobicContact CE1-CG 3.78Å; F95-K108 HydrophobicContact CZ-CB 4.33Å; F95-K108 HydrophobicContact CZ-CD 4.09Å; F95-K108 HydrophobicContact CZ-CG 3.93Å; K108-A151 CarbonylContact O-C 3.22Å; K108-A151 WeakPolarHBondContact O-CA 3.47Å; K108-T152 PolarHBondContact N-O 3.07Å; K108-T152 PolarHBondContact O-N 3.04Å; K108-T152 PolarHBondContact O-OG1 3.03Å; K108-R154 HydrophobicContact CB-CG 3.56Å
109	V	97.9	Very high	95.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.4	174.4	-174.1	0	0	0	0	107.5	I39 Y59 F62 A93 Y94 V149 E150 A151	I39-V109 HydrophobicContact CD1-CB 4.43Å; I39-V109 HydrophobicContact CD1-CG1 4.23Å; I39-V109 HydrophobicContact CD1-CG2 3.6Å; Y59-V109 HydrophobicContact CE1-CG1 3.82Å; F62-V109 HydrophobicContact CE1-CG2 4.45Å; A93-V109 WeakPolarHBondContact CA-O 3.08Å; Y94-V109 PolarHBondContact N-O 2.81Å; Y94-V109 PolarHBondContact O-N 3.05Å; V109-V149 HydrophobicContact CG1-CG1 3.63Å; V109-E150 WeakPolarHBondContact CA-O 3.31Å; V109-A151 HydrophobicContact CG2-CB 4.25Å
110	S	96.6	Very high	95.2	Very high	23 Å²	23	45.5 Å²	45.5	16%	0.161	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.2	-176.8	48.7	0	0	0	0	112.4	E150	S110-E150 PolarHBondContact N-O 2.92Å; S110-E150 PolarHBondContact O-N 2.97Å
111	E	95.4	Very high	94.9	Very high	88 Å²	88	49.6 Å²	49.6	41%	0.411	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	145.3	172	-66.3	-176.1	-174.7	0	0	111.3	Y59 L147 M148 V149	Y59-E111 HydrophobicContact CE2-CG 4.43Å; Y59-E111 WeakPolarHBondContact OH-CG 3.35Å; Y59-E111 PolarHBondContact OH-OE1 3.4Å; E111-L147 HydrophobicContact CB-CD1 3.86Å; E111-L147 HydrophobicContact CG-CD1 4.21Å; E111-M148 CarbonylContact C-O 3.57Å; E111-M148 WeakPolarHBondContact CA-O 3.37Å; E111-V149 HydrophobicContact CG-CG2 4.44Å
112	R	93.7	Very high	94.4	Very high	89 Å²	89	53.2 Å²	53.2	34%	0.336	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	117.1	175.3	-175.9	176.3	171.1	-170.1	-2.3	109.6	K114 M148 E150	R112-K114 WeakPolarHBondContact CG-O 3.45Å; R112-K114 PolarHBondContact NE-O 3.32Å; R112-M148 PolarHBondContact N-O 3.29Å; R112-M148 PolarHBondContact O-N 2.76Å; R112-E150 IonicContact NH1-OE1 2.69Å
113	D	94.7	Very high	93.7	Very high	82 Å²	82	54.7 Å²	54.7	44%	0.439	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	4.5	-179.5	70.5	-28.9	0	0	0	112.4	P144 M145 L147	D113-P144 CarbonylContact O-C 3.59Å; D113-P144 WeakPolarHBondContact O-CA 3.16Å; D113-M145 WeakPolarHBondContact O-CG 3.41Å; D113-M145 PolarHBondContact O-N 3.41Å; D113-L147 HydrophobicContact CB-CD1 4.32Å
114	K	94.4	Very high	92.9	Very high	100 Å²	100	61.9 Å²	61.9	44%	0.435	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.8	-176.8	-68.3	167.8	-165.1	172.2	0	112.6	R112 L142 R143	R112-K114 WeakPolarHBondContact CG-O 3.45Å; R112-K114 PolarHBondContact NE-O 3.32Å; K114-L142 HydrophobicContact CB-CB 4.42Å; K114-R143 CarbonylContact C-O 3.49Å; K114-R143 VanDerWaalsContact CA-O 3.24Å; K114-R143 WeakPolarHBondContact CA-O 3.39Å
115	R	92.6	Very high	92.1	Very high	124 Å²	124	68.7 Å²	68.7	47%	0.468	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.3	173.3	65.6	-175.3	-170	-168.5	2.2	112.6	E117 L142 R143 M145	R115-E117 HydrophobicContact CG-CG 4.3Å; R115-E117 IonicContact CZ-OE1 3.2Å; R115-E117 IonicContact NE-OE1 2.77Å; R115-E117 PolarHBondContact NE-OE1 2.88Å; R115-E117 IonicContact NH2-OE1 2.75Å; R115-E117 PolarHBondContact NH2-OE1 2.82Å; R115-L142 WeakPolarHBondContact O-CA 3.3Å; R115-R143 PolarHBondContact N-O 2.86Å; R115-R143 PolarHBondContact O-N 3.36Å; R115-M145 HydrophobicContact CB-CG 4.49Å; R115-M145 HydrophobicContact CB-SD 3.73Å; R115-M145 HydrophobicContact CG-CB 4.22Å; R115-M145 HydrophobicContact CG-SD 4.28Å
116	P	92.2	Very high	91.3	Very high	43 Å²	43	69.3 Å²	69.3	28%	0.279	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.9	172.1	29.5	-33.9	0	0	0	111.2	Y119 P140 L142	P116-Y119 VanDerWaalsContact CG-OH 3.26Å; P116-Y119 WeakPolarHBondContact CG-OH 3.44Å; P116-P140 HydrophobicContact CB-CB 4.31Å; P116-L142 HydrophobicContact CB-CD2 4.37Å
117	E	89.9	Confident	90.7	Very high	42 Å²	42	77.5 Å²	77.5	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	160.5	174	-68.7	-176.7	178.1	0	0	111.1	R115 P140 V141 R143	R115-E117 HydrophobicContact CG-CG 4.3Å; R115-E117 IonicContact CZ-OE1 3.2Å; R115-E117 IonicContact NE-OE1 2.77Å; R115-E117 PolarHBondContact NE-OE1 2.88Å; R115-E117 IonicContact NH2-OE1 2.75Å; R115-E117 PolarHBondContact NH2-OE1 2.82Å; E117-P140 CarbonylContact O-C 3.55Å; E117-P140 WeakPolarHBondContact O-CA 3.39Å; E117-P140 WeakPolarHBondContact O-CB 3.31Å; E117-V141 PolarHBondContact N-O 3.27Å; E117-V141 PolarHBondContact O-N 3.19Å; E117-R143 HydrophobicContact CB-CG 4.31Å; E117-R143 HydrophobicContact CG-CG 4.43Å; E117-R143 WeakPolarHBondContact OE2-CD 2.98Å; E117-R143 WeakPolarHBondContact OE2-CG 3.37Å; E117-R143 IonicContact OE2-NE 2.88Å; E117-R143 PolarHBondContact OE2-NE 3.34Å
118	G	88.9	Confident	90.2	Very high	38 Å²	38	83.8 Å²	83.8	39%	0.392	41%	0.406	S	S	.	.			trans	89.9	41.5	178.6	0	0	0	0	0	114.4
119	Y	90.6	Very high	89.6	Confident	118 Å²	118	83.9 Å²	83.9	46%	0.463	41%	0.405	S	S	.	.			trans	-66.7	147.2	174.8	-67	-81.4	0	0	0	111.8	P116 P140	P116-Y119 VanDerWaalsContact CG-OH 3.26Å; P116-Y119 WeakPolarHBondContact CG-OH 3.44Å; Y119-P140 HydrophobicContact CD1-CG 4.05Å; Y119-P140 HydrophobicContact CE1-CG 4.19Å
120	N	92.1	Very high	89.1	Confident	36 Å²	36	88.5 Å²	88.5	19%	0.193	43%	0.429	C	S	.	.	S	Bend	trans	-68.2	-39.1	-179.8	-70.1	-61.7	0	0	0	113.1	R129 I134 R138	N120-R129 PolarHBondContact O-NH1 3.25Å; N120-R129 VanDerWaalsContact O-NH1 3.15Å; N120-I134 HydrophobicContact CB-CD1 4.26Å; N120-I134 WeakPolarHBondContact O-CD1 3.22Å; N120-R138 PolarHBondContact ND2-O 3.04Å; N120-R138 PolarHBondContact OD1-N 2.83Å; N120-R138 PolarHBondContact OD1-O 2.85Å
121	L	91.7	Very high	88.7	Confident	86 Å²	86	91.6 Å²	91.6	45%	0.45	45%	0.449	S	S	.	.	S	Bend	trans	-100.3	4.2	-173.3	-67	165.8	0	0	0	113	L128 R129 P131 I134	L121-L128 CarbonylContact O-C 3.53Å; L121-L128 WeakPolarHBondContact O-CA 3.28Å; L121-R129 PolarHBondContact O-N 3.03Å; L121-P131 HydrophobicContact CD2-CB 4.29Å; L121-P131 HydrophobicContact CD2-CG 3.94Å; L121-I134 HydrophobicContact CD2-CD1 3.5Å; L121-I134 HydrophobicContact CG-CD1 4.13Å
122	K	87.2	Confident	88.5	Confident	102 Å²	102	91.6 Å²	91.6	44%	0.443	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-128.1	137.1	174.1	-65.3	-177.2	176.7	-176.1	0	110.1	R127	K122-R127 CarbonylContact C-O 3.59Å; K122-R127 WeakPolarHBondContact CA-O 3.3Å
123	D	81.5	Confident	88.2	Confident	55 Å²	55	91 Å²	91	29%	0.294	47%	0.47	S	S	.	.			trans	-74.3	-179.5	168.5	61.3	18.7	0	0	0	111.2	E125 G126 R127 R129	D123-E125 PolarHBondContact O-N 2.9Å; D123-E125 PolarHBondContact OD1-N 3.05Å; D123-G126 PolarHBondContact O-N 2.97Å; D123-G126 PolarHBondContact OD1-N 3.15Å; D123-R127 PolarHBondContact N-O 3.15Å; D123-R127 WeakPolarHBondContact OD1-CA 3.48Å; D123-R127 WeakPolarHBondContact OD1-CB 3.27Å; D123-R127 PolarHBondContact OD1-N 3.13Å; D123-R127 WeakPolarHBondContact OD2-CB 3.38Å; D123-R129 HydrophobicContact CB-CG 4.24Å
124	E	78.5	Confident	87.8	Confident	156 Å²	156	89 Å²	89	73%	0.729	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.8	-179.3	-61.2	-134.1	150.9	0	0	112.1	G126	E124-G126 VanDerWaalsContact C-N 3.28Å
125	E	82.3	Confident	87.5	Confident	144 Å²	144	90.5 Å²	90.5	67%	0.673	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	1.6	170.7	-59	86	-174.8	0	0	113.8	D123 R127	D123-E125 PolarHBondContact O-N 2.9Å; D123-E125 PolarHBondContact OD1-N 3.05Å; E125-R127 VanDerWaalsContact C-N 3.31Å; E125-R127 HydrophobicContact CB-CG 4.35Å; E125-R127 PolarHBondContact O-N 3.44Å
126	G	82.7	Confident	87.5	Confident	42 Å²	42	88.5 Å²	88.5	43%	0.433	48%	0.478	S	S	.	.			trans	79.5	5.5	178.2	0	0	0	0	0	115.1	D123 E124	D123-G126 PolarHBondContact O-N 2.97Å; D123-G126 PolarHBondContact OD1-N 3.15Å; E124-G126 VanDerWaalsContact C-N 3.28Å
127	R	86	Confident	87.5	Confident	179 Å²	179	93.5 Å²	93.5	68%	0.675	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-75.6	147.8	177.5	-52.5	176	172.3	-176.4	-0.9	110.1	K122 D123 E125 R129	K122-R127 CarbonylContact C-O 3.59Å; K122-R127 WeakPolarHBondContact CA-O 3.3Å; D123-R127 PolarHBondContact N-O 3.15Å; D123-R127 WeakPolarHBondContact OD1-CA 3.48Å; D123-R127 WeakPolarHBondContact OD1-CB 3.27Å; D123-R127 PolarHBondContact OD1-N 3.13Å; D123-R127 WeakPolarHBondContact OD2-CB 3.38Å; E125-R127 VanDerWaalsContact C-N 3.31Å; E125-R127 HydrophobicContact CB-CG 4.35Å; E125-R127 PolarHBondContact O-N 3.44Å; R127-R129 PolarHBondContact O-N 3.37Å
128	L	88.4	Confident	87.5	Confident	147 Å²	147	99 Å²	99	77%	0.77	52%	0.521	S	S	*	.	B	Isolated β-bridge	trans	-66.1	125.2	179.4	-72.3	165.6	0	0	0	110.4	L121	L121-L128 CarbonylContact O-C 3.53Å; L121-L128 WeakPolarHBondContact O-CA 3.28Å
129	R	85.2	Confident	87.7	Confident	68 Å²	68	103.3 Å²	103.3	26%	0.257	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-84.2	141.4	169.2	-73.3	179.5	53.8	-159.7	-6.3	109.9	N120 L121 D123 R127 P131 T133	N120-R129 PolarHBondContact O-NH1 3.25Å; N120-R129 VanDerWaalsContact O-NH1 3.15Å; L121-R129 PolarHBondContact O-N 3.03Å; D123-R129 HydrophobicContact CB-CG 4.24Å; R127-R129 PolarHBondContact O-N 3.37Å; R129-P131 WeakPolarHBondContact O-CD 3.49Å; R129-T133 PolarHBondContact NH2-O 3.02Å
130	D	87.6	Confident	87.8	Confident	96 Å²	96	100.1 Å²	100.1	51%	0.513	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-62.7	121.6	170.6	178.8	-3.2	0	0	0	109.6	A132 T133	D130-A132 PolarHBondContact O-N 3.36Å; D130-A132 VanDerWaalsContact O-N 3.1Å; D130-A132 WeakPolarHBondContact OD1-CB 3.42Å; D130-A132 PolarHBondContact OD1-N 3.14Å; D130-T133 HydrophobicContact CB-CG2 4.04Å; D130-T133 WeakPolarHBondContact O-CB 3.39Å; D130-T133 PolarHBondContact O-N 3.3Å; D130-T133 PolarHBondContact O-OG1 2.87Å
131	P	87.7	Confident	87.9	Confident	88 Å²	88	103.1 Å²	103.1	57%	0.571	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-51.4	-31.6	176.6	-25.9	33.3	0	0	0	114	L121 R129 T133 I134	L121-P131 HydrophobicContact CD2-CB 4.29Å; L121-P131 HydrophobicContact CD2-CG 3.94Å; R129-P131 WeakPolarHBondContact O-CD 3.49Å; P131-T133 PolarHBondContact O-N 3.27Å; P131-I134 WeakPolarHBondContact O-CB 3.47Å; P131-I134 PolarHBondContact O-N 3.15Å
132	A	90	Very high	88.1	Confident	89 Å²	89	104.4 Å²	104.4	74%	0.736	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-66.1	-19.2	179	0	0	0	0	0	113.4	D130	D130-A132 PolarHBondContact O-N 3.36Å; D130-A132 VanDerWaalsContact O-N 3.1Å; D130-A132 WeakPolarHBondContact OD1-CB 3.42Å; D130-A132 PolarHBondContact OD1-N 3.14Å
133	T	87.2	Confident	88.4	Confident	75 Å²	75	105.7 Å²	105.7	46%	0.46	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-88	-2	178.4	67.4	0	0	0	0	113.5	R129 D130 P131 T135	R129-T133 PolarHBondContact NH2-O 3.02Å; D130-T133 HydrophobicContact CB-CG2 4.04Å; D130-T133 WeakPolarHBondContact O-CB 3.39Å; D130-T133 PolarHBondContact O-N 3.3Å; D130-T133 PolarHBondContact O-OG1 2.87Å; P131-T133 PolarHBondContact O-N 3.27Å; T133-T135 PolarHBondContact O-N 3.01Å
134	I	86.5	Confident	89.1	Confident	40 Å²	40	108.3 Å²	108.3	21%	0.205	58%	0.581	C	S	.	*			trans	-83.9	103.3	-177.7	-58.9	177.8	0	0	0	109.4	N120 L121 P131 L137	N120-I134 HydrophobicContact CB-CD1 4.26Å; N120-I134 WeakPolarHBondContact O-CD1 3.22Å; L121-I134 HydrophobicContact CD2-CD1 3.5Å; L121-I134 HydrophobicContact CG-CD1 4.13Å; P131-I134 WeakPolarHBondContact O-CB 3.47Å; P131-I134 PolarHBondContact O-N 3.15Å; I134-L137 HydrophobicContact CG2-CD2 4.31Å
135	T	89.7	Confident	89.8	Confident	132 Å²	132	103.4 Å²	103.4	81%	0.81	56%	0.559	S	S	*	*			trans	-85.5	-26	177.9	53.5	0	0	0	0	113.6	T133	T133-T135 PolarHBondContact O-N 3.01Å
136	T	91	Very high	90.3	Very high	82 Å²	82	103.5 Å²	103.5	50%	0.503	56%	0.564	S	S	.	*	S	Bend	trans	-148.1	140.7	-178.9	60.2	0	0	0	0	110.3
137	L	92.4	Very high	90.7	Very high	149 Å²	149	106.4 Å²	106.4	78%	0.78	57%	0.569	S	S	*	*			trans	-78.1	138.5	171.8	-63.4	177.5	0	0	0	111	I134	I134-L137 HydrophobicContact CG2-CD2 4.31Å
138	R	90.1	Very high	91	Very high	158 Å²	158	101.1 Å²	101.1	60%	0.596	55%	0.553	S	S	*	*			trans	-120.6	147.5	177	-58.6	-177.9	-176.4	-178.6	0.9	109.8	N120	N120-R138 PolarHBondContact ND2-O 3.04Å; N120-R138 PolarHBondContact OD1-N 2.83Å; N120-R138 PolarHBondContact OD1-O 2.85Å
139	V	94.2	Very high	91.4	Very high	127 Å²	127	95.9 Å²	95.9	77%	0.77	53%	0.527	S	S	*	.			trans	-95.7	130	170.3	-179.9	0	0	0	0	107.7
140	P	92.2	Very high	91.9	Very high	52 Å²	52	96 Å²	96	34%	0.338	53%	0.53	S	S	.	.			trans	-57.8	143.4	175.8	-25.3	34.5	0	0	0	112.1	P116 E117 Y119	P116-P140 HydrophobicContact CB-CB 4.31Å; E117-P140 CarbonylContact O-C 3.55Å; E117-P140 WeakPolarHBondContact O-CA 3.39Å; E117-P140 WeakPolarHBondContact O-CB 3.31Å; Y119-P140 HydrophobicContact CD1-CG 4.05Å; Y119-P140 HydrophobicContact CE1-CG 4.19Å
141	V	94.6	Very high	92.4	Very high	98 Å²	98	92.6 Å²	92.6	59%	0.594	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	143.3	178.9	-175.6	0	0	0	0	109.1	E117 R143	E117-V141 PolarHBondContact N-O 3.27Å; E117-V141 PolarHBondContact O-N 3.19Å; V141-R143 PolarHBondContact O-N 3.41Å
142	L	95	Very high	92.9	Very high	114 Å²	114	91.1 Å²	91.1	60%	0.597	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.3	174.5	-68.2	173.9	0	0	0	110.1	K114 R115 P116	K114-L142 HydrophobicContact CB-CB 4.42Å; R115-L142 WeakPolarHBondContact O-CA 3.3Å; P116-L142 HydrophobicContact CB-CD2 4.37Å
143	R	93.4	Very high	93.2	Very high	128 Å²	128	90.6 Å²	90.6	48%	0.483	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	148.8	171.5	-64.2	-140.8	-165.3	-162.3	6.3	111.2	K114 R115 E117 V141	K114-R143 CarbonylContact C-O 3.49Å; K114-R143 VanDerWaalsContact CA-O 3.24Å; K114-R143 WeakPolarHBondContact CA-O 3.39Å; R115-R143 PolarHBondContact N-O 2.86Å; R115-R143 PolarHBondContact O-N 3.36Å; E117-R143 HydrophobicContact CB-CG 4.31Å; E117-R143 HydrophobicContact CG-CG 4.43Å; E117-R143 WeakPolarHBondContact OE2-CD 2.98Å; E117-R143 WeakPolarHBondContact OE2-CG 3.37Å; E117-R143 IonicContact OE2-NE 2.88Å; E117-R143 PolarHBondContact OE2-NE 3.34Å; V141-R143 PolarHBondContact O-N 3.41Å
144	P	95.6	Very high	93.7	Very high	110 Å²	110	92.5 Å²	92.5	71%	0.714	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.1	144.2	171.6	-22.3	33.2	0	0	0	111.8	D113	D113-P144 CarbonylContact O-C 3.59Å; D113-P144 WeakPolarHBondContact O-CA 3.16Å
145	M	93.2	Very high	94.2	Very high	53 Å²	53	93.7 Å²	93.7	26%	0.261	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	169.6	171	63.7	175.3	-80.3	0	0	109.6	D113 R115 M148	D113-M145 WeakPolarHBondContact O-CG 3.41Å; D113-M145 PolarHBondContact O-N 3.41Å; R115-M145 HydrophobicContact CB-CG 4.49Å; R115-M145 HydrophobicContact CB-SD 3.73Å; R115-M145 HydrophobicContact CG-CB 4.22Å; R115-M145 HydrophobicContact CG-SD 4.28Å; M145-M148 HydrophobicContact CE-CB 3.86Å; M145-M148 HydrophobicContact CE-CE 4.05Å; M145-M148 HydrophobicContact CE-SD 4.25Å
146	D	92.7	Very high	94.6	Very high	147 Å²	147	90.6 Å²	90.6	79%	0.786	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.2	139.7	170.4	-62	-36.6	0	0	0	110.4	M148	D146-M148 PolarHBondContact O-N 3.47Å
147	L	91.7	Very high	94.9	Very high	103 Å²	103	86.8 Å²	86.8	54%	0.539	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	121.9	-178.9	-176.2	69.9	0	0	0	109.9	E111 D113	E111-L147 HydrophobicContact CB-CD1 3.86Å; E111-L147 HydrophobicContact CG-CD1 4.21Å; D113-L147 HydrophobicContact CB-CD1 4.32Å
148	M	93.5	Very high	95	Very high	67 Å²	67	81.2 Å²	81.2	33%	0.33	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.8	176.5	-174.8	175.8	62.3	0	0	109.3	E111 R112 M145 D146 E150	E111-M148 CarbonylContact C-O 3.57Å; E111-M148 WeakPolarHBondContact CA-O 3.37Å; R112-M148 PolarHBondContact N-O 3.29Å; R112-M148 PolarHBondContact O-N 2.76Å; M145-M148 HydrophobicContact CE-CB 3.86Å; M145-M148 HydrophobicContact CE-CE 4.05Å; M145-M148 HydrophobicContact CE-SD 4.25Å; D146-M148 PolarHBondContact O-N 3.47Å; M148-E150 HydrophobicContact CE-CG 3.95Å; M148-E150 WeakPolarHBondContact CE-OE1 3.29Å; M148-E150 HydrophobicContact CG-CG 4.44Å
149	V	96	Very high	95.1	Very high	38 Å²	38	81.6 Å²	81.6	23%	0.23	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.5	176.1	-173.7	0	0	0	0	108.2	Y59 V109 E111	Y59-V149 HydrophobicContact CD1-CG1 4.12Å; Y59-V149 HydrophobicContact CD2-CG2 3.91Å; Y59-V149 HydrophobicContact CE1-CG1 3.6Å; Y59-V149 HydrophobicContact CE1-CG2 4.34Å; Y59-V149 HydrophobicContact CE2-CB 4.49Å; Y59-V149 HydrophobicContact CE2-CG1 4.24Å; Y59-V149 HydrophobicContact CE2-CG2 3.44Å; Y59-V149 VanDerWaalsContact CE2-CG2 3.44Å; V109-V149 HydrophobicContact CG1-CG1 3.63Å; E111-V149 HydrophobicContact CG-CG2 4.44Å
150	E	95.6	Very high	95.2	Very high	69 Å²	69	76.6 Å²	76.6	32%	0.322	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130	178.1	-68.5	179.3	175.6	0	0	109.8	V109 S110 R112 M148	V109-E150 WeakPolarHBondContact CA-O 3.31Å; S110-E150 PolarHBondContact N-O 2.92Å; S110-E150 PolarHBondContact O-N 2.97Å; R112-E150 IonicContact NH1-OE1 2.69Å; M148-E150 HydrophobicContact CE-CG 3.95Å; M148-E150 WeakPolarHBondContact CE-OE1 3.29Å; M148-E150 HydrophobicContact CG-CG 4.44Å
151	A	98	Very high	95.3	Very high	26 Å²	26	74.8 Å²	74.8	22%	0.215	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.8	169.8	0	0	0	0	0	109.9	F62 K108 V109	F62-A151 HydrophobicContact CB-CB 4.02Å; F62-A151 HydrophobicContact CD1-CB 3.27Å; F62-A151 HydrophobicContact CD2-CB 4.39Å; F62-A151 HydrophobicContact CE1-CB 3.73Å; F62-A151 HydrophobicContact CG-CB 3.65Å; F62-A151 HydrophobicContact CZ-CB 4.44Å; K108-A151 CarbonylContact O-C 3.22Å; K108-A151 WeakPolarHBondContact O-CA 3.47Å; V109-A151 HydrophobicContact CG2-CB 4.25Å
152	T	97.5	Very high	95.3	Very high	56 Å²	56	72.9 Å²	72.9	34%	0.344	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.6	-177.6	52.9	0	0	0	0	111.3	W107 K108 R154	W107-T152 WeakPolarHBondContact CA-O 3.02Å; W107-T152 VanDerWaalsContact CE3-C 3.48Å; K108-T152 PolarHBondContact N-O 3.07Å; K108-T152 PolarHBondContact O-N 3.04Å; K108-T152 PolarHBondContact O-OG1 3.03Å; T152-R154 PolarHBondContact O-N 3.39Å
153	P	97.2	Very high	95.3	Very high	78 Å²	78	69.5 Å²	69.5	51%	0.506	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.9	173	29	-29.2	0	0	0	108.7	W107	W107-P153 HydrophobicContact CD2-CB 4.3Å; W107-P153 HydrophobicContact CE3-CB 4.1Å; W107-P153 HydrophobicContact CH2-CB 3.75Å; W107-P153 HydrophobicContact CH2-CG 3.92Å; W107-P153 HydrophobicContact CZ2-CB 3.91Å; W107-P153 HydrophobicContact CZ3-CB 3.87Å; W107-P153 VanDerWaalsContact CZ3-CD 3.41Å; W107-P153 HydrophobicContact CZ3-CG 3.96Å
154	R	97	Very high	95.4	Very high	115 Å²	115	67.4 Å²	67.4	43%	0.434	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-40.5	-178.9	-74.1	-110.1	56.9	-165.5	-1.2	112.6	F95 L106 K108 T152	F95-R154 HydrophobicContact CE1-CG 4.49Å; L106-R154 HydrophobicContact CD2-CB 4.34Å; L106-R154 HydrophobicContact CG-CB 4.31Å; L106-R154 PolarHBondContact O-N 2.97Å; K108-R154 HydrophobicContact CB-CG 3.56Å; T152-R154 PolarHBondContact O-N 3.39Å
155	R	97.8	Very high	95.5	Very high	65 Å²	65	62.3 Å²	62.3	25%	0.245	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.3	-175.2	-57.8	-70	-179.1	-106.6	6.1	109.9	K105 L106 F157 E191 T193	K105-R155 WeakPolarHBondContact CA-O 3.28Å; L106-R155 HydrophobicContact CB-CB 3.96Å; L106-R155 HydrophobicContact CB-CG 4.47Å; L106-R155 HydrophobicContact CD2-CB 4.47Å; L106-R155 HydrophobicContact CD2-CG 4.1Å; L106-R155 PolarHBondContact N-O 2.83Å; L106-R155 PolarHBondContact O-N 3.46Å; R155-F157 HydrophobicContact CB-CE2 3.77Å; R155-F157 HydrophobicContact CB-CZ 3.79Å; R155-F157 HydrophobicContact CG-CZ 4.35Å; R155-E191 IonicContact CZ-OE2 3.12Å; R155-E191 IonicContact NE-OE2 2.64Å; R155-E191 PolarHBondContact NE-OE2 2.87Å; R155-E191 IonicContact NH2-OE2 2.66Å; R155-E191 PolarHBondContact NH2-OE2 3.46Å; R155-T193 HydrophobicContact CB-CG2 3.76Å; R155-T193 HydrophobicContact CG-CG2 4.19Å
156	V	97.9	Very high	95.7	Very high	68 Å²	68	60.8 Å²	60.8	41%	0.412	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	118.7	175.7	-176.6	0	0	0	0	107	T103 K105 A158 T193	T103-V156 HydrophobicContact CG2-CG1 3.46Å; T103-V156 VanDerWaalsContact CG2-CG1 3.46Å; K105-V156 HydrophobicContact CD-CG2 4.49Å; K105-V156 HydrophobicContact CG-CG1 4.26Å; K105-V156 HydrophobicContact CG-CG2 4.2Å; V156-A158 HydrophobicContact CG1-CB 4.41Å; V156-T193 WeakPolarHBondContact O-CB 3.15Å
157	F	98	Very high	96	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.009	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	100.6	178.7	-49.7	-93.1	0	0	0	107.5	L97 V104 L106 R155 Y177 W188 N189 F190 T193	L97-F157 HydrophobicContact CD2-CE2 4.31Å; V104-F157 HydrophobicContact CB-CB 4.22Å; V104-F157 HydrophobicContact CB-CD2 4.26Å; V104-F157 HydrophobicContact CG1-CD2 4.37Å; V104-F157 PolarHBondContact N-O 2.97Å; V104-F157 PolarHBondContact O-N 2.75Å; L106-F157 HydrophobicContact CB-CE2 4.04Å; R155-F157 HydrophobicContact CB-CE2 3.77Å; R155-F157 HydrophobicContact CB-CZ 3.79Å; R155-F157 HydrophobicContact CG-CZ 4.35Å; F157-Y177 VanDerWaalsContact CB-OH 3.28Å; F157-Y177 WeakPolarHBondContact CB-OH 3.4Å; F157-Y177 HydrophobicContact CD1-CE1 4.28Å; F157-Y177 WeakPolarHBondContact CD1-OH 3.29Å; F157-Y177 HydrophobicContact CD2-CE1 4.27Å; F157-Y177 WeakPolarHBondContact CD2-OH 3.2Å; F157-Y177 HydrophobicContact CE1-CE1 4.07Å; F157-Y177 HydrophobicContact CE2-CE1 4.04Å; F157-Y177 HydrophobicContact CG-CE1 4.4Å; F157-Y177 WeakPolarHBondContact CG-OH 3.5Å; F157-Y177 AromaticContact CZ-CE1 3.94Å; F157-Y177 HydrophobicContact CZ-CE1 3.94Å; F157-W188 HydrophobicContact CB-CD2 4.39Å; F157-W188 HydrophobicContact CB-CE3 4.02Å; F157-W188 HydrophobicContact CB-CH2 3.84Å; F157-W188 HydrophobicContact CB-CZ2 4.22Å; F157-W188 HydrophobicContact CB-CZ3 3.75Å; F157-W188 HydrophobicContact CD1-CD2 4.24Å; F157-W188 AromaticContact CD1-CE3 3.6Å; F157-W188 HydrophobicContact CD1-CE3 3.6Å; F157-W188 AromaticContact CD1-CZ3 3.97Å; F157-W188 HydrophobicContact CD1-CZ3 3.97Å; F157-W188 HydrophobicContact CG-CE3 4.22Å; F157-W188 HydrophobicContact CG-CZ3 4.36Å; F157-N189 WeakPolarHBondContact CE1-O 3.46Å; F157-F190 WeakPolarHBondContact CZ-O 3.34Å; F157-T193 HydrophobicContact CD1-CG2 3.89Å; F157-T193 HydrophobicContact CE1-CG2 3.77Å; F157-T193 HydrophobicContact CG-CG2 4.48Å; F157-T193 HydrophobicContact CZ-CG2 4.29Å
158	A	94.5	Very high	96.3	Very high	32 Å²	32	49.5 Å²	49.5	26%	0.264	27%	0.265	S	S	.	.			trans	-122.9	169	-172.5	0	0	0	0	0	111.1	T103 V156 A160	T103-A158 HydrophobicContact CG2-CB 4.12Å; V156-A158 HydrophobicContact CG1-CB 4.41Å; A158-A160 VanDerWaalsContact C-N 3.25Å; A158-A160 PolarHBondContact O-N 2.86Å; A158-A160 VanDerWaalsContact O-N 3.16Å
159	N	92	Very high	96.6	Very high	165 Å²	165	46.6 Å²	46.6	88%	0.882	25%	0.252	S	S	*	.	S	Bend	trans	62.1	19.6	169.1	-56	-46.2	0	0	0	116.5
160	A	95.1	Very high	96.7	Very high	23 Å²	23	46.1 Å²	46.1	19%	0.19	25%	0.249	C	C	.	.			trans	-99.8	-17.4	174.3	0	0	0	0	0	114	A158 N186 W188 S196	A158-A160 VanDerWaalsContact C-N 3.25Å; A158-A160 PolarHBondContact O-N 2.86Å; A158-A160 VanDerWaalsContact O-N 3.16Å; A160-N186 PolarHBondContact O-ND2 3.32Å; A160-N186 VanDerWaalsContact O-ND2 3.1Å; A160-W188 HydrophobicContact CB-CH2 3.32Å; A160-W188 HydrophobicContact CB-CZ2 3.21Å; A160-S196 WeakPolarHBondContact CB-OG 3.41Å
161	H	95.7	Very high	96.8	Very high	13 Å²	13	43 Å²	43	6%	0.06	24%	0.235	C	C	.	.			trans	-108.3	130.9	-176.5	-76	-75	0	0	0	111.6	I165 S179 D181 N186	H161-I165 HydrophobicContact CB-CD1 4.27Å; H161-I165 HydrophobicContact CB-CG1 3.92Å; H161-S179 PolarHBondContact CE1-O 2.78Å; H161-S179 VanDerWaalsContact CE1-O 3.32Å; H161-S179 WeakPolarHBondContact NE2-CB 3.39Å; H161-S179 PolarHBondContact NE2-O 3.46Å; H161-S179 PolarHBondContact NE2-OG 2.82Å; H161-D181 HydrophobicContact CB-CB 4.4Å; H161-D181 IonicContact CE1-OD2 2.75Å; H161-D181 IonicContact CG-OD2 3.19Å; H161-D181 VanDerWaalsContact ND1-CB 3.32Å; H161-D181 WeakPolarHBondContact ND1-CB 3.45Å; H161-D181 IonicContact ND1-OD2 3.93Å; H161-D181 PolarHBondContact ND1-OD2 3.01Å; H161-N186 PolarHBondContact CE1-ND2 2.84Å; H161-N186 PolarHBondContact NE2-ND2 2.76Å
162	T	93.6	Very high	96.8	Very high	59 Å²	59	43.4 Å²	43.4	36%	0.362	24%	0.236	S	C	.	.	S	Bend	trans	-86.9	-35.5	173.3	-58.7	0	0	0	0	110.2	K102 D181	K102-T162 PolarHBondContact NZ-O 3.42Å; T162-D181 PolarHBondContact N-OD2 2.76Å
163	Y	94.9	Very high	96.7	Very high	42 Å²	42	43.6 Å²	43.6	17%	0.165	24%	0.235	C	C	.	.	S	Bend	trans	-105.6	-171	-176.2	-51.7	-79.4	0	0	0	111.3	K102 D181 D182 L183 K203 M207	K102-Y163 PolarHBondContact NZ-O 2.77Å; Y163-D181 PolarHBondContact N-OD2 2.87Å; Y163-D182 HydrophobicContact CG-CB 4.5Å; Y163-L183 HydrophobicContact CD2-CB 4.08Å; Y163-L183 HydrophobicContact CD2-CD1 4.16Å; Y163-L183 HydrophobicContact CD2-CG 4.31Å; Y163-L183 HydrophobicContact CE1-CD1 4.15Å; Y163-L183 HydrophobicContact CE2-CB 4.07Å; Y163-L183 HydrophobicContact CE2-CD1 3.63Å; Y163-L183 HydrophobicContact CE2-CG 4.23Å; Y163-K203 PolarHBondContact OH-NZ 3.15Å; Y163-M207 HydrophobicContact CE1-CE 4.23Å; Y163-M207 PolarHBondContact OH-SD 2.56Å
164	H	96	Very high	96.6	Very high	85 Å²	85	46.5 Å²	46.5	39%	0.394	24%	0.236	S	C	.	.			trans	-82.1	125	-175.3	-61.8	-73.3	0	0	0	110.8	D101 N166 D181 D182	D101-H164 HydrophobicContact CB-CB 4.47Å; D101-H164 IonicContact OD1-ND1 2.97Å; D101-H164 IonicContact OD2-CE1 4Å; D101-H164 PolarHBondContact OD2-CE1 3.02Å; D101-H164 IonicContact OD2-CG 3.25Å; D101-H164 IonicContact OD2-ND1 3.78Å; D101-H164 PolarHBondContact OD2-ND1 2.84Å; H164-N166 PolarHBondContact O-N 3.31Å; H164-N166 VanDerWaalsContact O-N 3.15Å; H164-D181 VanDerWaalsContact O-CA 3.22Å; H164-D181 WeakPolarHBondContact O-CA 3.28Å; H164-D181 WeakPolarHBondContact O-CB 3.3Å; H164-D182 IonicContact CD2-OD2 3.79Å; H164-D182 PolarHBondContact N-OD2 3.21Å
165	I	98.3	Very high	96.6	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.241	C	C	.	.			trans	-65.5	115.8	174.9	-62.1	169.5	0	0	0	109.1	N82 T99 D101 V104 H161 I168 A180	N82-I165 PolarHBondContact ND2-O 3.36Å; T99-I165 HydrophobicContact CG2-CG2 4.05Å; D101-I165 WeakPolarHBondContact O-CG1 3.41Å; D101-I165 PolarHBondContact O-N 3.24Å; V104-I165 HydrophobicContact CG2-CD1 4.17Å; H161-I165 HydrophobicContact CB-CD1 4.27Å; H161-I165 HydrophobicContact CB-CG1 3.92Å; I165-I168 HydrophobicContact CG2-CG2 4.35Å; I165-A180 CarbonylContact C-O 3.55Å; I165-A180 WeakPolarHBondContact CA-O 3.27Å
