A0A3Q0KG74_SCHMA Loading...

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

AlphaFold DB , UniProt , Accession A0A3Q0KG74, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 511 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	31.2	Very low	247 Å²	247	143.6 Å²	143.6	100%	1.217	81%	0.813	S	S	*	*				0	95.5	0	-69.1	-179	-165.1	0	0	107.2
2	Q	32.2	Very low	31.1	Very low	202 Å²	202	139 Å²	139	94%	0.944	80%	0.797	S	S	*	*			trans	-85.1	111.6	176.8	-77.6	172.3	-20.9	0	0	107.8
3	S	33.2	Very low	31.4	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	78%	0.775	S	S	*	*			trans	-75.1	142.8	170.8	51.4	0	0	0	0	110
4	P	33.2	Very low	31.7	Very low	123 Å²	123	133.2 Å²	133.2	80%	0.799	77%	0.766	S	S	*	*			trans	-74.5	136.4	-175.7	30.6	-30.5	0	0	0	110.3	G6	P4-G6 PolarHBondContact O-N 3.02Å; P4-G6 VanDerWaalsContact O-N 3.09Å
5	I	34.8	Very low	32.3	Very low	162 Å²	162	129.1 Å²	129.1	83%	0.831	75%	0.754	S	S	*	*			trans	-61.2	108.6	169.8	-64.8	165.8	0	0	0	106.9	Q7	I5-Q7 PolarHBondContact O-N 3.16Å
6	G	30.5	Very low	33.1	Very low	62 Å²	62	122.6 Å²	122.6	64%	0.639	72%	0.717	S	S	*	*			trans	-65.1	103.2	171.7	0	0	0	0	0	109.5	P4 Y8	P4-G6 PolarHBondContact O-N 3.02Å; P4-G6 VanDerWaalsContact O-N 3.09Å; G6-Y8 PolarHBondContact O-N 3.23Å; G6-Y8 VanDerWaalsContact O-N 3.08Å
7	Q	28.8	Very low	33.5	Very low	185 Å²	185	119.6 Å²	119.6	86%	0.864	71%	0.709	S	S	*	*			trans	-63.8	102.5	159.9	-75.8	177.5	-18.4	0	0	107.1	I5 A9	I5-Q7 PolarHBondContact O-N 3.16Å; Q7-A9 PolarHBondContact O-N 2.9Å; Q7-A9 VanDerWaalsContact O-N 3.1Å
8	Y	31.2	Very low	34.2	Very low	231 Å²	231	120.8 Å²	120.8	91%	0.906	71%	0.707	S	S	*	*			trans	-62.7	108.6	159.4	-84.7	-91	0	0	0	106.6	G6 A10	G6-Y8 PolarHBondContact O-N 3.23Å; G6-Y8 VanDerWaalsContact O-N 3.08Å; Y8-A10 PolarHBondContact O-N 2.98Å; Y8-A10 VanDerWaalsContact O-N 3.09Å
9	A	26.4	Very low	35.2	Very low	95 Å²	95	119.8 Å²	119.8	79%	0.785	71%	0.707	S	S	*	*			trans	-60	112.3	168.9	0	0	0	0	0	107.5	Q7	Q7-A9 PolarHBondContact O-N 2.9Å; Q7-A9 VanDerWaalsContact O-N 3.1Å
10	A	29.3	Very low	36.5	Very low	76 Å²	76	115.9 Å²	115.9	63%	0.628	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-57.3	134.8	169.6	0	0	0	0	0	108.1	Y8 S12	Y8-A10 PolarHBondContact O-N 2.98Å; Y8-A10 VanDerWaalsContact O-N 3.09Å; A10-S12 PolarHBondContact O-N 3.13Å
11	P	29.2	Very low	38.2	Very low	92 Å²	92	115 Å²	115	60%	0.597	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-55.9	134.4	167.7	24.4	-30.1	0	0	0	107.7	C13	P11-C13 PolarHBondContact O-N 3.07Å; P11-C13 VanDerWaalsContact O-N 3.12Å
12	S	29.4	Very low	40.4	Very low	88 Å²	88	103.7 Å²	103.7	62%	0.615	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-54.1	121.3	179.5	44.5	0	0	0	0	109.4	A10 D14	A10-S12 PolarHBondContact O-N 3.13Å; S12-D14 PolarHBondContact O-N 3.04Å
13	C	35.3	Very low	43	Very low	76 Å²	76	98.4 Å²	98.4	51%	0.514	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-60.7	10.7	175	-97.4	0	0	0	0	114.2	P11 A15	P11-C13 PolarHBondContact O-N 3.07Å; P11-C13 VanDerWaalsContact O-N 3.12Å; C13-A15 VanDerWaalsContact C-N 3.35Å; C13-A15 PolarHBondContact O-N 2.74Å
14	D	36.1	Very low	45.8	Very low	121 Å²	121	93.4 Å²	93.4	65%	0.647	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-82.2	-5.6	-173.5	-68.2	-30.2	0	0	0	114	S12 V16 A17	S12-D14 PolarHBondContact O-N 3.04Å; D14-V16 PolarHBondContact O-N 3.4Å; D14-V16 VanDerWaalsContact O-N 3.17Å; D14-A17 WeakPolarHBondContact O-CB 3.03Å; D14-A17 PolarHBondContact O-N 2.92Å; D14-A17 VanDerWaalsContact O-N 3.1Å
15	A	40.3	Very low	48.6	Very low	71 Å²	71	89.1 Å²	89.1	59%	0.587	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.3	179.3	0	0	0	0	0	113.8	C13 N511	C13-A15 VanDerWaalsContact C-N 3.35Å; C13-A15 PolarHBondContact O-N 2.74Å; A15-N511 PolarHBondContact O-ND2 3.16Å; A15-N511 VanDerWaalsContact O-ND2 3.13Å
16	V	45.5	Very low	51.3	Low	26 Å²	26	81.4 Å²	81.4	16%	0.158	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-94.7	-3	177.9	-165.3	0	0	0	0	111.6	D14 Q18 R370 T494	D14-V16 PolarHBondContact O-N 3.4Å; D14-V16 VanDerWaalsContact O-N 3.17Å; V16-Q18 PolarHBondContact O-N 3.24Å; V16-R370 PolarHBondContact O-NH1 2.84Å; V16-T494 HydrophobicContact CG2-CG2 4.19Å
17	A	39	Very low	54.1	Low	72 Å²	72	78.6 Å²	78.6	60%	0.595	46%	0.459	S	S	*	.			trans	-75.9	14.8	-169.2	0	0	0	0	0	116.5	D14	D14-A17 WeakPolarHBondContact O-CB 3.03Å; D14-A17 PolarHBondContact O-N 2.92Å; D14-A17 VanDerWaalsContact O-N 3.1Å
18	Q	46.7	Very low	57	Low	141 Å²	141	69.8 Å²	69.8	66%	0.659	42%	0.418	S	S	*	.	S	Bend	trans	-107.8	135.6	176.3	-67.5	-175	-1.5	0	0	111.3	V16 G20	V16-Q18 PolarHBondContact O-N 3.24Å; Q18-G20 PolarHBondContact O-N 3.35Å
19	S	52.5	Low	59.8	Low	102 Å²	102	60.1 Å²	60.1	71%	0.713	38%	0.382	S	S	*	.			trans	-74.3	26.3	-169.8	67.1	0	0	0	0	114.6
20	G	62.5	Low	62.8	Low	40 Å²	40	56.5 Å²	56.5	41%	0.412	35%	0.349	S	S	.	.	S	Bend	trans	-100.6	154.6	-175.7	0	0	0	0	0	113.2	Q18 L22	Q18-G20 PolarHBondContact O-N 3.35Å; G20-L22 PolarHBondContact O-N 3.46Å