166	N	97.2	Very high	96.6	Very high	22 Å²	22	44.1 Å²	44.1	12%	0.118	23%	0.234	C	C	.	.			trans	-99.2	-26	177.5	60.1	63.8	0	0	0	112.6	H164 A180 D181 I214 T215	H164-N166 PolarHBondContact O-N 3.31Å; H164-N166 VanDerWaalsContact O-N 3.15Å; N166-A180 PolarHBondContact N-O 3.06Å; N166-D181 PolarHBondContact ND2-O 2.82Å; N166-D181 VanDerWaalsContact ND2-O 3.1Å; N166-I214 PolarHBondContact ND2-O 3.24Å; N166-T215 PolarHBondContact OD1-O 2.88Å
167	S	98.4	Very high	96.6	Very high	10 Å²	10	40.9 Å²	40.9	7%	0.07	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.4	-174.5	-54.3	0	0	0	0	112.9	S179 A180 A216 A217	S167-S179 CarbonylContact O-C 3.59Å; S167-S179 WeakPolarHBondContact O-CA 3.41Å; S167-A180 PolarHBondContact N-O 2.85Å; S167-A180 PolarHBondContact O-N 3.12Å; S167-A216 VanDerWaalsContact OG-CA 3.29Å; S167-A216 WeakPolarHBondContact OG-CA 3.34Å; S167-A217 WeakPolarHBondContact CB-O 2.94Å; S167-A217 PolarHBondContact OG-N 2.86Å
168	I	98.7	Very high	96.6	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.3	161.6	49.9	167.2	0	0	0	108.5	K83 R85 L97 T99 V104 I165 M178	K83-I168 HydrophobicContact CB-CD1 4.15Å; K83-I168 HydrophobicContact CB-CG1 3.72Å; R85-I168 HydrophobicContact CB-CD1 4.23Å; R85-I168 HydrophobicContact CG-CD1 4.08Å; R85-I168 HydrophobicContact CG-CG1 3.89Å; R85-I168 WeakPolarHBondContact CG-O 3.38Å; R85-I168 PolarHBondContact NE-O 3.01Å; L97-I168 HydrophobicContact CB-CD1 3.74Å; T99-I168 HydrophobicContact CG2-CD1 3.98Å; T99-I168 HydrophobicContact CG2-CG1 4.06Å; T99-I168 HydrophobicContact CG2-CG2 3.97Å; V104-I168 HydrophobicContact CG1-CG2 4.39Å; V104-I168 HydrophobicContact CG2-CG2 3.93Å; I165-I168 HydrophobicContact CG2-CG2 4.35Å; I168-M178 VanDerWaalsContact CA-O 3.29Å; I168-M178 WeakPolarHBondContact CA-O 3.43Å
169	S	98.6	Very high	96.8	Very high	7 Å²	7	39.4 Å²	39.4	5%	0.049	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	128.7	179.6	-171	0	0	0	0	110.2	Y177 M178 F219	S169-Y177 CarbonylContact O-C 3.57Å; S169-Y177 VanDerWaalsContact O-CA 3.31Å; S169-Y177 WeakPolarHBondContact O-CA 3.39Å; S169-Y177 VanDerWaalsContact O-CB 3.31Å; S169-Y177 WeakPolarHBondContact O-CB 3.34Å; S169-M178 PolarHBondContact N-O 2.99Å; S169-M178 PolarHBondContact O-N 2.95Å; S169-F219 WeakPolarHBondContact O-CD2 3.18Å; S169-F219 PolarHBondContact OG-N 3.25Å
170	V	98.2	Very high	97.1	Very high	28 Å²	28	31.5 Å²	31.5	17%	0.17	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	136.1	178.2	171.8	0	0	0	0	108.8	R85 L87 L97 F190	R85-V170 HydrophobicContact CB-CG2 4.3Å; L87-V170 HydrophobicContact CD1-CG2 4.19Å; L87-V170 HydrophobicContact CG-CG2 4.4Å; L97-V170 HydrophobicContact CD1-CG2 4.2Å; V170-F190 HydrophobicContact CG1-CE2 4.46Å; V170-F190 HydrophobicContact CG1-CZ 3.93Å; V170-F190 HydrophobicContact CG2-CZ 4.14Å
171	N	98.2	Very high	97.3	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	15%	0.151	C	C	.	.			trans	-81.3	152.3	177.5	-162.3	-10.7	0	0	0	110.8	D173 Y174 T176 F219 C224	N171-D173 WeakPolarHBondContact CB-OD1 3.43Å; N171-D173 PolarHBondContact ND2-OD2 2.84Å; N171-D173 PolarHBondContact O-N 2.88Å; N171-Y174 PolarHBondContact O-N 2.79Å; N171-T176 WeakPolarHBondContact CB-O 3.36Å; N171-T176 VanDerWaalsContact CB-OG1 3.28Å; N171-T176 WeakPolarHBondContact CB-OG1 3.46Å; N171-T176 PolarHBondContact N-O 2.76Å; N171-T176 PolarHBondContact ND2-OG1 2.89Å; N171-F219 HydrophobicContact CB-CD2 3.89Å; N171-F219 HydrophobicContact CB-CE2 3.86Å; N171-F219 HydrophobicContact CB-CG 4.28Å; N171-F219 HydrophobicContact CB-CZ 4.26Å; N171-C224 PolarHBondContact ND2-O 3.36Å; N171-C224 WeakPolarHBondContact OD1-CA 3.42Å; N171-C224 PolarHBondContact OD1-O 3.18Å
172	S	97.3	Very high	97.3	Very high	34 Å²	34	31.5 Å²	31.5	24%	0.238	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-2.4	175.5	57.6	0	0	0	0	114	Y174 P221 C224	S172-Y174 VanDerWaalsContact C-N 3.33Å; S172-Y174 VanDerWaalsContact O-CD2 3.28Å; S172-Y174 WeakPolarHBondContact O-CD2 3.27Å; S172-Y174 VanDerWaalsContact O-CE2 3.27Å; S172-Y174 WeakPolarHBondContact O-CE2 3.22Å; S172-P221 WeakPolarHBondContact CB-O 3.38Å; S172-C224 VanDerWaalsContact OG-CA 3.28Å; S172-C224 WeakPolarHBondContact OG-CA 3.42Å; S172-C224 PolarHBondContact OG-N 2.94Å; S172-C224 VanDerWaalsContact OG-N 3.14Å
173	D	96.8	Very high	97.5	Very high	60 Å²	60	28.8 Å²	28.8	32%	0.321	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.1	174.1	68.1	9.6	0	0	0	113.9	N171 E175 T176 C224	N171-D173 WeakPolarHBondContact CB-OD1 3.43Å; N171-D173 PolarHBondContact ND2-OD2 2.84Å; N171-D173 PolarHBondContact O-N 2.88Å; D173-E175 PolarHBondContact O-N 3.44Å; D173-E175 VanDerWaalsContact O-N 3.14Å; D173-E175 PolarHBondContact OD1-N 3.2Å; D173-T176 VanDerWaalsContact CG-OG1 3.29Å; D173-T176 PolarHBondContact OD1-N 2.7Å; D173-T176 PolarHBondContact OD1-OG1 2.99Å; D173-T176 PolarHBondContact OD2-OG1 3.29Å; D173-C224 HydrophobicContact CB-CB 4.03Å
174	Y	94.1	Very high	97.6	Very high	138 Å²	138	29.8 Å²	29.8	54%	0.541	14%	0.144	S	C	.	.	S	Bend	trans	60.5	12.7	-177.4	-55.1	-95.4	0	0	0	115.3	P88 N171 S172	P88-Y174 HydrophobicContact CB-CD1 3.77Å; P88-Y174 HydrophobicContact CB-CE1 3.37Å; P88-Y174 HydrophobicContact CG-CD1 3.68Å; P88-Y174 HydrophobicContact CG-CE1 3.37Å; N171-Y174 PolarHBondContact O-N 2.79Å; S172-Y174 VanDerWaalsContact C-N 3.33Å; S172-Y174 VanDerWaalsContact O-CD2 3.28Å; S172-Y174 WeakPolarHBondContact O-CD2 3.27Å; S172-Y174 VanDerWaalsContact O-CE2 3.27Å; S172-Y174 WeakPolarHBondContact O-CE2 3.22Å
175	E	96.6	Very high	97.7	Very high	114 Å²	114	25.8 Å²	25.8	53%	0.533	13%	0.125	S	C	.	.	S	Bend	trans	-123.2	-29.6	-177.5	-174.4	172.1	-167.9	0	0	111.9	D173 N189 F190	D173-E175 PolarHBondContact O-N 3.44Å; D173-E175 VanDerWaalsContact O-N 3.14Å; D173-E175 PolarHBondContact OD1-N 3.2Å; E175-N189 VanDerWaalsContact CG-ND2 3.3Å; E175-N189 WeakPolarHBondContact CG-ND2 3.27Å; E175-N189 WeakPolarHBondContact O-CA 3.34Å; E175-N189 PolarHBondContact OE1-ND2 2.88Å; E175-F190 WeakPolarHBondContact O-CD2 3.3Å; E175-F190 PolarHBondContact O-N 2.97Å
176	T	98	Very high	97.7	Very high	17 Å²	17	25.9 Å²	25.9	10%	0.104	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	162	-176	69.6	0	0	0	0	113.8	N171 D173 W188 F190	N171-T176 WeakPolarHBondContact CB-O 3.36Å; N171-T176 VanDerWaalsContact CB-OG1 3.28Å; N171-T176 WeakPolarHBondContact CB-OG1 3.46Å; N171-T176 PolarHBondContact N-O 2.76Å; N171-T176 PolarHBondContact ND2-OG1 2.89Å; D173-T176 VanDerWaalsContact CG-OG1 3.29Å; D173-T176 PolarHBondContact OD1-N 2.7Å; D173-T176 PolarHBondContact OD1-OG1 2.99Å; D173-T176 PolarHBondContact OD2-OG1 3.29Å; T176-W188 CarbonylContact C-O 3.43Å; T176-W188 WeakPolarHBondContact CA-O 3.39Å; T176-W188 WeakPolarHBondContact CB-O 3.25Å; T176-F190 WeakPolarHBondContact O-CE2 3.41Å; T176-F190 WeakPolarHBondContact O-CZ 3.42Å
177	Y	98.6	Very high	97.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	165.1	168	79.1	-85.5	0	0	0	109	L97 V104 F157 S169 W188 F190	L97-Y177 HydrophobicContact CD1-CD1 4.1Å; L97-Y177 HydrophobicContact CD1-CD2 3.6Å; L97-Y177 HydrophobicContact CD1-CE1 4.43Å; L97-Y177 HydrophobicContact CD1-CE2 4.01Å; L97-Y177 HydrophobicContact CD1-CG 3.67Å; V104-Y177 HydrophobicContact CG1-CE2 4.09Å; V104-Y177 HydrophobicContact CG2-CE2 4.38Å; F157-Y177 VanDerWaalsContact CB-OH 3.28Å; F157-Y177 WeakPolarHBondContact CB-OH 3.4Å; F157-Y177 HydrophobicContact CD1-CE1 4.28Å; F157-Y177 WeakPolarHBondContact CD1-OH 3.29Å; F157-Y177 HydrophobicContact CD2-CE1 4.27Å; F157-Y177 WeakPolarHBondContact CD2-OH 3.2Å; F157-Y177 HydrophobicContact CE1-CE1 4.07Å; F157-Y177 HydrophobicContact CE2-CE1 4.04Å; F157-Y177 HydrophobicContact CG-CE1 4.4Å; F157-Y177 WeakPolarHBondContact CG-OH 3.5Å; F157-Y177 AromaticContact CZ-CE1 3.94Å; F157-Y177 HydrophobicContact CZ-CE1 3.94Å; S169-Y177 CarbonylContact O-C 3.57Å; S169-Y177 VanDerWaalsContact O-CA 3.31Å; S169-Y177 WeakPolarHBondContact O-CA 3.39Å; S169-Y177 VanDerWaalsContact O-CB 3.31Å; S169-Y177 WeakPolarHBondContact O-CB 3.34Å; Y177-W188 HydrophobicContact CD1-CB 3.69Å; Y177-W188 HydrophobicContact CD1-CG 4.46Å; Y177-W188 HydrophobicContact CE1-CB 3.27Å; Y177-W188 AromaticContact CE1-CG 3.79Å; Y177-W188 HydrophobicContact CE1-CG 3.79Å; Y177-W188 HydrophobicContact CE2-CB 4.24Å; Y177-W188 AromaticContact CE2-CD1 3.63Å; Y177-W188 HydrophobicContact CE2-CG 4.01Å; Y177-W188 HydrophobicContact CG-CB 4.33Å; Y177-W188 AromaticContact CZ-CD1 3.6Å; Y177-W188 AromaticContact CZ-CG 3.5Å; Y177-W188 PolarHBondContact N-O 2.91Å; Y177-W188 PolarHBondContact O-N 2.94Å; Y177-F190 AromaticContact CD1-CD1 3.64Å; Y177-F190 HydrophobicContact CD1-CD1 3.64Å; Y177-F190 AromaticContact CD1-CE1 3.41Å; Y177-F190 HydrophobicContact CD1-CE1 3.41Å; Y177-F190 VanDerWaalsContact CD1-CE1 3.41Å; Y177-F190 HydrophobicContact CD1-CZ 4.12Å; Y177-F190 HydrophobicContact CE1-CD1 4.18Å; Y177-F190 HydrophobicContact CE1-CE1 4.28Å; Y177-F190 AromaticContact CG-CE1 3.91Å; Y177-F190 HydrophobicContact CG-CE1 3.91Å; Y177-F190 HydrophobicContact CG-CZ 4.36Å
178	M	98.2	Very high	97.7	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.3	173.8	70.1	178.7	-178.6	0	0	111.5	I168 S169 I185 N186 A217 F219 F227	I168-M178 VanDerWaalsContact CA-O 3.29Å; I168-M178 WeakPolarHBondContact CA-O 3.43Å; S169-M178 PolarHBondContact N-O 2.99Å; S169-M178 PolarHBondContact O-N 2.95Å; M178-I185 HydrophobicContact CB-CG2 4.03Å; M178-I185 HydrophobicContact CG-CG2 4.33Å; M178-I185 HydrophobicContact SD-CG2 3.82Å; M178-N186 CarbonylContact C-O 3.58Å; M178-N186 WeakPolarHBondContact CA-O 3.42Å; M178-N186 WeakPolarHBondContact CB-O 3.37Å; M178-A217 VanDerWaalsContact CE-C 3.44Å; M178-A217 HydrophobicContact CE-CB 3.75Å; M178-F219 HydrophobicContact CB-CD2 4.31Å; M178-F219 HydrophobicContact CB-CE2 3.5Å; M178-F219 VanDerWaalsContact CB-CE2 3.5Å; M178-F219 HydrophobicContact CB-CZ 3.96Å; M178-F219 HydrophobicContact CE-CD2 4.2Å; M178-F219 HydrophobicContact CE-CG 4.34Å; M178-F219 VanDerWaalsContact CE-N 3.34Å; M178-F219 HydrophobicContact CG-CD2 3.72Å; M178-F219 HydrophobicContact CG-CE2 3.4Å; M178-F219 VanDerWaalsContact CG-CE2 3.4Å; M178-F219 HydrophobicContact CG-CZ 4.07Å; M178-F219 HydrophobicContact SD-CD2 4Å; M178-F219 HydrophobicContact SD-CE1 4.39Å; M178-F219 HydrophobicContact SD-CE2 3.82Å; M178-F219 HydrophobicContact SD-CG 4.38Å; M178-F219 HydrophobicContact SD-CZ 3.99Å; M178-F227 HydrophobicContact CE-CB 4.18Å; M178-F227 HydrophobicContact SD-CB 4.16Å; M178-F227 HydrophobicContact SD-CD2 4.17Å; M178-F227 HydrophobicContact SD-CG 4.24Å
179	S	98.7	Very high	97.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.7	166.7	57	0	0	0	0	109.7	H161 S167 I185 N186 W188	H161-S179 PolarHBondContact CE1-O 2.78Å; H161-S179 VanDerWaalsContact CE1-O 3.32Å; H161-S179 WeakPolarHBondContact NE2-CB 3.39Å; H161-S179 PolarHBondContact NE2-O 3.46Å; H161-S179 PolarHBondContact NE2-OG 2.82Å; S167-S179 CarbonylContact O-C 3.59Å; S167-S179 WeakPolarHBondContact O-CA 3.41Å; S179-I185 WeakPolarHBondContact O-CA 3.38Å; S179-N186 PolarHBondContact N-O 3.17Å; S179-N186 PolarHBondContact O-N 3.46Å; S179-W188 PolarHBondContact OG-NE1 2.87Å
180	A	98.6	Very high	97.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.2	179.1	0	0	0	0	0	110.4	I165 N166 S167 R184 I185 I214 A217	I165-A180 CarbonylContact C-O 3.55Å; I165-A180 WeakPolarHBondContact CA-O 3.27Å; N166-A180 PolarHBondContact N-O 3.06Å; S167-A180 PolarHBondContact N-O 2.85Å; S167-A180 PolarHBondContact O-N 3.12Å; A180-R184 CarbonylContact C-O 3.55Å; A180-R184 VanDerWaalsContact CA-O 3.32Å; A180-R184 WeakPolarHBondContact CA-O 3.31Å; A180-I185 HydrophobicContact CB-CD1 4.43Å; A180-I185 HydrophobicContact CB-CG1 3.83Å; A180-I185 HydrophobicContact CB-CG2 4.48Å; A180-I214 HydrophobicContact CB-CG2 4.39Å; A180-A217 HydrophobicContact CB-CB 3.78Å
181	D	97.7	Very high	97.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.155	C	C	.	.			trans	-105.9	-170.3	163.2	70.6	29.7	0	0	0	110.9	H161 T162 Y163 H164 N166 L183 R184 I214	H161-D181 HydrophobicContact CB-CB 4.4Å; H161-D181 IonicContact CE1-OD2 2.75Å; H161-D181 IonicContact CG-OD2 3.19Å; H161-D181 VanDerWaalsContact ND1-CB 3.32Å; H161-D181 WeakPolarHBondContact ND1-CB 3.45Å; H161-D181 IonicContact ND1-OD2 3.93Å; H161-D181 PolarHBondContact ND1-OD2 3.01Å; T162-D181 PolarHBondContact N-OD2 2.76Å; Y163-D181 PolarHBondContact N-OD2 2.87Å; H164-D181 VanDerWaalsContact O-CA 3.22Å; H164-D181 WeakPolarHBondContact O-CA 3.28Å; H164-D181 WeakPolarHBondContact O-CB 3.3Å; N166-D181 PolarHBondContact ND2-O 2.82Å; N166-D181 VanDerWaalsContact ND2-O 3.1Å; D181-L183 PolarHBondContact O-N 2.98Å; D181-L183 VanDerWaalsContact O-N 3.12Å; D181-L183 PolarHBondContact OD1-N 2.86Å; D181-R184 PolarHBondContact N-O 2.68Å; D181-R184 WeakPolarHBondContact OD1-CB 3.33Å; D181-R184 PolarHBondContact OD1-N 2.91Å; D181-I214 WeakPolarHBondContact O-CB 3.39Å
182	D	97.2	Very high	97.6	Very high	35 Å²	35	36 Å²	36	19%	0.187	17%	0.172	C	C	.	.	S	Bend	trans	-61	-18.9	-176.2	-56.3	-40.3	0	0	0	114	Y163 H164 V213 I214	Y163-D182 HydrophobicContact CG-CB 4.5Å; H164-D182 IonicContact CD2-OD2 3.79Å; H164-D182 PolarHBondContact N-OD2 3.21Å; D182-V213 HydrophobicContact CB-CB 4.29Å; D182-V213 HydrophobicContact CB-CG1 4.36Å; D182-V213 CarbonylContact O-C 3.57Å; D182-V213 VanDerWaalsContact O-CA 3.26Å; D182-V213 WeakPolarHBondContact O-CA 3.14Å; D182-V213 VanDerWaalsContact O-CB 3.32Å; D182-V213 WeakPolarHBondContact O-CB 3.44Å; D182-I214 PolarHBondContact O-N 2.93Å
183	L	97.6	Very high	97.6	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	18%	0.175	C	C	.	.	S	Bend	trans	-136.9	-12.2	-175.7	-64.4	177.3	0	0	0	114.6	Y163 D181 I202 K203 M207 L210 V213	Y163-L183 HydrophobicContact CD2-CB 4.08Å; Y163-L183 HydrophobicContact CD2-CD1 4.16Å; Y163-L183 HydrophobicContact CD2-CG 4.31Å; Y163-L183 HydrophobicContact CE1-CD1 4.15Å; Y163-L183 HydrophobicContact CE2-CB 4.07Å; Y163-L183 HydrophobicContact CE2-CD1 3.63Å; Y163-L183 HydrophobicContact CE2-CG 4.23Å; D181-L183 PolarHBondContact O-N 2.98Å; D181-L183 VanDerWaalsContact O-N 3.12Å; D181-L183 PolarHBondContact OD1-N 2.86Å; L183-I202 HydrophobicContact CB-CG1 4.37Å; L183-I202 HydrophobicContact CD2-CD1 4.18Å; L183-I202 HydrophobicContact CD2-CG1 3.93Å; L183-I202 WeakPolarHBondContact O-CG1 3.23Å; L183-I202 PolarHBondContact O-N 2.73Å; L183-K203 HydrophobicContact CB-CB 4.37Å; L183-K203 HydrophobicContact CD1-CB 4.2Å; L183-K203 HydrophobicContact CD1-CG 4.28Å; L183-M207 HydrophobicContact CD1-SD 4.4Å; L183-L210 HydrophobicContact CD1-CD1 4.4Å; L183-L210 HydrophobicContact CD2-CD1 3.63Å; L183-V213 HydrophobicContact CD2-CG1 4.18Å
184	R	97.1	Very high	97.5	Very high	64 Å²	64	39.9 Å²	39.9	24%	0.242	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147	-171.9	-71.5	177.8	174.9	-174.5	-10.1	112.9	A180 D181 V200 D201	A180-R184 CarbonylContact C-O 3.55Å; A180-R184 VanDerWaalsContact CA-O 3.32Å; A180-R184 WeakPolarHBondContact CA-O 3.31Å; D181-R184 PolarHBondContact N-O 2.68Å; D181-R184 WeakPolarHBondContact OD1-CB 3.33Å; D181-R184 PolarHBondContact OD1-N 2.91Å; R184-V200 VanDerWaalsContact CA-O 3.24Å; R184-V200 WeakPolarHBondContact CA-O 3.48Å; R184-D201 HydrophobicContact CG-CB 4.29Å; R184-D201 WeakPolarHBondContact CG-OD1 3.48Å; R184-D201 IonicContact CZ-OD2 3.92Å; R184-D201 VanDerWaalsContact CZ-OD2 3.31Å; R184-D201 VanDerWaalsContact NE-CG 3.31Å; R184-D201 IonicContact NE-OD1 2.76Å; R184-D201 PolarHBondContact NE-OD1 3.34Å; R184-D201 VanDerWaalsContact NE-OD1 3.14Å; R184-D201 IonicContact NE-OD2 2.75Å; R184-D201 PolarHBondContact NE-OD2 2.85Å; R184-D201 IonicContact NH2-OD1 3.38Å; R184-D201 IonicContact NH2-OD2 3.58Å; R184-D201 PolarHBondContact NH2-OD2 2.94Å
185	I	98	Very high	97.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127	168.7	-51.3	-178.4	0	0	0	108.5	M178 S179 A180 N198 I199 V200 I214 A217 F227 Y229	M178-I185 HydrophobicContact CB-CG2 4.03Å; M178-I185 HydrophobicContact CG-CG2 4.33Å; M178-I185 HydrophobicContact SD-CG2 3.82Å; S179-I185 WeakPolarHBondContact O-CA 3.38Å; A180-I185 HydrophobicContact CB-CD1 4.43Å; A180-I185 HydrophobicContact CB-CG1 3.83Å; A180-I185 HydrophobicContact CB-CG2 4.48Å; I185-N198 PolarHBondContact O-ND2 3.06Å; I185-I199 HydrophobicContact CB-CG1 4.03Å; I185-I199 HydrophobicContact CG2-CD1 3.85Å; I185-I199 HydrophobicContact CG2-CG1 3.84Å; I185-I199 WeakPolarHBondContact O-CG1 3.22Å; I185-I199 PolarHBondContact O-N 2.94Å; I185-V200 HydrophobicContact CB-CB 3.92Å; I185-V200 HydrophobicContact CB-CG2 4.24Å; I185-V200 HydrophobicContact CD1-CB 4.15Å; I185-V200 HydrophobicContact CD1-CG2 4.03Å; I185-V200 HydrophobicContact CG1-CB 3.95Å; I185-V200 HydrophobicContact CG1-CG1 4.49Å; I185-V200 HydrophobicContact CG1-CG2 4.32Å; I185-V200 PolarHBondContact N-O 3.03Å; I185-V200 PolarHBondContact O-N 2.98Å; I185-I214 HydrophobicContact CD1-CD1 4.14Å; I185-I214 HydrophobicContact CG1-CD1 3.79Å; I185-A217 HydrophobicContact CD1-CB 3.99Å; I185-F227 HydrophobicContact CD1-CD2 4.42Å; I185-F227 HydrophobicContact CD1-CE2 3.93Å; I185-Y229 HydrophobicContact CD1-CD1 3.98Å; I185-Y229 HydrophobicContact CD1-CG 3.93Å
186	N	98	Very high	97.6	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.027	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.9	179.3	-64.3	-34.8	0	0	0	110	A160 H161 M178 S179 F197 N198	A160-N186 PolarHBondContact O-ND2 3.32Å; A160-N186 VanDerWaalsContact O-ND2 3.1Å; H161-N186 PolarHBondContact CE1-ND2 2.84Å; H161-N186 PolarHBondContact NE2-ND2 2.76Å; M178-N186 CarbonylContact C-O 3.58Å; M178-N186 WeakPolarHBondContact CA-O 3.42Å; M178-N186 WeakPolarHBondContact CB-O 3.37Å; S179-N186 PolarHBondContact N-O 3.17Å; S179-N186 PolarHBondContact O-N 3.46Å; N186-F197 CarbonylContact C-O 3.55Å; N186-F197 WeakPolarHBondContact CA-O 3.34Å; N186-N198 WeakPolarHBondContact OD1-CA 3.5Å; N186-N198 WeakPolarHBondContact OD1-CB 3.18Å; N186-N198 PolarHBondContact OD1-ND2 2.85Å
187	L	97.9	Very high	97.6	Very high	34 Å²	34	40.1 Å²	40.1	18%	0.178	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138	171.7	-174	71.1	0	0	0	110	S196 F197 I199 F219 M241	L187-S196 WeakPolarHBondContact O-CA 3.43Å; L187-S196 WeakPolarHBondContact O-CB 3.38Å; L187-F197 HydrophobicContact CB-CB 4.5Å; L187-F197 PolarHBondContact N-O 3.31Å; L187-F197 PolarHBondContact O-N 3.15Å; L187-I199 HydrophobicContact CB-CD1 4.43Å; L187-I199 HydrophobicContact CB-CG2 3.89Å; L187-F219 HydrophobicContact CD1-CE2 4.31Å; L187-F219 HydrophobicContact CD1-CZ 3.78Å; L187-M241 HydrophobicContact CD2-SD 4.41Å
188	W	98.5	Very high	97.5	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.027	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.2	-177.4	-60.2	87.3	0	0	0	110.9	F157 A160 T176 Y177 S179	F157-W188 HydrophobicContact CB-CD2 4.39Å; F157-W188 HydrophobicContact CB-CE3 4.02Å; F157-W188 HydrophobicContact CB-CH2 3.84Å; F157-W188 HydrophobicContact CB-CZ2 4.22Å; F157-W188 HydrophobicContact CB-CZ3 3.75Å; F157-W188 HydrophobicContact CD1-CD2 4.24Å; F157-W188 AromaticContact CD1-CE3 3.6Å; F157-W188 HydrophobicContact CD1-CE3 3.6Å; F157-W188 AromaticContact CD1-CZ3 3.97Å; F157-W188 HydrophobicContact CD1-CZ3 3.97Å; F157-W188 HydrophobicContact CG-CE3 4.22Å; F157-W188 HydrophobicContact CG-CZ3 4.36Å; A160-W188 HydrophobicContact CB-CH2 3.32Å; A160-W188 HydrophobicContact CB-CZ2 3.21Å; T176-W188 CarbonylContact C-O 3.43Å; T176-W188 WeakPolarHBondContact CA-O 3.39Å; T176-W188 WeakPolarHBondContact CB-O 3.25Å; Y177-W188 HydrophobicContact CD1-CB 3.69Å; Y177-W188 HydrophobicContact CD1-CG 4.46Å; Y177-W188 HydrophobicContact CE1-CB 3.27Å; Y177-W188 AromaticContact CE1-CG 3.79Å; Y177-W188 HydrophobicContact CE1-CG 3.79Å; Y177-W188 HydrophobicContact CE2-CB 4.24Å; Y177-W188 AromaticContact CE2-CD1 3.63Å; Y177-W188 HydrophobicContact CE2-CG 4.01Å; Y177-W188 HydrophobicContact CG-CB 4.33Å; Y177-W188 AromaticContact CZ-CD1 3.6Å; Y177-W188 AromaticContact CZ-CG 3.5Å; Y177-W188 PolarHBondContact N-O 2.91Å; Y177-W188 PolarHBondContact O-N 2.94Å; S179-W188 PolarHBondContact OG-NE1 2.87Å
189	N	98	Very high	97.4	Very high	35 Å²	35	42.4 Å²	42.4	19%	0.187	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	138	163.3	-179.1	-60.1	0	0	0	108.6	F157 E175 E191 I192	F157-N189 WeakPolarHBondContact CE1-O 3.46Å; E175-N189 VanDerWaalsContact CG-ND2 3.3Å; E175-N189 WeakPolarHBondContact CG-ND2 3.27Å; E175-N189 WeakPolarHBondContact O-CA 3.34Å; E175-N189 PolarHBondContact OE1-ND2 2.88Å; N189-E191 PolarHBondContact O-N 3.25Å; N189-E191 VanDerWaalsContact O-N 3.1Å; N189-E191 PolarHBondContact OD1-N 3.47Å; N189-I192 HydrophobicContact CB-CB 4.17Å; N189-I192 HydrophobicContact CB-CD1 4.13Å; N189-I192 HydrophobicContact CB-CG1 4.14Å; N189-I192 PolarHBondContact O-N 2.61Å; N189-I192 VanDerWaalsContact O-N 3.11Å
190	F	97.2	Very high	97.3	Very high	14 Å²	14	42.7 Å²	42.7	6%	0.061	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.7	-177.6	-69	-62.3	0	0	0	114.5	L87 L97 F157 V170 E175 T176 Y177	L87-F190 HydrophobicContact CD1-CE1 4.09Å; L87-F190 HydrophobicContact CD1-CZ 4.41Å; L87-F190 HydrophobicContact CD2-CD1 4.03Å; L87-F190 HydrophobicContact CD2-CD2 4.35Å; L87-F190 HydrophobicContact CD2-CE1 3.8Å; L87-F190 HydrophobicContact CD2-CE2 4.17Å; L87-F190 HydrophobicContact CD2-CG 4.3Å; L87-F190 HydrophobicContact CD2-CZ 3.89Å; L87-F190 HydrophobicContact CG-CE1 4.09Å; L87-F190 HydrophobicContact CG-CZ 4.02Å; L97-F190 HydrophobicContact CD1-CE1 4.06Å; L97-F190 HydrophobicContact CD2-CE1 4.34Å; L97-F190 HydrophobicContact CG-CE1 4.39Å; F157-F190 WeakPolarHBondContact CZ-O 3.34Å; V170-F190 HydrophobicContact CG1-CE2 4.46Å; V170-F190 HydrophobicContact CG1-CZ 3.93Å; V170-F190 HydrophobicContact CG2-CZ 4.14Å; E175-F190 WeakPolarHBondContact O-CD2 3.3Å; E175-F190 PolarHBondContact O-N 2.97Å; T176-F190 WeakPolarHBondContact O-CE2 3.41Å; T176-F190 WeakPolarHBondContact O-CZ 3.42Å; Y177-F190 AromaticContact CD1-CD1 3.64Å; Y177-F190 HydrophobicContact CD1-CD1 3.64Å; Y177-F190 AromaticContact CD1-CE1 3.41Å; Y177-F190 HydrophobicContact CD1-CE1 3.41Å; Y177-F190 VanDerWaalsContact CD1-CE1 3.41Å; Y177-F190 HydrophobicContact CD1-CZ 4.12Å; Y177-F190 HydrophobicContact CE1-CD1 4.18Å; Y177-F190 HydrophobicContact CE1-CE1 4.28Å; Y177-F190 AromaticContact CG-CE1 3.91Å; Y177-F190 HydrophobicContact CG-CE1 3.91Å; Y177-F190 HydrophobicContact CG-CZ 4.36Å
191	E	96.8	Very high	97.1	Very high	121 Å²	121	46.1 Å²	46.1	57%	0.565	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.6	-178.8	-65.5	-62.4	159.9	0	0	113.6	R155 N189	R155-E191 IonicContact CZ-OE2 3.12Å; R155-E191 IonicContact NE-OE2 2.64Å; R155-E191 PolarHBondContact NE-OE2 2.87Å; R155-E191 IonicContact NH2-OE2 2.66Å; R155-E191 PolarHBondContact NH2-OE2 3.46Å; N189-E191 PolarHBondContact O-N 3.25Å; N189-E191 VanDerWaalsContact O-N 3.1Å; N189-E191 PolarHBondContact OD1-N 3.47Å
192	I	97.7	Very high	97	Very high	73 Å²	73	48.3 Å²	48.3	37%	0.374	24%	0.244	S	C	.	.			trans	-116.5	109.7	-176	-54.3	177.5	0	0	0	109.8	N189 N194 Q195	N189-I192 HydrophobicContact CB-CB 4.17Å; N189-I192 HydrophobicContact CB-CD1 4.13Å; N189-I192 HydrophobicContact CB-CG1 4.14Å; N189-I192 PolarHBondContact O-N 2.61Å; N189-I192 VanDerWaalsContact O-N 3.11Å; I192-N194 WeakPolarHBondContact CG2-OD1 3.28Å; I192-Q195 HydrophobicContact CG2-CB 4.12Å
193	T	97.5	Very high	96.9	Very high	51 Å²	51	50.8 Å²	50.8	31%	0.313	25%	0.253	S	S	.	.			trans	-101.4	-17.4	-175.1	59.5	0	0	0	0	114.7	R155 V156 F157	R155-T193 HydrophobicContact CB-CG2 3.76Å; R155-T193 HydrophobicContact CG-CG2 4.19Å; V156-T193 WeakPolarHBondContact O-CB 3.15Å; F157-T193 HydrophobicContact CD1-CG2 3.89Å; F157-T193 HydrophobicContact CE1-CG2 3.77Å; F157-T193 HydrophobicContact CG-CG2 4.48Å; F157-T193 HydrophobicContact CZ-CG2 4.29Å
194	N	96.2	Very high	96.8	Very high	126 Å²	126	51.9 Å²	51.9	67%	0.674	26%	0.261	S	S	*	.	S	Bend	trans	-95	-0.2	-174.2	65	-35.3	0	0	0	113.4	I192	I192-N194 WeakPolarHBondContact CG2-OD1 3.28Å
195	Q	96.2	Very high	96.6	Very high	133 Å²	133	54.4 Å²	54.4	62%	0.621	30%	0.295	S	S	*	.			trans	-143.9	140.2	-179.6	-60.8	-179.3	21.6	0	0	109.4	I192	I192-Q195 HydrophobicContact CG2-CB 4.12Å
196	S	96.7	Very high	96.5	Very high	45 Å²	45	57.6 Å²	57.6	32%	0.315	31%	0.312	S	S	.	.			trans	-135.4	157.3	166.2	62.9	0	0	0	0	108.3	A160 L187	A160-S196 WeakPolarHBondContact CB-OG 3.41Å; L187-S196 WeakPolarHBondContact O-CA 3.43Å; L187-S196 WeakPolarHBondContact O-CB 3.38Å
197	F	96.7	Very high	96.2	Very high	96 Å²	96	61.2 Å²	61.2	42%	0.421	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.6	177.1	-179.9	-118.7	0	0	0	109.6	N186 L187 I199 A245 L246	N186-F197 CarbonylContact C-O 3.55Å; N186-F197 WeakPolarHBondContact CA-O 3.34Å; L187-F197 HydrophobicContact CB-CB 4.5Å; L187-F197 PolarHBondContact N-O 3.31Å; L187-F197 PolarHBondContact O-N 3.15Å; F197-I199 HydrophobicContact CD1-CG2 3.4Å; F197-I199 HydrophobicContact CE1-CG2 3.67Å; F197-I199 HydrophobicContact CG-CG2 4.45Å; F197-I199 PolarHBondContact O-N 2.88Å; F197-A245 WeakPolarHBondContact CE1-O 3.25Å; F197-A245 HydrophobicContact CZ-CB 4.5Å; F197-L246 HydrophobicContact CE2-CD2 4.37Å; F197-L246 HydrophobicContact CZ-CD2 3.9Å
198	N	96.2	Very high	96	Very high	48 Å²	48	67.8 Å²	67.8	26%	0.257	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.7	176.8	180	-107.5	0	0	0	109.6	I185 N186 V200 D201	I185-N198 PolarHBondContact O-ND2 3.06Å; N186-N198 WeakPolarHBondContact OD1-CA 3.5Å; N186-N198 WeakPolarHBondContact OD1-CB 3.18Å; N186-N198 PolarHBondContact OD1-ND2 2.85Å; N198-V200 PolarHBondContact ND2-O 3.28Å; N198-V200 PolarHBondContact OD1-O 2.96Å; N198-D201 WeakPolarHBondContact OD1-CB 3.42Å
199	I	96.5	Very high	95.8	Very high	2 Å²	2	73.6 Å²	73.6	1%	0.01	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-15.4	-177.6	58.3	171.2	0	0	0	112.9	I185 L187 F197 F227 M241 L246 C247	I185-I199 HydrophobicContact CB-CG1 4.03Å; I185-I199 HydrophobicContact CG2-CD1 3.85Å; I185-I199 HydrophobicContact CG2-CG1 3.84Å; I185-I199 WeakPolarHBondContact O-CG1 3.22Å; I185-I199 PolarHBondContact O-N 2.94Å; L187-I199 HydrophobicContact CB-CD1 4.43Å; L187-I199 HydrophobicContact CB-CG2 3.89Å; F197-I199 HydrophobicContact CD1-CG2 3.4Å; F197-I199 HydrophobicContact CE1-CG2 3.67Å; F197-I199 HydrophobicContact CG-CG2 4.45Å; F197-I199 PolarHBondContact O-N 2.88Å; I199-F227 HydrophobicContact CD1-CD1 4.39Å; I199-F227 HydrophobicContact CD1-CE1 3.8Å; I199-F227 HydrophobicContact CD1-CE2 4.39Å; I199-F227 HydrophobicContact CD1-CZ 3.79Å; I199-F227 HydrophobicContact CG1-CZ 4.37Å; I199-M241 HydrophobicContact CD1-SD 4.41Å; I199-L246 CarbonylContact O-C 3.59Å; I199-C247 VanDerWaalsContact O-CB 3.31Å; I199-C247 WeakPolarHBondContact O-CB 3.26Å
200	V	96.2	Very high	95.7	Very high	5 Å²	5	75.1 Å²	75.1	3%	0.03	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	132.3	172.5	177.3	0	0	0	0	108.1	R184 I185 N198 I202 I214 F227 Y229 C247	R184-V200 VanDerWaalsContact CA-O 3.24Å; R184-V200 WeakPolarHBondContact CA-O 3.48Å; I185-V200 HydrophobicContact CB-CB 3.92Å; I185-V200 HydrophobicContact CB-CG2 4.24Å; I185-V200 HydrophobicContact CD1-CB 4.15Å; I185-V200 HydrophobicContact CD1-CG2 4.03Å; I185-V200 HydrophobicContact CG1-CB 3.95Å; I185-V200 HydrophobicContact CG1-CG1 4.49Å; I185-V200 HydrophobicContact CG1-CG2 4.32Å; I185-V200 PolarHBondContact N-O 3.03Å; I185-V200 PolarHBondContact O-N 2.98Å; N198-V200 PolarHBondContact ND2-O 3.28Å; N198-V200 PolarHBondContact OD1-O 2.96Å; V200-I202 HydrophobicContact CG1-CG2 3.96Å; V200-I214 HydrophobicContact CG1-CD1 4.22Å; V200-F227 HydrophobicContact CG2-CE2 3.88Å; V200-F227 HydrophobicContact CG2-CZ 3.73Å; V200-Y229 HydrophobicContact CG1-CE1 4.24Å; V200-Y229 HydrophobicContact CG2-CE1 4.22Å; V200-C247 HydrophobicContact CG2-CB 4.26Å
201	D	95.3	Very high	95.6	Very high	73 Å²	73	78.8 Å²	78.8	39%	0.39	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	106.8	168.2	-163.4	-0.9	0	0	0	108.9	R184 N198 K203	R184-D201 HydrophobicContact CG-CB 4.29Å; R184-D201 WeakPolarHBondContact CG-OD1 3.48Å; R184-D201 IonicContact CZ-OD2 3.92Å; R184-D201 VanDerWaalsContact CZ-OD2 3.31Å; R184-D201 VanDerWaalsContact NE-CG 3.31Å; R184-D201 IonicContact NE-OD1 2.76Å; R184-D201 PolarHBondContact NE-OD1 3.34Å; R184-D201 VanDerWaalsContact NE-OD1 3.14Å; R184-D201 IonicContact NE-OD2 2.75Å; R184-D201 PolarHBondContact NE-OD2 2.85Å; R184-D201 IonicContact NH2-OD1 3.38Å; R184-D201 IonicContact NH2-OD2 3.58Å; R184-D201 PolarHBondContact NH2-OD2 2.94Å; N198-D201 WeakPolarHBondContact OD1-CB 3.42Å; D201-K203 WeakPolarHBondContact OD1-CB 2.96Å; D201-K203 PolarHBondContact OD1-N 3.13Å; D201-K203 VanDerWaalsContact OD1-N 3.13Å
202	I	94.7	Very high	95.5	Very high	46 Å²	46	74.6 Å²	74.6	24%	0.236	40%	0.399	C	S	.	.			trans	-99.7	11.3	174.5	65.7	161.8	0	0	0	112	L183 V200 P204 I214	L183-I202 HydrophobicContact CB-CG1 4.37Å; L183-I202 HydrophobicContact CD2-CD1 4.18Å; L183-I202 HydrophobicContact CD2-CG1 3.93Å; L183-I202 WeakPolarHBondContact O-CG1 3.23Å; L183-I202 PolarHBondContact O-N 2.73Å; V200-I202 HydrophobicContact CG1-CG2 3.96Å; I202-P204 WeakPolarHBondContact O-CD 3.36Å; I202-I214 HydrophobicContact CD1-CD1 4.33Å; I202-I214 HydrophobicContact CD1-CG1 3.61Å; I202-I214 HydrophobicContact CG1-CD1 4.24Å; I202-I214 HydrophobicContact CG1-CG1 4.05Å
203	K	95.2	Very high	95.5	Very high	86 Å²	86	73 Å²	73	37%	0.374	39%	0.392	S	S	.	.			trans	-60.8	123.7	178.8	177	173	173.8	159.2	0	110.4	Y163 L183 D201 M207	Y163-K203 PolarHBondContact OH-NZ 3.15Å; L183-K203 HydrophobicContact CB-CB 4.37Å; L183-K203 HydrophobicContact CD1-CB 4.2Å; L183-K203 HydrophobicContact CD1-CG 4.28Å; D201-K203 WeakPolarHBondContact OD1-CB 2.96Å; D201-K203 PolarHBondContact OD1-N 3.13Å; D201-K203 VanDerWaalsContact OD1-N 3.13Å; K203-M207 HydrophobicContact CG-SD 4.43Å
204	P	95	Very high	95.5	Very high	26 Å²	26	70.5 Å²	70.5	17%	0.169	38%	0.377	C	S	.	.			trans	-68.5	153.9	174.5	31	-36.4	0	0	0	110.6	I202 N206 E209 L210	I202-P204 WeakPolarHBondContact O-CD 3.36Å; P204-N206 VanDerWaalsContact C-N 3.27Å; P204-N206 WeakPolarHBondContact CB-O 3.34Å; P204-N206 VanDerWaalsContact CG-O 3.29Å; P204-N206 WeakPolarHBondContact CG-O 3.11Å; P204-N206 PolarHBondContact O-N 3.32Å; P204-E209 HydrophobicContact CB-CB 4.4Å; P204-L210 HydrophobicContact CG-CB 4.22Å; P204-L210 HydrophobicContact CG-CD1 4.34Å
205	A	94.3	Very high	95.6	Very high	116 Å²	116	65 Å²	65	96%	0.959	35%	0.348	S	S	*	.	S	Bend	trans	-61.1	-39.4	176.9	0	0	0	0	0	111.5
206	N	94.9	Very high	95.7	Very high	67 Å²	67	58.8 Å²	58.8	36%	0.358	32%	0.32	S	S	.	.	S	Bend	trans	-108	125.2	169.3	-174.3	0.9	0	0	0	109.9	P204 E208 E209	P204-N206 VanDerWaalsContact C-N 3.27Å; P204-N206 WeakPolarHBondContact CB-O 3.34Å; P204-N206 VanDerWaalsContact CG-O 3.29Å; P204-N206 WeakPolarHBondContact CG-O 3.11Å; P204-N206 PolarHBondContact O-N 3.32Å; N206-E208 PolarHBondContact ND2-OE2 2.69Å; N206-E208 PolarHBondContact O-N 3.44Å; N206-E208 PolarHBondContact OD1-N 3.13Å; N206-E208 VanDerWaalsContact OD1-N 3.11Å; N206-E209 HydrophobicContact CB-CG 4.25Å; N206-E209 PolarHBondContact O-N 3.22Å
207	M	92.7	Very high	95.8	Very high	81 Å²	81	57 Å²	57	40%	0.399	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-63.8	-21.1	178.1	-76.4	-65.9	-61.2	0	0	113.3	Y163 L183 K203 E209 L210	Y163-M207 HydrophobicContact CE1-CE 4.23Å; Y163-M207 PolarHBondContact OH-SD 2.56Å; L183-M207 HydrophobicContact CD1-SD 4.4Å; K203-M207 HydrophobicContact CG-SD 4.43Å; M207-E209 PolarHBondContact O-N 3.31Å; M207-L210 HydrophobicContact CE-CD2 4.13Å; M207-L210 WeakPolarHBondContact O-CB 3.45Å; M207-L210 PolarHBondContact O-N 2.75Å
208	E	94.4	Very high	95.9	Very high	172 Å²	172	53.8 Å²	53.8	80%	0.804	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-69.2	-20.6	174.8	-62.9	176.9	159.6	0	0	112.8	N206 L210	N206-E208 PolarHBondContact ND2-OE2 2.69Å; N206-E208 PolarHBondContact O-N 3.44Å; N206-E208 PolarHBondContact OD1-N 3.13Å; N206-E208 VanDerWaalsContact OD1-N 3.11Å; E208-L210 VanDerWaalsContact C-N 3.25Å; E208-L210 PolarHBondContact O-N 3.39Å
209	E	94	Very high	96	Very high	130 Å²	130	51.8 Å²	51.8	61%	0.607	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-89.3	10.9	176.6	-62.2	178.1	176.1	0	0	112.3	P204 N206 M207 T211	P204-E209 HydrophobicContact CB-CB 4.4Å; N206-E209 HydrophobicContact CB-CG 4.25Å; N206-E209 PolarHBondContact O-N 3.22Å; M207-E209 PolarHBondContact O-N 3.31Å; E209-T211 PolarHBondContact O-N 2.71Å; E209-T211 VanDerWaalsContact O-N 3.08Å
210	L	95.1	Very high	96.1	Very high	66 Å²	66	52.1 Å²	52.1	35%	0.346	28%	0.284	S	S	.	.			trans	-65.8	111.6	179.2	179.7	63.2	0	0	0	110.4	L183 P204 M207 E208 E212 V213	L183-L210 HydrophobicContact CD1-CD1 4.4Å; L183-L210 HydrophobicContact CD2-CD1 3.63Å; P204-L210 HydrophobicContact CG-CB 4.22Å; P204-L210 HydrophobicContact CG-CD1 4.34Å; M207-L210 HydrophobicContact CE-CD2 4.13Å; M207-L210 WeakPolarHBondContact O-CB 3.45Å; M207-L210 PolarHBondContact O-N 2.75Å; E208-L210 VanDerWaalsContact C-N 3.25Å; E208-L210 PolarHBondContact O-N 3.39Å; L210-E212 VanDerWaalsContact CD1-O 3.29Å; L210-E212 WeakPolarHBondContact CD1-O 3.21Å; L210-V213 HydrophobicContact CD1-CG1 4.15Å; L210-V213 HydrophobicContact CD2-CG1 4.3Å
211	T	94.7	Very high	96.2	Very high	91 Å²	91	54.4 Å²	54.4	56%	0.558	30%	0.299	S	S	*	.			trans	-120.3	-9.6	177.7	65.4	0	0	0	0	113.6	E209 K233	E209-T211 PolarHBondContact O-N 2.71Å; E209-T211 VanDerWaalsContact O-N 3.08Å; T211-K233 VanDerWaalsContact CB-NZ 3.28Å; T211-K233 WeakPolarHBondContact O-CE 3.44Å; T211-K233 PolarHBondContact OG1-NZ 3.19Å
212	E	95.4	Very high	96.3	Very high	33 Å²	33	56.4 Å²	56.4	15%	0.154	31%	0.306	C	S	.	.			trans	-147	136.1	-172.8	-173.4	173.1	-164.1	0	0	110.1	L210 S231 K233 T235 R237	L210-E212 VanDerWaalsContact CD1-O 3.29Å; L210-E212 WeakPolarHBondContact CD1-O 3.21Å; E212-S231 WeakPolarHBondContact OE1-CB 3.42Å; E212-S231 PolarHBondContact OE1-OG 2.86Å; E212-K233 HydrophobicContact CB-CD 4.17Å; E212-K233 HydrophobicContact CG-CD 4.32Å; E212-K233 HydrophobicContact CG-CG 4.39Å; E212-T235 PolarHBondContact OE1-OG1 3.18Å; E212-R237 VanDerWaalsContact CD-NH2 3.32Å; E212-R237 IonicContact OE1-CZ 3.83Å; E212-R237 VanDerWaalsContact OE1-CZ 3.31Å; E212-R237 IonicContact OE1-NH1 3.43Å; E212-R237 PolarHBondContact OE1-NH1 2.88Å; E212-R237 IonicContact OE1-NH2 3.44Å; E212-R237 PolarHBondContact OE1-NH2 2.73Å; E212-R237 IonicContact OE2-CZ 2.71Å; E212-R237 IonicContact OE2-NH1 3.34Å; E212-R237 IonicContact OE2-NH2 3.9Å; E212-R237 PolarHBondContact OE2-NH2 2.99Å
213	V	97.5	Very high	96.4	Very high	39 Å²	39	59 Å²	59	24%	0.236	32%	0.317	C	S	.	.			trans	-126.7	150.6	173.3	-64.1	0	0	0	0	110.5	D182 L183 L210 T215 S231 S232	D182-V213 HydrophobicContact CB-CB 4.29Å; D182-V213 HydrophobicContact CB-CG1 4.36Å; D182-V213 CarbonylContact O-C 3.57Å; D182-V213 VanDerWaalsContact O-CA 3.26Å; D182-V213 WeakPolarHBondContact O-CA 3.14Å; D182-V213 VanDerWaalsContact O-CB 3.32Å; D182-V213 WeakPolarHBondContact O-CB 3.44Å; L183-V213 HydrophobicContact CD2-CG1 4.18Å; L210-V213 HydrophobicContact CD1-CG1 4.15Å; L210-V213 HydrophobicContact CD2-CG1 4.3Å; V213-T215 HydrophobicContact CG2-CG2 4.35Å; V213-S231 CarbonylContact O-C 3.53Å; V213-S231 WeakPolarHBondContact O-CA 3.4Å; V213-S231 VanDerWaalsContact O-CB 3.3Å; V213-S231 WeakPolarHBondContact O-CB 3.41Å; V213-S232 PolarHBondContact N-OG 2.84Å; V213-S232 VanDerWaalsContact N-OG 3.13Å; V213-S232 PolarHBondContact O-N 2.97Å
214	I	98.2	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	128.6	169.9	-57	179.7	0	0	0	108.1	N166 A180 D181 D182 I185 V200 I202 Y229 S230	N166-I214 PolarHBondContact ND2-O 3.24Å; A180-I214 HydrophobicContact CB-CG2 4.39Å; D181-I214 WeakPolarHBondContact O-CB 3.39Å; D182-I214 PolarHBondContact O-N 2.93Å; I185-I214 HydrophobicContact CD1-CD1 4.14Å; I185-I214 HydrophobicContact CG1-CD1 3.79Å; V200-I214 HydrophobicContact CG1-CD1 4.22Å; I202-I214 HydrophobicContact CD1-CD1 4.33Å; I202-I214 HydrophobicContact CD1-CG1 3.61Å; I202-I214 HydrophobicContact CG1-CD1 4.24Å; I202-I214 HydrophobicContact CG1-CG1 4.05Å; I214-Y229 HydrophobicContact CD1-CD2 4.21Å; I214-Y229 HydrophobicContact CD1-CE2 4.47Å; I214-Y229 HydrophobicContact CG1-CD2 3.97Å; I214-Y229 HydrophobicContact CG1-CE2 4.29Å; I214-Y229 HydrophobicContact CG2-CD2 4.33Å; I214-S230 WeakPolarHBondContact CA-O 3.31Å
215	T	98.3	Very high	96.5	Very high	10 Å²	10	56.3 Å²	56.3	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-31.4	-176.3	53.1	0	0	0	0	113.5	N166 V213 S230 I273	N166-T215 PolarHBondContact OD1-O 2.88Å; V213-T215 HydrophobicContact CG2-CG2 4.35Å; T215-S230 PolarHBondContact N-O 3.34Å; T215-S230 PolarHBondContact OG1-O 3.45Å; T215-S230 PolarHBondContact OG1-OG 3.3Å; T215-I273 WeakPolarHBondContact CB-O 3.46Å; T215-I273 WeakPolarHBondContact CG2-O 3.11Å; T215-I273 PolarHBondContact OG1-O 2.97Å
216	A	98.6	Very high	96.6	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	153.4	173.8	0	0	0	0	0	110.4	S167 Y229 S230 V276	S167-A216 VanDerWaalsContact OG-CA 3.29Å; S167-A216 WeakPolarHBondContact OG-CA 3.34Å; A216-Y229 CarbonylContact O-C 3.55Å; A216-Y229 WeakPolarHBondContact O-CA 3.36Å; A216-S230 WeakPolarHBondContact CB-OG 3.29Å; A216-S230 PolarHBondContact N-OG 3.41Å; A216-S230 PolarHBondContact O-N 3.3Å; A216-S230 PolarHBondContact O-OG 3.12Å; A216-V276 HydrophobicContact CB-CB 4.34Å; A216-V276 HydrophobicContact CB-CG1 3.69Å
217	A	98.5	Very high	96.7	Very high	8 Å²	8	48.4 Å²	48.4	7%	0.066	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	141.8	174.5	0	0	0	0	0	111.6	S167 M178 A180 I185 V228	S167-A217 WeakPolarHBondContact CB-O 2.94Å; S167-A217 PolarHBondContact OG-N 2.86Å; M178-A217 VanDerWaalsContact CE-C 3.44Å; M178-A217 HydrophobicContact CE-CB 3.75Å; A180-A217 HydrophobicContact CB-CB 3.78Å; I185-A217 HydrophobicContact CD1-CB 3.99Å; A217-V228 CarbonylContact C-O 3.55Å; A217-V228 VanDerWaalsContact CA-O 3.22Å; A217-V228 WeakPolarHBondContact CA-O 3.31Å
218	E	98.5	Very high	97	Very high	27 Å²	27	44.5 Å²	44.5	13%	0.126	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	141.1	178.8	-160.7	173.2	-126.2	0	0	112.7	F227 V228 K277 F278	E218-F227 CarbonylContact O-C 3.51Å; E218-F227 WeakPolarHBondContact O-CA 3.3Å; E218-F227 WeakPolarHBondContact O-CB 3.09Å; E218-V228 HydrophobicContact CB-CG2 4.45Å; E218-V228 PolarHBondContact N-O 3.19Å; E218-V228 PolarHBondContact O-N 3.11Å; E218-K277 VanDerWaalsContact OE1-CD 3.3Å; E218-K277 WeakPolarHBondContact OE1-CD 3.18Å; E218-K277 IonicContact OE1-NZ 3.04Å; E218-K277 PolarHBondContact OE1-NZ 3.3Å; E218-K277 VanDerWaalsContact OE2-CA 3.23Å; E218-K277 WeakPolarHBondContact OE2-CA 3.34Å; E218-F278 HydrophobicContact CB-CD2 4.32Å; E218-F278 HydrophobicContact CG-CD2 4.37Å; E218-F278 WeakPolarHBondContact O-CE2 3.39Å; E218-F278 PolarHBondContact OE2-N 3.21Å
219	F	98.4	Very high	97.2	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	149.9	171.1	-89.5	-63	0	0	0	110.6	S169 N171 M178 L187 F227 M241 F278	S169-F219 WeakPolarHBondContact O-CD2 3.18Å; S169-F219 PolarHBondContact OG-N 3.25Å; N171-F219 HydrophobicContact CB-CD2 3.89Å; N171-F219 HydrophobicContact CB-CE2 3.86Å; N171-F219 HydrophobicContact CB-CG 4.28Å; N171-F219 HydrophobicContact CB-CZ 4.26Å; M178-F219 HydrophobicContact CB-CD2 4.31Å; M178-F219 HydrophobicContact CB-CE2 3.5Å; M178-F219 VanDerWaalsContact CB-CE2 3.5Å; M178-F219 HydrophobicContact CB-CZ 3.96Å; M178-F219 HydrophobicContact CE-CD2 4.2Å; M178-F219 HydrophobicContact CE-CG 4.34Å; M178-F219 VanDerWaalsContact CE-N 3.34Å; M178-F219 HydrophobicContact CG-CD2 3.72Å; M178-F219 HydrophobicContact CG-CE2 3.4Å; M178-F219 VanDerWaalsContact CG-CE2 3.4Å; M178-F219 HydrophobicContact CG-CZ 4.07Å; M178-F219 HydrophobicContact SD-CD2 4Å; M178-F219 HydrophobicContact SD-CE1 4.39Å; M178-F219 HydrophobicContact SD-CE2 3.82Å; M178-F219 HydrophobicContact SD-CG 4.38Å; M178-F219 HydrophobicContact SD-CZ 3.99Å; L187-F219 HydrophobicContact CD1-CE2 4.31Å; L187-F219 HydrophobicContact CD1-CZ 3.78Å; F219-F227 HydrophobicContact CD1-CB 3.64Å; F219-F227 HydrophobicContact CE1-CB 3.94Å; F219-F227 HydrophobicContact CE1-CD1 4.22Å; F219-F227 HydrophobicContact CE1-CG 4.4Å; F219-F227 HydrophobicContact CG-CB 4.33Å; F219-M241 HydrophobicContact CE1-CE 4.3Å; F219-M241 HydrophobicContact CE1-SD 4.37Å; F219-F278 VanDerWaalsContact O-CD2 3.27Å; F219-F278 WeakPolarHBondContact O-CD2 3.44Å
220	H	98.4	Very high	97.4	Very high	9 Å²	9	30.6 Å²	30.6	4%	0.042	17%	0.166	C	C	.	.			trans	-66.4	135	171	-173.6	-85.1	0	0	0	110.3	H222 H223 T226 F278 G282	H220-H222 PolarHBondContact ND1-N 3.25Å; H220-H222 VanDerWaalsContact ND1-N 3.12Å; H220-H222 PolarHBondContact O-N 2.97Å; H220-H222 VanDerWaalsContact O-N 3.12Å; H220-H223 HydrophobicContact CB-CB 4.11Å; H220-H223 AromaticContact CE1-CD2 3.14Å; H220-H223 PolarHBondContact CE1-CD2 2.62Å; H220-H223 AromaticContact CE1-CG 3.68Å; H220-H223 AromaticContact CE1-NE2 3.78Å; H220-H223 WeakPolarHBondContact ND1-CB 3.31Å; H220-H223 AromaticContact ND1-CD2 3.37Å; H220-H223 PolarHBondContact ND1-CD2 3.28Å; H220-H223 AromaticContact ND1-CG 3.46Å; H220-H223 PolarHBondContact ND1-N 2.87Å; H220-H223 AromaticContact NE2-CD2 3.66Å; H220-T226 HydrophobicContact CB-CG2 4.09Å; H220-T226 VanDerWaalsContact CB-O 3.28Å; H220-T226 WeakPolarHBondContact CB-O 3.32Å; H220-T226 PolarHBondContact N-O 2.99Å; H220-F278 HydrophobicContact CB-CE2 4.16Å; H220-F278 HydrophobicContact CB-CZ 4.1Å; H220-F278 AromaticContact CD2-CD1 3.96Å; H220-F278 AromaticContact CD2-CE1 3.66Å; H220-G282 WeakPolarHBondContact NE2-CA 3.35Å; H220-G282 PolarHBondContact NE2-O 3.07Å
221	P	97.4	Very high	97.5	Very high	54 Å²	54	27.5 Å²	27.5	35%	0.351	15%	0.15	S	C	.	.	S	Bend	trans	-63.2	-24.9	-172.6	22.3	-33.9	0	0	0	114.4	S172 F278	S172-P221 WeakPolarHBondContact CB-O 3.38Å; P221-F278 HydrophobicContact CG-CB 4.31Å
222	H	97.4	Very high	97.6	Very high	115 Å²	115	24.5 Å²	24.5	53%	0.532	13%	0.132	S	C	.	.	S	Bend	trans	-122.9	-6.7	-175	-53.8	-63.9	0	0	0	115.2	H220 H280	H220-H222 PolarHBondContact ND1-N 3.25Å; H220-H222 VanDerWaalsContact ND1-N 3.12Å; H220-H222 PolarHBondContact O-N 2.97Å; H220-H222 VanDerWaalsContact O-N 3.12Å; H222-H280 PolarHBondContact NE2-O 2.77Å
223	H	97.2	Very high	97.5	Very high	100 Å²	100	26.4 Å²	26.4	46%	0.463	14%	0.14	S	C	.	.			trans	-125.7	101.8	-170.5	-66.2	-36.5	0	0	0	109	H220 N225 T226	H220-H223 HydrophobicContact CB-CB 4.11Å; H220-H223 AromaticContact CE1-CD2 3.14Å; H220-H223 PolarHBondContact CE1-CD2 2.62Å; H220-H223 AromaticContact CE1-CG 3.68Å; H220-H223 AromaticContact CE1-NE2 3.78Å; H220-H223 WeakPolarHBondContact ND1-CB 3.31Å; H220-H223 AromaticContact ND1-CD2 3.37Å; H220-H223 PolarHBondContact ND1-CD2 3.28Å; H220-H223 AromaticContact ND1-CG 3.46Å; H220-H223 PolarHBondContact ND1-N 2.87Å; H220-H223 AromaticContact NE2-CD2 3.66Å; H223-N225 PolarHBondContact O-N 3.34Å; H223-T226 PolarHBondContact O-N 3.36Å
224	C	96.8	Very high	97.4	Very high	45 Å²	45	25.5 Å²	25.5	30%	0.304	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.6	-170.5	62.1	0	0	0	0	115	N171 S172 D173 M241	N171-C224 PolarHBondContact ND2-O 3.36Å; N171-C224 WeakPolarHBondContact OD1-CA 3.42Å; N171-C224 PolarHBondContact OD1-O 3.18Å; S172-C224 VanDerWaalsContact OG-CA 3.28Å; S172-C224 WeakPolarHBondContact OG-CA 3.42Å; S172-C224 PolarHBondContact OG-N 2.94Å; S172-C224 VanDerWaalsContact OG-N 3.14Å; D173-C224 HydrophobicContact CB-CB 4.03Å; C224-M241 WeakPolarHBondContact O-CE 3.43Å
225	N	96	Very high	97.3	Very high	11 Å²	11	25.8 Å²	25.8	6%	0.059	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-9.2	179	60	-71.5	0	0	0	113.9	H223 D240 M241 R242	H223-N225 PolarHBondContact O-N 3.34Å; N225-D240 VanDerWaalsContact ND2-CG 3.25Å; N225-D240 PolarHBondContact ND2-OD1 2.87Å; N225-D240 PolarHBondContact ND2-OD2 2.97Å; N225-D240 CarbonylContact O-C 3.54Å; N225-D240 WeakPolarHBondContact O-CA 3.35Å; N225-M241 WeakPolarHBondContact O-CG 3.31Å; N225-M241 PolarHBondContact O-N 3.29Å; N225-R242 HydrophobicContact CB-CG 3.71Å; N225-R242 PolarHBondContact OD1-NH1 2.75Å; N225-R242 PolarHBondContact OD1-NH2 3.49Å
226	T	96.5	Very high	97.3	Very high	16 Å²	16	25.3 Å²	25.3	10%	0.098	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.2	-170.1	-53.5	0	0	0	0	110.6	H220 H223 L238 C239	H220-T226 HydrophobicContact CB-CG2 4.09Å; H220-T226 VanDerWaalsContact CB-O 3.28Å; H220-T226 WeakPolarHBondContact CB-O 3.32Å; H220-T226 PolarHBondContact N-O 2.99Å; H223-T226 PolarHBondContact O-N 3.36Å; T226-L238 HydrophobicContact CG2-CD1 4.12Å; T226-L238 HydrophobicContact CG2-CD2 3.89Å; T226-L238 HydrophobicContact CG2-CG 3.93Å; T226-C239 WeakPolarHBondContact CA-O 3.47Å
227	F	97.7	Very high	97.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164.5	170.1	68	-85	0	0	0	110.7	M178 I185 I199 V200 E218 F219 Y229 L238 C239 M241 C247	M178-F227 HydrophobicContact CE-CB 4.18Å; M178-F227 HydrophobicContact SD-CB 4.16Å; M178-F227 HydrophobicContact SD-CD2 4.17Å; M178-F227 HydrophobicContact SD-CG 4.24Å; I185-F227 HydrophobicContact CD1-CD2 4.42Å; I185-F227 HydrophobicContact CD1-CE2 3.93Å; I199-F227 HydrophobicContact CD1-CD1 4.39Å; I199-F227 HydrophobicContact CD1-CE1 3.8Å; I199-F227 HydrophobicContact CD1-CE2 4.39Å; I199-F227 HydrophobicContact CD1-CZ 3.79Å; I199-F227 HydrophobicContact CG1-CZ 4.37Å; V200-F227 HydrophobicContact CG2-CE2 3.88Å; V200-F227 HydrophobicContact CG2-CZ 3.73Å; E218-F227 CarbonylContact O-C 3.51Å; E218-F227 WeakPolarHBondContact O-CA 3.3Å; E218-F227 WeakPolarHBondContact O-CB 3.09Å; F219-F227 HydrophobicContact CD1-CB 3.64Å; F219-F227 HydrophobicContact CE1-CB 3.94Å; F219-F227 HydrophobicContact CE1-CD1 4.22Å; F219-F227 HydrophobicContact CE1-CG 4.4Å; F219-F227 HydrophobicContact CG-CB 4.33Å; F227-Y229 HydrophobicContact CE2-CD1 4.07Å; F227-L238 WeakPolarHBondContact O-CA 3.34Å; F227-C239 HydrophobicContact CD1-CB 4.05Å; F227-C239 HydrophobicContact CD2-CB 4.37Å; F227-C239 HydrophobicContact CE1-CB 3.48Å; F227-C239 VanDerWaalsContact CE1-CB 3.48Å; F227-C239 HydrophobicContact CE2-CB 3.84Å; F227-C239 HydrophobicContact CG-CB 4.46Å; F227-C239 HydrophobicContact CZ-CB 3.37Å; F227-C239 PolarHBondContact N-O 3.36Å; F227-C239 PolarHBondContact O-N 3.03Å; F227-M241 HydrophobicContact CD1-CG 4.11Å; F227-M241 HydrophobicContact CE1-CG 3.84Å; F227-M241 HydrophobicContact CE1-SD 4.45Å; F227-C247 HydrophobicContact CE1-CB 4.31Å; F227-C247 HydrophobicContact CZ-CB 3.99Å
228	V	97.8	Very high	97.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.7	172.8	-66.5	0	0	0	0	110.7	A217 E218 I236 R237 L238 V276 F278 I285	A217-V228 CarbonylContact C-O 3.55Å; A217-V228 VanDerWaalsContact CA-O 3.22Å; A217-V228 WeakPolarHBondContact CA-O 3.31Å; E218-V228 HydrophobicContact CB-CG2 4.45Å; E218-V228 PolarHBondContact N-O 3.19Å; E218-V228 PolarHBondContact O-N 3.11Å; V228-I236 HydrophobicContact CB-CG2 4.13Å; V228-I236 HydrophobicContact CG1-CG2 4.36Å; V228-R237 CarbonylContact C-O 3.55Å; V228-R237 VanDerWaalsContact CA-O 3.22Å; V228-R237 WeakPolarHBondContact CA-O 3.42Å; V228-L238 HydrophobicContact CG1-CB 3.85Å; V228-L238 HydrophobicContact CG1-CD1 4.15Å; V228-L238 HydrophobicContact CG1-CG 4.03Å; V228-V276 HydrophobicContact CG2-CG1 4.15Å; V228-V276 HydrophobicContact CG2-CG2 3.82Å; V228-F278 HydrophobicContact CB-CE2 4.28Å; V228-F278 HydrophobicContact CB-CZ 4.22Å; V228-F278 HydrophobicContact CG1-CE1 4.2Å; V228-F278 HydrophobicContact CG1-CE2 4Å; V228-F278 HydrophobicContact CG1-CZ 3.44Å; V228-F278 VanDerWaalsContact CG1-CZ 3.44Å; V228-F278 HydrophobicContact CG2-CD2 4.21Å; V228-F278 HydrophobicContact CG2-CE2 3.55Å; V228-F278 HydrophobicContact CG2-CZ 3.9Å; V228-I285 HydrophobicContact CG1-CD1 3.74Å
229	Y	98.1	Very high	97	Very high	10 Å²	10	25.5 Å²	25.5	4%	0.039	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.6	161.4	67.7	-84.5	0	0	0	110.7	I185 V200 I214 A216 F227 R237	I185-Y229 HydrophobicContact CD1-CD1 3.98Å; I185-Y229 HydrophobicContact CD1-CG 3.93Å; V200-Y229 HydrophobicContact CG1-CE1 4.24Å; V200-Y229 HydrophobicContact CG2-CE1 4.22Å; I214-Y229 HydrophobicContact CD1-CD2 4.21Å; I214-Y229 HydrophobicContact CD1-CE2 4.47Å; I214-Y229 HydrophobicContact CG1-CD2 3.97Å; I214-Y229 HydrophobicContact CG1-CE2 4.29Å; I214-Y229 HydrophobicContact CG2-CD2 4.33Å; A216-Y229 CarbonylContact O-C 3.55Å; A216-Y229 WeakPolarHBondContact O-CA 3.36Å; F227-Y229 HydrophobicContact CE2-CD1 4.07Å; Y229-R237 HydrophobicContact CD1-CB 4.01Å; Y229-R237 HydrophobicContact CE1-CB 3.56Å; Y229-R237 HydrophobicContact CE1-CG 4.5Å; Y229-R237 HydrophobicContact CE2-CB 4.13Å; Y229-R237 HydrophobicContact CE2-CG 4.44Å; Y229-R237 HydrophobicContact CG-CB 4.48Å; Y229-R237 PolarHBondContact N-O 3.02Å; Y229-R237 PolarHBondContact O-N 3.08Å; Y229-R237 WeakPolarHBondContact OH-CD 3.48Å
230	S	98.2	Very high	96.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	162.9	175.2	64.8	0	0	0	0	110.9	I214 T215 A216 T235 I273	I214-S230 WeakPolarHBondContact CA-O 3.31Å; T215-S230 PolarHBondContact N-O 3.34Å; T215-S230 PolarHBondContact OG1-O 3.45Å; T215-S230 PolarHBondContact OG1-OG 3.3Å; A216-S230 WeakPolarHBondContact CB-OG 3.29Å; A216-S230 PolarHBondContact N-OG 3.41Å; A216-S230 PolarHBondContact O-N 3.3Å; A216-S230 PolarHBondContact O-OG 3.12Å; S230-T235 VanDerWaalsContact CA-O 3.3Å; S230-T235 WeakPolarHBondContact CA-O 3.47Å; S230-I273 VanDerWaalsContact CB-CG2 3.48Å; S230-I273 WeakPolarHBondContact OG-CG2 3.23Å
231	S	97.2	Very high	96.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	168	178.2	77.7	0	0	0	0	115.1	E212 V213 K233 G234 T235 I273	E212-S231 WeakPolarHBondContact OE1-CB 3.42Å; E212-S231 PolarHBondContact OE1-OG 2.86Å; V213-S231 CarbonylContact O-C 3.53Å; V213-S231 WeakPolarHBondContact O-CA 3.4Å; V213-S231 VanDerWaalsContact O-CB 3.3Å; V213-S231 WeakPolarHBondContact O-CB 3.41Å; S231-K233 PolarHBondContact O-N 3.43Å; S231-K233 VanDerWaalsContact O-N 3.13Å; S231-K233 PolarHBondContact OG-N 2.82Å; S231-G234 PolarHBondContact O-N 2.9Å; S231-G234 VanDerWaalsContact O-N 3.15Å; S231-T235 PolarHBondContact N-O 3.13Å; S231-T235 PolarHBondContact OG-OG1 3.17Å; S231-I273 PolarHBondContact O-N 3.26Å
232	S	96.8	Very high	96.5	Very high	28 Å²	28	35.1 Å²	35.1	20%	0.196	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.9	174	61.8	0	0	0	0	114.2	V213 S272	V213-S232 PolarHBondContact N-OG 2.84Å; V213-S232 VanDerWaalsContact N-OG 3.13Å; V213-S232 PolarHBondContact O-N 2.97Å; S232-S272 WeakPolarHBondContact CA-OG 3.49Å; S232-S272 WeakPolarHBondContact O-CA 3.48Å; S232-S272 WeakPolarHBondContact O-CB 3.29Å
233	K	95	Very high	96.2	Very high	74 Å²	74	33.3 Å²	33.3	32%	0.322	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	4.1	176.4	-76.7	-174	161.4	164.9	0	113.8	T211 E212 S231 T235	T211-K233 VanDerWaalsContact CB-NZ 3.28Å; T211-K233 WeakPolarHBondContact O-CE 3.44Å; T211-K233 PolarHBondContact OG1-NZ 3.19Å; E212-K233 HydrophobicContact CB-CD 4.17Å; E212-K233 HydrophobicContact CG-CD 4.32Å; E212-K233 HydrophobicContact CG-CG 4.39Å; S231-K233 PolarHBondContact O-N 3.43Å; S231-K233 VanDerWaalsContact O-N 3.13Å; S231-K233 PolarHBondContact OG-N 2.82Å; K233-T235 HydrophobicContact CB-CG2 4.4Å
234	G	95.4	Very high	95.8	Very high	19 Å²	19	30.2 Å²	30.2	20%	0.196	16%	0.164	C	C	.	.	S	Bend	trans	80.1	21.9	179.7	0	0	0	0	0	114.8	S231 S271	S231-G234 PolarHBondContact O-N 2.9Å; S231-G234 VanDerWaalsContact O-N 3.15Å; G234-S271 WeakPolarHBondContact CA-O 3.31Å; G234-S271 PolarHBondContact N-O 3.09Å
235	T	95.9	Very high	95	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.037	18%	0.176	C	C	.	.			trans	-105.4	151.7	-179.8	72.8	0	0	0	0	111.1	E212 S230 S231 K233 R237 F253	E212-T235 PolarHBondContact OE1-OG1 3.18Å; S230-T235 VanDerWaalsContact CA-O 3.3Å; S230-T235 WeakPolarHBondContact CA-O 3.47Å; S231-T235 PolarHBondContact N-O 3.13Å; S231-T235 PolarHBondContact OG-OG1 3.17Å; K233-T235 HydrophobicContact CB-CG2 4.4Å; T235-R237 PolarHBondContact OG1-NH1 2.85Å; T235-F253 HydrophobicContact CG2-CE2 4.02Å; T235-F253 HydrophobicContact CG2-CZ 3.6Å
236	I	97.9	Very high	94.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	173.1	-40.5	157.9	0	0	0	108.1	V228 F254 I273 V276 I285 T287 W296	V228-I236 HydrophobicContact CB-CG2 4.13Å; V228-I236 HydrophobicContact CG1-CG2 4.36Å; I236-F254 HydrophobicContact CB-CB 4.01Å; I236-F254 HydrophobicContact CB-CD2 4.4Å; I236-F254 HydrophobicContact CB-CG 4.49Å; I236-F254 HydrophobicContact CD1-CB 4.06Å; I236-F254 HydrophobicContact CG1-CB 4.39Å; I236-F254 PolarHBondContact N-O 3.09Å; I236-F254 VanDerWaalsContact N-O 3.11Å; I236-F254 PolarHBondContact O-N 3.25Å; I236-I273 HydrophobicContact CG1-CD1 3.85Å; I236-V276 HydrophobicContact CG2-CG2 4.43Å; I236-I285 HydrophobicContact CD1-CG2 4.43Å; I236-I285 HydrophobicContact CG2-CD1 4.41Å; I236-T287 HydrophobicContact CD1-CG2 3.31Å; I236-T287 HydrophobicContact CG1-CG2 3.76Å; I236-W296 HydrophobicContact CD1-CD2 4.07Å; I236-W296 HydrophobicContact CD1-CG 4.05Å; I236-W296 HydrophobicContact CD1-CZ2 4.32Å