21	R	71.6	Confident	65.5	Low	99 Å²	99	57.4 Å²	57.4	37%	0.374	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-60.5	120.8	169.2	-179.3	178.9	177.1	172.5	5.1	109.9	D444	R21-D444 IonicContact CZ-OD2 3.99Å; R21-D444 IonicContact NE-OD2 3.33Å; R21-D444 PolarHBondContact NE-OD2 2.97Å; R21-D444 PolarHBondContact NH2-O 3.21Å; R21-D444 IonicContact NH2-OD1 3.04Å; R21-D444 IonicContact NH2-OD2 3.63Å; R21-D444 PolarHBondContact NH2-OD2 2.85Å
22	L	80.6	Confident	68.2	Low	8 Å²	8	56.1 Å²	56.1	4%	0.042	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-68.3	135.1	177.1	-63.6	174.8	0	0	0	110.8	G20 A509 N511	G20-L22 PolarHBondContact O-N 3.46Å; L22-A509 HydrophobicContact CB-CB 4.2Å; L22-A509 HydrophobicContact CD1-CB 4.08Å; L22-N511 WeakPolarHBondContact CD2-OD1 3.25Å
23	K	87.5	Confident	70.7	Confident	92 Å²	92	56 Å²	56	40%	0.4	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	121.7	172.7	-65.2	173.1	-172.1	153.5	0	109.1	Y25 I510	K23-Y25 HydrophobicContact CB-CE2 3.81Å; K23-I510 WeakPolarHBondContact CB-O 3.19Å; K23-I510 PolarHBondContact N-O 3.23Å; K23-I510 PolarHBondContact O-N 2.83Å; K23-I510 VanDerWaalsContact O-O 3.14Å
24	W	91.7	Very high	72.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136.7	178.1	-70.5	81.3	0	0	0	112.5	M373 V383 Y394 L396 R441 I442 W489 I507 E508 A509	W24-M373 HydrophobicContact CH2-CE 3.4Å; W24-M373 HydrophobicContact CZ2-CE 4.05Å; W24-M373 HydrophobicContact CZ3-CE 3.71Å; W24-V383 HydrophobicContact CZ2-CG1 4.17Å; W24-V383 HydrophobicContact CZ2-CG2 4.1Å; W24-Y394 AromaticContact CD1-CE2 3.37Å; W24-Y394 AromaticContact CD1-CZ 3.82Å; W24-Y394 AromaticContact CE2-CE2 3.83Å; W24-Y394 HydrophobicContact CG-CE2 4.39Å; W24-Y394 HydrophobicContact CZ2-CE2 4.47Å; W24-Y394 AromaticContact NE1-CE2 2.97Å; W24-Y394 AromaticContact NE1-CZ 3.11Å; W24-Y394 PolarHBondContact NE1-OH 3.21Å; W24-L396 HydrophobicContact CB-CD1 4.29Å; W24-L396 HydrophobicContact CB-CD2 3.84Å; W24-L396 HydrophobicContact CD2-CD1 3.93Å; W24-L396 HydrophobicContact CE3-CD1 4.27Å; W24-L396 HydrophobicContact CG-CD1 3.93Å; W24-L396 HydrophobicContact CG-CD2 3.74Å; W24-R441 WeakPolarHBondContact O-CD 3.43Å; W24-R441 PolarHBondContact O-NH1 3.16Å; W24-I442 HydrophobicContact CB-CB 4.22Å; W24-I442 HydrophobicContact CB-CD1 4.23Å; W24-I442 PolarHBondContact O-N 2.86Å; W24-W489 AromaticContact CH2-CH2 3.87Å; W24-W489 HydrophobicContact CH2-CH2 3.87Å; W24-W489 HydrophobicContact CH2-CZ2 4.39Å; W24-W489 HydrophobicContact CH2-CZ3 4.34Å; W24-W489 HydrophobicContact CZ2-CH2 4.23Å; W24-I507 HydrophobicContact CE3-CB 4.14Å; W24-I507 HydrophobicContact CE3-CD1 3.85Å; W24-I507 HydrophobicContact CE3-CG1 3.98Å; W24-I507 HydrophobicContact CZ3-CB 4.47Å; W24-I507 HydrophobicContact CZ3-CD1 3.86Å; W24-I507 HydrophobicContact CZ3-CG1 3.87Å; W24-E508 WeakPolarHBondContact CA-O 3.33Å; W24-A509 HydrophobicContact CD2-CB 3.86Å; W24-A509 HydrophobicContact CE3-CB 4.01Å; W24-A509 HydrophobicContact CH2-CB 3.78Å; W24-A509 HydrophobicContact CZ2-CB 3.58Å; W24-A509 HydrophobicContact CZ3-CB 3.96Å
25	Y	91.5	Very high	75	Confident	32 Å²	32	59.6 Å²	59.6	13%	0.125	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.9	175.3	-65.3	-96.4	0	0	0	109.5	K23 T74 P439 R440 R441 I507 E508 I510	K23-Y25 HydrophobicContact CB-CE2 3.81Å; Y25-T74 HydrophobicContact CD1-CG2 3.96Å; Y25-T74 HydrophobicContact CE1-CG2 3.74Å; Y25-T74 HydrophobicContact CE2-CG2 4.33Å; Y25-T74 HydrophobicContact CG-CG2 4.36Å; Y25-P439 HydrophobicContact CD1-CG 4.09Å; Y25-P439 HydrophobicContact CG-CG 4.44Å; Y25-R440 CarbonylContact C-O 3.57Å; Y25-R440 VanDerWaalsContact CA-O 3.25Å; Y25-R440 WeakPolarHBondContact CA-O 3.22Å; Y25-R441 HydrophobicContact CD1-CB 4.17Å; Y25-R441 HydrophobicContact CE1-CB 3.96Å; Y25-R441 HydrophobicContact CE1-CG 4.36Å; Y25-I507 CarbonylContact O-C 3.57Å; Y25-I507 VanDerWaalsContact O-CA 3.22Å; Y25-I507 WeakPolarHBondContact O-CA 3.35Å; Y25-E508 PolarHBondContact N-O 3.17Å; Y25-E508 PolarHBondContact O-N 3Å; Y25-I510 HydrophobicContact CD2-CB 4.12Å; Y25-I510 HydrophobicContact CD2-CD1 3.85Å; Y25-I510 HydrophobicContact CD2-CG1 4.13Å; Y25-I510 HydrophobicContact CE2-CB 4.06Å; Y25-I510 HydrophobicContact CE2-CD1 4.29Å; Y25-I510 HydrophobicContact CG-CD1 4.46Å
26	C	91.4	Very high	77.3	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.9	168.2	-172.8	0	0	0	0	107.3	W438 P439 R440 I442 I507	C26-W438 HydrophobicContact CB-CZ3 4.4Å; C26-W438 WeakPolarHBondContact O-CZ3 3.37Å; C26-P439 CarbonylContact O-C 3.51Å; C26-P439 WeakPolarHBondContact O-CA 3.36Å; C26-P439 WeakPolarHBondContact O-CB 3.39Å; C26-R440 PolarHBondContact N-O 3.3Å; C26-R440 PolarHBondContact O-N 2.79Å; C26-I442 HydrophobicContact CB-CD1 3.92Å; C26-I442 HydrophobicContact CB-CG1 3.92Å; C26-I507 HydrophobicContact CB-CG2 4.48Å
27	N	89.7	Confident	79.5	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.011	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-40.5	-176.9	-67.4	-2.7	0	0	0	111.4	H78 S79 F406 W438 L506 E508	N27-H78 HydrophobicContact CB-CB 4.37Å; N27-H78 PolarHBondContact OD1-ND1 3.47Å; N27-S79 WeakPolarHBondContact CB-O 3.42Å; N27-S79 PolarHBondContact ND2-N 2.94Å; N27-S79 PolarHBondContact ND2-O 2.91Å; N27-S79 VanDerWaalsContact ND2-O 3.16Å; N27-F406 WeakPolarHBondContact O-CD2 3.41Å; N27-F406 WeakPolarHBondContact O-CE2 3.36Å; N27-W438 VanDerWaalsContact C-CE3 3.47Å; N27-L506 PolarHBondContact N-O 3.35Å; N27-E508 WeakPolarHBondContact ND2-CB 3.23Å; N27-E508 PolarHBondContact ND2-OE2 3.14Å
28	E	88.8	Confident	82.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	146.1	-174.2	-176.1	174.2	-166.8	0	0	110	L30 S81 F406 R411 L506	E28-L30 HydrophobicContact CG-CD2 4.15Å; E28-L30 HydrophobicContact CG-CG 4.4Å; E28-L30 WeakPolarHBondContact OE1-CD2 3.24Å; E28-S81 PolarHBondContact OE1-OG 3.32Å; E28-S81 WeakPolarHBondContact OE2-CB 3.49Å; E28-S81 PolarHBondContact OE2-N 2.66Å; E28-S81 PolarHBondContact OE2-OG 3.31Å; E28-F406 HydrophobicContact CB-CG 4.39Å; E28-F406 HydrophobicContact CG-CB 4.03Å; E28-F406 HydrophobicContact CG-CD1 4.05Å; E28-F406 HydrophobicContact CG-CG 4.04Å; E28-R411 IonicContact OE1-CZ 3.61Å; E28-R411 IonicContact OE1-NE 2.62Å; E28-R411 IonicContact OE1-NH2 3.38Å; E28-R411 PolarHBondContact OE1-NH2 2.95Å; E28-L506 HydrophobicContact CB-CB 4.41Å; E28-L506 HydrophobicContact CB-CD1 4.36Å; E28-L506 PolarHBondContact O-N 3.42Å
29	I	90.4	Very high	84.6	Confident	28 Å²	28	49.3 Å²	49.3	14%	0.144	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.9	170.5	-63.3	172.2	0	0	0	108	E401 W438 H505	I29-E401 HydrophobicContact CG2-CG 4Å; I29-W438 HydrophobicContact CB-CH2 4.3Å; I29-W438 HydrophobicContact CD1-CH2 3.96Å; I29-W438 HydrophobicContact CG1-CH2 3.84Å; I29-W438 HydrophobicContact CG1-CZ3 4.46Å; I29-H505 WeakPolarHBondContact CD1-CE1 3.47Å
30	L	89.9	Confident	86.6	Confident	20 Å²	20	45.4 Å²	45.4	11%	0.105	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.1	177.1	-63.3	173.7	0	0	0	109.3	E28 I63 S81 G503 I504	E28-L30 HydrophobicContact CG-CD2 4.15Å; E28-L30 HydrophobicContact CG-CG 4.4Å; E28-L30 WeakPolarHBondContact OE1-CD2 3.24Å; L30-I63 HydrophobicContact CD1-CD1 3.28Å; L30-S81 WeakPolarHBondContact CD2-OG 3.42Å; L30-G503 CarbonylContact O-C 3.58Å; L30-G503 WeakPolarHBondContact O-CA 3.39Å; L30-I504 HydrophobicContact CB-CB 4.26Å; L30-I504 PolarHBondContact N-O 2.89Å; L30-I504 PolarHBondContact O-N 3.37Å
31	R	87	Confident	88.3	Confident	94 Å²	94	43.7 Å²	43.7	36%	0.355	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	144	173.3	-66.3	-167.3	166.1	160.8	3.3	110.9	E401 D402 M403	R31-E401 WeakPolarHBondContact CD-OE2 3.18Å; R31-E401 WeakPolarHBondContact CG-OE2 3.37Å; R31-E401 IonicContact CZ-OE2 2.74Å; R31-E401 IonicContact NE-OE2 2.98Å; R31-E401 PolarHBondContact NE-OE2 3.43Å; R31-E401 PolarHBondContact NH2-O 2.82Å; R31-D402 PolarHBondContact NH2-O 3.05Å; R31-D402 VanDerWaalsContact NH2-O 3.08Å; R31-M403 PolarHBondContact NH1-SD 3.2Å
32	R	85.1	Confident	89.5	Confident	66 Å²	66	39 Å²	39	25%	0.249	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-56.1	144.8	163.6	179.1	-175.2	63.7	-171.9	-6.2	109.5	E34 S36 G37 I39 D502	R32-E34 PolarHBondContact O-N 3.04Å; R32-S36 WeakPolarHBondContact CD-O 3.21Å; R32-S36 WeakPolarHBondContact CD-OG 3.29Å; R32-S36 WeakPolarHBondContact CG-OG 3.44Å; R32-S36 PolarHBondContact NE-O 2.89Å; R32-S36 PolarHBondContact NH1-O 3.34Å; R32-G37 WeakPolarHBondContact CD-O 3.45Å; R32-G37 VanDerWaalsContact NH1-C 3.3Å; R32-I39 HydrophobicContact CB-CD1 4.24Å; R32-I39 HydrophobicContact CB-CG1 4.28Å; R32-I39 HydrophobicContact CG-CG1 4.45Å; R32-D502 WeakPolarHBondContact CB-O 3.45Å; R32-D502 IonicContact CZ-OD1 3.88Å; R32-D502 VanDerWaalsContact CZ-OD1 3.23Å; R32-D502 PolarHBondContact N-O 3.41Å; R32-D502 IonicContact NE-OD1 2.99Å; R32-D502 IonicContact NH1-OD1 2.94Å; R32-D502 IonicContact NH2-OD1 2.92Å; R32-D502 PolarHBondContact NH2-OD1 2.59Å
33	I	80.9	Confident	90.4	Very high	84 Å²	84	40 Å²	40	43%	0.431	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-60.9	128.5	174.5	-58.7	171.2	0	0	0	109	G35 S36	I33-G35 PolarHBondContact O-N 2.74Å; I33-S36 WeakPolarHBondContact O-CB 3.19Å; I33-S36 PolarHBondContact O-N 2.93Å; I33-S36 PolarHBondContact O-OG 2.92Å
34	E	79.2	Confident	90.8	Very high	188 Å²	188	36.2 Å²	36.2	88%	0.879	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	131.9	177.6	-68.9	-175	178.5	0	0	111	R32 S36	R32-E34 PolarHBondContact O-N 3.04Å; E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 2.82Å
35	G	82.8	Confident	91.1	Very high	85 Å²	85	36.2 Å²	36.2	88%	0.876	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	-6.5	-176.3	0	0	0	0	0	115.5	I33	I33-G35 PolarHBondContact O-N 2.74Å