237	R	96.8	Very high	93.8	Very high	30 Å²	30	35 Å²	35	11%	0.113	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.8	175.7	-74.6	174	-169.8	104.7	-10.4	108.8	E212 V228 Y229 T235 H250 F253	E212-R237 VanDerWaalsContact CD-NH2 3.32Å; E212-R237 IonicContact OE1-CZ 3.83Å; E212-R237 VanDerWaalsContact OE1-CZ 3.31Å; E212-R237 IonicContact OE1-NH1 3.43Å; E212-R237 PolarHBondContact OE1-NH1 2.88Å; E212-R237 IonicContact OE1-NH2 3.44Å; E212-R237 PolarHBondContact OE1-NH2 2.73Å; E212-R237 IonicContact OE2-CZ 2.71Å; E212-R237 IonicContact OE2-NH1 3.34Å; E212-R237 IonicContact OE2-NH2 3.9Å; E212-R237 PolarHBondContact OE2-NH2 2.99Å; V228-R237 CarbonylContact C-O 3.55Å; V228-R237 VanDerWaalsContact CA-O 3.22Å; V228-R237 WeakPolarHBondContact CA-O 3.42Å; Y229-R237 HydrophobicContact CD1-CB 4.01Å; Y229-R237 HydrophobicContact CE1-CB 3.56Å; Y229-R237 HydrophobicContact CE1-CG 4.5Å; Y229-R237 HydrophobicContact CE2-CB 4.13Å; Y229-R237 HydrophobicContact CE2-CG 4.44Å; Y229-R237 HydrophobicContact CG-CB 4.48Å; Y229-R237 PolarHBondContact N-O 3.02Å; Y229-R237 PolarHBondContact O-N 3.08Å; Y229-R237 WeakPolarHBondContact OH-CD 3.48Å; T235-R237 PolarHBondContact OG1-NH1 2.85Å; R237-H250 HydrophobicContact CB-CB 3.93Å; R237-H250 HydrophobicContact CG-CB 4.16Å; R237-F253 HydrophobicContact CG-CD2 3.74Å; R237-F253 HydrophobicContact CG-CE2 4.1Å
238	L	96.9	Very high	92.8	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.068	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.4	172.5	-179	155.9	0	0	0	108.6	T226 F227 V228 H250 T251 K252 F254 L298	T226-L238 HydrophobicContact CG2-CD1 4.12Å; T226-L238 HydrophobicContact CG2-CD2 3.89Å; T226-L238 HydrophobicContact CG2-CG 3.93Å; F227-L238 WeakPolarHBondContact O-CA 3.34Å; V228-L238 HydrophobicContact CG1-CB 3.85Å; V228-L238 HydrophobicContact CG1-CD1 4.15Å; V228-L238 HydrophobicContact CG1-CG 4.03Å; L238-H250 CarbonylContact O-C 3.6Å; L238-T251 PolarHBondContact O-N 2.74Å; L238-K252 HydrophobicContact CB-CB 4.15Å; L238-K252 PolarHBondContact N-O 3.37Å; L238-K252 PolarHBondContact O-N 3.11Å; L238-F254 HydrophobicContact CB-CE2 3.93Å; L238-F254 HydrophobicContact CD1-CE2 4.35Å; L238-L298 HydrophobicContact CD1-CD2 3.45Å; L238-L298 VanDerWaalsContact CD1-CD2 3.45Å
239	C	96.4	Very high	91.8	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.3	-177.2	-65.7	0	0	0	0	111.1	T226 F227 C247	T226-C239 WeakPolarHBondContact CA-O 3.47Å; F227-C239 HydrophobicContact CD1-CB 4.05Å; F227-C239 HydrophobicContact CD2-CB 4.37Å; F227-C239 HydrophobicContact CE1-CB 3.48Å; F227-C239 VanDerWaalsContact CE1-CB 3.48Å; F227-C239 HydrophobicContact CE2-CB 3.84Å; F227-C239 HydrophobicContact CG-CB 4.46Å; F227-C239 HydrophobicContact CZ-CB 3.37Å; F227-C239 PolarHBondContact N-O 3.36Å; F227-C239 PolarHBondContact O-N 3.03Å; C239-C247 HydrophobicContact CB-CB 3.97Å
240	D	95.1	Very high	90.9	Very high	40 Å²	40	53 Å²	53	21%	0.214	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	110.1	172.6	-172.5	-14.5	0	0	0	110	N225 R242 A243 T251	N225-D240 VanDerWaalsContact ND2-CG 3.25Å; N225-D240 PolarHBondContact ND2-OD1 2.87Å; N225-D240 PolarHBondContact ND2-OD2 2.97Å; N225-D240 CarbonylContact O-C 3.54Å; N225-D240 WeakPolarHBondContact O-CA 3.35Å; D240-R242 PolarHBondContact O-N 3.31Å; D240-R242 VanDerWaalsContact O-N 3.15Å; D240-R242 VanDerWaalsContact OD1-CB 3.31Å; D240-R242 WeakPolarHBondContact OD1-CB 3.19Å; D240-R242 PolarHBondContact OD1-N 2.88Å; D240-A243 HydrophobicContact CB-CB 4.26Å; D240-A243 WeakPolarHBondContact O-CB 3.4Å; D240-A243 PolarHBondContact O-N 3Å; D240-T251 VanDerWaalsContact CB-OG1 3.29Å; D240-T251 WeakPolarHBondContact CB-OG1 3.17Å; D240-T251 PolarHBondContact N-OG1 3.03Å; D240-T251 VanDerWaalsContact N-OG1 3.15Å
241	M	94.4	Very high	90.1	Very high	45 Å²	45	56.4 Å²	56.4	22%	0.222	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.2	179.6	-60.7	-165.5	-52.9	0	0	113.5	L187 I199 F219 C224 N225 F227	L187-M241 HydrophobicContact CD2-SD 4.41Å; I199-M241 HydrophobicContact CD1-SD 4.41Å; F219-M241 HydrophobicContact CE1-CE 4.3Å; F219-M241 HydrophobicContact CE1-SD 4.37Å; C224-M241 WeakPolarHBondContact O-CE 3.43Å; N225-M241 WeakPolarHBondContact O-CG 3.31Å; N225-M241 PolarHBondContact O-N 3.29Å; F227-M241 HydrophobicContact CD1-CG 4.11Å; F227-M241 HydrophobicContact CE1-CG 3.84Å; F227-M241 HydrophobicContact CE1-SD 4.45Å
242	R	93.4	Very high	89.8	Confident	185 Å²	185	58.9 Å²	58.9	70%	0.698	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-27.9	173.3	-67.1	171.9	179.1	157.9	3.2	112.2	N225 D240	N225-R242 HydrophobicContact CB-CG 3.71Å; N225-R242 PolarHBondContact OD1-NH1 2.75Å; N225-R242 PolarHBondContact OD1-NH2 3.49Å; D240-R242 PolarHBondContact O-N 3.31Å; D240-R242 VanDerWaalsContact O-N 3.15Å; D240-R242 VanDerWaalsContact OD1-CB 3.31Å; D240-R242 WeakPolarHBondContact OD1-CB 3.19Å; D240-R242 PolarHBondContact OD1-N 2.88Å
243	A	90.6	Very high	89.7	Confident	78 Å²	78	60.4 Å²	60.4	65%	0.645	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-39.1	-176.9	0	0	0	0	0	112	D240	D240-A243 HydrophobicContact CB-CB 4.26Å; D240-A243 WeakPolarHBondContact O-CB 3.4Å; D240-A243 PolarHBondContact O-N 3Å
244	S	88	Confident	89.8	Confident	34 Å²	34	56.9 Å²	56.9	24%	0.238	29%	0.294	C	S	.	.			trans	-150.1	131.7	174.6	179.3	0	0	0	0	109.5	L246 C247 D248	S244-L246 PolarHBondContact O-N 3.38Å; S244-L246 PolarHBondContact OG-N 2.63Å; S244-C247 PolarHBondContact O-N 3.2Å; S244-C247 PolarHBondContact O-SG 3.47Å; S244-D248 WeakPolarHBondContact CB-OD1 3.36Å; S244-D248 PolarHBondContact OG-OD1 3.34Å
245	A	80.7	Confident	89.7	Confident	67 Å²	67	60.8 Å²	60.8	55%	0.554	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.7	175.2	0	0	0	0	0	112	F197	F197-A245 WeakPolarHBondContact CE1-O 3.25Å; F197-A245 HydrophobicContact CZ-CB 4.5Å
246	L	83.9	Confident	89.4	Confident	101 Å²	101	64.1 Å²	64.1	53%	0.529	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.8	-177.9	-66.1	176.3	0	0	0	113.7	F197 I199 S244 D248	F197-L246 HydrophobicContact CE2-CD2 4.37Å; F197-L246 HydrophobicContact CZ-CD2 3.9Å; I199-L246 CarbonylContact O-C 3.59Å; S244-L246 PolarHBondContact O-N 3.38Å; S244-L246 PolarHBondContact OG-N 2.63Å; L246-D248 HydrophobicContact CB-CB 4.37Å; L246-D248 PolarHBondContact O-N 3.35Å
247	C	84.6	Confident	88.7	Confident	4 Å²	4	69.1 Å²	69.1	3%	0.027	36%	0.355	C	S	.	.			trans	37.3	32.1	-177	-54.7	0	0	0	0	114.6	I199 V200 F227 C239 S244 R249	I199-C247 VanDerWaalsContact O-CB 3.31Å; I199-C247 WeakPolarHBondContact O-CB 3.26Å; V200-C247 HydrophobicContact CG2-CB 4.26Å; F227-C247 HydrophobicContact CE1-CB 4.31Å; F227-C247 HydrophobicContact CZ-CB 3.99Å; C239-C247 HydrophobicContact CB-CB 3.97Å; S244-C247 PolarHBondContact O-N 3.2Å; S244-C247 PolarHBondContact O-SG 3.47Å; C247-R249 PolarHBondContact O-N 2.99Å
248	D	76.8	Confident	87.9	Confident	111 Å²	111	72.6 Å²	72.6	59%	0.594	37%	0.372	S	S	*	.			trans	-72.5	-24.4	-174.1	58.2	-41.4	0	0	0	111.2	S244 L246	S244-D248 WeakPolarHBondContact CB-OD1 3.36Å; S244-D248 PolarHBondContact OG-OD1 3.34Å; L246-D248 HydrophobicContact CB-CB 4.37Å; L246-D248 PolarHBondContact O-N 3.35Å
249	R	76.1	Confident	87	Confident	205 Å²	205	76.1 Å²	76.1	77%	0.774	39%	0.391	S	S	*	.	S	Bend	trans	-107.8	114.7	163.1	-64.1	-176.4	179.3	-174.4	-1.1	108.5	C247	C247-R249 PolarHBondContact O-N 2.99Å
250	H	79	Confident	86.3	Confident	74 Å²	74	81.4 Å²	81.4	34%	0.343	43%	0.425	S	S	.	.			trans	-65.2	141.3	166.4	52.1	-91.6	0	0	0	109	R237 L238 F253	R237-H250 HydrophobicContact CB-CB 3.93Å; R237-H250 HydrophobicContact CG-CB 4.16Å; L238-H250 CarbonylContact O-C 3.6Å; H250-F253 AromaticContact NE2-CD2 3.82Å; H250-F253 AromaticContact NE2-CG 3.94Å
251	T	80.1	Confident	85.6	Confident	70 Å²	70	83.9 Å²	83.9	43%	0.429	45%	0.446	S	S	.	.	S	Bend	trans	-72.4	-35.8	-179.6	-49.2	0	0	0	0	110.9	L238 D240	L238-T251 PolarHBondContact O-N 2.74Å; D240-T251 VanDerWaalsContact CB-OG1 3.29Å; D240-T251 WeakPolarHBondContact CB-OG1 3.17Å; D240-T251 PolarHBondContact N-OG1 3.03Å; D240-T251 VanDerWaalsContact N-OG1 3.15Å
252	K	92.5	Very high	84.8	Confident	53 Å²	53	87.5 Å²	87.5	23%	0.23	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	146.6	-178.5	-64	-174.9	162.8	177.5	0	111.1	L238 F254 L298 E301	L238-K252 HydrophobicContact CB-CB 4.15Å; L238-K252 PolarHBondContact N-O 3.37Å; L238-K252 PolarHBondContact O-N 3.11Å; K252-F254 HydrophobicContact CB-CD2 4.43Å; K252-F254 HydrophobicContact CB-CE2 3.69Å; K252-F254 HydrophobicContact CB-CZ 4.26Å; K252-F254 HydrophobicContact CD-CE2 4.43Å; K252-F254 HydrophobicContact CD-CZ 4.22Å; K252-L298 PolarHBondContact NZ-O 2.93Å; K252-E301 WeakPolarHBondContact CA-OE2 3.11Å; K252-E301 HydrophobicContact CB-CG 4.04Å; K252-E301 WeakPolarHBondContact CB-OE2 3.21Å; K252-E301 HydrophobicContact CD-CG 4.25Å; K252-E301 WeakPolarHBondContact CD-OE1 3.36Å; K252-E301 VanDerWaalsContact CE-OE1 3.27Å; K252-E301 WeakPolarHBondContact CE-OE1 3.46Å; K252-E301 HydrophobicContact CG-CG 4.43Å; K252-E301 WeakPolarHBondContact CG-OE1 3.32Å
253	F	94.5	Very high	84.2	Confident	60 Å²	60	86.4 Å²	86.4	26%	0.263	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	109.6	-177.7	-174.2	-108.6	0	0	0	110	T235 R237 H250 E255 E301	T235-F253 HydrophobicContact CG2-CE2 4.02Å; T235-F253 HydrophobicContact CG2-CZ 3.6Å; R237-F253 HydrophobicContact CG-CD2 3.74Å; R237-F253 HydrophobicContact CG-CE2 4.1Å; H250-F253 AromaticContact NE2-CD2 3.82Å; H250-F253 AromaticContact NE2-CG 3.94Å; F253-E255 HydrophobicContact CD1-CB 4.06Å; F253-E255 HydrophobicContact CE1-CB 3.6Å; F253-E255 HydrophobicContact CE1-CG 4.25Å; F253-E255 WeakPolarHBondContact CE1-OE2 3.22Å; F253-E255 HydrophobicContact CZ-CB 4.29Å; F253-E301 PolarHBondContact N-OE2 3.45Å
254	F	96.3	Very high	84	Confident	0 Å²	0	85.6 Å²	85.6	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.1	-178.9	-56.1	-109.7	0	0	0	109.3	I236 L238 K252 I285 W296 L298 E301	I236-F254 HydrophobicContact CB-CB 4.01Å; I236-F254 HydrophobicContact CB-CD2 4.4Å; I236-F254 HydrophobicContact CB-CG 4.49Å; I236-F254 HydrophobicContact CD1-CB 4.06Å; I236-F254 HydrophobicContact CG1-CB 4.39Å; I236-F254 PolarHBondContact N-O 3.09Å; I236-F254 VanDerWaalsContact N-O 3.11Å; I236-F254 PolarHBondContact O-N 3.25Å; L238-F254 HydrophobicContact CB-CE2 3.93Å; L238-F254 HydrophobicContact CD1-CE2 4.35Å; K252-F254 HydrophobicContact CB-CD2 4.43Å; K252-F254 HydrophobicContact CB-CE2 3.69Å; K252-F254 HydrophobicContact CB-CZ 4.26Å; K252-F254 HydrophobicContact CD-CE2 4.43Å; K252-F254 HydrophobicContact CD-CZ 4.22Å; F254-I285 HydrophobicContact CE2-CD1 4.41Å; F254-I285 HydrophobicContact CZ-CD1 4.4Å; F254-W296 HydrophobicContact CB-CD2 4.42Å; F254-W296 HydrophobicContact CB-CE3 3.93Å; F254-W296 HydrophobicContact CB-CZ3 3.96Å; F254-W296 HydrophobicContact CD1-CB 4.24Å; F254-W296 HydrophobicContact CD1-CD2 4.4Å; F254-W296 AromaticContact CD1-CE3 3.88Å; F254-W296 HydrophobicContact CD1-CE3 3.88Å; F254-W296 HydrophobicContact CG-CE3 4.41Å; F254-L298 HydrophobicContact CZ-CD2 4.02Å; F254-E301 VanDerWaalsContact CA-O 3.31Å; F254-E301 WeakPolarHBondContact CA-O 3.49Å; F254-E301 HydrophobicContact CD1-CB 4.23Å; F254-E301 HydrophobicContact CD1-CG 4.02Å; F254-E301 HydrophobicContact CD2-CG 4.33Å; F254-E301 HydrophobicContact CE1-CB 4.39Å; F254-E301 HydrophobicContact CE1-CG 3.75Å; F254-E301 HydrophobicContact CE2-CG 4.09Å; F254-E301 HydrophobicContact CG-CB 4.47Å; F254-E301 HydrophobicContact CG-CG 4.28Å; F254-E301 HydrophobicContact CZ-CG 3.78Å
255	E	93.5	Very high	84	Confident	100 Å²	100	90.6 Å²	90.6	47%	0.467	47%	0.469	S	S	.	.			trans	-145.3	138.7	179.5	-175.8	178.3	-139	0	0	108.8	F253 E301 N302	F253-E255 HydrophobicContact CD1-CB 4.06Å; F253-E255 HydrophobicContact CE1-CB 3.6Å; F253-E255 HydrophobicContact CE1-CG 4.25Å; F253-E255 WeakPolarHBondContact CE1-OE2 3.22Å; F253-E255 HydrophobicContact CZ-CB 4.29Å; E255-E301 PolarHBondContact N-O 3.28Å; E255-N302 CarbonylContact O-C 3.25Å
256	E	90	Very high	84.6	Confident	77 Å²	77	89.6 Å²	89.6	36%	0.36	45%	0.453	S	S	.	.			trans	-97.2	122.8	171.6	-176.7	173.5	-156.9	0	0	108.1	E258 K294 W296	E256-E258 PolarHBondContact O-N 3.03Å; E256-E258 VanDerWaalsContact O-N 3.07Å; E256-K294 IonicContact OE2-NZ 2.65Å; E256-K294 PolarHBondContact OE2-NZ 3.49Å; E256-W296 HydrophobicContact CB-CH2 4.06Å
257	P	83.5	Confident	85	Confident	105 Å²	105	85.3 Å²	85.3	68%	0.682	43%	0.431	S	S	*	.			trans	-59.7	115.5	176.5	-21.6	31.2	0	0	0	110.6	N302	P257-N302 WeakPolarHBondContact CD-O 3.3Å
258	E	79.3	Confident	85.3	Confident	102 Å²	102	89.7 Å²	89.7	48%	0.477	45%	0.451	S	S	.	.			trans	-78.3	133.7	170.5	-78.7	-164.9	153.6	0	0	110.6	E256 P260	E256-E258 PolarHBondContact O-N 3.03Å; E256-E258 VanDerWaalsContact O-N 3.07Å; E258-P260 WeakPolarHBondContact O-CD 3.49Å
259	D	78.2	Confident	86.1	Confident	88 Å²	88	86 Å²	86	47%	0.471	43%	0.431	S	S	.	.			trans	-66.9	119.5	168.9	-171.6	-28.7	0	0	0	109	S261 N262 R263	D259-S261 PolarHBondContact O-N 2.95Å; D259-S261 WeakPolarHBondContact OD1-CB 3.43Å; D259-S261 PolarHBondContact OD1-N 3.3Å; D259-S261 PolarHBondContact OD1-OG 3.5Å; D259-S261 PolarHBondContact OD2-OG 3.24Å; D259-N262 HydrophobicContact CB-CB 4.47Å; D259-N262 PolarHBondContact O-N 3.38Å; D259-R263 PolarHBondContact O-N 2.86Å
260	P	81.7	Confident	87	Confident	110 Å²	110	77.1 Å²	77.1	71%	0.714	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-54.8	-26.8	179.3	-24.8	33.8	0	0	0	113.5	E258 N262 R263	E258-P260 WeakPolarHBondContact O-CD 3.49Å; P260-N262 VanDerWaalsContact C-N 3.32Å; P260-R263 PolarHBondContact O-N 3.29Å
261	S	79.9	Confident	87.8	Confident	93 Å²	93	74.6 Å²	74.6	65%	0.65	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-72.3	-24.3	178.6	67	0	0	0	0	113.8	D259	D259-S261 PolarHBondContact O-N 2.95Å; D259-S261 WeakPolarHBondContact OD1-CB 3.43Å; D259-S261 PolarHBondContact OD1-N 3.3Å; D259-S261 PolarHBondContact OD1-OG 3.5Å; D259-S261 PolarHBondContact OD2-OG 3.24Å
262	N	77.9	Confident	88.6	Confident	121 Å²	121	73 Å²	73	65%	0.647	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-94.8	-4.3	176.6	-69.6	-38.1	0	0	0	112.6	D259 P260 S264 S267	D259-N262 HydrophobicContact CB-CB 4.47Å; D259-N262 PolarHBondContact O-N 3.38Å; P260-N262 VanDerWaalsContact C-N 3.32Å; N262-S264 PolarHBondContact O-N 3.35Å; N262-S267 PolarHBondContact O-OG 3.02Å
263	R	81.8	Confident	88.9	Confident	162 Å²	162	70.7 Å²	70.7	61%	0.611	37%	0.371	S	S	*	.			trans	-73.8	115.8	-178	-163.2	172.1	179.5	172.4	1.2	109.8	D259 P260	D259-R263 PolarHBondContact O-N 2.86Å; P260-R263 PolarHBondContact O-N 3.29Å
264	S	86.7	Confident	89.1	Confident	61 Å²	61	68.8 Å²	68.8	43%	0.427	37%	0.365	S	S	.	.			trans	-115	169.6	174.2	73.4	0	0	0	0	109.9	N262 F266 S267	N262-S264 PolarHBondContact O-N 3.35Å; S264-F266 PolarHBondContact O-N 2.83Å; S264-F266 PolarHBondContact OG-N 2.87Å; S264-S267 PolarHBondContact N-OG 2.99Å; S264-S267 VanDerWaalsContact O-CB 3.29Å; S264-S267 WeakPolarHBondContact O-CB 3.08Å; S264-S267 PolarHBondContact O-N 3.22Å; S264-S267 PolarHBondContact O-OG 3.47Å; S264-S267 PolarHBondContact OG-N 2.96Å; S264-S267 PolarHBondContact OG-OG 3.11Å
265	F	87.6	Confident	89.2	Confident	139 Å²	139	69.3 Å²	69.3	61%	0.61	37%	0.368	S	S	*	.	H	α-helix	trans	-52.3	-41.2	169.5	170.5	-103.6	0	0	0	112	S267 I269 Y322	F265-S267 VanDerWaalsContact C-N 3.26Å; F265-S267 PolarHBondContact O-N 2.89Å; F265-I269 HydrophobicContact CD1-CD1 4.22Å; F265-I269 HydrophobicContact CE1-CD1 3.55Å; F265-I269 HydrophobicContact CZ-CD1 3.81Å; F265-Y322 HydrophobicContact CE1-CE2 4.3Å; F265-Y322 HydrophobicContact CZ-CE2 4.48Å
266	F	92.6	Very high	89.4	Confident	46 Å²	46	64.6 Å²	64.6	20%	0.202	35%	0.346	C	S	.	.	H	α-helix	trans	-72.3	-18.5	-179.8	-64.2	-68.5	0	0	0	113.5	S264 E268 I269 I270 L318 C319 Y322 I327	S264-F266 PolarHBondContact O-N 2.83Å; S264-F266 PolarHBondContact OG-N 2.87Å; F266-E268 VanDerWaalsContact C-N 3.3Å; F266-E268 PolarHBondContact O-N 3.23Å; F266-I269 HydrophobicContact CD1-CD1 4.25Å; F266-I269 PolarHBondContact O-N 3.14Å; F266-I269 VanDerWaalsContact O-N 3.14Å; F266-I270 VanDerWaalsContact O-CG1 3.3Å; F266-I270 WeakPolarHBondContact O-CG1 3.41Å; F266-I270 PolarHBondContact O-N 3.22Å; F266-L318 HydrophobicContact CB-CD1 4.1Å; F266-L318 HydrophobicContact CD1-CB 4.29Å; F266-L318 HydrophobicContact CD2-CB 4.41Å; F266-L318 HydrophobicContact CG-CB 4.2Å; F266-L318 HydrophobicContact CG-CD1 4.47Å; F266-C319 HydrophobicContact CZ-CB 4.23Å; F266-Y322 HydrophobicContact CE1-CD2 4.42Å; F266-Y322 HydrophobicContact CE1-CG 4.07Å; F266-I327 HydrophobicContact CD1-CD1 4.12Å
267	S	91.9	Very high	89.8	Confident	11 Å²	11	62.2 Å²	62.2	8%	0.077	34%	0.335	C	S	.	.	H	α-helix	trans	-59.5	-42.3	-177.8	-61.8	0	0	0	0	111.4	N262 S264 F265 S271	N262-S267 PolarHBondContact O-OG 3.02Å; S264-S267 PolarHBondContact N-OG 2.99Å; S264-S267 VanDerWaalsContact O-CB 3.29Å; S264-S267 WeakPolarHBondContact O-CB 3.08Å; S264-S267 PolarHBondContact O-N 3.22Å; S264-S267 PolarHBondContact O-OG 3.47Å; S264-S267 PolarHBondContact OG-N 2.96Å; S264-S267 PolarHBondContact OG-OG 3.11Å; F265-S267 VanDerWaalsContact C-N 3.26Å; F265-S267 PolarHBondContact O-N 2.89Å; S267-S271 WeakPolarHBondContact O-CB 3.31Å; S267-S271 PolarHBondContact O-N 3.24Å; S267-S271 PolarHBondContact O-OG 2.63Å; S267-S271 VanDerWaalsContact O-OG 3.13Å
268	E	90.4	Very high	90.5	Very high	96 Å²	96	57.9 Å²	57.9	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-69.5	-32.7	177.9	-172.6	165.5	-171.5	0	0	112.7	F266 S271	F266-E268 VanDerWaalsContact C-N 3.3Å; F266-E268 PolarHBondContact O-N 3.23Å; E268-S271 PolarHBondContact O-OG 3.23Å
269	I	94.4	Very high	91.4	Very high	33 Å²	33	53 Å²	53	17%	0.169	28%	0.282	C	S	.	.	H	α-helix	trans	-71	-48.1	178.4	-58	176.7	0	0	0	110.2	F265 F266 S272 Y322 I327 F328	F265-I269 HydrophobicContact CD1-CD1 4.22Å; F265-I269 HydrophobicContact CE1-CD1 3.55Å; F265-I269 HydrophobicContact CZ-CD1 3.81Å; F266-I269 HydrophobicContact CD1-CD1 4.25Å; F266-I269 PolarHBondContact O-N 3.14Å; F266-I269 VanDerWaalsContact O-N 3.14Å; I269-S272 WeakPolarHBondContact O-CB 3.28Å; I269-Y322 HydrophobicContact CD1-CD2 3.78Å; I269-Y322 HydrophobicContact CD1-CE2 3.69Å; I269-I327 HydrophobicContact CB-CD1 4.42Å; I269-I327 HydrophobicContact CG2-CD1 3.79Å; I269-I327 HydrophobicContact CG2-CG1 3.9Å; I269-I327 HydrophobicContact CG2-CG2 4.04Å; I269-F328 HydrophobicContact CG2-CD1 4.34Å; I269-F328 HydrophobicContact CG2-CE1 3.84Å
270	I	95.8	Very high	92.4	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.092	28%	0.278	C	S	.	.	H	α-helix	trans	-79.6	-16.7	-176.1	70.2	-172.2	0	0	0	113.3	F266 S272 D289 Y290 L291 L318 I327	F266-I270 VanDerWaalsContact O-CG1 3.3Å; F266-I270 WeakPolarHBondContact O-CG1 3.41Å; F266-I270 PolarHBondContact O-N 3.22Å; I270-S272 VanDerWaalsContact C-N 3.31Å; I270-D289 WeakPolarHBondContact O-CB 3.42Å; I270-Y290 HydrophobicContact CG2-CD1 4.01Å; I270-Y290 HydrophobicContact CG2-CG 4.37Å; I270-Y290 PolarHBondContact O-N 2.99Å; I270-L291 HydrophobicContact CD1-CD1 3.92Å; I270-L318 HydrophobicContact CD1-CD1 4.22Å; I270-L318 HydrophobicContact CG2-CD1 4.39Å; I270-L318 HydrophobicContact CG2-CD2 3.85Å; I270-I327 HydrophobicContact CG2-CD1 3.81Å; I270-I327 HydrophobicContact CG2-CG1 4.1Å
271	S	95	Very high	93.1	Very high	22 Å²	22	50.7 Å²	50.7	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-77	-18.6	175.2	68.6	0	0	0	0	112.8	G234 S267 E268 I273	G234-S271 WeakPolarHBondContact CA-O 3.31Å; G234-S271 PolarHBondContact N-O 3.09Å; S267-S271 WeakPolarHBondContact O-CB 3.31Å; S267-S271 PolarHBondContact O-N 3.24Å; S267-S271 PolarHBondContact O-OG 2.63Å; S267-S271 VanDerWaalsContact O-OG 3.13Å; E268-S271 PolarHBondContact O-OG 3.23Å; S271-I273 PolarHBondContact O-N 2.88Å; S271-I273 VanDerWaalsContact O-N 3.15Å
272	S	97.2	Very high	93.9	Very high	36 Å²	36	46.4 Å²	46.4	25%	0.252	24%	0.237	S	C	.	.	S	Bend	trans	-50.9	119.6	174	-177.9	0	0	0	0	111.1	S232 I269 I270 S274	S232-S272 WeakPolarHBondContact CA-OG 3.49Å; S232-S272 WeakPolarHBondContact O-CA 3.48Å; S232-S272 WeakPolarHBondContact O-CB 3.29Å; I269-S272 WeakPolarHBondContact O-CB 3.28Å; I270-S272 VanDerWaalsContact C-N 3.31Å; S272-S274 PolarHBondContact O-N 2.9Å
273	I	98.5	Very high	94.9	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	23%	0.229	C	C	.	.			trans	-77.9	124.9	177.9	-68.4	158.4	0	0	0	107.8	T215 S230 S231 I236 S271 D275 T287 R288	T215-I273 WeakPolarHBondContact CB-O 3.46Å; T215-I273 WeakPolarHBondContact CG2-O 3.11Å; T215-I273 PolarHBondContact OG1-O 2.97Å; S230-I273 VanDerWaalsContact CB-CG2 3.48Å; S230-I273 WeakPolarHBondContact OG-CG2 3.23Å; S231-I273 PolarHBondContact O-N 3.26Å; I236-I273 HydrophobicContact CG1-CD1 3.85Å; S271-I273 PolarHBondContact O-N 2.88Å; S271-I273 VanDerWaalsContact O-N 3.15Å; I273-D275 WeakPolarHBondContact CG2-O 3.46Å; I273-T287 HydrophobicContact CD1-CG2 4.14Å; I273-T287 HydrophobicContact CG2-CG2 4.23Å; I273-R288 CarbonylContact C-O 3.6Å
274	S	98.2	Very high	95.7	Very high	20 Å²	20	41.1 Å²	41.1	14%	0.14	21%	0.208	C	C	.	.			trans	-91	-25.8	178.2	55.8	0	0	0	0	113.9	S272 R288 F331	S272-S274 PolarHBondContact O-N 2.9Å; S274-R288 PolarHBondContact N-O 2.89Å; S274-R288 WeakPolarHBondContact OG-CG 3.35Å; S274-R288 PolarHBondContact OG-O 3Å; S274-F331 PolarHBondContact OG-O 3.12Å
275	D	98.5	Very high	96.2	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.053	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147.2	179.9	-166.5	23.2	0	0	0	111.1	I273 T287 R288 E332 C333	I273-D275 WeakPolarHBondContact CG2-O 3.46Å; D275-T287 WeakPolarHBondContact O-CA 3.29Å; D275-R288 HydrophobicContact CB-CB 4.36Å; D275-R288 PolarHBondContact O-N 3.22Å; D275-E332 WeakPolarHBondContact OD2-CA 3.46Å; D275-C333 PolarHBondContact OD2-N 2.88Å
276	V	98.4	Very high	96.7	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.5	177.5	70.3	0	0	0	0	109.2	A216 V228 I236 I285 M286 T287	A216-V276 HydrophobicContact CB-CB 4.34Å; A216-V276 HydrophobicContact CB-CG1 3.69Å; V228-V276 HydrophobicContact CG2-CG1 4.15Å; V228-V276 HydrophobicContact CG2-CG2 3.82Å; I236-V276 HydrophobicContact CG2-CG2 4.43Å; V276-I285 HydrophobicContact CG2-CG2 3.47Å; V276-I285 VanDerWaalsContact CG2-CG2 3.47Å; V276-M286 CarbonylContact C-O 3.59Å; V276-M286 WeakPolarHBondContact CA-O 3.33Å; V276-T287 HydrophobicContact CG2-CG2 4.07Å
277	K	98.5	Very high	97	Very high	26 Å²	26	29.6 Å²	29.6	11%	0.113	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	118.5	-175.4	-70.2	-64.3	178.2	176.3	0	113.8	E218 M286 C333 W335	E218-K277 VanDerWaalsContact OE1-CD 3.3Å; E218-K277 WeakPolarHBondContact OE1-CD 3.18Å; E218-K277 IonicContact OE1-NZ 3.04Å; E218-K277 PolarHBondContact OE1-NZ 3.3Å; E218-K277 VanDerWaalsContact OE2-CA 3.23Å; E218-K277 WeakPolarHBondContact OE2-CA 3.34Å; K277-M286 HydrophobicContact CB-CB 4.43Å; K277-M286 HydrophobicContact CB-CE 4Å; K277-M286 HydrophobicContact CG-CE 4.46Å; K277-M286 PolarHBondContact N-O 2.88Å; K277-M286 PolarHBondContact O-N 3.45Å; K277-C333 WeakPolarHBondContact CG-O 3.36Å; K277-W335 PolarHBondContact O-NE1 2.93Å; K277-W335 VanDerWaalsContact O-NE1 3.16Å
278	F	98.6	Very high	97.3	Very high	14 Å²	14	29 Å²	29	6%	0.061	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	140.4	164.7	-77.9	-72.8	0	0	0	110.7	E218 F219 H220 P221 V228 Y284 I285 L298 W335	E218-F278 HydrophobicContact CB-CD2 4.32Å; E218-F278 HydrophobicContact CG-CD2 4.37Å; E218-F278 WeakPolarHBondContact O-CE2 3.39Å; E218-F278 PolarHBondContact OE2-N 3.21Å; F219-F278 VanDerWaalsContact O-CD2 3.27Å; F219-F278 WeakPolarHBondContact O-CD2 3.44Å; H220-F278 HydrophobicContact CB-CE2 4.16Å; H220-F278 HydrophobicContact CB-CZ 4.1Å; H220-F278 AromaticContact CD2-CD1 3.96Å; H220-F278 AromaticContact CD2-CE1 3.66Å; P221-F278 HydrophobicContact CG-CB 4.31Å; V228-F278 HydrophobicContact CB-CE2 4.28Å; V228-F278 HydrophobicContact CB-CZ 4.22Å; V228-F278 HydrophobicContact CG1-CE1 4.2Å; V228-F278 HydrophobicContact CG1-CE2 4Å; V228-F278 HydrophobicContact CG1-CZ 3.44Å; V228-F278 VanDerWaalsContact CG1-CZ 3.44Å; V228-F278 HydrophobicContact CG2-CD2 4.21Å; V228-F278 HydrophobicContact CG2-CE2 3.55Å; V228-F278 HydrophobicContact CG2-CZ 3.9Å; F278-Y284 WeakPolarHBondContact CA-O 3.06Å; F278-I285 HydrophobicContact CD1-CG1 3.89Å; F278-I285 HydrophobicContact CE1-CD1 4.24Å; F278-I285 HydrophobicContact CE1-CG1 3.73Å; F278-L298 HydrophobicContact CE1-CD1 4.22Å; F278-L298 HydrophobicContact CE1-CD2 4.15Å; F278-W335 VanDerWaalsContact O-CD1 3.26Å; F278-W335 PolarHBondContact O-NE1 3.24Å
279	S	98.4	Very high	97.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.			trans	-64.8	151.4	164.5	64.2	0	0	0	0	110	S281 G282 R283 Y284 D339	S279-S281 PolarHBondContact O-N 3.14Å; S279-S281 PolarHBondContact OG-OG 3.08Å; S279-G282 WeakPolarHBondContact O-CA 3.32Å; S279-G282 PolarHBondContact O-N 3.27Å; S279-G282 PolarHBondContact OG-N 3.48Å; S279-R283 PolarHBondContact OG-N 3.39Å; S279-Y284 PolarHBondContact N-O 3.45Å; S279-Y284 PolarHBondContact OG-N 2.86Å; S279-Y284 PolarHBondContact OG-O 2.87Å; S279-D339 WeakPolarHBondContact CB-OD2 3.28Å
280	H	97.6	Very high	97.8	Very high	84 Å²	84	23.9 Å²	23.9	39%	0.389	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.9	178.9	-58.2	90.7	0	0	0	112.6	H222 G282 N336 D339	H222-H280 PolarHBondContact NE2-O 2.77Å; H280-G282 PolarHBondContact O-N 3.13Å; H280-N336 PolarHBondContact CE1-O 3.16Å; H280-N336 PolarHBondContact ND1-O 3.12Å; H280-D339 WeakPolarHBondContact CB-OD1 3.24Å; H280-D339 IonicContact CE1-OD1 3.31Å; H280-D339 IonicContact CG-OD1 2.81Å; H280-D339 VanDerWaalsContact N-CG 3.33Å; H280-D339 PolarHBondContact N-OD1 2.91Å; H280-D339 PolarHBondContact N-OD2 3.11Å; H280-D339 VanDerWaalsContact N-OD2 3.12Å; H280-D339 IonicContact ND1-OD1 3.53Å; H280-D339 PolarHBondContact ND1-OD1 2.83Å
281	S	97	Very high	97.9	Very high	66 Å²	66	23.1 Å²	23.1	46%	0.462	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.4	172.7	56.5	0	0	0	0	114.4	S279 R283 D339	S279-S281 PolarHBondContact O-N 3.14Å; S279-S281 PolarHBondContact OG-OG 3.08Å; S281-R283 PolarHBondContact O-N 3.21Å; S281-D339 WeakPolarHBondContact CB-OD2 3.47Å; S281-D339 PolarHBondContact N-OD2 2.8Å; S281-D339 PolarHBondContact OG-OD2 2.77Å
282	G	97.5	Very high	98	Very high	3 Å²	3	22.5 Å²	22.5	3%	0.031	11%	0.113	C	C	.	.	S	Bend	trans	72.6	-4.6	-174.4	0	0	0	0	0	114.8	H220 S279 H280 L298	H220-G282 WeakPolarHBondContact NE2-CA 3.35Å; H220-G282 PolarHBondContact NE2-O 3.07Å; S279-G282 WeakPolarHBondContact O-CA 3.32Å; S279-G282 PolarHBondContact O-N 3.27Å; S279-G282 PolarHBondContact OG-N 3.48Å; H280-G282 PolarHBondContact O-N 3.13Å; G282-L298 WeakPolarHBondContact O-CD1 3.26Å
283	R	97.4	Very high	98.1	Very high	130 Å²	130	20.8 Å²	20.8	49%	0.491	10%	0.101	S	C	.	.	S	Bend	trans	-80.3	-30.6	-173.8	179.3	171.7	174.4	172.9	0.3	114	S279 S281 D297 L298	S279-R283 PolarHBondContact OG-N 3.39Å; S281-R283 PolarHBondContact O-N 3.21Å; R283-D297 IonicContact CZ-OD2 3.5Å; R283-D297 IonicContact NE-OD2 3.43Å; R283-D297 PolarHBondContact NE-OD2 3.37Å; R283-D297 IonicContact NH2-OD2 3.01Å; R283-D297 PolarHBondContact NH2-OD2 3.46Å; R283-L298 WeakPolarHBondContact O-CG 3.29Å; R283-L298 PolarHBondContact O-N 3Å; R283-L298 VanDerWaalsContact O-N 3.12Å
284	Y	98.5	Very high	98.1	Very high	42 Å²	42	22.2 Å²	22.2	17%	0.165	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	152.5	-172.4	-51	-75.7	0	0	0	111.6	F278 S279 V295 W296 D297 I305	F278-Y284 WeakPolarHBondContact CA-O 3.06Å; S279-Y284 PolarHBondContact N-O 3.45Å; S279-Y284 PolarHBondContact OG-N 2.86Å; S279-Y284 PolarHBondContact OG-O 2.87Å; Y284-V295 HydrophobicContact CD1-CG1 4.3Å; Y284-V295 HydrophobicContact CG-CG1 4.29Å; Y284-W296 CarbonylContact C-O 3.57Å; Y284-W296 WeakPolarHBondContact CA-O 3.47Å; Y284-W296 WeakPolarHBondContact CB-O 3.49Å; Y284-D297 HydrophobicContact CD1-CB 4.18Å; Y284-D297 HydrophobicContact CE1-CB 4.22Å; Y284-I305 HydrophobicContact CD1-CD1 3.64Å; Y284-I305 HydrophobicContact CE1-CD1 3.57Å
285	I	98.4	Very high	98.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.9	167.1	-58.4	165.4	0	0	0	107.6	V228 I236 F254 V276 F278 T287 V295 W296 L298	V228-I285 HydrophobicContact CG1-CD1 3.74Å; I236-I285 HydrophobicContact CD1-CG2 4.43Å; I236-I285 HydrophobicContact CG2-CD1 4.41Å; F254-I285 HydrophobicContact CE2-CD1 4.41Å; F254-I285 HydrophobicContact CZ-CD1 4.4Å; V276-I285 HydrophobicContact CG2-CG2 3.47Å; V276-I285 VanDerWaalsContact CG2-CG2 3.47Å; F278-I285 HydrophobicContact CD1-CG1 3.89Å; F278-I285 HydrophobicContact CE1-CD1 4.24Å; F278-I285 HydrophobicContact CE1-CG1 3.73Å; I285-T287 HydrophobicContact CG2-CG2 4.25Å; I285-V295 CarbonylContact O-C 3.48Å; I285-V295 WeakPolarHBondContact O-CA 3.4Å; I285-W296 HydrophobicContact CB-CB 4.34Å; I285-W296 PolarHBondContact N-O 3.12Å; I285-W296 PolarHBondContact O-N 3.31Å; I285-L298 HydrophobicContact CD1-CD2 3.32Å; I285-L298 HydrophobicContact CG1-CD2 3.62Å; I285-L298 HydrophobicContact CG1-CG 4.49Å
286	M	98.6	Very high	98.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.3	166.4	176.1	169.7	60.1	0	0	109.8	V276 K277 V293 K294 C333 W335 I342	V276-M286 CarbonylContact C-O 3.59Å; V276-M286 WeakPolarHBondContact CA-O 3.33Å; K277-M286 HydrophobicContact CB-CB 4.43Å; K277-M286 HydrophobicContact CB-CE 4Å; K277-M286 HydrophobicContact CG-CE 4.46Å; K277-M286 PolarHBondContact N-O 2.88Å; K277-M286 PolarHBondContact O-N 3.45Å; M286-V293 HydrophobicContact CG-CG1 3.57Å; M286-V293 HydrophobicContact SD-CG1 3.62Å; M286-K294 CarbonylContact C-O 3.59Å; M286-K294 VanDerWaalsContact CA-O 3.3Å; M286-K294 WeakPolarHBondContact CA-O 3.09Å; M286-C333 HydrophobicContact CE-CB 3.66Å; M286-C333 VanDerWaalsContact CE-SG 3.59Å; M286-C333 HydrophobicContact CG-CB 4.42Å; M286-C333 HydrophobicContact SD-CB 3.91Å; M286-W335 HydrophobicContact CB-CH2 4.39Å; M286-W335 HydrophobicContact CB-CZ2 3.45Å; M286-W335 VanDerWaalsContact CB-CZ2 3.45Å; M286-W335 HydrophobicContact CE-CD2 4.17Å; M286-W335 HydrophobicContact CE-CG 4.06Å; M286-W335 HydrophobicContact CG-CZ2 4.49Å; M286-I342 HydrophobicContact CE-CG2 4.34Å; M286-I342 HydrophobicContact SD-CB 4.12Å; M286-I342 HydrophobicContact SD-CD1 3.86Å; M286-I342 HydrophobicContact SD-CG1 3.75Å; M286-I342 HydrophobicContact SD-CG2 3.28Å; M286-I342 WeakPolarHBondContact SD-CG2 3.21Å
287	T	98.6	Very high	98.1	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.018	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141	172.4	52.6	0	0	0	0	110.8	I236 I273 D275 V276 I285 V293 K294 W296	I236-T287 HydrophobicContact CD1-CG2 3.31Å; I236-T287 HydrophobicContact CG1-CG2 3.76Å; I273-T287 HydrophobicContact CD1-CG2 4.14Å; I273-T287 HydrophobicContact CG2-CG2 4.23Å; D275-T287 WeakPolarHBondContact O-CA 3.29Å; V276-T287 HydrophobicContact CG2-CG2 4.07Å; I285-T287 HydrophobicContact CG2-CG2 4.25Å; T287-V293 CarbonylContact O-C 3.56Å; T287-V293 WeakPolarHBondContact O-CA 3.23Å; T287-K294 PolarHBondContact N-O 3.49Å; T287-K294 PolarHBondContact O-N 3.29Å; T287-W296 PolarHBondContact OG1-NE1 2.87Å; T287-W296 VanDerWaalsContact OG1-NE1 3.07Å
288	R	98.6	Very high	98	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	113.6	171.6	178.1	65.4	-157.7	-111.4	0.7	110	I273 S274 D275 Y290 T292 V293 V310 H311 F331 C333 T344 G345	I273-R288 CarbonylContact C-O 3.6Å; S274-R288 PolarHBondContact N-O 2.89Å; S274-R288 WeakPolarHBondContact OG-CG 3.35Å; S274-R288 PolarHBondContact OG-O 3Å; D275-R288 HydrophobicContact CB-CB 4.36Å; D275-R288 PolarHBondContact O-N 3.22Å; R288-Y290 PolarHBondContact NH2-O 2.77Å; R288-T292 WeakPolarHBondContact CD-O 3.47Å; R288-V293 VanDerWaalsContact CD-CG2 3.42Å; R288-V310 VanDerWaalsContact NH1-CG1 3.34Å; R288-H311 PolarHBondContact NH2-CE1 2.85Å; R288-H311 PolarHBondContact NH2-NE2 2.88Å; R288-F331 HydrophobicContact CG-CB 4.06Å; R288-F331 WeakPolarHBondContact CG-O 3.48Å; R288-C333 HydrophobicContact CB-CB 4.09Å; R288-T344 PolarHBondContact NH1-OG1 2.87Å; R288-G345 PolarHBondContact NH1-O 2.97Å
289	D	97.5	Very high	97.9	Very high	13 Å²	13	26.7 Å²	26.7	7%	0.07	13%	0.131	C	C	.	.			trans	-95	-173.9	163.7	72	40.8	0	0	0	109.7	I270 L291 T292 K294	I270-D289 WeakPolarHBondContact O-CB 3.42Å; D289-L291 PolarHBondContact O-N 2.97Å; D289-L291 PolarHBondContact OD1-N 2.92Å; D289-T292 VanDerWaalsContact CG-OG1 3.24Å; D289-T292 PolarHBondContact N-O 3.15Å; D289-T292 WeakPolarHBondContact OD1-CA 3.42Å; D289-T292 PolarHBondContact OD1-N 3.18Å; D289-T292 PolarHBondContact OD1-OG1 2.88Å; D289-T292 PolarHBondContact OD2-OG1 2.83Å; D289-K294 WeakPolarHBondContact OD2-CE 3.06Å; D289-K294 IonicContact OD2-NZ 2.92Å
290	Y	97.8	Very high	97.7	Very high	7 Å²	7	29.8 Å²	29.8	3%	0.027	15%	0.146	C	C	.	.	S	Bend	trans	-60	-50	-175.7	-171.6	-111.3	0	0	0	111.9	I270 R288 H311 L318 L321 C326 I327 F331 Y347	I270-Y290 HydrophobicContact CG2-CD1 4.01Å; I270-Y290 HydrophobicContact CG2-CG 4.37Å; I270-Y290 PolarHBondContact O-N 2.99Å; R288-Y290 PolarHBondContact NH2-O 2.77Å; Y290-H311 PolarHBondContact O-NE2 2.89Å; Y290-L318 HydrophobicContact CD1-CD2 4.16Å; Y290-L318 HydrophobicContact CE1-CD2 4.02Å; Y290-L321 HydrophobicContact CE1-CD1 4.28Å; Y290-C326 WeakPolarHBondContact CE2-O 3.43Å; Y290-I327 HydrophobicContact CD1-CG1 4.21Å; Y290-I327 WeakPolarHBondContact CD2-O 3.49Å; Y290-I327 HydrophobicContact CE1-CG1 4.15Å; Y290-I327 HydrophobicContact CE2-CG1 4.48Å; Y290-I327 HydrophobicContact CG-CG1 4.4Å; Y290-F331 HydrophobicContact CE2-CE2 4.21Å; Y290-Y347 HydrophobicContact CE2-CE2 4.48Å; Y290-Y347 WeakPolarHBondContact CE2-OH 3.27Å; Y290-Y347 WeakPolarHBondContact OH-CE2 3.48Å; Y290-Y347 PolarHBondContact OH-OH 3.43Å
291	L	97.2	Very high	97.6	Very high	3 Å²	3	29 Å²	29	2%	0.016	14%	0.143	C	C	.	.	S	Bend	trans	-96	-21.8	-171.4	-64.9	-179.4	0	0	0	114	I270 D289 V310 L314 R315	I270-L291 HydrophobicContact CD1-CD1 3.92Å; D289-L291 PolarHBondContact O-N 2.97Å; D289-L291 PolarHBondContact OD1-N 2.92Å; L291-V310 WeakPolarHBondContact O-CB 3.36Å; L291-V310 PolarHBondContact O-N 3.33Å; L291-L314 HydrophobicContact CD2-CB 4.48Å; L291-R315 HydrophobicContact CD1-CB 4.44Å
292	T	97.8	Very high	97.5	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.055	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.4	-165.6	86	0	0	0	0	113.6	R288 D289 K294 Y308	R288-T292 WeakPolarHBondContact CD-O 3.47Å; D289-T292 VanDerWaalsContact CG-OG1 3.24Å; D289-T292 PolarHBondContact N-O 3.15Å; D289-T292 WeakPolarHBondContact OD1-CA 3.42Å; D289-T292 PolarHBondContact OD1-N 3.18Å; D289-T292 PolarHBondContact OD1-OG1 2.88Å; D289-T292 PolarHBondContact OD2-OG1 2.83Å; T292-K294 VanDerWaalsContact OG1-CE 3.26Å; T292-K294 WeakPolarHBondContact OG1-CE 3.43Å; T292-Y308 CarbonylContact C-O 3.57Å; T292-Y308 VanDerWaalsContact CA-O 3.25Å; T292-Y308 WeakPolarHBondContact CA-O 3.47Å; T292-Y308 WeakPolarHBondContact CB-O 3.42Å
293	V	98.6	Very high	97.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.4	161.9	178.1	0	0	0	0	108	M286 T287 R288 Y308 V310 I342 T344	M286-V293 HydrophobicContact CG-CG1 3.57Å; M286-V293 HydrophobicContact SD-CG1 3.62Å; T287-V293 CarbonylContact O-C 3.56Å; T287-V293 WeakPolarHBondContact O-CA 3.23Å; R288-V293 VanDerWaalsContact CD-CG2 3.42Å; V293-Y308 PolarHBondContact N-O 3.03Å; V293-Y308 PolarHBondContact O-N 3.01Å; V293-V310 HydrophobicContact CB-CG2 4.49Å; V293-V310 HydrophobicContact CG2-CG2 3.74Å; V293-I342 HydrophobicContact CG1-CG2 4.01Å; V293-T344 HydrophobicContact CG2-CG2 3.68Å
294	K	98.3	Very high	97.5	Very high	35 Å²	35	31.9 Å²	31.9	15%	0.152	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.8	179.9	-59.9	176	-175.5	-173.3	0	110.1	E256 M286 T287 D289 T292 W296 P304 E306 T307	E256-K294 IonicContact OE2-NZ 2.65Å; E256-K294 PolarHBondContact OE2-NZ 3.49Å; M286-K294 CarbonylContact C-O 3.59Å; M286-K294 VanDerWaalsContact CA-O 3.3Å; M286-K294 WeakPolarHBondContact CA-O 3.09Å; T287-K294 PolarHBondContact N-O 3.49Å; T287-K294 PolarHBondContact O-N 3.29Å; D289-K294 WeakPolarHBondContact OD2-CE 3.06Å; D289-K294 IonicContact OD2-NZ 2.92Å; T292-K294 VanDerWaalsContact OG1-CE 3.26Å; T292-K294 WeakPolarHBondContact OG1-CE 3.43Å; K294-W296 HydrophobicContact CD-CZ2 4.33Å; K294-P304 HydrophobicContact CB-CB 3.93Å; K294-P304 HydrophobicContact CB-CG 4.42Å; K294-P304 HydrophobicContact CD-CG 4.18Å; K294-P304 HydrophobicContact CG-CB 4.46Å; K294-P304 HydrophobicContact CG-CG 4.44Å; K294-E306 CarbonylContact C-O 3.55Å; K294-E306 WeakPolarHBondContact CA-O 3.29Å; K294-T307 HydrophobicContact CG-CG2 4.11Å
295	V	98.5	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.7	172.3	-175.6	0	0	0	0	108.6	Y284 I285 P304 I305 E306 Y308 W335 I342	Y284-V295 HydrophobicContact CD1-CG1 4.3Å; Y284-V295 HydrophobicContact CG-CG1 4.29Å; I285-V295 CarbonylContact O-C 3.48Å; I285-V295 WeakPolarHBondContact O-CA 3.4Å; V295-P304 CarbonylContact O-C 3.45Å; V295-P304 WeakPolarHBondContact O-CA 3.43Å; V295-P304 WeakPolarHBondContact O-CB 3.38Å; V295-I305 HydrophobicContact CB-CG1 4.19Å; V295-I305 HydrophobicContact CG1-CD1 3.97Å; V295-I305 HydrophobicContact CG1-CG1 4Å; V295-I305 WeakPolarHBondContact O-CG1 3.47Å; V295-I305 PolarHBondContact O-N 2.59Å; V295-E306 HydrophobicContact CB-CB 4.04Å; V295-E306 HydrophobicContact CG2-CB 4.26Å; V295-E306 PolarHBondContact N-O 2.78Å; V295-E306 PolarHBondContact O-N 2.98Å; V295-Y308 HydrophobicContact CG2-CE2 4.2Å; V295-W335 HydrophobicContact CG1-CH2 3.78Å; V295-W335 HydrophobicContact CG1-CZ2 4.34Å; V295-W335 HydrophobicContact CG2-CH2 3.94Å; V295-I342 HydrophobicContact CG2-CD1 3.48Å; V295-I342 VanDerWaalsContact CG2-CD1 3.48Å
296	W	98.5	Very high	97.4	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.8	180	-55.8	80.9	0	0	0	109	I236 F254 E256 Y284 I285 T287 K294 R303 P304	I236-W296 HydrophobicContact CD1-CD2 4.07Å; I236-W296 HydrophobicContact CD1-CG 4.05Å; I236-W296 HydrophobicContact CD1-CZ2 4.32Å; F254-W296 HydrophobicContact CB-CD2 4.42Å; F254-W296 HydrophobicContact CB-CE3 3.93Å; F254-W296 HydrophobicContact CB-CZ3 3.96Å; F254-W296 HydrophobicContact CD1-CB 4.24Å; F254-W296 HydrophobicContact CD1-CD2 4.4Å; F254-W296 AromaticContact CD1-CE3 3.88Å; F254-W296 HydrophobicContact CD1-CE3 3.88Å; F254-W296 HydrophobicContact CG-CE3 4.41Å; E256-W296 HydrophobicContact CB-CH2 4.06Å; Y284-W296 CarbonylContact C-O 3.57Å; Y284-W296 WeakPolarHBondContact CA-O 3.47Å; Y284-W296 WeakPolarHBondContact CB-O 3.49Å; I285-W296 HydrophobicContact CB-CB 4.34Å; I285-W296 PolarHBondContact N-O 3.12Å; I285-W296 PolarHBondContact O-N 3.31Å; T287-W296 PolarHBondContact OG1-NE1 2.87Å; T287-W296 VanDerWaalsContact OG1-NE1 3.07Å; K294-W296 HydrophobicContact CD-CZ2 4.33Å; W296-R303 VanDerWaalsContact CE3-C 3.42Å; W296-P304 HydrophobicContact CD2-CB 4Å; W296-P304 HydrophobicContact CE3-CB 4.31Å; W296-P304 HydrophobicContact CG-CB 4.43Å; W296-P304 HydrophobicContact CZ2-CB 4.28Å; W296-P304 HydrophobicContact CZ2-CG 4.44Å
297	D	97.7	Very high	97.3	Very high	16 Å²	16	37.3 Å²	37.3	9%	0.086	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	133.3	166.1	-172.6	-53.7	0	0	0	107.3	R283 Y284 N299 M300 I305	R283-D297 IonicContact CZ-OD2 3.5Å; R283-D297 IonicContact NE-OD2 3.43Å; R283-D297 PolarHBondContact NE-OD2 3.37Å; R283-D297 IonicContact NH2-OD2 3.01Å; R283-D297 PolarHBondContact NH2-OD2 3.46Å; Y284-D297 HydrophobicContact CD1-CB 4.18Å; Y284-D297 HydrophobicContact CE1-CB 4.22Å; D297-N299 PolarHBondContact O-N 3Å; D297-N299 WeakPolarHBondContact OD1-CB 3.35Å; D297-N299 PolarHBondContact OD1-N 3.35Å; D297-N299 PolarHBondContact OD1-ND2 3.21Å; D297-M300 HydrophobicContact CB-CB 4.38Å; D297-M300 CarbonylContact O-C 3.59Å; D297-M300 PolarHBondContact O-N 2.99Å; D297-I305 HydrophobicContact CB-CD1 4.4Å; D297-I305 HydrophobicContact CB-CG2 3.89Å
298	L	96.3	Very high	97.3	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-16.6	179	-74.3	-174.7	0	0	0	114.4	L238 K252 F254 F278 G282 R283 I285	L238-L298 HydrophobicContact CD1-CD2 3.45Å; L238-L298 VanDerWaalsContact CD1-CD2 3.45Å; K252-L298 PolarHBondContact NZ-O 2.93Å; F254-L298 HydrophobicContact CZ-CD2 4.02Å; F278-L298 HydrophobicContact CE1-CD1 4.22Å; F278-L298 HydrophobicContact CE1-CD2 4.15Å; G282-L298 WeakPolarHBondContact O-CD1 3.26Å; R283-L298 WeakPolarHBondContact O-CG 3.29Å; R283-L298 PolarHBondContact O-N 3Å; R283-L298 VanDerWaalsContact O-N 3.12Å; I285-L298 HydrophobicContact CD1-CD2 3.32Å; I285-L298 HydrophobicContact CG1-CD2 3.62Å; I285-L298 HydrophobicContact CG1-CG 4.49Å
299	N	96.1	Very high	97.2	Very high	122 Å²	122	41.9 Å²	41.9	65%	0.652	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.1	177.2	-53.9	-62.6	0	0	0	113.8	D297	D297-N299 PolarHBondContact O-N 3Å; D297-N299 WeakPolarHBondContact OD1-CB 3.35Å; D297-N299 PolarHBondContact OD1-N 3.35Å; D297-N299 PolarHBondContact OD1-ND2 3.21Å
300	M	95.9	Very high	97.2	Very high	66 Å²	66	41.3 Å²	41.3	33%	0.325	20%	0.202	S	C	.	.			trans	-130.2	95	179.3	-173.2	172.5	-67.1	0	0	110.4	D297 N302 R303 I305	D297-M300 HydrophobicContact CB-CB 4.38Å; D297-M300 CarbonylContact O-C 3.59Å; D297-M300 PolarHBondContact O-N 2.99Å; M300-N302 VanDerWaalsContact CG-OD1 3.25Å; M300-N302 WeakPolarHBondContact CG-OD1 3.28Å; M300-R303 HydrophobicContact CG-CG 4.37Å; M300-R303 HydrophobicContact SD-CG 3.94Å; M300-I305 HydrophobicContact SD-CG2 4.15Å
301	E	95.1	Very high	97.2	Very high	66 Å²	66	41 Å²	41	31%	0.308	20%	0.201	S	C	.	.			trans	-84.1	-25.1	-174.1	-70.6	168.2	-128.5	0	0	113.9	K252 F253 F254 E255 R303	K252-E301 WeakPolarHBondContact CA-OE2 3.11Å; K252-E301 HydrophobicContact CB-CG 4.04Å; K252-E301 WeakPolarHBondContact CB-OE2 3.21Å; K252-E301 HydrophobicContact CD-CG 4.25Å; K252-E301 WeakPolarHBondContact CD-OE1 3.36Å; K252-E301 VanDerWaalsContact CE-OE1 3.27Å; K252-E301 WeakPolarHBondContact CE-OE1 3.46Å; K252-E301 HydrophobicContact CG-CG 4.43Å; K252-E301 WeakPolarHBondContact CG-OE1 3.32Å; F253-E301 PolarHBondContact N-OE2 3.45Å; F254-E301 VanDerWaalsContact CA-O 3.31Å; F254-E301 WeakPolarHBondContact CA-O 3.49Å; F254-E301 HydrophobicContact CD1-CB 4.23Å; F254-E301 HydrophobicContact CD1-CG 4.02Å; F254-E301 HydrophobicContact CD2-CG 4.33Å; F254-E301 HydrophobicContact CE1-CB 4.39Å; F254-E301 HydrophobicContact CE1-CG 3.75Å; F254-E301 HydrophobicContact CE2-CG 4.09Å; F254-E301 HydrophobicContact CG-CB 4.47Å; F254-E301 HydrophobicContact CG-CG 4.28Å; F254-E301 HydrophobicContact CZ-CG 3.78Å; E255-E301 PolarHBondContact N-O 3.28Å; E301-R303 PolarHBondContact O-N 2.97Å
302	N	94.9	Very high	97	Very high	103 Å²	103	44.1 Å²	44.1	55%	0.551	22%	0.217	S	C	*	.	S	Bend	trans	-84	-7.8	-168.3	64.7	-21.6	0	0	0	115.4	E255 P257 M300	E255-N302 CarbonylContact O-C 3.25Å; P257-N302 WeakPolarHBondContact CD-O 3.3Å; M300-N302 VanDerWaalsContact CG-OD1 3.25Å; M300-N302 WeakPolarHBondContact CG-OD1 3.28Å
303	R	96.3	Very high	96.8	Very high	146 Å²	146	45.4 Å²	45.4	55%	0.551	22%	0.221	S	C	*	.	S	Bend	trans	-169.3	154.6	176.2	60.1	-177.9	179.6	-173.6	0	111.2	W296 M300 E301	W296-R303 VanDerWaalsContact CE3-C 3.42Å; M300-R303 HydrophobicContact CG-CG 4.37Å; M300-R303 HydrophobicContact SD-CG 3.94Å; E301-R303 PolarHBondContact O-N 2.97Å
304	P	97.4	Very high	96.6	Very high	12 Å²	12	45.4 Å²	45.4	8%	0.078	22%	0.221	C	C	.	.			trans	-66.2	149	167.6	31	-37.2	0	0	0	111	K294 V295 W296 T307	K294-P304 HydrophobicContact CB-CB 3.93Å; K294-P304 HydrophobicContact CB-CG 4.42Å; K294-P304 HydrophobicContact CD-CG 4.18Å; K294-P304 HydrophobicContact CG-CB 4.46Å; K294-P304 HydrophobicContact CG-CG 4.44Å; V295-P304 CarbonylContact O-C 3.45Å; V295-P304 WeakPolarHBondContact O-CA 3.43Å; V295-P304 WeakPolarHBondContact O-CB 3.38Å; W296-P304 HydrophobicContact CD2-CB 4Å; W296-P304 HydrophobicContact CE3-CB 4.31Å; W296-P304 HydrophobicContact CG-CB 4.43Å; W296-P304 HydrophobicContact CZ2-CB 4.28Å; W296-P304 HydrophobicContact CZ2-CG 4.44Å; P304-T307 WeakPolarHBondContact CG-OG1 3.32Å
305	I	97.2	Very high	96.4	Very high	64 Å²	64	49.5 Å²	49.5	33%	0.328	24%	0.236	S	C	.	.	S	Bend	trans	-79.7	-24.9	172.7	56.1	159.6	0	0	0	112.2	Y284 V295 D297 M300	Y284-I305 HydrophobicContact CD1-CD1 3.64Å; Y284-I305 HydrophobicContact CE1-CD1 3.57Å; V295-I305 HydrophobicContact CB-CG1 4.19Å; V295-I305 HydrophobicContact CG1-CD1 3.97Å; V295-I305 HydrophobicContact CG1-CG1 4Å; V295-I305 WeakPolarHBondContact O-CG1 3.47Å; V295-I305 PolarHBondContact O-N 2.59Å; D297-I305 HydrophobicContact CB-CD1 4.4Å; D297-I305 HydrophobicContact CB-CG2 3.89Å; M300-I305 HydrophobicContact SD-CG2 4.15Å
306	E	97.6	Very high	96.1	Very high	28 Å²	28	54 Å²	54	13%	0.131	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	136.3	-179.8	-54	166.4	-149.5	0	0	109.7	K294 V295 Y308 R356 K359	K294-E306 CarbonylContact C-O 3.55Å; K294-E306 WeakPolarHBondContact CA-O 3.29Å; V295-E306 HydrophobicContact CB-CB 4.04Å; V295-E306 HydrophobicContact CG2-CB 4.26Å; V295-E306 PolarHBondContact N-O 2.78Å; V295-E306 PolarHBondContact O-N 2.98Å; E306-Y308 HydrophobicContact CB-CE2 3.69Å; E306-Y308 WeakPolarHBondContact OE2-CE2 3.32Å; E306-Y308 PolarHBondContact OE2-OH 2.96Å; E306-R356 IonicContact OE1-CZ 3.36Å; E306-R356 IonicContact OE1-NE 3.06Å; E306-R356 PolarHBondContact OE1-NE 2.75Å; E306-R356 IonicContact OE1-NH2 2.79Å; E306-R356 PolarHBondContact OE1-NH2 2.64Å; E306-R356 VanDerWaalsContact OE2-CG 3.29Å; E306-R356 WeakPolarHBondContact OE2-CG 3.42Å; E306-R356 IonicContact OE2-NE 3.06Å; E306-R356 PolarHBondContact OE2-NE 2.66Å; E306-K359 IonicContact OE2-NZ 3.7Å; E306-K359 PolarHBondContact OE2-NZ 2.62Å
307	T	97.5	Very high	95.9	Very high	63 Å²	63	56.8 Å²	56.8	39%	0.387	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.3	176.8	-60.6	0	0	0	0	109.6	K294 P304	K294-T307 HydrophobicContact CG-CG2 4.11Å; P304-T307 WeakPolarHBondContact CG-OG1 3.32Å
308	Y	98.2	Very high	95.7	Very high	22 Å²	22	56.6 Å²	56.6	9%	0.086	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.7	-176.3	-63	-76.3	0	0	0	110.5	T292 V293 V295 E306 V310 I342 F354 R356 K359	T292-Y308 CarbonylContact C-O 3.57Å; T292-Y308 VanDerWaalsContact CA-O 3.25Å; T292-Y308 WeakPolarHBondContact CA-O 3.47Å; T292-Y308 WeakPolarHBondContact CB-O 3.42Å; V293-Y308 PolarHBondContact N-O 3.03Å; V293-Y308 PolarHBondContact O-N 3.01Å; V295-Y308 HydrophobicContact CG2-CE2 4.2Å; E306-Y308 HydrophobicContact CB-CE2 3.69Å; E306-Y308 WeakPolarHBondContact OE2-CE2 3.32Å; E306-Y308 PolarHBondContact OE2-OH 2.96Å; Y308-V310 PolarHBondContact O-N 2.91Å; Y308-I342 HydrophobicContact CD2-CD1 4.46Å; Y308-I342 HydrophobicContact CE2-CD1 4.13Å; Y308-F354 HydrophobicContact CD1-CB 3.84Å; Y308-F354 AromaticContact CD1-CD1 3.43Å; Y308-F354 HydrophobicContact CD1-CD1 3.43Å; Y308-F354 VanDerWaalsContact CD1-CD1 3.43Å; Y308-F354 HydrophobicContact CD1-CE1 4.14Å; Y308-F354 AromaticContact CD1-CG 3.81Å; Y308-F354 HydrophobicContact CD1-CG 3.81Å; Y308-F354 HydrophobicContact CE1-CB 4.02Å; Y308-F354 HydrophobicContact CE1-CD1 4.3Å; Y308-F354 HydrophobicContact CE1-CG 4.48Å; Y308-F354 HydrophobicContact CG-CB 4.11Å; Y308-F354 AromaticContact CG-CD1 3.77Å; Y308-F354 HydrophobicContact CG-CD1 3.77Å; Y308-F354 HydrophobicContact CG-CD2 4.47Å; Y308-F354 HydrophobicContact CG-CE1 4.26Å; Y308-F354 AromaticContact CG-CG 3.88Å; Y308-F354 HydrophobicContact CG-CG 3.88Å; Y308-R356 WeakPolarHBondContact OH-CA 3.35Å; Y308-K359 PolarHBondContact OH-NZ 2.82Å
309	Q	97.4	Very high	95.7	Very high	77 Å²	77	58.9 Å²	58.9	36%	0.36	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.5	175.8	-62.2	-59.9	-28.9	0	0	109.5	D312 R352	Q309-D312 HydrophobicContact CB-CB 4.15Å; Q309-D312 HydrophobicContact CG-CB 4.48Å; Q309-R352 PolarHBondContact O-NH2 2.78Å
310	V	97.9	Very high	95.6	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.012	28%	0.282	C	S	.	.	S	Bend	trans	-83.1	-52.8	-176.9	-176.5	0	0	0	0	111.1	R288 L291 V293 Y308 T344 R352 F354	R288-V310 VanDerWaalsContact NH1-CG1 3.34Å; L291-V310 WeakPolarHBondContact O-CB 3.36Å; L291-V310 PolarHBondContact O-N 3.33Å; V293-V310 HydrophobicContact CB-CG2 4.49Å; V293-V310 HydrophobicContact CG2-CG2 3.74Å; Y308-V310 PolarHBondContact O-N 2.91Å; V310-T344 HydrophobicContact CG1-CG2 3.98Å; V310-T344 HydrophobicContact CG2-CG2 3.93Å; V310-R352 HydrophobicContact CG1-CB 4.35Å; V310-R352 HydrophobicContact CG1-CG 3.78Å; V310-R352 WeakPolarHBondContact O-CD 3.45Å; V310-R352 PolarHBondContact O-NE 2.78Å; V310-F354 HydrophobicContact CG2-CE2 4.31Å; V310-F354 HydrophobicContact CG2-CZ 4.26Å
311	H	96.1	Very high	95.6	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.267	C	S	.	.	S	Bend	trans	-150.6	52	-175.9	49.9	-159.8	0	0	0	110.8	R288 Y290 Y313 L314 S346 Y347	R288-H311 PolarHBondContact NH2-CE1 2.85Å; R288-H311 PolarHBondContact NH2-NE2 2.88Å; Y290-H311 PolarHBondContact O-NE2 2.89Å; H311-Y313 HydrophobicContact CB-CD1 4.39Å; H311-Y313 HydrophobicContact CB-CD2 4.43Å; H311-Y313 HydrophobicContact CB-CE1 3.72Å; H311-Y313 HydrophobicContact CB-CE2 3.76Å; H311-Y313 WeakPolarHBondContact CB-OH 3.38Å; H311-Y313 PolarHBondContact O-N 2.95Å; H311-L314 HydrophobicContact CB-CD1 3.96Å; H311-L314 HydrophobicContact CB-CG 4.21Å; H311-L314 VanDerWaalsContact O-CB 3.31Å; H311-L314 WeakPolarHBondContact O-CB 3.32Å; H311-L314 WeakPolarHBondContact O-CG 3.22Å; H311-L314 PolarHBondContact O-N 2.97Å; H311-S346 PolarHBondContact ND1-OG 3.33Å; H311-Y347 AromaticContact CE1-CE2 3.92Å
312	D	94	Very high	95.6	Very high	67 Å²	67	53.8 Å²	53.8	36%	0.358	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-58.8	-18.9	-178	-168.2	61	0	0	0	113.4	Q309 L314 R315	Q309-D312 HydrophobicContact CB-CB 4.15Å; Q309-D312 HydrophobicContact CG-CB 4.48Å; D312-L314 PolarHBondContact O-N 2.84Å; D312-R315 VanDerWaalsContact O-CB 3.23Å; D312-R315 WeakPolarHBondContact O-CB 3.33Å; D312-R315 PolarHBondContact O-N 3.15Å; D312-R315 IonicContact OD1-CZ 2.9Å; D312-R315 VanDerWaalsContact OD1-CZ 3.31Å; D312-R315 IonicContact OD1-NE 3.21Å; D312-R315 PolarHBondContact OD1-NE 3.32Å; D312-R315 IonicContact OD1-NH2 3.07Å; D312-R315 PolarHBondContact OD1-NH2 2.87Å
313	Y	93.6	Very high	95.7	Very high	36 Å²	36	56.1 Å²	56.1	14%	0.141	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-58.5	-13.8	168	55.2	-105.9	0	0	0	114.3	H311 V382 V384 V395 L398	H311-Y313 HydrophobicContact CB-CD1 4.39Å; H311-Y313 HydrophobicContact CB-CD2 4.43Å; H311-Y313 HydrophobicContact CB-CE1 3.72Å; H311-Y313 HydrophobicContact CB-CE2 3.76Å; H311-Y313 WeakPolarHBondContact CB-OH 3.38Å; H311-Y313 PolarHBondContact O-N 2.95Å; Y313-V382 HydrophobicContact CD1-CB 3.91Å; Y313-V382 HydrophobicContact CD1-CG1 4.03Å; Y313-V382 HydrophobicContact CD1-CG2 4.4Å; Y313-V382 HydrophobicContact CD2-CG1 3.83Å; Y313-V382 HydrophobicContact CE1-CB 3.8Å; Y313-V382 HydrophobicContact CE1-CG1 4.15Å; Y313-V382 HydrophobicContact CE1-CG2 3.77Å; Y313-V382 HydrophobicContact CE2-CB 4.44Å; Y313-V382 HydrophobicContact CE2-CG1 3.96Å; Y313-V382 HydrophobicContact CE2-CG2 4.32Å; Y313-V382 HydrophobicContact CG-CB 4.28Å; Y313-V382 HydrophobicContact CG-CG1 3.88Å; Y313-V384 VanDerWaalsContact CB-CG2 3.41Å; Y313-V395 HydrophobicContact CD2-CG1 4.48Å; Y313-V395 HydrophobicContact CD2-CG2 3.96Å; Y313-V395 HydrophobicContact CG-CG2 4.22Å; Y313-L398 HydrophobicContact CD2-CD1 4.12Å; Y313-L398 HydrophobicContact CE2-CD1 3.5Å
314	L	95.2	Very high	95.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-88.2	-8.1	174.1	-61.5	-178.8	0	0	0	113.7	L291 H311 D312 S316 K317 L318 L321 Y347 V395 L398 F400	L291-L314 HydrophobicContact CD2-CB 4.48Å; H311-L314 HydrophobicContact CB-CD1 3.96Å; H311-L314 HydrophobicContact CB-CG 4.21Å; H311-L314 VanDerWaalsContact O-CB 3.31Å; H311-L314 WeakPolarHBondContact O-CB 3.32Å; H311-L314 WeakPolarHBondContact O-CG 3.22Å; H311-L314 PolarHBondContact O-N 2.97Å; D312-L314 PolarHBondContact O-N 2.84Å; L314-S316 PolarHBondContact O-N 2.78Å; L314-K317 CarbonylContact O-C 3.55Å; L314-K317 WeakPolarHBondContact O-CA 3.49Å; L314-K317 WeakPolarHBondContact O-CB 3.37Å; L314-K317 PolarHBondContact O-N 2.93Å; L314-L318 PolarHBondContact O-N 2.66Å; L314-L321 HydrophobicContact CB-CD1 3.97Å; L314-L321 HydrophobicContact CD1-CD1 4.43Å; L314-Y347 HydrophobicContact CD1-CD2 3.6Å; L314-Y347 HydrophobicContact CD1-CE2 3.78Å; L314-V395 HydrophobicContact CD2-CG1 4.18Å; L314-L398 HydrophobicContact CD2-CD1 4.15Å; L314-F400 HydrophobicContact CD1-CE1 4.28Å; L314-F400 HydrophobicContact CD2-CE1 3.74Å; L314-F400 HydrophobicContact CD2-CZ 3.81Å