36	S	88.8	Confident	91.1	Very high	19 Å²	19	38.5 Å²	38.5	13%	0.133	21%	0.21	C	C	.	.	S	Bend	trans	-87.3	152.9	169.1	71.7	0	0	0	0	111.6	R32 I33 E34 D57	R32-S36 WeakPolarHBondContact CD-O 3.21Å; R32-S36 WeakPolarHBondContact CD-OG 3.29Å; R32-S36 WeakPolarHBondContact CG-OG 3.44Å; R32-S36 PolarHBondContact NE-O 2.89Å; R32-S36 PolarHBondContact NH1-O 3.34Å; I33-S36 WeakPolarHBondContact O-CB 3.19Å; I33-S36 PolarHBondContact O-N 2.93Å; I33-S36 PolarHBondContact O-OG 2.92Å; E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 2.82Å; S36-D57 WeakPolarHBondContact CA-OD2 3.28Å
37	G	92.7	Very high	91.2	Very high	11 Å²	11	41.2 Å²	41.2	11%	0.113	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-74	163.5	179.4	0	0	0	0	0	113.2	R32 N55 S56 D57	R32-G37 WeakPolarHBondContact CD-O 3.45Å; R32-G37 VanDerWaalsContact NH1-C 3.3Å; G37-N55 WeakPolarHBondContact O-CB 3.19Å; G37-S56 VanDerWaalsContact CA-OG 3.23Å; G37-S56 WeakPolarHBondContact CA-OG 3.46Å; G37-D57 WeakPolarHBondContact CA-OD1 3.36Å; G37-D57 VanDerWaalsContact N-CG 3.33Å; G37-D57 PolarHBondContact N-OD1 3.28Å; G37-D57 PolarHBondContact N-OD2 3.17Å
38	P	95	Very high	91.4	Very high	53 Å²	53	41.3 Å²	41.3	34%	0.344	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-54.7	144.6	-170	20.6	-35.9	0	0	0	114.7	S40 N55 S56 T501	P38-S40 PolarHBondContact O-N 2.98Å; P38-N55 CarbonylContact O-C 3.52Å; P38-N55 VanDerWaalsContact O-CA 3.22Å; P38-N55 WeakPolarHBondContact O-CA 3.08Å; P38-N55 WeakPolarHBondContact O-CB 3.18Å; P38-S56 WeakPolarHBondContact CD-OG 3.33Å; P38-S56 PolarHBondContact O-N 2.86Å; P38-T501 WeakPolarHBondContact CA-O 3.12Å; P38-T501 HydrophobicContact CB-CG2 4.09Å
39	I	96.2	Very high	91.7	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.062	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	126.6	171.7	-56.7	179.1	0	0	0	108.2	R32 I42 T501 I504	R32-I39 HydrophobicContact CB-CD1 4.24Å; R32-I39 HydrophobicContact CB-CG1 4.28Å; R32-I39 HydrophobicContact CG-CG1 4.45Å; I39-I42 HydrophobicContact CG2-CG2 3.99Å; I39-T501 PolarHBondContact N-O 2.91Å; I39-I504 HydrophobicContact CD1-CD1 4.08Å; I39-I504 HydrophobicContact CD1-CG1 3.63Å
40	S	96.1	Very high	92	Very high	20 Å²	20	42.9 Å²	42.9	14%	0.14	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	-33.4	-173.7	51.5	0	0	0	0	113	P38 G54 I106 Q486	P38-S40 PolarHBondContact O-N 2.98Å; S40-G54 PolarHBondContact N-O 3Å; S40-G54 PolarHBondContact OG-O 2.83Å; S40-G54 VanDerWaalsContact OG-O 3.09Å; S40-I106 VanDerWaalsContact CB-O 3.24Å; S40-I106 WeakPolarHBondContact CB-O 3.34Å; S40-I106 PolarHBondContact OG-O 2.89Å; S40-Q486 WeakPolarHBondContact O-CG 3.46Å; S40-Q486 PolarHBondContact O-NE2 3.04Å
41	V	97.4	Very high	92.4	Very high	3 Å²	3	42 Å²	42	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	145	-177.1	61.8	0	0	0	0	111	Y53 G54 I106 I109	V41-Y53 CarbonylContact O-C 3.58Å; V41-Y53 WeakPolarHBondContact O-CA 3.49Å; V41-Y53 WeakPolarHBondContact O-CB 3.14Å; V41-G54 PolarHBondContact O-N 3.44Å; V41-I106 HydrophobicContact CG1-CB 4.46Å; V41-I106 HydrophobicContact CG1-CG2 3.81Å; V41-I109 HydrophobicContact CG1-CB 4.43Å; V41-I109 HydrophobicContact CG1-CD1 3.84Å; V41-I109 HydrophobicContact CG1-CG1 3.78Å
42	I	97.8	Very high	92.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.6	172.6	70.8	-176.8	0	0	0	109.2	I39 L51 A52 Q486 A497 I504	I39-I42 HydrophobicContact CG2-CG2 3.99Å; I42-L51 HydrophobicContact CB-CD1 4.43Å; I42-A52 CarbonylContact C-O 3.48Å; I42-A52 WeakPolarHBondContact CA-O 3.3Å; I42-Q486 HydrophobicContact CD1-CB 4.15Å; I42-Q486 HydrophobicContact CG1-CB 3.9Å; I42-A497 HydrophobicContact CD1-CB 3.96Å; I42-A497 WeakPolarHBondContact CD1-O 3.44Å; I42-I504 HydrophobicContact CG2-CD1 3.83Å; I42-I504 HydrophobicContact CG2-CG1 4.21Å
43	E	97.9	Very high	93.5	Very high	30 Å²	30	35.8 Å²	35.8	14%	0.14	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	126.2	177.1	-170.9	82.3	136.5	0	0	111.6	L51 A52 I109 R110 W111 S488	E43-L51 VanDerWaalsContact C-CD1 3.49Å; E43-A52 PolarHBondContact N-O 2.62Å; E43-A52 PolarHBondContact O-N 2.67Å; E43-I109 HydrophobicContact CB-CB 4.4Å; E43-I109 HydrophobicContact CB-CG2 4.26Å; E43-R110 WeakPolarHBondContact OE1-CD 3.47Å; E43-R110 IonicContact OE1-CZ 3.06Å; E43-R110 IonicContact OE1-NE 3.15Å; E43-R110 IonicContact OE1-NH1 3.31Å; E43-R110 PolarHBondContact OE1-NH1 3.33Å; E43-R110 IonicContact OE2-NH1 3.56Å; E43-W111 PolarHBondContact O-NE1 2.77Å; E43-S488 PolarHBondContact OE2-OG 3.13Å