315	R	93.3	Very high	95.5	Very high	122 Å²	122	57.2 Å²	57.2	46%	0.46	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-58.4	-35.4	-178	-173.1	178.9	-66.9	-91	-2.5	112.7	L291 D312 K317 L318	L291-R315 HydrophobicContact CD1-CB 4.44Å; D312-R315 VanDerWaalsContact O-CB 3.23Å; D312-R315 WeakPolarHBondContact O-CB 3.33Å; D312-R315 PolarHBondContact O-N 3.15Å; D312-R315 IonicContact OD1-CZ 2.9Å; D312-R315 VanDerWaalsContact OD1-CZ 3.31Å; D312-R315 IonicContact OD1-NE 3.21Å; D312-R315 PolarHBondContact OD1-NE 3.32Å; D312-R315 IonicContact OD1-NH2 3.07Å; D312-R315 PolarHBondContact OD1-NH2 2.87Å; R315-K317 PolarHBondContact O-N 3.5Å; R315-L318 HydrophobicContact CG-CD1 4.36Å; R315-L318 VanDerWaalsContact O-CG 3.31Å; R315-L318 WeakPolarHBondContact O-CG 3.46Å
316	S	91.9	Very high	95.5	Very high	95 Å²	95	54.9 Å²	54.9	66%	0.664	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-75.8	-8.8	175.3	60.3	0	0	0	0	114	L314	L314-S316 PolarHBondContact O-N 2.78Å
317	K	93.7	Very high	95.4	Very high	61 Å²	61	53.8 Å²	53.8	27%	0.265	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-107.5	4.6	-178.3	-60.6	-63.9	-170.6	171.7	0	113.2	L314 R315 C319 S320 L321 V395 D396	L314-K317 CarbonylContact O-C 3.55Å; L314-K317 WeakPolarHBondContact O-CA 3.49Å; L314-K317 WeakPolarHBondContact O-CB 3.37Å; L314-K317 PolarHBondContact O-N 2.93Å; R315-K317 PolarHBondContact O-N 3.5Å; K317-C319 PolarHBondContact O-N 3.26Å; K317-C319 VanDerWaalsContact O-N 3.17Å; K317-S320 PolarHBondContact O-N 3.2Å; K317-S320 PolarHBondContact O-OG 3.45Å; K317-L321 HydrophobicContact CB-CD1 3.96Å; K317-L321 HydrophobicContact CB-CG 4.3Å; K317-L321 VanDerWaalsContact O-CG 3.3Å; K317-L321 WeakPolarHBondContact O-CG 3.42Å; K317-L321 PolarHBondContact O-N 3.1Å; K317-V395 HydrophobicContact CG-CG1 4.11Å; K317-D396 VanDerWaalsContact CE-OD1 3.31Å; K317-D396 WeakPolarHBondContact CE-OD1 3.43Å; K317-D396 IonicContact NZ-OD1 3.31Å; K317-D396 PolarHBondContact NZ-OD1 2.93Å
318	L	95	Very high	95.4	Very high	13 Å²	13	55.9 Å²	55.9	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-54.5	-38	-176.8	-68.5	175.9	0	0	0	113.2	F266 I270 Y290 L314 R315 L321 Y322 I327	F266-L318 HydrophobicContact CB-CD1 4.1Å; F266-L318 HydrophobicContact CD1-CB 4.29Å; F266-L318 HydrophobicContact CD2-CB 4.41Å; F266-L318 HydrophobicContact CG-CB 4.2Å; F266-L318 HydrophobicContact CG-CD1 4.47Å; I270-L318 HydrophobicContact CD1-CD1 4.22Å; I270-L318 HydrophobicContact CG2-CD1 4.39Å; I270-L318 HydrophobicContact CG2-CD2 3.85Å; Y290-L318 HydrophobicContact CD1-CD2 4.16Å; Y290-L318 HydrophobicContact CE1-CD2 4.02Å; L314-L318 PolarHBondContact O-N 2.66Å; R315-L318 HydrophobicContact CG-CD1 4.36Å; R315-L318 VanDerWaalsContact O-CG 3.31Å; R315-L318 WeakPolarHBondContact O-CG 3.46Å; L318-L321 PolarHBondContact O-N 2.89Å; L318-Y322 WeakPolarHBondContact O-CB 3.46Å; L318-Y322 PolarHBondContact O-N 3.12Å; L318-I327 HydrophobicContact CD2-CD1 4.02Å
319	C	94.6	Very high	95.4	Very high	71 Å²	71	55.8 Å²	55.8	48%	0.48	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-51.1	175.7	-165.7	0	0	0	0	111.8	F266 K317 L321 Y322 E323	F266-C319 HydrophobicContact CZ-CB 4.23Å; K317-C319 PolarHBondContact O-N 3.26Å; K317-C319 VanDerWaalsContact O-N 3.17Å; C319-L321 VanDerWaalsContact C-N 3.29Å; C319-L321 PolarHBondContact O-N 2.76Å; C319-Y322 WeakPolarHBondContact O-CB 3.12Å; C319-Y322 PolarHBondContact O-N 3.1Å; C319-E323 WeakPolarHBondContact O-CG 3.02Å; C319-E323 PolarHBondContact O-N 2.89Å; C319-E323 VanDerWaalsContact O-N 3.09Å
320	S	94.4	Very high	95.4	Very high	53 Å²	53	57.6 Å²	57.6	37%	0.371	29%	0.289	S	S	.	.	H	α-helix	trans	-66.3	-30.7	177	52.6	0	0	0	0	113.4	K317 Y322 N324	K317-S320 PolarHBondContact O-N 3.2Å; K317-S320 PolarHBondContact O-OG 3.45Å; S320-Y322 VanDerWaalsContact C-N 3.32Å; S320-N324 VanDerWaalsContact O-CG 3.27Å; S320-N324 PolarHBondContact O-N 2.85Å; S320-N324 PolarHBondContact O-OD1 3.4Å
321	L	95.9	Very high	95.4	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-76.1	-24.3	178.1	-67.9	165.7	0	0	0	112.5	Y290 L314 K317 L318 C319 N324 D325 C326 I327 F400	Y290-L321 HydrophobicContact CE1-CD1 4.28Å; L314-L321 HydrophobicContact CB-CD1 3.97Å; L314-L321 HydrophobicContact CD1-CD1 4.43Å; K317-L321 HydrophobicContact CB-CD1 3.96Å; K317-L321 HydrophobicContact CB-CG 4.3Å; K317-L321 VanDerWaalsContact O-CG 3.3Å; K317-L321 WeakPolarHBondContact O-CG 3.42Å; K317-L321 PolarHBondContact O-N 3.1Å; L318-L321 PolarHBondContact O-N 2.89Å; C319-L321 VanDerWaalsContact C-N 3.29Å; C319-L321 PolarHBondContact O-N 2.76Å; L321-N324 VanDerWaalsContact C-OD1 3.25Å; L321-N324 WeakPolarHBondContact CA-OD1 3.42Å; L321-N324 PolarHBondContact O-OD1 3.48Å; L321-D325 PolarHBondContact O-N 3.04Å; L321-C326 HydrophobicContact CD2-CB 3.84Å; L321-C326 PolarHBondContact O-N 3.05Å; L321-I327 HydrophobicContact CB-CB 4.33Å; L321-I327 PolarHBondContact O-N 3.11Å; L321-F400 HydrophobicContact CD2-CD1 3.59Å; L321-F400 HydrophobicContact CD2-CE1 3.49Å; L321-F400 VanDerWaalsContact CD2-CE1 3.49Å; L321-F400 HydrophobicContact CD2-CG 4.25Å; L321-F400 HydrophobicContact CD2-CZ 4.05Å
322	Y	96.1	Very high	95.5	Very high	93 Å²	93	58.4 Å²	58.4	37%	0.365	29%	0.293	S	S	.	.	H	α-helix	trans	-76.1	-43.2	171.1	177.2	-95.7	0	0	0	111	F265 F266 I269 L318 C319 S320 N324 D325 I327 F328	F265-Y322 HydrophobicContact CE1-CE2 4.3Å; F265-Y322 HydrophobicContact CZ-CE2 4.48Å; F266-Y322 HydrophobicContact CE1-CD2 4.42Å; F266-Y322 HydrophobicContact CE1-CG 4.07Å; I269-Y322 HydrophobicContact CD1-CD2 3.78Å; I269-Y322 HydrophobicContact CD1-CE2 3.69Å; L318-Y322 WeakPolarHBondContact O-CB 3.46Å; L318-Y322 PolarHBondContact O-N 3.12Å; C319-Y322 WeakPolarHBondContact O-CB 3.12Å; C319-Y322 PolarHBondContact O-N 3.1Å; S320-Y322 VanDerWaalsContact C-N 3.32Å; Y322-N324 PolarHBondContact O-N 2.82Å; Y322-D325 PolarHBondContact O-N 2.75Å; Y322-I327 HydrophobicContact CD2-CG2 4.02Å; Y322-F328 HydrophobicContact CD2-CE2 4.36Å; Y322-F328 AromaticContact CD2-CZ 3.99Å; Y322-F328 HydrophobicContact CD2-CZ 3.99Å; Y322-F328 HydrophobicContact CE2-CE2 4.38Å; Y322-F328 AromaticContact CE2-CZ 3.8Å; Y322-F328 HydrophobicContact CE2-CZ 3.8Å
323	E	95.6	Very high	95.7	Very high	151 Å²	151	55.2 Å²	55.2	71%	0.706	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-24.6	178.3	-71.3	174.1	-173	0	0	114.1	C319	C319-E323 WeakPolarHBondContact O-CG 3.02Å; C319-E323 PolarHBondContact O-N 2.89Å; C319-E323 VanDerWaalsContact O-N 3.09Å
324	N	94.6	Very high	95.9	Very high	73 Å²	73	54.6 Å²	54.6	39%	0.39	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	15.4	179.7	74.3	1.1	0	0	0	113.7	S320 L321 Y322 C326	S320-N324 VanDerWaalsContact O-CG 3.27Å; S320-N324 PolarHBondContact O-N 2.85Å; S320-N324 PolarHBondContact O-OD1 3.4Å; L321-N324 VanDerWaalsContact C-OD1 3.25Å; L321-N324 WeakPolarHBondContact CA-OD1 3.42Å; L321-N324 PolarHBondContact O-OD1 3.48Å; Y322-N324 PolarHBondContact O-N 2.82Å; N324-C326 VanDerWaalsContact CG-SG 3.51Å; N324-C326 PolarHBondContact O-N 3.48Å; N324-C326 WeakPolarHBondContact OD1-CB 3.47Å; N324-C326 PolarHBondContact OD1-N 3.34Å; N324-C326 VanDerWaalsContact OD1-N 3.09Å; N324-C326 PolarHBondContact OD1-SG 2.79Å
325	D	96.3	Very high	96.1	Very high	109 Å²	109	55.1 Å²	55.1	58%	0.583	28%	0.278	S	S	*	.	S	Bend	trans	58.8	3.9	-179.4	-60.7	-47.6	0	0	0	116.3	L321 Y322 I327 F328	L321-D325 PolarHBondContact O-N 3.04Å; Y322-D325 PolarHBondContact O-N 2.75Å; D325-I327 PolarHBondContact O-N 3.27Å; D325-F328 HydrophobicContact CB-CD2 4.1Å; D325-F328 PolarHBondContact O-N 2.91Å; D325-F328 VanDerWaalsContact O-N 3.11Å
326	C	96.7	Very high	96.3	Very high	15 Å²	15	49.7 Å²	49.7	10%	0.101	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-65	-27.3	179.7	-68.5	0	0	0	0	111.7	Y290 L321 N324 F328 D329 Y347	Y290-C326 WeakPolarHBondContact CE2-O 3.43Å; L321-C326 HydrophobicContact CD2-CB 3.84Å; L321-C326 PolarHBondContact O-N 3.05Å; N324-C326 VanDerWaalsContact CG-SG 3.51Å; N324-C326 PolarHBondContact O-N 3.48Å; N324-C326 WeakPolarHBondContact OD1-CB 3.47Å; N324-C326 PolarHBondContact OD1-N 3.34Å; N324-C326 VanDerWaalsContact OD1-N 3.09Å; N324-C326 PolarHBondContact OD1-SG 2.79Å; C326-F328 PolarHBondContact O-N 3.4Å; C326-F328 VanDerWaalsContact O-N 3.11Å; C326-D329 VanDerWaalsContact O-CB 3.26Å; C326-D329 WeakPolarHBondContact O-CB 3.32Å; C326-D329 PolarHBondContact O-N 3.17Å; C326-Y347 HydrophobicContact CB-CE1 4.25Å; C326-Y347 PolarHBondContact O-OH 3.47Å
327	I	96.2	Very high	96.4	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.026	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.7	-19.7	176.4	-158	169.5	0	0	0	113.3	F266 I269 I270 Y290 L318 L321 Y322 D325	F266-I327 HydrophobicContact CD1-CD1 4.12Å; I269-I327 HydrophobicContact CB-CD1 4.42Å; I269-I327 HydrophobicContact CG2-CD1 3.79Å; I269-I327 HydrophobicContact CG2-CG1 3.9Å; I269-I327 HydrophobicContact CG2-CG2 4.04Å; I270-I327 HydrophobicContact CG2-CD1 3.81Å; I270-I327 HydrophobicContact CG2-CG1 4.1Å; Y290-I327 HydrophobicContact CD1-CG1 4.21Å; Y290-I327 WeakPolarHBondContact CD2-O 3.49Å; Y290-I327 HydrophobicContact CE1-CG1 4.15Å; Y290-I327 HydrophobicContact CE2-CG1 4.48Å; Y290-I327 HydrophobicContact CG-CG1 4.4Å; L318-I327 HydrophobicContact CD2-CD1 4.02Å; L321-I327 HydrophobicContact CB-CB 4.33Å; L321-I327 PolarHBondContact O-N 3.11Å; Y322-I327 HydrophobicContact CD2-CG2 4.02Å; D325-I327 PolarHBondContact O-N 3.27Å
328	F	96.7	Very high	96.6	Very high	107 Å²	107	47.5 Å²	47.5	47%	0.469	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-93.1	4.4	178.3	-54.8	-64.2	0	0	0	113.6	I269 Y322 D325 C326 K330	I269-F328 HydrophobicContact CG2-CD1 4.34Å; I269-F328 HydrophobicContact CG2-CE1 3.84Å; Y322-F328 HydrophobicContact CD2-CE2 4.36Å; Y322-F328 AromaticContact CD2-CZ 3.99Å; Y322-F328 HydrophobicContact CD2-CZ 3.99Å; Y322-F328 HydrophobicContact CE2-CE2 4.38Å; Y322-F328 AromaticContact CE2-CZ 3.8Å; Y322-F328 HydrophobicContact CE2-CZ 3.8Å; D325-F328 HydrophobicContact CB-CD2 4.1Å; D325-F328 PolarHBondContact O-N 2.91Å; D325-F328 VanDerWaalsContact O-N 3.11Å; C326-F328 PolarHBondContact O-N 3.4Å; C326-F328 VanDerWaalsContact O-N 3.11Å; F328-K330 PolarHBondContact O-N 2.81Å
329	D	97.5	Very high	96.7	Very high	20 Å²	20	47.5 Å²	47.5	11%	0.107	26%	0.255	C	S	.	.			trans	-62.2	126.8	174.7	-77.4	-35.2	0	0	0	111.3	C326 F331 Y347 K403 L405	C326-D329 VanDerWaalsContact O-CB 3.26Å; C326-D329 WeakPolarHBondContact O-CB 3.32Å; C326-D329 PolarHBondContact O-N 3.17Å; D329-F331 HydrophobicContact CB-CD2 4.25Å; D329-F331 HydrophobicContact CB-CE2 3.66Å; D329-F331 HydrophobicContact CB-CZ 4.16Å; D329-F331 PolarHBondContact O-N 2.97Å; D329-Y347 VanDerWaalsContact OD2-CE1 3.25Å; D329-Y347 WeakPolarHBondContact OD2-CE1 3.29Å; D329-Y347 PolarHBondContact OD2-OH 3.33Å; D329-K403 WeakPolarHBondContact OD1-CD 3.29Å; D329-K403 IonicContact OD1-NZ 3.46Å; D329-K403 PolarHBondContact OD1-NZ 2.78Å; D329-K403 WeakPolarHBondContact OD2-CD 3.42Å; D329-K403 IonicContact OD2-NZ 3.43Å; D329-L405 HydrophobicContact CB-CD2 4.06Å
330	K	97.4	Very high	96.8	Very high	115 Å²	115	45.3 Å²	45.3	50%	0.5	24%	0.241	S	C	.	.			trans	-95.2	96.8	-179	-60.5	-175.9	-177.6	-176	0	109.8	F328	F328-K330 PolarHBondContact O-N 2.81Å
331	F	98.3	Very high	97	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.			trans	-82.6	131.6	178.6	-69.3	-86.6	0	0	0	110.9	S274 R288 Y290 D329 Y347 I404 L405	S274-F331 PolarHBondContact OG-O 3.12Å; R288-F331 HydrophobicContact CG-CB 4.06Å; R288-F331 WeakPolarHBondContact CG-O 3.48Å; Y290-F331 HydrophobicContact CE2-CE2 4.21Å; D329-F331 HydrophobicContact CB-CD2 4.25Å; D329-F331 HydrophobicContact CB-CE2 3.66Å; D329-F331 HydrophobicContact CB-CZ 4.16Å; D329-F331 PolarHBondContact O-N 2.97Å; F331-Y347 HydrophobicContact CE2-CE2 4.17Å; F331-Y347 AromaticContact CE2-CZ 3.99Å; F331-Y347 HydrophobicContact CZ-CD1 4.45Å; F331-Y347 HydrophobicContact CZ-CD2 4.32Å; F331-Y347 HydrophobicContact CZ-CE1 4.01Å; F331-Y347 AromaticContact CZ-CE2 3.86Å; F331-Y347 HydrophobicContact CZ-CE2 3.86Å; F331-Y347 AromaticContact CZ-CZ 3.68Å; F331-I404 WeakPolarHBondContact CD1-O 3.42Å; F331-I404 WeakPolarHBondContact CE1-O 3.33Å; F331-L405 HydrophobicContact CD1-CD2 3.84Å; F331-L405 HydrophobicContact CD2-CD2 4.5Å; F331-L405 HydrophobicContact CE1-CD2 3.76Å; F331-L405 HydrophobicContact CE2-CD2 4.45Å; F331-L405 HydrophobicContact CG-CD2 4.2Å; F331-L405 HydrophobicContact CZ-CD2 4.08Å
332	E	98.4	Very high	97.1	Very high	19 Å²	19	44 Å²	44	9%	0.089	23%	0.23	C	C	.	.			trans	-83.7	161.3	172.2	-64.7	171.7	-178.9	0	0	111.6	K83 D275 T344 L405 H406	K83-E332 IonicContact NZ-OE1 2.72Å; K83-E332 PolarHBondContact NZ-OE1 2.78Å; D275-E332 WeakPolarHBondContact OD2-CA 3.46Å; E332-T344 PolarHBondContact O-OG1 3.1Å; E332-L405 WeakPolarHBondContact CB-O 3.43Å; E332-L405 WeakPolarHBondContact CG-O 3.26Å; E332-L405 PolarHBondContact N-O 3.06Å; E332-H406 VanDerWaalsContact CD-ND1 3.33Å; E332-H406 IonicContact OE1-CE1 2.97Å; E332-H406 IonicContact OE1-ND1 3.57Å; E332-H406 PolarHBondContact OE1-ND1 3.27Å; E332-H406 WeakPolarHBondContact OE2-CA 3.37Å; E332-H406 IonicContact OE2-ND1 3.48Å; E332-H406 PolarHBondContact OE2-ND1 3.42Å
333	C	98.4	Very high	97.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.4	175.4	57.2	0	0	0	0	110.5	D275 K277 M286 R288 M343	D275-C333 PolarHBondContact OD2-N 2.88Å; K277-C333 WeakPolarHBondContact CG-O 3.36Å; M286-C333 HydrophobicContact CE-CB 3.66Å; M286-C333 VanDerWaalsContact CE-SG 3.59Å; M286-C333 HydrophobicContact CG-CB 4.42Å; M286-C333 HydrophobicContact SD-CB 3.91Å; R288-C333 HydrophobicContact CB-CB 4.09Å; C333-M343 CarbonylContact C-O 3.6Å; C333-M343 WeakPolarHBondContact CA-O 3.29Å
334	V	98.4	Very high	97.4	Very high	23 Å²	23	32.3 Å²	32.3	14%	0.139	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.3	-177.9	-64.4	0	0	0	0	112.5	I342 M343 T407 W409	V334-I342 WeakPolarHBondContact O-CA 3.44Å; V334-M343 HydrophobicContact CG2-CB 3.92Å; V334-M343 HydrophobicContact CG2-CE 3.37Å; V334-M343 PolarHBondContact N-O 2.86Å; V334-M343 PolarHBondContact O-N 2.84Å; V334-T407 VanDerWaalsContact CG1-O 3.23Å; V334-T407 WeakPolarHBondContact CG1-O 2.94Å; V334-W409 HydrophobicContact CG2-CB 4.13Å; V334-W409 HydrophobicContact CG2-CE3 4.46Å
335	W	98.5	Very high	97.6	Very high	11 Å²	11	28.9 Å²	28.9	4%	0.042	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	148	171.5	-64.6	103.5	0	0	0	110.2	K277 F278 M286 V295 D339 I342 W409	K277-W335 PolarHBondContact O-NE1 2.93Å; K277-W335 VanDerWaalsContact O-NE1 3.16Å; F278-W335 VanDerWaalsContact O-CD1 3.26Å; F278-W335 PolarHBondContact O-NE1 3.24Å; M286-W335 HydrophobicContact CB-CH2 4.39Å; M286-W335 HydrophobicContact CB-CZ2 3.45Å; M286-W335 VanDerWaalsContact CB-CZ2 3.45Å; M286-W335 HydrophobicContact CE-CD2 4.17Å; M286-W335 HydrophobicContact CE-CG 4.06Å; M286-W335 HydrophobicContact CG-CZ2 4.49Å; V295-W335 HydrophobicContact CG1-CH2 3.78Å; V295-W335 HydrophobicContact CG1-CZ2 4.34Å; V295-W335 HydrophobicContact CG2-CH2 3.94Å; W335-D339 HydrophobicContact CE3-CB 4.07Å; W335-D339 HydrophobicContact CZ3-CB 4.3Å; W335-D339 WeakPolarHBondContact CZ3-O 3.49Å; W335-I342 HydrophobicContact CD2-CG1 4.39Å; W335-I342 HydrophobicContact CE3-CD1 4.31Å; W335-I342 HydrophobicContact CE3-CG1 3.71Å; W335-I342 HydrophobicContact CH2-CD1 4.05Å; W335-I342 HydrophobicContact CH2-CG1 4.35Å; W335-I342 HydrophobicContact CZ3-CD1 3.8Å; W335-I342 HydrophobicContact CZ3-CG1 3.7Å; W335-W409 WeakPolarHBondContact O-CB 3.3Å
336	N	97.6	Very high	97.6	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.043	13%	0.133	C	C	.	.			trans	-73.4	165.3	158.2	82.2	-32.8	0	0	0	110.6	H280 S338 D339 S340 V341 W409	H280-N336 PolarHBondContact CE1-O 3.16Å; H280-N336 PolarHBondContact ND1-O 3.12Å; N336-S338 PolarHBondContact ND2-OG 2.6Å; N336-S338 PolarHBondContact O-N 3.39Å; N336-D339 PolarHBondContact O-N 3.46Å; N336-D339 WeakPolarHBondContact OD1-CA 3.49Å; N336-D339 PolarHBondContact OD1-N 2.93Å; N336-D339 VanDerWaalsContact OD1-N 3.08Å; N336-S340 PolarHBondContact ND2-OG 2.72Å; N336-S340 VanDerWaalsContact ND2-OG 3.13Å; N336-S340 PolarHBondContact OD1-N 3.3Å; N336-V341 HydrophobicContact CB-CB 4.27Å; N336-V341 PolarHBondContact N-O 2.91Å; N336-V341 PolarHBondContact OD1-N 3.3Å; N336-V341 PolarHBondContact OD1-O 2.82Å; N336-W409 HydrophobicContact CB-CD2 3.59Å; N336-W409 HydrophobicContact CB-CE3 3.86Å; N336-W409 HydrophobicContact CB-CG 4.24Å; N336-W409 HydrophobicContact CB-CH2 3.68Å; N336-W409 HydrophobicContact CB-CZ2 3.4Å; N336-W409 VanDerWaalsContact CB-CZ2 3.4Å; N336-W409 HydrophobicContact CB-CZ3 3.89Å
337	G	94.8	Very high	97.6	Very high	29 Å²	29	23 Å²	23	30%	0.299	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.6	-176.4	0	0	0	0	0	116.3	P411	G337-P411 WeakPolarHBondContact CA-O 3.41Å
338	S	96.6	Very high	97.6	Very high	82 Å²	82	23.6 Å²	23.6	57%	0.573	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	8.9	178.7	62.3	0	0	0	0	114.2	N336 S340	N336-S338 PolarHBondContact ND2-OG 2.6Å; N336-S338 PolarHBondContact O-N 3.39Å; S338-S340 PolarHBondContact O-N 2.74Å; S338-S340 PolarHBondContact OG-OG 3.43Å
339	D	97.8	Very high	97.6	Very high	13 Å²	13	19.4 Å²	19.4	7%	0.07	11%	0.114	C	C	.	.	S	Bend	trans	56.2	15.3	-175.5	-57	-30.3	0	0	0	115.1	S279 H280 S281 W335 N336 R356	S279-D339 WeakPolarHBondContact CB-OD2 3.28Å; H280-D339 WeakPolarHBondContact CB-OD1 3.24Å; H280-D339 IonicContact CE1-OD1 3.31Å; H280-D339 IonicContact CG-OD1 2.81Å; H280-D339 VanDerWaalsContact N-CG 3.33Å; H280-D339 PolarHBondContact N-OD1 2.91Å; H280-D339 PolarHBondContact N-OD2 3.11Å; H280-D339 VanDerWaalsContact N-OD2 3.12Å; H280-D339 IonicContact ND1-OD1 3.53Å; H280-D339 PolarHBondContact ND1-OD1 2.83Å; S281-D339 WeakPolarHBondContact CB-OD2 3.47Å; S281-D339 PolarHBondContact N-OD2 2.8Å; S281-D339 PolarHBondContact OG-OD2 2.77Å; W335-D339 HydrophobicContact CE3-CB 4.07Å; W335-D339 HydrophobicContact CZ3-CB 4.3Å; W335-D339 WeakPolarHBondContact CZ3-O 3.49Å; N336-D339 PolarHBondContact O-N 3.46Å; N336-D339 WeakPolarHBondContact OD1-CA 3.49Å; N336-D339 PolarHBondContact OD1-N 2.93Å; N336-D339 VanDerWaalsContact OD1-N 3.08Å; D339-R356 WeakPolarHBondContact O-CD 3.42Å; D339-R356 PolarHBondContact O-NH1 2.96Å
340	S	97.4	Very high	97.6	Very high	25 Å²	25	18.5 Å²	18.5	18%	0.175	11%	0.109	C	C	.	.	S	Bend	trans	-94.1	-22.9	-174.8	62.2	0	0	0	0	113.7	N336 S338 R356	N336-S340 PolarHBondContact ND2-OG 2.72Å; N336-S340 VanDerWaalsContact ND2-OG 3.13Å; N336-S340 PolarHBondContact OD1-N 3.3Å; S338-S340 PolarHBondContact O-N 2.74Å; S338-S340 PolarHBondContact OG-OG 3.43Å; S340-R356 WeakPolarHBondContact O-CB 3.39Å; S340-R356 WeakPolarHBondContact O-CG 3.5Å; S340-R356 PolarHBondContact O-N 2.82Å
341	V	98.1	Very high	97.6	Very high	25 Å²	25	13 Å²	13	15%	0.152	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.8	179.2	-171.7	0	0	0	0	109	N336 M353 F354 D355 W409	N336-V341 HydrophobicContact CB-CB 4.27Å; N336-V341 PolarHBondContact N-O 2.91Å; N336-V341 PolarHBondContact OD1-N 3.3Å; N336-V341 PolarHBondContact OD1-O 2.82Å; V341-M353 HydrophobicContact CG1-CB 4.37Å; V341-M353 HydrophobicContact CG1-CE 4.28Å; V341-F354 CarbonylContact C-O 3.34Å; V341-F354 VanDerWaalsContact CA-O 3.3Å; V341-F354 WeakPolarHBondContact CA-O 3.38Å; V341-F354 WeakPolarHBondContact CG1-O 3.41Å; V341-D355 HydrophobicContact CG2-CB 4.46Å; V341-W409 HydrophobicContact CB-CH2 3.76Å; V341-W409 HydrophobicContact CB-CZ3 4.2Å; V341-W409 HydrophobicContact CG1-CH2 3.57Å; V341-W409 HydrophobicContact CG1-CZ3 3.92Å
342	I	98.3	Very high	97.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142	178	-69.6	165.1	0	0	0	108.6	M286 V293 V295 Y308 V334 W335 M353 F354 R356	M286-I342 HydrophobicContact CE-CG2 4.34Å; M286-I342 HydrophobicContact SD-CB 4.12Å; M286-I342 HydrophobicContact SD-CD1 3.86Å; M286-I342 HydrophobicContact SD-CG1 3.75Å; M286-I342 HydrophobicContact SD-CG2 3.28Å; M286-I342 WeakPolarHBondContact SD-CG2 3.21Å; V293-I342 HydrophobicContact CG1-CG2 4.01Å; V295-I342 HydrophobicContact CG2-CD1 3.48Å; V295-I342 VanDerWaalsContact CG2-CD1 3.48Å; Y308-I342 HydrophobicContact CD2-CD1 4.46Å; Y308-I342 HydrophobicContact CE2-CD1 4.13Å; V334-I342 WeakPolarHBondContact O-CA 3.44Å; W335-I342 HydrophobicContact CD2-CG1 4.39Å; W335-I342 HydrophobicContact CE3-CD1 4.31Å; W335-I342 HydrophobicContact CE3-CG1 3.71Å; W335-I342 HydrophobicContact CH2-CD1 4.05Å; W335-I342 HydrophobicContact CH2-CG1 4.35Å; W335-I342 HydrophobicContact CZ3-CD1 3.8Å; W335-I342 HydrophobicContact CZ3-CG1 3.7Å; I342-M353 CarbonylContact O-C 3.56Å; I342-M353 VanDerWaalsContact O-CA 3.23Å; I342-M353 WeakPolarHBondContact O-CA 3.41Å; I342-F354 HydrophobicContact CB-CB 4.4Å; I342-F354 HydrophobicContact CG2-CD2 4.42Å; I342-F354 PolarHBondContact N-O 2.79Å; I342-F354 PolarHBondContact O-N 2.91Å; I342-R356 HydrophobicContact CD1-CG 4.1Å
343	M	98.5	Very high	97.6	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.9	171.3	179.5	179.2	63	0	0	111.1	C333 V334 F351 R352 M353 T407 W409 I416 V418	C333-M343 CarbonylContact C-O 3.6Å; C333-M343 WeakPolarHBondContact CA-O 3.29Å; V334-M343 HydrophobicContact CG2-CB 3.92Å; V334-M343 HydrophobicContact CG2-CE 3.37Å; V334-M343 PolarHBondContact N-O 2.86Å; V334-M343 PolarHBondContact O-N 2.84Å; M343-F351 HydrophobicContact CG-CD2 4.34Å; M343-F351 HydrophobicContact SD-CD2 4.01Å; M343-F351 HydrophobicContact SD-CE2 4.44Å; M343-R352 VanDerWaalsContact CA-O 3.3Å; M343-R352 WeakPolarHBondContact CA-O 3.41Å; M343-M353 HydrophobicContact CB-CG 4.38Å; M343-M353 HydrophobicContact CG-CG 4.27Å; M343-T407 HydrophobicContact CE-CG2 4.39Å; M343-W409 HydrophobicContact CB-CE3 3.83Å; M343-W409 HydrophobicContact CB-CZ3 3.76Å; M343-W409 HydrophobicContact CE-CE3 4.38Å; M343-I416 HydrophobicContact CE-CB 3.99Å; M343-I416 HydrophobicContact CE-CG2 3.96Å; M343-I416 HydrophobicContact SD-CB 4.06Å; M343-I416 HydrophobicContact SD-CD1 3.75Å; M343-I416 HydrophobicContact SD-CG1 4.48Å; M343-I416 HydrophobicContact SD-CG2 4.01Å; M343-V418 HydrophobicContact SD-CG2 4.41Å
344	T	98.8	Very high	97.5	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	160.1	172.2	-170.8	0	0	0	0	110.7	R288 V293 V310 E332 F351 R352 F354	R288-T344 PolarHBondContact NH1-OG1 2.87Å; V293-T344 HydrophobicContact CG2-CG2 3.68Å; V310-T344 HydrophobicContact CG1-CG2 3.98Å; V310-T344 HydrophobicContact CG2-CG2 3.93Å; E332-T344 PolarHBondContact O-OG1 3.1Å; T344-F351 CarbonylContact O-C 3.56Å; T344-F351 WeakPolarHBondContact O-CA 3.5Å; T344-R352 HydrophobicContact CG2-CB 4.24Å; T344-R352 PolarHBondContact N-O 3.16Å; T344-R352 PolarHBondContact O-N 2.82Å; T344-F354 HydrophobicContact CG2-CE2 4.13Å
345	G	98.2	Very high	97.5	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	171.2	179.6	0	0	0	0	0	115.4	R288 I404	R288-G345 PolarHBondContact NH1-O 2.97Å; G345-I404 VanDerWaalsContact CA-O 3.29Å; G345-I404 WeakPolarHBondContact CA-O 3.4Å
346	S	98	Very high	97.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.101	C	C	.	.			trans	-153.7	-169.9	174.8	-169.8	0	0	0	0	109.4	H311 F350 I404	H311-S346 PolarHBondContact ND1-OG 3.33Å; S346-F350 CarbonylContact C-O 3.59Å; S346-F350 WeakPolarHBondContact CA-O 3.47Å; S346-F350 PolarHBondContact N-O 2.92Å; S346-I404 PolarHBondContact O-N 2.98Å
347	Y	96.8	Very high	97.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-83.5	173.8	177	-61.5	-76.6	0	0	0	112.8	Y290 H311 L314 C326 D329 F331 N349 F350 F400 K402 K403	Y290-Y347 HydrophobicContact CE2-CE2 4.48Å; Y290-Y347 WeakPolarHBondContact CE2-OH 3.27Å; Y290-Y347 WeakPolarHBondContact OH-CE2 3.48Å; Y290-Y347 PolarHBondContact OH-OH 3.43Å; H311-Y347 AromaticContact CE1-CE2 3.92Å; L314-Y347 HydrophobicContact CD1-CD2 3.6Å; L314-Y347 HydrophobicContact CD1-CE2 3.78Å; C326-Y347 HydrophobicContact CB-CE1 4.25Å; C326-Y347 PolarHBondContact O-OH 3.47Å; D329-Y347 VanDerWaalsContact OD2-CE1 3.25Å; D329-Y347 WeakPolarHBondContact OD2-CE1 3.29Å; D329-Y347 PolarHBondContact OD2-OH 3.33Å; F331-Y347 HydrophobicContact CE2-CE2 4.17Å; F331-Y347 AromaticContact CE2-CZ 3.99Å; F331-Y347 HydrophobicContact CZ-CD1 4.45Å; F331-Y347 HydrophobicContact CZ-CD2 4.32Å; F331-Y347 HydrophobicContact CZ-CE1 4.01Å; F331-Y347 AromaticContact CZ-CE2 3.86Å; F331-Y347 HydrophobicContact CZ-CE2 3.86Å; F331-Y347 AromaticContact CZ-CZ 3.68Å; Y347-N349 VanDerWaalsContact C-N 3.26Å; Y347-N349 PolarHBondContact O-N 2.76Å; Y347-F350 WeakPolarHBondContact O-CB 3.38Å; Y347-F350 WeakPolarHBondContact O-CG 3.45Å; Y347-F350 PolarHBondContact O-N 3.11Å; Y347-F400 HydrophobicContact CD1-CB 4.13Å; Y347-F400 AromaticContact CD1-CD1 3.65Å; Y347-F400 HydrophobicContact CD1-CD1 3.65Å; Y347-F400 HydrophobicContact CD1-CG 4.35Å; Y347-F400 AromaticContact CD2-CD1 3.8Å; Y347-F400 HydrophobicContact CD2-CD1 3.8Å; Y347-F400 AromaticContact CD2-CE1 3.94Å; Y347-F400 HydrophobicContact CD2-CE1 3.94Å; Y347-F400 HydrophobicContact CE1-CB 4.45Å; Y347-F400 AromaticContact CE1-CD1 3.98Å; Y347-F400 HydrophobicContact CE1-CD1 3.98Å; Y347-F400 HydrophobicContact CE2-CD1 4.13Å; Y347-F400 HydrophobicContact CE2-CE1 4.36Å; Y347-F400 AromaticContact CG-CD1 3.54Å; Y347-F400 HydrophobicContact CG-CD1 3.54Å; Y347-F400 HydrophobicContact CG-CE1 4.04Å; Y347-K402 CarbonylContact C-O 3.59Å; Y347-K402 VanDerWaalsContact C-O 3.25Å; Y347-K402 WeakPolarHBondContact CA-O 3.43Å; Y347-K403 HydrophobicContact CD1-CB 4.04Å; Y347-K403 HydrophobicContact CE1-CB 4.22Å
348	N	95.6	Very high	97.5	Very high	19 Å²	19	24.7 Å²	24.7	10%	0.102	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	36.3	-176.4	-161.6	73.8	0	0	0	113.8	F350 L398 D399 K402	N348-F350 HydrophobicContact CB-CD2 4.28Å; N348-F350 HydrophobicContact CB-CE1 4.47Å; N348-F350 HydrophobicContact CB-CE2 4.2Å; N348-F350 HydrophobicContact CB-CG 4.46Å; N348-F350 HydrophobicContact CB-CZ 4.31Å; N348-F350 VanDerWaalsContact ND2-CE1 3.34Å; N348-F350 WeakPolarHBondContact ND2-CE1 3.03Å; N348-F350 WeakPolarHBondContact ND2-CZ 3.28Å; N348-F350 VanDerWaalsContact O-CD1 3.27Å; N348-F350 WeakPolarHBondContact O-CD1 3.22Å; N348-F350 PolarHBondContact O-N 2.69Å; N348-F350 VanDerWaalsContact O-N 3.13Å; N348-L398 HydrophobicContact CB-CB 4.4Å; N348-L398 HydrophobicContact CB-CD2 3.76Å; N348-D399 WeakPolarHBondContact CA-O 3.33Å; N348-D399 PolarHBondContact N-O 3.27Å; N348-D399 PolarHBondContact OD1-N 3.38Å; N348-K402 WeakPolarHBondContact CA-O 3.29Å; N348-K402 PolarHBondContact N-O 2.78Å
349	N	96.1	Very high	97.3	Very high	18 Å²	18	26.5 Å²	26.5	10%	0.096	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	23.9	-171.2	-70.5	-16.3	0	0	0	113.9	Y347 A366 K402 I404	Y347-N349 VanDerWaalsContact C-N 3.26Å; Y347-N349 PolarHBondContact O-N 2.76Å; N349-A366 HydrophobicContact CB-CB 4.41Å; N349-A366 VanDerWaalsContact CB-O 3.31Å; N349-A366 WeakPolarHBondContact CB-O 3.42Å; N349-A366 PolarHBondContact ND2-O 3.28Å; N349-A366 PolarHBondContact O-N 2.84Å; N349-K402 PolarHBondContact N-O 3.31Å; N349-K402 WeakPolarHBondContact OD1-CB 3.41Å; N349-I404 HydrophobicContact CB-CD1 4.15Å
350	F	97.2	Very high	97.3	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	146	177.1	-64.1	-19.1	0	0	0	111.7	S346 Y347 N348 T363 L364 E365 R380 V382 I393 L398 I404	S346-F350 CarbonylContact C-O 3.59Å; S346-F350 WeakPolarHBondContact CA-O 3.47Å; S346-F350 PolarHBondContact N-O 2.92Å; Y347-F350 WeakPolarHBondContact O-CB 3.38Å; Y347-F350 WeakPolarHBondContact O-CG 3.45Å; Y347-F350 PolarHBondContact O-N 3.11Å; N348-F350 HydrophobicContact CB-CD2 4.28Å; N348-F350 HydrophobicContact CB-CE1 4.47Å; N348-F350 HydrophobicContact CB-CE2 4.2Å; N348-F350 HydrophobicContact CB-CG 4.46Å; N348-F350 HydrophobicContact CB-CZ 4.31Å; N348-F350 VanDerWaalsContact ND2-CE1 3.34Å; N348-F350 WeakPolarHBondContact ND2-CE1 3.03Å; N348-F350 WeakPolarHBondContact ND2-CZ 3.28Å; N348-F350 VanDerWaalsContact O-CD1 3.27Å; N348-F350 WeakPolarHBondContact O-CD1 3.22Å; N348-F350 PolarHBondContact O-N 2.69Å; N348-F350 VanDerWaalsContact O-N 3.13Å; F350-T363 HydrophobicContact CB-CG2 3.93Å; F350-T363 HydrophobicContact CD2-CG2 3.99Å; F350-T363 HydrophobicContact CG-CG2 3.95Å; F350-L364 WeakPolarHBondContact CA-O 3.39Å; F350-E365 HydrophobicContact CD1-CB 3.8Å; F350-E365 HydrophobicContact CD1-CG 3.9Å; F350-E365 HydrophobicContact CE1-CB 3.84Å; F350-E365 HydrophobicContact CE1-CG 3.79Å; F350-R380 HydrophobicContact CE1-CB 4.22Å; F350-R380 HydrophobicContact CE1-CG 3.94Å; F350-R380 HydrophobicContact CZ-CB 4.16Å; F350-R380 HydrophobicContact CZ-CG 4.27Å; F350-V382 HydrophobicContact CD2-CG2 4.34Å; F350-V382 HydrophobicContact CE2-CG2 3.84Å; F350-I393 HydrophobicContact CE2-CG2 3.9Å; F350-I393 HydrophobicContact CZ-CG2 3.92Å; F350-L398 HydrophobicContact CD2-CD2 4.49Å; F350-L398 HydrophobicContact CE2-CD2 3.85Å; F350-I404 WeakPolarHBondContact O-CG1 3.42Å
351	F	97.7	Very high	97.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.4	166	62.7	-82.3	0	0	0	109.2	M343 T344 M353 L364 A366 L377 I416 V418 F427	M343-F351 HydrophobicContact CG-CD2 4.34Å; M343-F351 HydrophobicContact SD-CD2 4.01Å; M343-F351 HydrophobicContact SD-CE2 4.44Å; T344-F351 CarbonylContact O-C 3.56Å; T344-F351 WeakPolarHBondContact O-CA 3.5Å; F351-M353 HydrophobicContact CD2-CG 4.44Å; F351-M353 HydrophobicContact CE2-SD 4.34Å; F351-L364 HydrophobicContact CD1-CB 4.19Å; F351-L364 HydrophobicContact CD2-CB 4.17Å; F351-L364 HydrophobicContact CE1-CB 3.64Å; F351-L364 HydrophobicContact CE2-CB 3.63Å; F351-L364 HydrophobicContact CE2-CD1 3.62Å; F351-L364 HydrophobicContact CE2-CG 4.19Å; F351-L364 HydrophobicContact CG-CB 4.44Å; F351-L364 HydrophobicContact CZ-CB 3.34Å; F351-L364 HydrophobicContact CZ-CD1 3.79Å; F351-L364 HydrophobicContact CZ-CG 4.2Å; F351-L364 PolarHBondContact N-O 3.41Å; F351-L364 PolarHBondContact O-N 2.92Å; F351-A366 HydrophobicContact CE1-CB 4.41Å; F351-L377 HydrophobicContact CZ-CD1 3.99Å; F351-I416 HydrophobicContact CD2-CD1 4.41Å; F351-I416 HydrophobicContact CE2-CD1 3.58Å; F351-I416 HydrophobicContact CZ-CD1 4.1Å; F351-V418 HydrophobicContact CD1-CG1 4.24Å; F351-V418 HydrophobicContact CD1-CG2 4.41Å; F351-V418 HydrophobicContact CE1-CG2 4.46Å; F351-V418 HydrophobicContact CG-CG2 4.44Å; F351-F427 HydrophobicContact CE1-CD2 4.32Å; F351-F427 AromaticContact CE1-CE2 3.78Å; F351-F427 HydrophobicContact CE1-CE2 3.78Å; F351-F427 HydrophobicContact CE1-CZ 4.45Å; F351-F427 AromaticContact CZ-CD2 3.86Å; F351-F427 HydrophobicContact CZ-CD2 3.86Å; F351-F427 AromaticContact CZ-CE2 3.79Å; F351-F427 HydrophobicContact CZ-CE2 3.79Å
352	R	98	Very high	97.1	Very high	24 Å²	24	39 Å²	39	9%	0.091	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.2	-171.9	-67	-89.7	-73.3	154.3	4.8	108.1	Q309 V310 M343 T344 F354 D361 V362 T363	Q309-R352 PolarHBondContact O-NH2 2.78Å; V310-R352 HydrophobicContact CG1-CB 4.35Å; V310-R352 HydrophobicContact CG1-CG 3.78Å; V310-R352 WeakPolarHBondContact O-CD 3.45Å; V310-R352 PolarHBondContact O-NE 2.78Å; M343-R352 VanDerWaalsContact CA-O 3.3Å; M343-R352 WeakPolarHBondContact CA-O 3.41Å; T344-R352 HydrophobicContact CG2-CB 4.24Å; T344-R352 PolarHBondContact N-O 3.16Å; T344-R352 PolarHBondContact O-N 2.82Å; R352-F354 HydrophobicContact CB-CE2 3.68Å; R352-F354 HydrophobicContact CB-CZ 3.96Å; R352-D361 IonicContact CZ-OD2 3.49Å; R352-D361 IonicContact NH1-OD2 2.63Å; R352-D361 PolarHBondContact NH1-OD2 3.22Å; R352-D361 IonicContact NH2-OD2 3.93Å; R352-D361 PolarHBondContact NH2-OD2 2.87Å; R352-V362 WeakPolarHBondContact CA-O 3.35Å; R352-T363 WeakPolarHBondContact CD-OG1 3.38Å; R352-T363 PolarHBondContact NH1-OG1 2.83Å; R352-T363 VanDerWaalsContact NH1-OG1 3.07Å
353	M	97.9	Very high	97	Very high	35 Å²	35	39.7 Å²	39.7	17%	0.172	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.6	170.9	-56.5	173	73.9	0	0	109.3	V341 I342 M343 F351 D361 V362 L364 W409	V341-M353 HydrophobicContact CG1-CB 4.37Å; V341-M353 HydrophobicContact CG1-CE 4.28Å; I342-M353 CarbonylContact O-C 3.56Å; I342-M353 VanDerWaalsContact O-CA 3.23Å; I342-M353 WeakPolarHBondContact O-CA 3.41Å; M343-M353 HydrophobicContact CB-CG 4.38Å; M343-M353 HydrophobicContact CG-CG 4.27Å; F351-M353 HydrophobicContact CD2-CG 4.44Å; F351-M353 HydrophobicContact CE2-SD 4.34Å; M353-D361 CarbonylContact O-C 3.56Å; M353-D361 WeakPolarHBondContact O-CA 3.07Å; M353-V362 HydrophobicContact CB-CG1 3.83Å; M353-V362 HydrophobicContact CG-CG1 4.4Å; M353-V362 PolarHBondContact N-O 3.45Å; M353-V362 PolarHBondContact O-N 3.33Å; M353-V362 HydrophobicContact SD-CG1 4.39Å; M353-L364 HydrophobicContact SD-CD1 3.86Å; M353-W409 HydrophobicContact CE-CH2 3.26Å; M353-W409 HydrophobicContact CE-CZ2 4.03Å; M353-W409 HydrophobicContact CE-CZ3 3.81Å
354	F	98.3	Very high	96.9	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.1	-177.7	-58.6	-85	0	0	0	109.7	Y308 V310 V341 I342 T344 R352 D361	Y308-F354 HydrophobicContact CD1-CB 3.84Å; Y308-F354 AromaticContact CD1-CD1 3.43Å; Y308-F354 HydrophobicContact CD1-CD1 3.43Å; Y308-F354 VanDerWaalsContact CD1-CD1 3.43Å; Y308-F354 HydrophobicContact CD1-CE1 4.14Å; Y308-F354 AromaticContact CD1-CG 3.81Å; Y308-F354 HydrophobicContact CD1-CG 3.81Å; Y308-F354 HydrophobicContact CE1-CB 4.02Å; Y308-F354 HydrophobicContact CE1-CD1 4.3Å; Y308-F354 HydrophobicContact CE1-CG 4.48Å; Y308-F354 HydrophobicContact CG-CB 4.11Å; Y308-F354 AromaticContact CG-CD1 3.77Å; Y308-F354 HydrophobicContact CG-CD1 3.77Å; Y308-F354 HydrophobicContact CG-CD2 4.47Å; Y308-F354 HydrophobicContact CG-CE1 4.26Å; Y308-F354 AromaticContact CG-CG 3.88Å; Y308-F354 HydrophobicContact CG-CG 3.88Å; V310-F354 HydrophobicContact CG2-CE2 4.31Å; V310-F354 HydrophobicContact CG2-CZ 4.26Å; V341-F354 CarbonylContact C-O 3.34Å; V341-F354 VanDerWaalsContact CA-O 3.3Å; V341-F354 WeakPolarHBondContact CA-O 3.38Å; V341-F354 WeakPolarHBondContact CG1-O 3.41Å; I342-F354 HydrophobicContact CB-CB 4.4Å; I342-F354 HydrophobicContact CG2-CD2 4.42Å; I342-F354 PolarHBondContact N-O 2.79Å; I342-F354 PolarHBondContact O-N 2.91Å; T344-F354 HydrophobicContact CG2-CE2 4.13Å; R352-F354 HydrophobicContact CB-CE2 3.68Å; R352-F354 HydrophobicContact CB-CZ 3.96Å; F354-D361 HydrophobicContact CD1-CB 3.51Å; F354-D361 HydrophobicContact CE1-CB 3.77Å; F354-D361 HydrophobicContact CG-CB 4.44Å
355	D	97.6	Very high	96.7	Very high	42 Å²	42	41.9 Å²	41.9	23%	0.225	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.3	173.2	-179.4	-26.6	0	0	0	109.5	V341 N357 T358 K359 R360	V341-D355 HydrophobicContact CG2-CB 4.46Å; D355-N357 VanDerWaalsContact C-N 3.32Å; D355-N357 PolarHBondContact O-N 3.26Å; D355-N357 WeakPolarHBondContact OD1-CA 3.46Å; D355-N357 WeakPolarHBondContact OD1-CB 3.5Å; D355-N357 PolarHBondContact OD1-N 3.17Å; D355-T358 VanDerWaalsContact CB-OG1 3.3Å; D355-T358 WeakPolarHBondContact CB-OG1 3.41Å; D355-T358 PolarHBondContact OD1-N 3.4Å; D355-T358 VanDerWaalsContact OD2-CG2 3.28Å; D355-T358 WeakPolarHBondContact OD2-CG2 3.35Å; D355-T358 PolarHBondContact OD2-OG1 2.91Å; D355-K359 WeakPolarHBondContact O-CA 3.46Å; D355-K359 PolarHBondContact O-N 3.43Å; D355-R360 PolarHBondContact N-O 3.02Å
356	R	97.3	Very high	96.5	Very high	26 Å²	26	41.9 Å²	41.9	10%	0.098	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-28.2	-176.5	-62.8	179.1	56.7	-154	2.2	113.2	E306 Y308 D339 S340 I342 K359	E306-R356 IonicContact OE1-CZ 3.36Å; E306-R356 IonicContact OE1-NE 3.06Å; E306-R356 PolarHBondContact OE1-NE 2.75Å; E306-R356 IonicContact OE1-NH2 2.79Å; E306-R356 PolarHBondContact OE1-NH2 2.64Å; E306-R356 VanDerWaalsContact OE2-CG 3.29Å; E306-R356 WeakPolarHBondContact OE2-CG 3.42Å; E306-R356 IonicContact OE2-NE 3.06Å; E306-R356 PolarHBondContact OE2-NE 2.66Å; Y308-R356 WeakPolarHBondContact OH-CA 3.35Å; D339-R356 WeakPolarHBondContact O-CD 3.42Å; D339-R356 PolarHBondContact O-NH1 2.96Å; S340-R356 WeakPolarHBondContact O-CB 3.39Å; S340-R356 WeakPolarHBondContact O-CG 3.5Å; S340-R356 PolarHBondContact O-N 2.82Å; I342-R356 HydrophobicContact CD1-CG 4.1Å; R356-K359 WeakPolarHBondContact O-CD 3.45Å; R356-K359 WeakPolarHBondContact O-CE 3.44Å; R356-K359 PolarHBondContact O-NZ 3.06Å
357	N	96.4	Very high	96.1	Very high	129 Å²	129	42.5 Å²	42.5	69%	0.69	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-49.3	-177.8	-63.9	-32.1	0	0	0	110.5	D355	D355-N357 VanDerWaalsContact C-N 3.32Å; D355-N357 PolarHBondContact O-N 3.26Å; D355-N357 WeakPolarHBondContact OD1-CA 3.46Å; D355-N357 WeakPolarHBondContact OD1-CB 3.5Å; D355-N357 PolarHBondContact OD1-N 3.17Å
358	T	96.2	Very high	95.4	Very high	75 Å²	75	52.2 Å²	52.2	46%	0.46	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.7	-176.9	68.6	0	0	0	0	113.3	D355 R360	D355-T358 VanDerWaalsContact CB-OG1 3.3Å; D355-T358 WeakPolarHBondContact CB-OG1 3.41Å; D355-T358 PolarHBondContact OD1-N 3.4Å; D355-T358 VanDerWaalsContact OD2-CG2 3.28Å; D355-T358 WeakPolarHBondContact OD2-CG2 3.35Å; D355-T358 PolarHBondContact OD2-OG1 2.91Å; T358-R360 PolarHBondContact O-N 3.34Å; T358-R360 VanDerWaalsContact O-N 3.14Å
359	K	94	Very high	94.4	Very high	119 Å²	119	60.2 Å²	60.2	52%	0.517	28%	0.281	S	S	.	.			trans	55.9	22.8	-173.8	-57.4	-56.1	-172.2	-161.6	0	113.2	E306 Y308 D355 R356	E306-K359 IonicContact OE2-NZ 3.7Å; E306-K359 PolarHBondContact OE2-NZ 2.62Å; Y308-K359 PolarHBondContact OH-NZ 2.82Å; D355-K359 WeakPolarHBondContact O-CA 3.46Å; D355-K359 PolarHBondContact O-N 3.43Å; R356-K359 WeakPolarHBondContact O-CD 3.45Å; R356-K359 WeakPolarHBondContact O-CE 3.44Å; R356-K359 PolarHBondContact O-NZ 3.06Å
360	R	96.2	Very high	93.2	Very high	194 Å²	194	63.8 Å²	63.8	73%	0.732	30%	0.3	S	S	*	.			trans	-93.7	145.4	174.5	-65.6	-177	178.6	-177.7	0.7	109.7	D355 T358	D355-R360 PolarHBondContact N-O 3.02Å; T358-R360 PolarHBondContact O-N 3.34Å; T358-R360 VanDerWaalsContact O-N 3.14Å
361	D	96.1	Very high	92.1	Very high	89 Å²	89	65.1 Å²	65.1	48%	0.476	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	153.4	174.6	63.6	-63.8	0	0	0	111.3	R352 M353 F354	R352-D361 IonicContact CZ-OD2 3.49Å; R352-D361 IonicContact NH1-OD2 2.63Å; R352-D361 PolarHBondContact NH1-OD2 3.22Å; R352-D361 IonicContact NH2-OD2 3.93Å; R352-D361 PolarHBondContact NH2-OD2 2.87Å; M353-D361 CarbonylContact O-C 3.56Å; M353-D361 WeakPolarHBondContact O-CA 3.07Å; F354-D361 HydrophobicContact CD1-CB 3.51Å; F354-D361 HydrophobicContact CE1-CB 3.77Å; F354-D361 HydrophobicContact CG-CB 4.44Å
362	V	96.3	Very high	91.1	Very high	43 Å²	43	73.4 Å²	73.4	26%	0.261	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.6	174.9	65	0	0	0	0	110.1	R352 M353 L364 P379	R352-V362 WeakPolarHBondContact CA-O 3.35Å; M353-V362 HydrophobicContact CB-CG1 3.83Å; M353-V362 HydrophobicContact CG-CG1 4.4Å; M353-V362 PolarHBondContact N-O 3.45Å; M353-V362 PolarHBondContact O-N 3.33Å; M353-V362 HydrophobicContact SD-CG1 4.39Å; V362-L364 HydrophobicContact CG1-CD1 4.46Å; V362-L364 HydrophobicContact CG1-CG 4.37Å; V362-L364 HydrophobicContact CG2-CD2 3.83Å; V362-L364 HydrophobicContact CG2-CG 4.11Å; V362-P379 HydrophobicContact CG2-CB 3.88Å; V362-P379 HydrophobicContact CG2-CG 3.9Å
363	T	96.5	Very high	90.2	Very high	15 Å²	15	78.2 Å²	78.2	9%	0.092	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.7	170.7	-53.5	0	0	0	0	108.2	F350 R352 P379 R380	F350-T363 HydrophobicContact CB-CG2 3.93Å; F350-T363 HydrophobicContact CD2-CG2 3.99Å; F350-T363 HydrophobicContact CG-CG2 3.95Å; R352-T363 WeakPolarHBondContact CD-OG1 3.38Å; R352-T363 PolarHBondContact NH1-OG1 2.83Å; R352-T363 VanDerWaalsContact NH1-OG1 3.07Å; T363-P379 CarbonylContact O-C 3.57Å; T363-P379 WeakPolarHBondContact O-CA 3.42Å; T363-R380 HydrophobicContact CG2-CB 4.35Å; T363-R380 PolarHBondContact O-N 3.07Å
364	L	95.6	Very high	89.3	Confident	20 Å²	20	84.9 Å²	84.9	11%	0.105	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	164.7	-179.7	-61.8	176.5	0	0	0	109.7	F350 F351 M353 V362 L377	F350-L364 WeakPolarHBondContact CA-O 3.39Å; F351-L364 HydrophobicContact CD1-CB 4.19Å; F351-L364 HydrophobicContact CD2-CB 4.17Å; F351-L364 HydrophobicContact CE1-CB 3.64Å; F351-L364 HydrophobicContact CE2-CB 3.63Å; F351-L364 HydrophobicContact CE2-CD1 3.62Å; F351-L364 HydrophobicContact CE2-CG 4.19Å; F351-L364 HydrophobicContact CG-CB 4.44Å; F351-L364 HydrophobicContact CZ-CB 3.34Å; F351-L364 HydrophobicContact CZ-CD1 3.79Å; F351-L364 HydrophobicContact CZ-CG 4.2Å; F351-L364 PolarHBondContact N-O 3.41Å; F351-L364 PolarHBondContact O-N 2.92Å; M353-L364 HydrophobicContact SD-CD1 3.86Å; V362-L364 HydrophobicContact CG1-CD1 4.46Å; V362-L364 HydrophobicContact CG1-CG 4.37Å; V362-L364 HydrophobicContact CG2-CD2 3.83Å; V362-L364 HydrophobicContact CG2-CG 4.11Å; L364-L377 HydrophobicContact CB-CD1 4.31Å; L364-L377 HydrophobicContact CD1-CD1 4.13Å; L364-L377 HydrophobicContact CD2-CB 3.93Å
365	E	94.9	Very high	88.6	Confident	25 Å²	25	87.1 Å²	87.1	12%	0.117	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.2	-174.9	-176	-169.2	167.4	0	0	110.9	F350 S367 N370 R380	F350-E365 HydrophobicContact CD1-CB 3.8Å; F350-E365 HydrophobicContact CD1-CG 3.9Å; F350-E365 HydrophobicContact CE1-CB 3.84Å; F350-E365 HydrophobicContact CE1-CG 3.79Å; E365-S367 PolarHBondContact O-N 3.32Å; E365-S367 VanDerWaalsContact OE1-CB 3.31Å; E365-S367 WeakPolarHBondContact OE1-CB 3.4Å; E365-N370 PolarHBondContact OE1-ND2 3.02Å; E365-N370 PolarHBondContact OE2-ND2 3.31Å; E365-R380 HydrophobicContact CB-CG 4.13Å; E365-R380 IonicContact OE2-CZ 3.69Å; E365-R380 IonicContact OE2-NE 2.83Å; E365-R380 PolarHBondContact OE2-NE 3.26Å; E365-R380 IonicContact OE2-NH2 3.31Å; E365-R380 PolarHBondContact OE2-NH2 2.65Å
366	A	94.1	Very high	88.1	Confident	0 Å²	0	91.8 Å²	91.8	0%	0	45%	0.446	C	S	.	.			trans	-88.3	89.7	171.7	0	0	0	0	0	110.4	N349 F351 I404 V418 A420 Y425 F427	N349-A366 HydrophobicContact CB-CB 4.41Å; N349-A366 VanDerWaalsContact CB-O 3.31Å; N349-A366 WeakPolarHBondContact CB-O 3.42Å; N349-A366 PolarHBondContact ND2-O 3.28Å; N349-A366 PolarHBondContact O-N 2.84Å; F351-A366 HydrophobicContact CE1-CB 4.41Å; A366-I404 HydrophobicContact CB-CD1 4.27Å; A366-V418 HydrophobicContact CB-CG1 4.02Å; A366-A420 HydrophobicContact CB-CB 4.44Å; A366-Y425 HydrophobicContact CB-CD2 3.87Å; A366-Y425 HydrophobicContact CB-CE2 4.14Å; A366-Y425 HydrophobicContact CB-CG 4.06Å; A366-F427 HydrophobicContact CB-CE2 4.4Å; A366-F427 HydrophobicContact CB-CZ 4.35Å
367	S	89.6	Confident	87.7	Confident	14 Å²	14	92.4 Å²	92.4	10%	0.098	45%	0.451	C	S	.	.			trans	-141.4	126.9	179.6	169.6	0	0	0	0	111.9	E365 E369 N370 S371	E365-S367 PolarHBondContact O-N 3.32Å; E365-S367 VanDerWaalsContact OE1-CB 3.31Å; E365-S367 WeakPolarHBondContact OE1-CB 3.4Å; S367-E369 PolarHBondContact OG-N 2.79Å; S367-N370 PolarHBondContact OG-N 3.09Å; S367-S371 WeakPolarHBondContact O-CB 3.27Å; S367-S371 PolarHBondContact O-N 3.48Å; S367-S371 PolarHBondContact O-OG 2.98Å
368	R	81.1	Confident	87.4	Confident	204 Å²	204	93.5 Å²	93.5	77%	0.77	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-35.4	176.5	-168.3	177.6	-174.3	-174.1	2.5	112.4	N370 Y425	R368-N370 VanDerWaalsContact C-N 3.35Å; R368-Y425 HydrophobicContact CB-CE1 4.45Å; R368-Y425 PolarHBondContact N-OH 3.28Å; R368-Y425 VanDerWaalsContact N-OH 3.12Å
369	E	75.6	Confident	87.3	Confident	186 Å²	186	94.2 Å²	94.2	87%	0.869	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-34.8	-179.8	-65.1	175.6	-179.8	0	0	111.6	S367	S367-E369 PolarHBondContact OG-N 2.79Å
370	N	71.2	Confident	87.2	Confident	94 Å²	94	91.2 Å²	91.2	50%	0.503	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.5	-175.9	-73	-26.5	0	0	0	114	E365 S367 R368	E365-N370 PolarHBondContact OE1-ND2 3.02Å; E365-N370 PolarHBondContact OE2-ND2 3.31Å; S367-N370 PolarHBondContact OG-N 3.09Å; R368-N370 VanDerWaalsContact C-N 3.35Å
371	S	72.5	Confident	86.9	Confident	29 Å²	29	88.8 Å²	88.8	20%	0.203	44%	0.436	C	S	.	.			trans	-136.5	112.2	-169.9	-39.9	0	0	0	0	111.4	S367	S367-S371 WeakPolarHBondContact O-CB 3.27Å; S367-S371 PolarHBondContact O-N 3.48Å; S367-S371 PolarHBondContact O-OG 2.98Å
372	K	78	Confident	86.7	Confident	175 Å²	175	85.9 Å²	85.9	76%	0.761	42%	0.421	S	S	*	.			trans	-70.4	153.3	167.7	-67.1	-174.6	179.6	-177.3	0	109.8	R374 A375	K372-R374 PolarHBondContact O-N 2.98Å; K372-A375 HydrophobicContact CB-CB 4.31Å; K372-A375 WeakPolarHBondContact O-CB 3.39Å; K372-A375 PolarHBondContact O-N 3.4Å
373	P	78.5	Confident	86.2	Confident	125 Å²	125	85.3 Å²	85.3	81%	0.812	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	130.3	171.8	-26.8	34.4	0	0	0	111	A375	P373-A375 PolarHBondContact O-N 2.97Å
374	R	79.1	Confident	85.3	Confident	174 Å²	174	89.2 Å²	89.2	66%	0.657	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	13.4	-179.4	-50	177.6	179.9	169.1	1.7	115.6	E55 K372	E55-R374 IonicContact OE1-NH2 2.96Å; K372-R374 PolarHBondContact O-N 2.98Å
375	A	84.4	Confident	84.1	Confident	51 Å²	51	91.3 Å²	91.3	42%	0.421	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-71.2	141	170.5	0	0	0	0	0	110.7	K372 P373 L377	K372-A375 HydrophobicContact CB-CB 4.31Å; K372-A375 WeakPolarHBondContact O-CB 3.39Å; K372-A375 PolarHBondContact O-N 3.4Å; P373-A375 PolarHBondContact O-N 2.97Å; A375-L377 PolarHBondContact O-N 3.39Å
376	I	85.9	Confident	82.8	Confident	141 Å²	141	93.8 Å²	93.8	72%	0.723	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-69.2	126.7	170.6	-61.6	172.3	0	0	0	107.9	K378	I376-K378 PolarHBondContact O-N 2.76Å
377	L	90.5	Very high	81.2	Confident	38 Å²	38	103.8 Å²	103.8	20%	0.199	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-65.5	133.2	176.9	-63.4	179.8	0	0	0	110.2	F351 L364 A375 F427	F351-L377 HydrophobicContact CZ-CD1 3.99Å; L364-L377 HydrophobicContact CB-CD1 4.31Å; L364-L377 HydrophobicContact CD1-CD1 4.13Å; L364-L377 HydrophobicContact CD2-CB 3.93Å; A375-L377 PolarHBondContact O-N 3.39Å; L377-F427 HydrophobicContact CD1-CD1 3.67Å; L377-F427 HydrophobicContact CD1-CD2 4.29Å; L377-F427 HydrophobicContact CD1-CE1 3.74Å; L377-F427 HydrophobicContact CD1-CE2 4.34Å; L377-F427 HydrophobicContact CD1-CG 3.95Å; L377-F427 HydrophobicContact CD1-CZ 4.07Å; L377-F427 HydrophobicContact CD2-CD1 4.32Å; L377-F427 HydrophobicContact CD2-CE1 3.87Å; L377-F427 HydrophobicContact CD2-CZ 4.5Å; L377-F427 HydrophobicContact CG-CD1 4.21Å; L377-F427 HydrophobicContact CG-CE1 4.21Å
378	K	89.8	Confident	80.1	Confident	153 Å²	153	112.1 Å²	112.1	67%	0.665	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-88.3	129.2	175.2	-69.7	-177.4	180	-178.6	0	109.6	I376 R380	I376-K378 PolarHBondContact O-N 2.76Å; K378-R380 PolarHBondContact O-NH1 2.91Å
379	P	92.5	Very high	79.7	Confident	90 Å²	90	111 Å²	111	58%	0.584	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-51.9	139.7	171.1	-28.6	36.4	0	0	0	112.3	V362 T363	V362-P379 HydrophobicContact CG2-CB 3.88Å; V362-P379 HydrophobicContact CG2-CG 3.9Å; T363-P379 CarbonylContact O-C 3.57Å; T363-P379 WeakPolarHBondContact O-CA 3.42Å
380	R	92.5	Very high	79.4	Confident	55 Å²	55	111.5 Å²	111.5	21%	0.208	57%	0.569	C	S	.	*			trans	-105	150.5	174.3	-64.3	-62.6	-170.2	-111.1	0.2	110.5	F350 T363 E365 K378	F350-R380 HydrophobicContact CE1-CB 4.22Å; F350-R380 HydrophobicContact CE1-CG 3.94Å; F350-R380 HydrophobicContact CZ-CB 4.16Å; F350-R380 HydrophobicContact CZ-CG 4.27Å; T363-R380 HydrophobicContact CG2-CB 4.35Å; T363-R380 PolarHBondContact O-N 3.07Å; E365-R380 HydrophobicContact CB-CG 4.13Å; E365-R380 IonicContact OE2-CZ 3.69Å; E365-R380 IonicContact OE2-NE 2.83Å; E365-R380 PolarHBondContact OE2-NE 3.26Å; E365-R380 IonicContact OE2-NH2 3.31Å; E365-R380 PolarHBondContact OE2-NH2 2.65Å; K378-R380 PolarHBondContact O-NH1 2.91Å
381	K	90.5	Very high	79.6	Confident	144 Å²	144	113.3 Å²	113.3	63%	0.626	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130.6	137	173.1	-75.9	-172.7	177.9	-174.9	0	110.2	E392 I393	K381-E392 HydrophobicContact CB-CG 3.9Å; K381-E392 WeakPolarHBondContact O-CA 3.45Å; K381-I393 PolarHBondContact O-N 3.3Å
382	V	90.8	Very high	80.2	Confident	27 Å²	27	113.5 Å²	113.5	16%	0.164	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.4	129.6	175.5	-174.7	0	0	0	0	108.3	Y313 F350 I393 V395 L398	Y313-V382 HydrophobicContact CD1-CB 3.91Å; Y313-V382 HydrophobicContact CD1-CG1 4.03Å; Y313-V382 HydrophobicContact CD1-CG2 4.4Å; Y313-V382 HydrophobicContact CD2-CG1 3.83Å; Y313-V382 HydrophobicContact CE1-CB 3.8Å; Y313-V382 HydrophobicContact CE1-CG1 4.15Å; Y313-V382 HydrophobicContact CE1-CG2 3.77Å; Y313-V382 HydrophobicContact CE2-CB 4.44Å; Y313-V382 HydrophobicContact CE2-CG1 3.96Å; Y313-V382 HydrophobicContact CE2-CG2 4.32Å; Y313-V382 HydrophobicContact CG-CB 4.28Å; Y313-V382 HydrophobicContact CG-CG1 3.88Å; F350-V382 HydrophobicContact CD2-CG2 4.34Å; F350-V382 HydrophobicContact CE2-CG2 3.84Å; V382-I393 CarbonylContact C-O 3.59Å; V382-I393 WeakPolarHBondContact CA-O 3.28Å; V382-I393 HydrophobicContact CB-CG2 4.39Å; V382-I393 HydrophobicContact CG1-CG2 4.5Å; V382-I393 HydrophobicContact CG2-CG2 3.84Å; V382-V395 HydrophobicContact CG1-CG2 3.6Å; V382-L398 HydrophobicContact CG1-CD1 4.27Å; V382-L398 HydrophobicContact CG2-CD2 4.45Å
383	C	85.5	Confident	80.7	Confident	31 Å²	31	107.1 Å²	107.1	21%	0.209	55%	0.55	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	131	179.7	-96.1	0	0	0	0	112.1	E392 I393 V395	C383-E392 PolarHBondContact SG-OE2 3.13Å; C383-I393 PolarHBondContact N-O 2.93Å; C383-V395 PolarHBondContact O-N 3.46Å
384	V	78.5	Confident	81.3	Confident	97 Å²	97	102.8 Å²	102.8	59%	0.588	52%	0.522	S	S	*	.			trans	-98.4	87.2	175.1	-168.2	0	0	0	0	108.8	Y313 V395	Y313-V384 VanDerWaalsContact CB-CG2 3.41Å; V384-V395 HydrophobicContact CG2-CG2 4.21Å
385	G	71.4	Confident	81.9	Confident	64 Å²	64	94.9 Å²	94.9	66%	0.66	49%	0.494	S	S	*	.	S	Bend	trans	73.4	154.9	179.6	0	0	0	0	0	114.9
386	G	67.3	Low	82.1	Confident	78 Å²	78	98.1 Å²	98.1	80%	0.804	50%	0.504	S	S	*	.	S	Bend	trans	98.7	-179.2	177.9	0	0	0	0	0	115.5	R388	G386-R388 PolarHBondContact O-N 2.79Å
387	K	60.9	Low	82.4	Confident	209 Å²	209	94.8 Å²	94.8	91%	0.909	49%	0.493	S	S	*	.	S	Bend	trans	-67	112	-178.8	-76.5	-173.8	178.4	178.7	0	110.3	R389	K387-R389 PolarHBondContact O-N 3.46Å
388	R	64.8	Low	82.5	Confident	190 Å²	190	93.5 Å²	93.5	72%	0.717	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-50.5	121.8	174.8	-165	179.6	85.6	164.9	6	111	G386 E392	G386-R388 PolarHBondContact O-N 2.79Å; R388-E392 WeakPolarHBondContact CD-O 3.43Å; R388-E392 WeakPolarHBondContact CG-O 3.38Å
389	R	73.1	Confident	82.7	Confident	181 Å²	181	88.7 Å²	88.7	68%	0.683	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-79	163.9	168.2	-56.5	-179.9	173.9	-168.9	-0.4	110.3	K387 D391 E392	K387-R389 PolarHBondContact O-N 3.46Å; R389-D391 PolarHBondContact O-N 2.87Å; R389-E392 HydrophobicContact CB-CG 4.33Å; R389-E392 WeakPolarHBondContact CB-OE2 3.42Å; R389-E392 VanDerWaalsContact CG-OE2 3.22Å; R389-E392 WeakPolarHBondContact CG-OE2 3.35Å; R389-E392 PolarHBondContact N-OE2 2.87Å; R389-E392 PolarHBondContact O-N 3.22Å
390	K	69	Low	82.8	Confident	195 Å²	195	86.5 Å²	86.5	85%	0.848	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	125.6	172	-158.5	174.7	-179.2	-179	0	107.6
391	D	76	Confident	82.8	Confident	132 Å²	132	87.2 Å²	87.2	71%	0.706	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	7.1	-177.7	-45.8	-37	0	0	0	117.6	R389	R389-D391 PolarHBondContact O-N 2.87Å
392	E	85.3	Confident	83	Confident	34 Å²	34	84.7 Å²	84.7	16%	0.159	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.8	171.2	-76.1	167.8	177.9	0	0	111.7	K381 C383 R388 R389	K381-E392 HydrophobicContact CB-CG 3.9Å; K381-E392 WeakPolarHBondContact O-CA 3.45Å; C383-E392 PolarHBondContact SG-OE2 3.13Å; R388-E392 WeakPolarHBondContact CD-O 3.43Å; R388-E392 WeakPolarHBondContact CG-O 3.38Å; R389-E392 HydrophobicContact CB-CG 4.33Å; R389-E392 WeakPolarHBondContact CB-OE2 3.42Å; R389-E392 VanDerWaalsContact CG-OE2 3.22Å; R389-E392 WeakPolarHBondContact CG-OE2 3.35Å; R389-E392 PolarHBondContact N-OE2 2.87Å; R389-E392 PolarHBondContact O-N 3.22Å
393	I	89.4	Confident	83.3	Confident	41 Å²	41	86.7 Å²	86.7	21%	0.21	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.7	173.4	-165.8	163	0	0	0	110	F350 K381 V382 C383 L398	F350-I393 HydrophobicContact CE2-CG2 3.9Å; F350-I393 HydrophobicContact CZ-CG2 3.92Å; K381-I393 PolarHBondContact O-N 3.3Å; V382-I393 CarbonylContact C-O 3.59Å; V382-I393 WeakPolarHBondContact CA-O 3.28Å; V382-I393 HydrophobicContact CB-CG2 4.39Å; V382-I393 HydrophobicContact CG1-CG2 4.5Å; V382-I393 HydrophobicContact CG2-CG2 3.84Å; C383-I393 PolarHBondContact N-O 2.93Å; I393-L398 HydrophobicContact CD1-CD2 4.11Å; I393-L398 HydrophobicContact CG1-CD2 4.32Å; I393-L398 HydrophobicContact CG2-CD2 3.93Å