44	F	97.7	Very high	94.3	Very high	11 Å²	11	31.8 Å²	31.8	5%	0.048	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	145.2	169	-79.1	-72.2	0	0	0	111.3	H50 L51 I65 S488 K490 A497 L506	F44-H50 WeakPolarHBondContact CA-O 3.43Å; F44-L51 HydrophobicContact CB-CD1 4.47Å; F44-L51 HydrophobicContact CD1-CB 3.84Å; F44-L51 HydrophobicContact CD1-CD1 3.82Å; F44-L51 HydrophobicContact CD1-CG 4.43Å; F44-L51 HydrophobicContact CD2-CD1 3.87Å; F44-L51 HydrophobicContact CE1-CB 3.76Å; F44-L51 HydrophobicContact CE1-CD1 3.93Å; F44-L51 HydrophobicContact CE1-CG 4.29Å; F44-L51 HydrophobicContact CE2-CD1 4Å; F44-L51 HydrophobicContact CG-CD1 3.78Å; F44-L51 HydrophobicContact CZ-CB 4.48Å; F44-L51 HydrophobicContact CZ-CD1 4.02Å; F44-L51 HydrophobicContact CZ-CD2 4.48Å; F44-I65 HydrophobicContact CE1-CD1 4.06Å; F44-I65 HydrophobicContact CE1-CG1 3.91Å; F44-S488 WeakPolarHBondContact CD2-O 3.25Å; F44-S488 VanDerWaalsContact CE2-O 3.26Å; F44-S488 WeakPolarHBondContact CE2-O 3.46Å; F44-S488 PolarHBondContact N-OG 3.3Å; F44-K490 HydrophobicContact CD1-CB 4.28Å; F44-K490 HydrophobicContact CD1-CG 4.28Å; F44-K490 HydrophobicContact CD2-CB 4.07Å; F44-K490 HydrophobicContact CE1-CB 4.17Å; F44-K490 HydrophobicContact CE1-CG 4.28Å; F44-K490 HydrophobicContact CE2-CB 3.93Å; F44-K490 HydrophobicContact CG-CB 4.24Å; F44-K490 HydrophobicContact CZ-CB 3.99Å; F44-A497 HydrophobicContact CD2-CB 4.47Å; F44-A497 HydrophobicContact CE2-CB 3.51Å; F44-A497 HydrophobicContact CZ-CB 3.76Å; F44-L506 HydrophobicContact CZ-CD2 4.15Å
45	N	96.4	Very high	95.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.146	C	C	.	.			trans	-69.2	160.6	168.4	73.5	-29.4	0	0	0	111.4	E47 G48 T49 H50 W111 P491	N45-E47 PolarHBondContact ND2-OE2 2.8Å; N45-E47 PolarHBondContact O-N 3.02Å; N45-E47 VanDerWaalsContact O-N 3.1Å; N45-G48 PolarHBondContact O-N 2.91Å; N45-G48 WeakPolarHBondContact OD1-CA 3.33Å; N45-G48 PolarHBondContact OD1-N 3.03Å; N45-T49 PolarHBondContact ND2-OG1 3.42Å; N45-T49 PolarHBondContact OD1-N 3.18Å; N45-H50 PolarHBondContact N-O 2.91Å; N45-H50 PolarHBondContact OD1-N 2.74Å; N45-H50 PolarHBondContact OD1-O 3.12Å; N45-W111 VanDerWaalsContact CA-CD1 3.46Å; N45-W111 VanDerWaalsContact CA-CG 3.45Å; N45-W111 HydrophobicContact CB-CB 4.17Å; N45-W111 HydrophobicContact CB-CD2 3.52Å; N45-W111 HydrophobicContact CB-CE3 3.91Å; N45-W111 HydrophobicContact CB-CG 3.68Å; N45-W111 HydrophobicContact CB-CZ2 4.26Å; N45-W111 HydrophobicContact CB-CZ3 4.49Å; N45-P491 WeakPolarHBondContact O-CG 3.36Å
46	K	92.8	Very high	95.7	Very high	80 Å²	80	20.7 Å²	20.7	35%	0.348	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.5	-178.4	-64.3	-167.7	177.5	-166.1	0	112.7	P113 P491 W492	K46-P113 HydrophobicContact CD-CG 4.17Å; K46-P491 WeakPolarHBondContact O-CB 3.23Å; K46-P491 WeakPolarHBondContact O-CG 3.44Å; K46-W492 WeakPolarHBondContact O-CH2 3.29Å; K46-W492 WeakPolarHBondContact O-CZ3 3.42Å
47	E	93	Very high	96.1	Very high	59 Å²	59	22.5 Å²	22.5	28%	0.276	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.1	178.6	-57.2	76.4	-162.9	0	0	113.9	N45 T49 K114	N45-E47 PolarHBondContact ND2-OE2 2.8Å; N45-E47 PolarHBondContact O-N 3.02Å; N45-E47 VanDerWaalsContact O-N 3.1Å; E47-T49 HydrophobicContact CB-CG2 4.22Å; E47-T49 PolarHBondContact O-N 3.4Å; E47-K114 VanDerWaalsContact OE1-CB 3.3Å; E47-K114 WeakPolarHBondContact OE1-CB 3.44Å; E47-K114 PolarHBondContact OE1-N 3.16Å
48	G	94	Very high	96.3	Very high	3 Å²	3	22 Å²	22	3%	0.031	12%	0.118	C	C	.	.	S	Bend	trans	68.4	15.5	-175.1	0	0	0	0	0	114.9	N45 K490	N45-G48 PolarHBondContact O-N 2.91Å; N45-G48 WeakPolarHBondContact OD1-CA 3.33Å; N45-G48 PolarHBondContact OD1-N 3.03Å; G48-K490 WeakPolarHBondContact O-CE 3.34Å
49	T	94.8	Very high	96.4	Very high	53 Å²	53	21.6 Å²	21.6	33%	0.325	11%	0.112	S	C	.	.	S	Bend	trans	-92.9	-19.5	-179.3	52.7	0	0	0	0	113.4	N45 E47 I65	N45-T49 PolarHBondContact ND2-OG1 3.42Å; N45-T49 PolarHBondContact OD1-N 3.18Å; E47-T49 HydrophobicContact CB-CG2 4.22Å; E47-T49 PolarHBondContact O-N 3.4Å; T49-I65 PolarHBondContact O-N 2.78Å
50	H	96.8	Very high	96.5	Very high	9 Å²	9	21 Å²	21	4%	0.042	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.9	-176.9	-64.3	71.3	0	0	0	110.6	F44 N45 V62 I63 Y84 W111 H119	F44-H50 WeakPolarHBondContact CA-O 3.43Å; N45-H50 PolarHBondContact N-O 2.91Å; N45-H50 PolarHBondContact OD1-N 2.74Å; N45-H50 PolarHBondContact OD1-O 3.12Å; H50-V62 HydrophobicContact CB-CG1 4.11Å; H50-I63 CarbonylContact C-O 3.58Å; H50-I63 WeakPolarHBondContact CA-O 3.39Å; H50-Y84 AromaticContact CD2-CG 3.89Å; H50-Y84 AromaticContact NE2-CD2 3.58Å; H50-Y84 AromaticContact NE2-CE2 3.55Å; H50-Y84 AromaticContact NE2-CG 3.92Å; H50-Y84 AromaticContact NE2-CZ 3.86Å; H50-W111 HydrophobicContact CB-CH2 4.21Å; H50-W111 HydrophobicContact CB-CZ2 4.21Å; H50-H119 AromaticContact CE1-CE1 3.53Å; H50-H119 AromaticContact CE1-NE2 3.43Å; H50-H119 PolarHBondContact CE1-NE2 2.86Å; H50-H119 AromaticContact ND1-CE1 3.43Å; H50-H119 PolarHBondContact ND1-CE1 2.95Å; H50-H119 AromaticContact ND1-NE2 3.82Å