394	S	90.7	Very high	83.9	Confident	33 Å²	33	85.2 Å²	85.2	23%	0.231	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	147.6	173	-175.6	0	0	0	0	109.9	D396 S397	S394-D396 PolarHBondContact O-N 3.18Å; S394-D396 PolarHBondContact OG-N 2.87Å; S394-S397 PolarHBondContact O-N 3.06Å
395	V	91.1	Very high	84.8	Confident	9 Å²	9	82.1 Å²	82.1	6%	0.055	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-54.1	-40.3	171.2	178	0	0	0	0	111.3	Y313 L314 K317 V382 C383 V384 S397 L398	Y313-V395 HydrophobicContact CD2-CG1 4.48Å; Y313-V395 HydrophobicContact CD2-CG2 3.96Å; Y313-V395 HydrophobicContact CG-CG2 4.22Å; L314-V395 HydrophobicContact CD2-CG1 4.18Å; K317-V395 HydrophobicContact CG-CG1 4.11Å; V382-V395 HydrophobicContact CG1-CG2 3.6Å; C383-V395 PolarHBondContact O-N 3.46Å; V384-V395 HydrophobicContact CG2-CG2 4.21Å; V395-S397 PolarHBondContact O-N 2.97Å; V395-L398 HydrophobicContact CG1-CD1 4.39Å; V395-L398 WeakPolarHBondContact O-CB 3.29Å; V395-L398 WeakPolarHBondContact O-CG 3.24Å; V395-L398 PolarHBondContact O-N 2.79Å
396	D	88.7	Confident	86.1	Confident	118 Å²	118	80.5 Å²	80.5	63%	0.631	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-70.7	-10.1	-179.9	-56.3	-51.7	0	0	0	113.5	K317 S394	K317-D396 VanDerWaalsContact CE-OD1 3.31Å; K317-D396 WeakPolarHBondContact CE-OD1 3.43Å; K317-D396 IonicContact NZ-OD1 3.31Å; K317-D396 PolarHBondContact NZ-OD1 2.93Å; S394-D396 PolarHBondContact O-N 3.18Å; S394-D396 PolarHBondContact OG-N 2.87Å
397	S	91.5	Very high	87.6	Confident	72 Å²	72	76.8 Å²	76.8	50%	0.503	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-102.4	3.6	177.6	-53.6	0	0	0	0	112.9	S394 V395	S394-S397 PolarHBondContact O-N 3.06Å; V395-S397 PolarHBondContact O-N 2.97Å
398	L	93.5	Very high	89.4	Confident	11 Å²	11	67 Å²	67	6%	0.058	32%	0.324	C	S	.	.			trans	-72.6	132.2	177.1	-63.7	175.8	0	0	0	110.3	Y313 L314 N348 F350 V382 I393 V395 F400	Y313-L398 HydrophobicContact CD2-CD1 4.12Å; Y313-L398 HydrophobicContact CE2-CD1 3.5Å; L314-L398 HydrophobicContact CD2-CD1 4.15Å; N348-L398 HydrophobicContact CB-CB 4.4Å; N348-L398 HydrophobicContact CB-CD2 3.76Å; F350-L398 HydrophobicContact CD2-CD2 4.49Å; F350-L398 HydrophobicContact CE2-CD2 3.85Å; V382-L398 HydrophobicContact CG1-CD1 4.27Å; V382-L398 HydrophobicContact CG2-CD2 4.45Å; I393-L398 HydrophobicContact CD1-CD2 4.11Å; I393-L398 HydrophobicContact CG1-CD2 4.32Å; I393-L398 HydrophobicContact CG2-CD2 3.93Å; V395-L398 HydrophobicContact CG1-CD1 4.39Å; V395-L398 WeakPolarHBondContact O-CB 3.29Å; V395-L398 WeakPolarHBondContact O-CG 3.24Å; V395-L398 PolarHBondContact O-N 2.79Å; L398-F400 HydrophobicContact CB-CE2 4.27Å; L398-F400 HydrophobicContact CB-CZ 4.21Å; L398-F400 WeakPolarHBondContact O-CD2 3.43Å
399	D	93.8	Very high	91	Very high	51 Å²	51	59.2 Å²	59.2	27%	0.273	29%	0.294	S	S	.	.			trans	-87.7	107.5	172.5	-174	-11.2	0	0	0	110.2	N348 S401 K402	N348-D399 WeakPolarHBondContact CA-O 3.33Å; N348-D399 PolarHBondContact N-O 3.27Å; N348-D399 PolarHBondContact OD1-N 3.38Å; D399-S401 VanDerWaalsContact C-N 3.3Å; D399-S401 WeakPolarHBondContact OD1-CB 3.5Å; D399-S401 PolarHBondContact OD1-N 3.12Å; D399-S401 PolarHBondContact OD1-OG 3.33Å; D399-S401 PolarHBondContact OD2-OG 2.76Å; D399-K402 HydrophobicContact CB-CB 4.29Å; D399-K402 HydrophobicContact CB-CD 4.08Å; D399-K402 HydrophobicContact CB-CG 4.32Å; D399-K402 PolarHBondContact O-N 3.42Å; D399-K402 VanDerWaalsContact OD2-CD 3.23Å; D399-K402 WeakPolarHBondContact OD2-CD 3.47Å; D399-K402 WeakPolarHBondContact OD2-CE 3.04Å; D399-K402 WeakPolarHBondContact OD2-CG 3.36Å; D399-K402 IonicContact OD2-NZ 3.39Å; D399-K402 PolarHBondContact OD2-NZ 3.1Å
400	F	94.6	Very high	92.2	Very high	44 Å²	44	50.7 Å²	50.7	19%	0.193	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.2	-179.8	-65.3	-81.4	0	0	0	113.5	L314 L321 Y347 L398 K402	L314-F400 HydrophobicContact CD1-CE1 4.28Å; L314-F400 HydrophobicContact CD2-CE1 3.74Å; L314-F400 HydrophobicContact CD2-CZ 3.81Å; L321-F400 HydrophobicContact CD2-CD1 3.59Å; L321-F400 HydrophobicContact CD2-CE1 3.49Å; L321-F400 VanDerWaalsContact CD2-CE1 3.49Å; L321-F400 HydrophobicContact CD2-CG 4.25Å; L321-F400 HydrophobicContact CD2-CZ 4.05Å; Y347-F400 HydrophobicContact CD1-CB 4.13Å; Y347-F400 AromaticContact CD1-CD1 3.65Å; Y347-F400 HydrophobicContact CD1-CD1 3.65Å; Y347-F400 HydrophobicContact CD1-CG 4.35Å; Y347-F400 AromaticContact CD2-CD1 3.8Å; Y347-F400 HydrophobicContact CD2-CD1 3.8Å; Y347-F400 AromaticContact CD2-CE1 3.94Å; Y347-F400 HydrophobicContact CD2-CE1 3.94Å; Y347-F400 HydrophobicContact CE1-CB 4.45Å; Y347-F400 AromaticContact CE1-CD1 3.98Å; Y347-F400 HydrophobicContact CE1-CD1 3.98Å; Y347-F400 HydrophobicContact CE2-CD1 4.13Å; Y347-F400 HydrophobicContact CE2-CE1 4.36Å; Y347-F400 AromaticContact CG-CD1 3.54Å; Y347-F400 HydrophobicContact CG-CD1 3.54Å; Y347-F400 HydrophobicContact CG-CE1 4.04Å; L398-F400 HydrophobicContact CB-CE2 4.27Å; L398-F400 HydrophobicContact CB-CZ 4.21Å; L398-F400 WeakPolarHBondContact O-CD2 3.43Å; F400-K402 VanDerWaalsContact C-N 3.25Å; F400-K402 PolarHBondContact O-N 2.72Å
401	S	93.3	Very high	93.4	Very high	70 Å²	70	43.1 Å²	43.1	49%	0.49	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-25.7	172	75.5	0	0	0	0	111.9	D399 K403	D399-S401 VanDerWaalsContact C-N 3.3Å; D399-S401 WeakPolarHBondContact OD1-CB 3.5Å; D399-S401 PolarHBondContact OD1-N 3.12Å; D399-S401 PolarHBondContact OD1-OG 3.33Å; D399-S401 PolarHBondContact OD2-OG 2.76Å; S401-K403 PolarHBondContact O-N 2.85Å
402	K	94.9	Very high	94.3	Very high	92 Å²	92	41.2 Å²	41.2	40%	0.4	23%	0.23	S	C	.	.	S	Bend	trans	-89	81.2	177.8	-73.1	179.6	-172.3	163.7	0	110.9	Y347 N348 N349 D399 F400	Y347-K402 CarbonylContact C-O 3.59Å; Y347-K402 VanDerWaalsContact C-O 3.25Å; Y347-K402 WeakPolarHBondContact CA-O 3.43Å; N348-K402 WeakPolarHBondContact CA-O 3.29Å; N348-K402 PolarHBondContact N-O 2.78Å; N349-K402 PolarHBondContact N-O 3.31Å; N349-K402 WeakPolarHBondContact OD1-CB 3.41Å; D399-K402 HydrophobicContact CB-CB 4.29Å; D399-K402 HydrophobicContact CB-CD 4.08Å; D399-K402 HydrophobicContact CB-CG 4.32Å; D399-K402 PolarHBondContact O-N 3.42Å; D399-K402 VanDerWaalsContact OD2-CD 3.23Å; D399-K402 WeakPolarHBondContact OD2-CD 3.47Å; D399-K402 WeakPolarHBondContact OD2-CE 3.04Å; D399-K402 WeakPolarHBondContact OD2-CG 3.36Å; D399-K402 IonicContact OD2-NZ 3.39Å; D399-K402 PolarHBondContact OD2-NZ 3.1Å; F400-K402 VanDerWaalsContact C-N 3.25Å; F400-K402 PolarHBondContact O-N 2.72Å
403	K	96.4	Very high	94.7	Very high	69 Å²	69	41.7 Å²	41.7	30%	0.3	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-109.5	133.7	-179.5	53.7	-169.2	174.8	-172.8	0	111.8	D329 Y347 S401 L405	D329-K403 WeakPolarHBondContact OD1-CD 3.29Å; D329-K403 IonicContact OD1-NZ 3.46Å; D329-K403 PolarHBondContact OD1-NZ 2.78Å; D329-K403 WeakPolarHBondContact OD2-CD 3.42Å; D329-K403 IonicContact OD2-NZ 3.43Å; Y347-K403 HydrophobicContact CD1-CB 4.04Å; Y347-K403 HydrophobicContact CE1-CB 4.22Å; S401-K403 PolarHBondContact O-N 2.85Å; K403-L405 HydrophobicContact CB-CD2 4.21Å; K403-L405 HydrophobicContact CB-CG 4.33Å; K403-L405 HydrophobicContact CD-CD1 4Å; K403-L405 HydrophobicContact CD-CD2 4.09Å; K403-L405 HydrophobicContact CD-CG 4.12Å; K403-L405 HydrophobicContact CG-CD1 4.23Å; K403-L405 HydrophobicContact CG-CD2 4.22Å; K403-L405 HydrophobicContact CG-CG 3.97Å
404	I	98	Very high	94.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.			trans	-92.3	97.4	170.1	-56.5	-54.2	0	0	0	107.2	F331 G345 S346 N349 F350 A366 T407 V418 A419 A420	F331-I404 WeakPolarHBondContact CD1-O 3.42Å; F331-I404 WeakPolarHBondContact CE1-O 3.33Å; G345-I404 VanDerWaalsContact CA-O 3.29Å; G345-I404 WeakPolarHBondContact CA-O 3.4Å; S346-I404 PolarHBondContact O-N 2.98Å; N349-I404 HydrophobicContact CB-CD1 4.15Å; F350-I404 WeakPolarHBondContact O-CG1 3.42Å; A366-I404 HydrophobicContact CB-CD1 4.27Å; I404-T407 HydrophobicContact CG2-CG2 3.43Å; I404-T407 VanDerWaalsContact CG2-CG2 3.43Å; I404-V418 HydrophobicContact CD1-CG1 3.93Å; I404-V418 HydrophobicContact CG1-CG1 4.26Å; I404-V418 HydrophobicContact CG2-CG1 3.61Å; I404-A419 WeakPolarHBondContact CD1-O 3.08Å; I404-A420 HydrophobicContact CD1-CB 3.54Å
405	L	98.1	Very high	95.1	Very high	32 Å²	32	41.9 Å²	41.9	17%	0.168	23%	0.231	C	C	.	.			trans	-93	-33.3	179.1	-60.7	-179	0	0	0	112.4	D329 F331 E332 K403	D329-L405 HydrophobicContact CB-CD2 4.06Å; F331-L405 HydrophobicContact CD1-CD2 3.84Å; F331-L405 HydrophobicContact CD2-CD2 4.5Å; F331-L405 HydrophobicContact CE1-CD2 3.76Å; F331-L405 HydrophobicContact CE2-CD2 4.45Å; F331-L405 HydrophobicContact CG-CD2 4.2Å; F331-L405 HydrophobicContact CZ-CD2 4.08Å; E332-L405 WeakPolarHBondContact CB-O 3.43Å; E332-L405 WeakPolarHBondContact CG-O 3.26Å; E332-L405 PolarHBondContact N-O 3.06Å; K403-L405 HydrophobicContact CB-CD2 4.21Å; K403-L405 HydrophobicContact CB-CG 4.33Å; K403-L405 HydrophobicContact CD-CD1 4Å; K403-L405 HydrophobicContact CD-CD2 4.09Å; K403-L405 HydrophobicContact CD-CG 4.12Å; K403-L405 HydrophobicContact CG-CD1 4.23Å; K403-L405 HydrophobicContact CG-CD2 4.22Å; K403-L405 HydrophobicContact CG-CG 3.97Å
406	H	98.3	Very high	95.4	Very high	29 Å²	29	42 Å²	42	13%	0.134	23%	0.231	C	C	.	.			trans	-119.2	126.2	-171.7	-47	-65.3	0	0	0	110.5	I16 S17 V19 E332 A419	I16-H406 PolarHBondContact O-CD2 3.09Å; S17-H406 PolarHBondContact O-CE1 3.27Å; S17-H406 PolarHBondContact O-ND1 2.82Å; S17-H406 PolarHBondContact O-NE2 3.45Å; V19-H406 HydrophobicContact CG2-CB 4.12Å; E332-H406 VanDerWaalsContact CD-ND1 3.33Å; E332-H406 IonicContact OE1-CE1 2.97Å; E332-H406 IonicContact OE1-ND1 3.57Å; E332-H406 PolarHBondContact OE1-ND1 3.27Å; E332-H406 WeakPolarHBondContact OE2-CA 3.37Å; E332-H406 IonicContact OE2-ND1 3.48Å; E332-H406 PolarHBondContact OE2-ND1 3.42Å; H406-A419 HydrophobicContact CB-CB 4.19Å; H406-A419 PolarHBondContact O-N 3.33Å; H406-A419 VanDerWaalsContact O-N 3.08Å
407	T	98.3	Very high	95.9	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	146.7	178.2	65.4	0	0	0	0	109.8	V334 M343 I404 A417 V418	V334-T407 VanDerWaalsContact CG1-O 3.23Å; V334-T407 WeakPolarHBondContact CG1-O 2.94Å; M343-T407 HydrophobicContact CE-CG2 4.39Å; I404-T407 HydrophobicContact CG2-CG2 3.43Å; I404-T407 VanDerWaalsContact CG2-CG2 3.43Å; T407-A417 CarbonylContact C-O 3.56Å; T407-A417 VanDerWaalsContact CA-O 3.29Å; T407-A417 WeakPolarHBondContact CA-O 3.36Å; T407-V418 HydrophobicContact CG2-CG1 4.33Å; T407-V418 HydrophobicContact CG2-CG2 4.32Å
408	A	98.5	Very high	96.2	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.033	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.8	174.6	0	0	0	0	0	110.8	V19 F21 I416 A417	V19-A408 HydrophobicContact CB-CB 4.31Å; V19-A408 HydrophobicContact CG1-CB 3.82Å; F21-A408 HydrophobicContact CD2-CB 3.75Å; F21-A408 HydrophobicContact CE2-CB 4.02Å; A408-I416 WeakPolarHBondContact O-CA 3.48Å; A408-A417 HydrophobicContact CB-CB 4.37Å; A408-A417 PolarHBondContact N-O 3.33Å; A408-A417 PolarHBondContact O-N 2.97Å
409	W	98.2	Very high	96.4	Very high	25 Å²	25	32.6 Å²	32.6	10%	0.095	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.1	173.2	-154.4	-49.9	0	0	0	108.9	F21 V334 W335 N336 V341 M343 M353 E413 I416	F21-W409 VanDerWaalsContact CD2-C 3.44Å; F21-W409 WeakPolarHBondContact CD2-O 3.5Å; V334-W409 HydrophobicContact CG2-CB 4.13Å; V334-W409 HydrophobicContact CG2-CE3 4.46Å; W335-W409 WeakPolarHBondContact O-CB 3.3Å; N336-W409 HydrophobicContact CB-CD2 3.59Å; N336-W409 HydrophobicContact CB-CE3 3.86Å; N336-W409 HydrophobicContact CB-CG 4.24Å; N336-W409 HydrophobicContact CB-CH2 3.68Å; N336-W409 HydrophobicContact CB-CZ2 3.4Å; N336-W409 VanDerWaalsContact CB-CZ2 3.4Å; N336-W409 HydrophobicContact CB-CZ3 3.89Å; V341-W409 HydrophobicContact CB-CH2 3.76Å; V341-W409 HydrophobicContact CB-CZ3 4.2Å; V341-W409 HydrophobicContact CG1-CH2 3.57Å; V341-W409 HydrophobicContact CG1-CZ3 3.92Å; M343-W409 HydrophobicContact CB-CE3 3.83Å; M343-W409 HydrophobicContact CB-CZ3 3.76Å; M343-W409 HydrophobicContact CE-CE3 4.38Å; M353-W409 HydrophobicContact CE-CH2 3.26Å; M353-W409 HydrophobicContact CE-CZ2 4.03Å; M353-W409 HydrophobicContact CE-CZ3 3.81Å; W409-E413 PolarHBondContact NE1-O 2.77Å; W409-E413 VanDerWaalsContact NE1-O 3.12Å; W409-I416 HydrophobicContact CB-CG2 4.48Å; W409-I416 HydrophobicContact CD2-CG2 3.57Å; W409-I416 HydrophobicContact CE3-CG2 4Å; W409-I416 HydrophobicContact CG-CG2 3.82Å; W409-I416 HydrophobicContact CZ2-CG2 4.25Å
410	H	97.7	Very high	96.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.009	16%	0.163	C	C	.	.			trans	-58.2	135.7	172.1	-171.7	-77.2	0	0	0	111.1	F21 G25 Y56 S412 E413 I415	F21-H410 HydrophobicContact CE2-CB 4.34Å; F21-H410 HydrophobicContact CZ-CB 4.32Å; G25-H410 VanDerWaalsContact CA-NE2 3.35Å; G25-H410 WeakPolarHBondContact CA-NE2 3.42Å; G25-H410 PolarHBondContact O-CD2 2.87Å; G25-H410 PolarHBondContact O-NE2 2.91Å; Y56-H410 PolarHBondContact OH-CD2 2.69Å; Y56-H410 VanDerWaalsContact OH-CD2 3.28Å; H410-S412 PolarHBondContact CE1-OG 2.76Å; H410-S412 VanDerWaalsContact CE1-OG 3.24Å; H410-S412 PolarHBondContact ND1-N 3.25Å; H410-S412 PolarHBondContact ND1-OG 3.25Å; H410-S412 PolarHBondContact O-N 2.91Å; H410-E413 HydrophobicContact CB-CB 4.37Å; H410-E413 IonicContact CE1-OE1 2.82Å; H410-E413 WeakPolarHBondContact ND1-CB 3.17Å; H410-E413 PolarHBondContact ND1-N 2.89Å; H410-E413 VanDerWaalsContact ND1-N 3.15Å; H410-I415 HydrophobicContact CB-CB 3.81Å; H410-I415 VanDerWaalsContact CB-O 3.27Å; H410-I415 WeakPolarHBondContact CB-O 3.44Å; H410-I415 PolarHBondContact N-O 3.15Å
411	P	95.9	Very high	96.2	Very high	37 Å²	37	31.1 Å²	31.1	24%	0.24	17%	0.172	C	C	.	.	S	Bend	trans	-62.4	-23.7	-170	22.9	-35.2	0	0	0	114.4	H23 G337	H23-P411 WeakPolarHBondContact O-CG 3.45Å; G337-P411 WeakPolarHBondContact CA-O 3.41Å
412	S	94	Very high	96	Very high	91 Å²	91	30.8 Å²	30.8	64%	0.636	17%	0.165	S	C	*	.	S	Bend	trans	-133	-5	-175.4	58.9	0	0	0	0	115.4	H410	H410-S412 PolarHBondContact CE1-OG 2.76Å; H410-S412 VanDerWaalsContact CE1-OG 3.24Å; H410-S412 PolarHBondContact ND1-N 3.25Å; H410-S412 PolarHBondContact ND1-OG 3.25Å; H410-S412 PolarHBondContact O-N 2.91Å
413	E	94	Very high	95.9	Very high	45 Å²	45	29.6 Å²	29.6	21%	0.21	16%	0.163	C	C	.	.	S	Bend	trans	-130.9	158.3	-171.9	-67.5	-172.8	-148.9	0	0	111.4	R42 R53 W409 H410 I415	R42-E413 IonicContact CZ-OE1 2.62Å; R42-E413 IonicContact CZ-OE2 3.96Å; R42-E413 IonicContact NH1-OE1 3.96Å; R42-E413 PolarHBondContact NH1-OE1 3.19Å; R42-E413 IonicContact NH1-OE2 3.52Å; R42-E413 PolarHBondContact NH1-OE2 2.99Å; R42-E413 IonicContact NH2-OE1 3.92Å; R42-E413 PolarHBondContact NH2-OE1 3.35Å; R42-E413 IonicContact NH2-OE2 3.14Å; R42-E413 PolarHBondContact NH2-OE2 2.76Å; R53-E413 IonicContact CZ-OE2 3.43Å; R53-E413 IonicContact NE-OE2 2.76Å; R53-E413 PolarHBondContact NE-OE2 2.87Å; R53-E413 IonicContact NH1-OE2 2.97Å; R53-E413 PolarHBondContact NH1-OE2 3.48Å; R53-E413 IonicContact NH2-OE2 3.68Å; R53-E413 PolarHBondContact NH2-OE2 2.81Å; W409-E413 PolarHBondContact NE1-O 2.77Å; W409-E413 VanDerWaalsContact NE1-O 3.12Å; H410-E413 HydrophobicContact CB-CB 4.37Å; H410-E413 IonicContact CE1-OE1 2.82Å; H410-E413 WeakPolarHBondContact ND1-CB 3.17Å; H410-E413 PolarHBondContact ND1-N 2.89Å; H410-E413 VanDerWaalsContact ND1-N 3.15Å; E413-I415 HydrophobicContact CB-CD1 4.28Å; E413-I415 HydrophobicContact CB-CG1 4.13Å; E413-I415 PolarHBondContact O-N 3.46Å; E413-I415 WeakPolarHBondContact OE2-CD1 3.19Å
414	N	93.9	Very high	95.9	Very high	77 Å²	77	28.4 Å²	28.4	41%	0.412	16%	0.16	S	C	.	.	S	Bend	trans	-77.2	59.5	170.6	-65.2	-18.4	0	0	0	111.1	Q428 D429	N414-Q428 WeakPolarHBondContact O-CA 3.43Å; N414-D429 HydrophobicContact CB-CB 3.7Å; N414-D429 PolarHBondContact O-N 2.95Å
415	I	95.4	Very high	95.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.5	170.7	-56.8	175	0	0	0	106.6	F21 Y56 H410 E413 I426 F427 Q428	F21-I415 HydrophobicContact CZ-CG2 4.26Å; Y56-I415 HydrophobicContact CE2-CD1 4.49Å; Y56-I415 HydrophobicContact CE2-CG2 4.28Å; H410-I415 HydrophobicContact CB-CB 3.81Å; H410-I415 VanDerWaalsContact CB-O 3.27Å; H410-I415 WeakPolarHBondContact CB-O 3.44Å; H410-I415 PolarHBondContact N-O 3.15Å; E413-I415 HydrophobicContact CB-CD1 4.28Å; E413-I415 HydrophobicContact CB-CG1 4.13Å; E413-I415 PolarHBondContact O-N 3.46Å; E413-I415 WeakPolarHBondContact OE2-CD1 3.19Å; I415-I426 HydrophobicContact CG2-CG2 3.79Å; I415-F427 CarbonylContact C-O 3.59Å; I415-F427 WeakPolarHBondContact CA-O 3.4Å; I415-Q428 HydrophobicContact CG1-CB 3.98Å
416	I	97.1	Very high	95.6	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.056	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144	178.1	59.8	171.8	0	0	0	109.9	M343 F351 A408 W409 V418 I426 F427	M343-I416 HydrophobicContact CE-CB 3.99Å; M343-I416 HydrophobicContact CE-CG2 3.96Å; M343-I416 HydrophobicContact SD-CB 4.06Å; M343-I416 HydrophobicContact SD-CD1 3.75Å; M343-I416 HydrophobicContact SD-CG1 4.48Å; M343-I416 HydrophobicContact SD-CG2 4.01Å; F351-I416 HydrophobicContact CD2-CD1 4.41Å; F351-I416 HydrophobicContact CE2-CD1 3.58Å; F351-I416 HydrophobicContact CZ-CD1 4.1Å; A408-I416 WeakPolarHBondContact O-CA 3.48Å; W409-I416 HydrophobicContact CB-CG2 4.48Å; W409-I416 HydrophobicContact CD2-CG2 3.57Å; W409-I416 HydrophobicContact CE3-CG2 4Å; W409-I416 HydrophobicContact CG-CG2 3.82Å; W409-I416 HydrophobicContact CZ2-CG2 4.25Å; I416-V418 HydrophobicContact CD1-CG2 4.33Å; I416-I426 WeakPolarHBondContact O-CA 3.39Å; I416-F427 HydrophobicContact CD1-CB 4.04Å; I416-F427 HydrophobicContact CD1-CD2 4Å; I416-F427 HydrophobicContact CD1-CG 4.48Å; I416-F427 HydrophobicContact CG1-CB 3.7Å; I416-F427 HydrophobicContact CG1-CD2 4.11Å; I416-F427 HydrophobicContact CG1-CG 4.42Å; I416-F427 PolarHBondContact N-O 3.23Å; I416-F427 PolarHBondContact O-N 3.19Å
417	A	97.9	Very high	95.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.7	173.9	0	0	0	0	0	108.9	V19 F21 L28 T407 A408 L424 Y425	V19-A417 HydrophobicContact CG1-CB 3.83Å; F21-A417 HydrophobicContact CE2-CB 3.91Å; F21-A417 HydrophobicContact CZ-CB 4.1Å; L28-A417 HydrophobicContact CD1-CB 4.05Å; L28-A417 HydrophobicContact CD2-CB 3.76Å; T407-A417 CarbonylContact C-O 3.56Å; T407-A417 VanDerWaalsContact CA-O 3.29Å; T407-A417 WeakPolarHBondContact CA-O 3.36Å; A408-A417 HydrophobicContact CB-CB 4.37Å; A408-A417 PolarHBondContact N-O 3.33Å; A408-A417 PolarHBondContact O-N 2.97Å; A417-L424 HydrophobicContact CB-CD1 4.22Å; A417-Y425 CarbonylContact C-O 3.57Å; A417-Y425 WeakPolarHBondContact CA-O 3.44Å
418	V	98	Very high	95.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.5	-174.5	177.8	0	0	0	0	108.7	M343 F351 A366 I404 T407 I416 Y425 F427	M343-V418 HydrophobicContact SD-CG2 4.41Å; F351-V418 HydrophobicContact CD1-CG1 4.24Å; F351-V418 HydrophobicContact CD1-CG2 4.41Å; F351-V418 HydrophobicContact CE1-CG2 4.46Å; F351-V418 HydrophobicContact CG-CG2 4.44Å; A366-V418 HydrophobicContact CB-CG1 4.02Å; I404-V418 HydrophobicContact CD1-CG1 3.93Å; I404-V418 HydrophobicContact CG1-CG1 4.26Å; I404-V418 HydrophobicContact CG2-CG1 3.61Å; T407-V418 HydrophobicContact CG2-CG1 4.33Å; T407-V418 HydrophobicContact CG2-CG2 4.32Å; I416-V418 HydrophobicContact CD1-CG2 4.33Å; V418-Y425 PolarHBondContact N-O 2.65Å; V418-Y425 PolarHBondContact O-N 2.86Å; V418-F427 HydrophobicContact CB-CE2 4.28Å; V418-F427 HydrophobicContact CG2-CD2 4.2Å; V418-F427 HydrophobicContact CG2-CE2 4.2Å
419	A	97.4	Very high	94.5	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.033	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.8	175.4	0	0	0	0	0	110.4	I16 V19 I404 H406	I16-A419 HydrophobicContact CB-CB 3.99Å; I16-A419 HydrophobicContact CD1-CB 4.35Å; I16-A419 HydrophobicContact CG2-CB 3.69Å; V19-A419 HydrophobicContact CG2-CB 3.8Å; I404-A419 WeakPolarHBondContact CD1-O 3.08Å; H406-A419 HydrophobicContact CB-CB 4.19Å; H406-A419 PolarHBondContact O-N 3.33Å; H406-A419 VanDerWaalsContact O-N 3.08Å
420	A	95	Very high	93.3	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	102.1	170.4	0	0	0	0	0	108.3	A366 I404 N422 N423 Y425	A366-A420 HydrophobicContact CB-CB 4.44Å; I404-A420 HydrophobicContact CD1-CB 3.54Å; A420-N422 PolarHBondContact O-N 2.75Å; A420-N423 PolarHBondContact N-O 2.99Å; A420-N423 PolarHBondContact O-N 3.45Å; A420-Y425 HydrophobicContact CB-CD2 4.16Å; A420-Y425 HydrophobicContact CB-CE2 3.83Å
421	T	90.7	Very high	91.7	Very high	63 Å²	63	50.6 Å²	50.6	39%	0.387	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	-102.2	-172.8	37	0	0	0	0	112.7	I16	I16-T421 PolarHBondContact N-O 3.43Å
422	N	88.2	Confident	89.5	Confident	64 Å²	64	59.1 Å²	59.1	34%	0.342	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	1.9	-177.8	62.1	-24.2	0	0	0	113.4	D14 A420	D14-N422 HydrophobicContact CB-CB 4.21Å; D14-N422 WeakPolarHBondContact O-CA 3.49Å; D14-N422 WeakPolarHBondContact O-CB 3.49Å; A420-N422 PolarHBondContact O-N 2.75Å
423	N	94	Very high	89.3	Confident	66 Å²	66	57.6 Å²	57.6	35%	0.353	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.3	179.9	-61.9	-71.7	0	0	0	110.8	A420 Y425	A420-N423 PolarHBondContact N-O 2.99Å; A420-N423 PolarHBondContact O-N 3.45Å; N423-Y425 HydrophobicContact CB-CD2 4.23Å; N423-Y425 HydrophobicContact CB-CE2 3.63Å
424	L	95.9	Very high	89.1	Confident	44 Å²	44	58.2 Å²	58.2	23%	0.23	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.7	168.1	-174.3	66.7	0	0	0	109.3	I16 V19 L28 T30 F40 A417	I16-L424 HydrophobicContact CD1-CB 3.86Å; I16-L424 HydrophobicContact CD1-CD1 4.48Å; V19-L424 HydrophobicContact CG1-CD1 4.09Å; V19-L424 HydrophobicContact CG2-CD1 4.12Å; L28-L424 HydrophobicContact CD2-CD2 3.86Å; T30-L424 HydrophobicContact CG2-CD1 4.04Å; T30-L424 HydrophobicContact CG2-CD2 3.71Å; T30-L424 HydrophobicContact CG2-CG 4.43Å; F40-L424 HydrophobicContact CD2-CD2 4.16Å; F40-L424 HydrophobicContact CE2-CD2 3.79Å; F40-L424 HydrophobicContact CZ-CD2 4.21Å; A417-L424 HydrophobicContact CB-CD1 4.22Å
425	Y	95.6	Very high	88.8	Confident	39 Å²	39	57.2 Å²	57.2	15%	0.153	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.5	173.4	-67.5	-98.5	0	0	0	109.7	A366 R368 A417 V418 A420 N423 F427	A366-Y425 HydrophobicContact CB-CD2 3.87Å; A366-Y425 HydrophobicContact CB-CE2 4.14Å; A366-Y425 HydrophobicContact CB-CG 4.06Å; R368-Y425 HydrophobicContact CB-CE1 4.45Å; R368-Y425 PolarHBondContact N-OH 3.28Å; R368-Y425 VanDerWaalsContact N-OH 3.12Å; A417-Y425 CarbonylContact C-O 3.57Å; A417-Y425 WeakPolarHBondContact CA-O 3.44Å; V418-Y425 PolarHBondContact N-O 2.65Å; V418-Y425 PolarHBondContact O-N 2.86Å; A420-Y425 HydrophobicContact CB-CD2 4.16Å; A420-Y425 HydrophobicContact CB-CE2 3.83Å; N423-Y425 HydrophobicContact CB-CD2 4.23Å; N423-Y425 HydrophobicContact CB-CE2 3.63Å; Y425-F427 HydrophobicContact CD1-CE1 4.42Å; Y425-F427 AromaticContact CD1-CZ 3.9Å; Y425-F427 HydrophobicContact CD1-CZ 3.9Å; Y425-F427 HydrophobicContact CG-CE2 4.4Å; Y425-F427 HydrophobicContact CG-CZ 4.04Å
426	I	94.8	Very high	88.4	Confident	63 Å²	63	60.5 Å²	60.5	32%	0.323	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.4	172.8	-58.4	178.5	0	0	0	107.7	L28 Y56 I415 I416	L28-I426 HydrophobicContact CD2-CD1 3.99Å; L28-I426 HydrophobicContact CD2-CG1 4.4Å; Y56-I426 HydrophobicContact CD2-CD1 3.87Å; Y56-I426 HydrophobicContact CD2-CG2 4.4Å; Y56-I426 HydrophobicContact CG-CD1 3.9Å; I415-I426 HydrophobicContact CG2-CG2 3.79Å; I416-I426 WeakPolarHBondContact O-CA 3.39Å
427	F	94.3	Very high	87.9	Confident	35 Å²	35	63.6 Å²	63.6	15%	0.154	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141	174.3	-53	-70.5	0	0	0	109.2	F351 A366 L377 I415 I416 V418 Y425	F351-F427 HydrophobicContact CE1-CD2 4.32Å; F351-F427 AromaticContact CE1-CE2 3.78Å; F351-F427 HydrophobicContact CE1-CE2 3.78Å; F351-F427 HydrophobicContact CE1-CZ 4.45Å; F351-F427 AromaticContact CZ-CD2 3.86Å; F351-F427 HydrophobicContact CZ-CD2 3.86Å; F351-F427 AromaticContact CZ-CE2 3.79Å; F351-F427 HydrophobicContact CZ-CE2 3.79Å; A366-F427 HydrophobicContact CB-CE2 4.4Å; A366-F427 HydrophobicContact CB-CZ 4.35Å; L377-F427 HydrophobicContact CD1-CD1 3.67Å; L377-F427 HydrophobicContact CD1-CD2 4.29Å; L377-F427 HydrophobicContact CD1-CE1 3.74Å; L377-F427 HydrophobicContact CD1-CE2 4.34Å; L377-F427 HydrophobicContact CD1-CG 3.95Å; L377-F427 HydrophobicContact CD1-CZ 4.07Å; L377-F427 HydrophobicContact CD2-CD1 4.32Å; L377-F427 HydrophobicContact CD2-CE1 3.87Å; L377-F427 HydrophobicContact CD2-CZ 4.5Å; L377-F427 HydrophobicContact CG-CD1 4.21Å; L377-F427 HydrophobicContact CG-CE1 4.21Å; I415-F427 CarbonylContact C-O 3.59Å; I415-F427 WeakPolarHBondContact CA-O 3.4Å; I416-F427 HydrophobicContact CD1-CB 4.04Å; I416-F427 HydrophobicContact CD1-CD2 4Å; I416-F427 HydrophobicContact CD1-CG 4.48Å; I416-F427 HydrophobicContact CG1-CB 3.7Å; I416-F427 HydrophobicContact CG1-CD2 4.11Å; I416-F427 HydrophobicContact CG1-CG 4.42Å; I416-F427 PolarHBondContact N-O 3.23Å; I416-F427 PolarHBondContact O-N 3.19Å; V418-F427 HydrophobicContact CB-CE2 4.28Å; V418-F427 HydrophobicContact CG2-CD2 4.2Å; V418-F427 HydrophobicContact CG2-CE2 4.2Å; Y425-F427 HydrophobicContact CD1-CE1 4.42Å; Y425-F427 AromaticContact CD1-CZ 3.9Å; Y425-F427 HydrophobicContact CD1-CZ 3.9Å; Y425-F427 HydrophobicContact CG-CE2 4.4Å; Y425-F427 HydrophobicContact CG-CZ 4.04Å
428	Q	90.6	Very high	87.2	Confident	87 Å²	87	67.9 Å²	67.9	41%	0.407	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.6	177.4	62.1	-177.3	-3.1	0	0	109.8	N414 I415	N414-Q428 WeakPolarHBondContact O-CA 3.43Å; I415-Q428 HydrophobicContact CG1-CB 3.98Å
429	D	85.8	Confident	86.4	Confident	99 Å²	99	72.7 Å²	72.7	53%	0.529	38%	0.375	S	S	.	.			trans	-66.3	152.2	173.8	-157.3	1.4	0	0	0	110.7	N414 V431	N414-D429 HydrophobicContact CB-CB 3.7Å; N414-D429 PolarHBondContact O-N 2.95Å; D429-V431 PolarHBondContact O-N 3.1Å
430	K	72.3	Confident	85.6	Confident	155 Å²	155	78 Å²	78	67%	0.674	40%	0.401	S	S	*	.			trans	-76.5	109.3	177.8	-155.4	-179.7	-177.6	-170.1	0	107.4	N432	K430-N432 PolarHBondContact O-N 2.93Å
431	V	64.2	Low	84.8	Confident	82 Å²	82	84.4 Å²	84.4	50%	0.497	43%	0.434	S	S	.	.			trans	-63.2	121.4	169.6	-172.1	0	0	0	0	107.1	R53 D429	R53-V431 HydrophobicContact CG-CG2 3.94Å; D429-V431 PolarHBondContact O-N 3.1Å
432	N	51.1	Low	84.3	Confident	216 Å²	216	86.4 Å²	86.4	100%	1.155	44%	0.438	S	S	*	.			trans	-69	0	175.9	-83.1	-23	0	0	0	111.8	K430	K430-N432 PolarHBondContact O-N 2.93Å

Retrieved 432 of 432 residues in 2233.9 ms (Link to these results)

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