51	L	97.7	Very high	96.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.6	168.5	178.1	75	0	0	0	107.9	I42 E43 F44 V62 I63 I65 A497 I504 L506	I42-L51 HydrophobicContact CB-CD1 4.43Å; E43-L51 VanDerWaalsContact C-CD1 3.49Å; F44-L51 HydrophobicContact CB-CD1 4.47Å; F44-L51 HydrophobicContact CD1-CB 3.84Å; F44-L51 HydrophobicContact CD1-CD1 3.82Å; F44-L51 HydrophobicContact CD1-CG 4.43Å; F44-L51 HydrophobicContact CD2-CD1 3.87Å; F44-L51 HydrophobicContact CE1-CB 3.76Å; F44-L51 HydrophobicContact CE1-CD1 3.93Å; F44-L51 HydrophobicContact CE1-CG 4.29Å; F44-L51 HydrophobicContact CE2-CD1 4Å; F44-L51 HydrophobicContact CG-CD1 3.78Å; F44-L51 HydrophobicContact CZ-CB 4.48Å; F44-L51 HydrophobicContact CZ-CD1 4.02Å; F44-L51 HydrophobicContact CZ-CD2 4.48Å; L51-V62 WeakPolarHBondContact O-CA 3.04Å; L51-I63 HydrophobicContact CB-CD1 3.91Å; L51-I63 HydrophobicContact CB-CG1 3.64Å; L51-I63 HydrophobicContact CD2-CD1 3.75Å; L51-I63 HydrophobicContact CD2-CG1 4.37Å; L51-I63 HydrophobicContact CG-CD1 4.31Å; L51-I63 HydrophobicContact CG-CG1 4.41Å; L51-I63 PolarHBondContact N-O 3.17Å; L51-I63 WeakPolarHBondContact O-CG1 3.4Å; L51-I63 PolarHBondContact O-N 2.98Å; L51-I65 HydrophobicContact CB-CD1 4.31Å; L51-A497 HydrophobicContact CD1-CB 4.09Å; L51-A497 HydrophobicContact CD2-CB 3.81Å; L51-I504 HydrophobicContact CD2-CG2 4.17Å; L51-L506 HydrophobicContact CD2-CD2 4.36Å
52	A	97.9	Very high	96.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.7	168.5	0	0	0	0	0	109.3	I42 E43 S61 V62 I109 W111 L121	I42-A52 CarbonylContact C-O 3.48Å; I42-A52 WeakPolarHBondContact CA-O 3.3Å; E43-A52 PolarHBondContact N-O 2.62Å; E43-A52 PolarHBondContact O-N 2.67Å; A52-S61 CarbonylContact C-O 3.49Å; A52-S61 WeakPolarHBondContact CA-O 3.41Å; A52-V62 HydrophobicContact CB-CG2 4.23Å; A52-I109 HydrophobicContact CB-CD1 4.19Å; A52-I109 HydrophobicContact CB-CG2 3.95Å; A52-W111 HydrophobicContact CB-CH2 4.3Å; A52-W111 HydrophobicContact CB-CZ2 3.39Å; A52-L121 HydrophobicContact CB-CD2 4.37Å
53	Y	97.8	Very high	96.4	Very high	30 Å²	30	20.8 Å²	20.8	12%	0.118	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145	168.1	65.5	-90.2	0	0	0	110.9	V41 V60 S61 I63 I504	V41-Y53 CarbonylContact O-C 3.58Å; V41-Y53 WeakPolarHBondContact O-CA 3.49Å; V41-Y53 WeakPolarHBondContact O-CB 3.14Å; Y53-V60 WeakPolarHBondContact O-CA 3.37Å; Y53-S61 VanDerWaalsContact CE2-CB 3.44Å; Y53-S61 PolarHBondContact N-O 3.42Å; Y53-S61 PolarHBondContact O-N 3.14Å; Y53-S61 WeakPolarHBondContact OH-CB 3.45Å; Y53-S61 PolarHBondContact OH-OG 3.11Å; Y53-I63 HydrophobicContact CE1-CG2 4.11Å; Y53-I504 HydrophobicContact CD1-CD1 3.56Å; Y53-I504 HydrophobicContact CD2-CD1 4.15Å; Y53-I504 HydrophobicContact CE1-CD1 4.16Å; Y53-I504 HydrophobicContact CG-CD1 3.55Å
54	G	97.3	Very high	96.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	155.8	177.2	0	0	0	0	0	110.8	S40 V41 I59	S40-G54 PolarHBondContact N-O 3Å; S40-G54 PolarHBondContact OG-O 2.83Å; S40-G54 VanDerWaalsContact OG-O 3.09Å; V41-G54 PolarHBondContact O-N 3.44Å; G54-I59 WeakPolarHBondContact CA-O 3.46Å
55	N	96.4	Very high	96	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.048	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	177.4	175.4	76.2	-2.1	0	0	0	112.9	G37 P38 D57 G58 I59 I106	G37-N55 WeakPolarHBondContact O-CB 3.19Å; P38-N55 CarbonylContact O-C 3.52Å; P38-N55 VanDerWaalsContact O-CA 3.22Å; P38-N55 WeakPolarHBondContact O-CA 3.08Å; P38-N55 WeakPolarHBondContact O-CB 3.18Å; N55-D57 PolarHBondContact O-N 3.37Å; N55-D57 PolarHBondContact OD1-N 2.87Å; N55-G58 PolarHBondContact O-N 3.37Å; N55-G58 PolarHBondContact OD1-N 3.3Å; N55-I59 PolarHBondContact N-O 3.29Å; N55-I59 VanDerWaalsContact N-O 3.15Å; N55-I59 WeakPolarHBondContact OD1-CB 3.41Å; N55-I59 PolarHBondContact OD1-N 2.87Å; N55-I59 PolarHBondContact OD1-O 3.28Å; N55-I106 PolarHBondContact O-N 3.43Å
56	S	96.2	Very high	95.7	Very high	31 Å²	31	23.5 Å²	23.5	22%	0.217	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.7	177	61.7	0	0	0	0	115.1	G37 P38 G58 K105	G37-S56 VanDerWaalsContact CA-OG 3.23Å; G37-S56 WeakPolarHBondContact CA-OG 3.46Å; P38-S56 WeakPolarHBondContact CD-OG 3.33Å; P38-S56 PolarHBondContact O-N 2.86Å; S56-G58 VanDerWaalsContact C-N 3.28Å; S56-G58 PolarHBondContact O-N 3.16Å; S56-K105 WeakPolarHBondContact O-CA 3.44Å; S56-K105 PolarHBondContact O-N 2.8Å
57	D	96.2	Very high	95.4	Very high	58 Å²	58	25.6 Å²	25.6	31%	0.31	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	13.6	-178.3	-52.6	-14.4	0	0	0	112.2	S36 G37 N55 I59	S36-D57 WeakPolarHBondContact CA-OD2 3.28Å; G37-D57 WeakPolarHBondContact CA-OD1 3.36Å; G37-D57 VanDerWaalsContact N-CG 3.33Å; G37-D57 PolarHBondContact N-OD1 3.28Å; G37-D57 PolarHBondContact N-OD2 3.17Å; N55-D57 PolarHBondContact O-N 3.37Å; N55-D57 PolarHBondContact OD1-N 2.87Å; D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 HydrophobicContact CB-CD1 4.4Å; D57-I59 HydrophobicContact CB-CG1 4.42Å; D57-I59 PolarHBondContact O-N 3Å
58	G	96.6	Very high	94.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	74.4	12	179.6	0	0	0	0	0	115.1	N55 S56 S89 H90 E104	N55-G58 PolarHBondContact O-N 3.37Å; N55-G58 PolarHBondContact OD1-N 3.3Å; S56-G58 VanDerWaalsContact C-N 3.28Å; S56-G58 PolarHBondContact O-N 3.16Å; G58-S89 WeakPolarHBondContact O-CA 3.38Å; G58-S89 WeakPolarHBondContact O-CB 3.46Å; G58-S89 PolarHBondContact O-N 2.74Å; G58-H90 PolarHBondContact O-N 3.12Å; G58-H90 VanDerWaalsContact O-N 3.11Å; G58-E104 WeakPolarHBondContact CA-O 3.29Å
59	I	97.2	Very high	94.1	Very high	45 Å²	45	27.4 Å²	27.4	23%	0.231	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	135.2	-179.9	-57.8	173.3	0	0	0	109.8	G54 N55 D57 V86 L88	G54-I59 WeakPolarHBondContact CA-O 3.46Å; N55-I59 PolarHBondContact N-O 3.29Å; N55-I59 VanDerWaalsContact N-O 3.15Å; N55-I59 WeakPolarHBondContact OD1-CB 3.41Å; N55-I59 PolarHBondContact OD1-N 2.87Å; N55-I59 PolarHBondContact OD1-O 3.28Å; D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 HydrophobicContact CB-CD1 4.4Å; D57-I59 HydrophobicContact CB-CG1 4.42Å; D57-I59 PolarHBondContact O-N 3Å; I59-V86 HydrophobicContact CG2-CG1 3.43Å; I59-V86 VanDerWaalsContact CG2-CG1 3.43Å; I59-L88 HydrophobicContact CG1-CD1 4.06Å
60	V	97.6	Very high	93.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.7	169.4	175.5	0	0	0	0	108.9	Y53 V62 F87 I106 I109 L121	Y53-V60 WeakPolarHBondContact O-CA 3.37Å; V60-V62 HydrophobicContact CG1-CG2 4.41Å; V60-F87 HydrophobicContact CB-CD2 4.42Å; V60-F87 HydrophobicContact CB-CE1 4.08Å; V60-F87 HydrophobicContact CB-CE2 3.83Å; V60-F87 HydrophobicContact CB-CZ 3.65Å; V60-F87 HydrophobicContact CG1-CE1 3.89Å; V60-F87 HydrophobicContact CG1-CE2 4.27Å; V60-F87 HydrophobicContact CG1-CZ 3.58Å; V60-F87 HydrophobicContact CG2-CE2 4.38Å; V60-F87 HydrophobicContact CG2-CZ 4.47Å; V60-F87 PolarHBondContact N-O 2.8Å; V60-F87 PolarHBondContact O-N 3.4Å; V60-I106 HydrophobicContact CG2-CD1 4.24Å; V60-I106 HydrophobicContact CG2-CG1 4.08Å; V60-I106 HydrophobicContact CG2-CG2 4.37Å; V60-I109 HydrophobicContact CG1-CD1 4.16Å; V60-I109 HydrophobicContact CG2-CD1 4.26Å; V60-L121 HydrophobicContact CG1-CD2 4.46Å
61	S	96.7	Very high	92.6	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.042	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.5	176.4	-67.8	0	0	0	0	109.5	A52 Y53	A52-S61 CarbonylContact C-O 3.49Å; A52-S61 WeakPolarHBondContact CA-O 3.41Å; Y53-S61 VanDerWaalsContact CE2-CB 3.44Å; Y53-S61 PolarHBondContact N-O 3.42Å; Y53-S61 PolarHBondContact O-N 3.14Å; Y53-S61 WeakPolarHBondContact OH-CB 3.45Å; Y53-S61 PolarHBondContact OH-OG 3.11Å
62	V	97	Very high	91.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.4	177.1	-175	0	0	0	0	108.2	H50 L51 A52 V60 Y84 Q85 F87 W111 L121 L134	H50-V62 HydrophobicContact CB-CG1 4.11Å; L51-V62 WeakPolarHBondContact O-CA 3.04Å; A52-V62 HydrophobicContact CB-CG2 4.23Å; V60-V62 HydrophobicContact CG1-CG2 4.41Å; V62-Y84 HydrophobicContact CB-CD1 4.13Å; V62-Y84 HydrophobicContact CG1-CD1 3.8Å; V62-Y84 HydrophobicContact CG1-CG 4.34Å; V62-Y84 WeakPolarHBondContact O-CA 3.44Å; V62-Y84 VanDerWaalsContact O-CB 3.29Å; V62-Y84 WeakPolarHBondContact O-CB 3.46Å; V62-Y84 PolarHBondContact O-N 2.87Å; V62-Q85 PolarHBondContact N-O 3.36Å; V62-Q85 PolarHBondContact O-N 2.84Å; V62-F87 HydrophobicContact CG2-CE1 4.27Å; V62-W111 HydrophobicContact CG1-CH2 3.92Å; V62-W111 HydrophobicContact CG1-CZ2 4.28Å; V62-W111 HydrophobicContact CG2-CH2 4.31Å; V62-L121 HydrophobicContact CG2-CD2 4.3Å; V62-L134 HydrophobicContact CB-CD2 4.32Å; V62-L134 HydrophobicContact CG2-CD2 3.82Å
63	I	95.6	Very high	90.6	Very high	10 Å²	10	42.3 Å²	42.3	5%	0.051	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144.8	172.5	64.2	178	0	0	0	109.3	L30 H50 L51 Y53 I65 K82	L30-I63 HydrophobicContact CD1-CD1 3.28Å; H50-I63 CarbonylContact C-O 3.58Å; H50-I63 WeakPolarHBondContact CA-O 3.39Å; L51-I63 HydrophobicContact CB-CD1 3.91Å; L51-I63 HydrophobicContact CB-CG1 3.64Å; L51-I63 HydrophobicContact CD2-CD1 3.75Å; L51-I63 HydrophobicContact CD2-CG1 4.37Å; L51-I63 HydrophobicContact CG-CD1 4.31Å; L51-I63 HydrophobicContact CG-CG1 4.41Å; L51-I63 PolarHBondContact N-O 3.17Å; L51-I63 WeakPolarHBondContact O-CG1 3.4Å; L51-I63 PolarHBondContact O-N 2.98Å; Y53-I63 HydrophobicContact CE1-CG2 4.11Å; I63-I65 HydrophobicContact CD1-CD1 4.06Å; I63-I65 HydrophobicContact CG1-CD1 4.19Å; I63-K82 CarbonylContact C-O 3.51Å; I63-K82 WeakPolarHBondContact CA-O 3.42Å
64	E	94.9	Very high	89.7	Confident	69 Å²	69	41.6 Å²	41.6	32%	0.322	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.8	170.9	-175.6	177.7	-173.4	0	0	109.1	S81 K82 Y84	E64-S81 CarbonylContact O-C 3.58Å; E64-S81 VanDerWaalsContact O-CA 3.23Å; E64-S81 WeakPolarHBondContact O-CA 3.4Å; E64-K82 PolarHBondContact N-O 3.09Å; E64-K82 PolarHBondContact O-N 3.34Å; E64-Y84 HydrophobicContact CB-CD2 4.38Å
65	I	94	Very high	88.8	Confident	17 Å²	17	48.2 Å²	48.2	9%	0.087	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	114.4	179.7	-53.3	-65	0	0	0	108.6	F44 T49 L51 I63 C80 K490 L506	F44-I65 HydrophobicContact CE1-CD1 4.06Å; F44-I65 HydrophobicContact CE1-CG1 3.91Å; T49-I65 PolarHBondContact O-N 2.78Å; L51-I65 HydrophobicContact CB-CD1 4.31Å; I63-I65 HydrophobicContact CD1-CD1 4.06Å; I63-I65 HydrophobicContact CG1-CD1 4.19Å; I65-C80 WeakPolarHBondContact CA-O 3.46Å; I65-K490 HydrophobicContact CG2-CD 4.41Å; I65-L506 HydrophobicContact CD1-CD1 4.24Å
66	G	89.5	Confident	87.9	Confident	13 Å²	13	52.5 Å²	52.5	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-161.1	176.7	0	0	0	0	0	112.9	S79 C80 F410	G66-S79 WeakPolarHBondContact O-CA 3.23Å; G66-C80 PolarHBondContact N-O 3.32Å; G66-C80 PolarHBondContact O-N 3.21Å; G66-F410 VanDerWaalsContact CA-CZ 3.48Å
67	Q	86.7	Confident	87.3	Confident	123 Å²	123	58.2 Å²	58.2	58%	0.575	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.7	169.3	-69.7	-174	-29.6	0	0	108.7	H78	Q67-H78 CarbonylContact C-O 3.57Å; Q67-H78 WeakPolarHBondContact CA-O 3.46Å
68	A	81.5	Confident	86.8	Confident	10 Å²	10	55.9 Å²	55.9	8%	0.083	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	168.8	171.8	0	0	0	0	0	111.2	H78 C80 F406 D408	A68-H78 PolarHBondContact N-O 2.6Å; A68-C80 HydrophobicContact CB-CB 4.08Å; A68-C80 PolarHBondContact N-SG 3.42Å; A68-F406 HydrophobicContact CB-CZ 4.42Å; A68-D408 WeakPolarHBondContact CA-OD2 3.29Å; A68-D408 WeakPolarHBondContact CB-OD2 3.47Å
69	D	77.5	Confident	86.4	Confident	91 Å²	91	56 Å²	56	49%	0.487	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	163.7	165.5	-74.1	-39.6	0	0	0	111.8	S71 T409	D69-S71 PolarHBondContact O-N 3Å; D69-T409 WeakPolarHBondContact OD2-CG2 3.19Å; D69-T409 PolarHBondContact OD2-OG1 2.77Å
70	L	81.7	Confident	86	Confident	110 Å²	110	54 Å²	54	58%	0.576	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	121	-178	-171.7	72.3	0	0	0	109.9	H75 R77	L70-H75 WeakPolarHBondContact CD1-O 3.5Å; L70-R77 HydrophobicContact CD1-CG 4.28Å
71	S	78.3	Confident	85.7	Confident	11 Å²	11	54 Å²	54	8%	0.077	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-71.2	135.9	176.4	177.8	0	0	0	0	111.4	D69 I73 H75 H76 H78 W438 P439	D69-S71 PolarHBondContact O-N 3Å; S71-I73 PolarHBondContact O-N 3.22Å; S71-I73 PolarHBondContact OG-N 3.03Å; S71-I73 VanDerWaalsContact OG-N 3.11Å; S71-H75 WeakPolarHBondContact O-CA 3.1Å; S71-H75 PolarHBondContact O-N 3.47Å; S71-H76 PolarHBondContact N-O 2.9Å; S71-H78 WeakPolarHBondContact CB-NE2 3.25Å; S71-W438 PolarHBondContact OG-O 2.83Å; S71-P439 WeakPolarHBondContact OG-CD 3.33Å
72	E	76.4	Confident	85.4	Confident	176 Å²	176	55.1 Å²	55.1	82%	0.822	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-24	171.2	-62.7	-173.8	169	0	0	112.7	H75	E72-H75 PolarHBondContact O-CE1 2.75Å
73	I	77.3	Confident	85.2	Confident	78 Å²	78	58.5 Å²	58.5	40%	0.4	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-49.8	-174.4	-62.9	163.9	0	0	0	111.3	S71 T437 P439	S71-I73 PolarHBondContact O-N 3.22Å; S71-I73 PolarHBondContact OG-N 3.03Å; S71-I73 VanDerWaalsContact OG-N 3.11Å; I73-T437 WeakPolarHBondContact CD1-O 3.44Å; I73-T437 WeakPolarHBondContact CD1-OG1 3.34Å; I73-P439 WeakPolarHBondContact CD1-O 3.47Å
74	T	79.1	Confident	85	Confident	15 Å²	15	59 Å²	59	9%	0.092	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-16.7	-173.9	64.8	0	0	0	0	112	Y25 H76 H78 P439 I510	Y25-T74 HydrophobicContact CD1-CG2 3.96Å; Y25-T74 HydrophobicContact CE1-CG2 3.74Å; Y25-T74 HydrophobicContact CE2-CG2 4.33Å; Y25-T74 HydrophobicContact CG-CG2 4.36Å; T74-H76 PolarHBondContact O-N 3.08Å; T74-H76 PolarHBondContact O-ND1 3.1Å; T74-H76 PolarHBondContact OG1-N 3.17Å; T74-H76 VanDerWaalsContact OG1-N 3.09Å; T74-H78 PolarHBondContact OG1-CE1 2.98Å; T74-H78 VanDerWaalsContact OG1-CE1 3.31Å; T74-H78 PolarHBondContact OG1-NE2 3.29Å; T74-P439 HydrophobicContact CG2-CG 3.67Å; T74-I510 HydrophobicContact CG2-CD1 4.27Å
75	H	78.5	Confident	85	Confident	138 Å²	138	58.4 Å²	58.4	64%	0.639	29%	0.287	S	S	*	.	S	Bend	trans	56.4	28.6	-166.9	-52.6	-54.9	0	0	0	113.5	L70 S71 E72	L70-H75 WeakPolarHBondContact CD1-O 3.5Å; S71-H75 WeakPolarHBondContact O-CA 3.1Å; S71-H75 PolarHBondContact O-N 3.47Å; E72-H75 PolarHBondContact O-CE1 2.75Å
76	H	78.5	Confident	85	Confident	99 Å²	99	59.8 Å²	59.8	46%	0.458	30%	0.296	S	S	.	.	S	Bend	trans	-123.1	155.7	176	-68.8	81.2	0	0	0	111	S71 T74 H78	S71-H76 PolarHBondContact N-O 2.9Å; T74-H76 PolarHBondContact O-N 3.08Å; T74-H76 PolarHBondContact O-ND1 3.1Å; T74-H76 PolarHBondContact OG1-N 3.17Å; T74-H76 VanDerWaalsContact OG1-N 3.09Å; H76-H78 PolarHBondContact O-CD2 3.17Å; H76-H78 PolarHBondContact O-NE2 2.83Å
77	R	83.7	Confident	85.4	Confident	151 Å²	151	60.2 Å²	60.2	57%	0.57	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.2	169.9	-71.8	-174	177.5	178.4	-4	108.8	L70	L70-R77 HydrophobicContact CD1-CG 4.28Å
78	H	84.6	Confident	85.8	Confident	9 Å²	9	58.5 Å²	58.5	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	152	-176.9	-67.5	-72.4	0	0	0	111.6	N27 Q67 A68 S71 T74 H76 C80 P439 E508 I510	N27-H78 HydrophobicContact CB-CB 4.37Å; N27-H78 PolarHBondContact OD1-ND1 3.47Å; Q67-H78 CarbonylContact C-O 3.57Å; Q67-H78 WeakPolarHBondContact CA-O 3.46Å; A68-H78 PolarHBondContact N-O 2.6Å; S71-H78 WeakPolarHBondContact CB-NE2 3.25Å; T74-H78 PolarHBondContact OG1-CE1 2.98Å; T74-H78 VanDerWaalsContact OG1-CE1 3.31Å; T74-H78 PolarHBondContact OG1-NE2 3.29Å; H76-H78 PolarHBondContact O-CD2 3.17Å; H76-H78 PolarHBondContact O-NE2 2.83Å; H78-C80 PolarHBondContact O-N 2.81Å; H78-P439 VanDerWaalsContact CE1-CG 3.46Å; H78-P439 WeakPolarHBondContact CE1-CG 3.28Å; H78-P439 VanDerWaalsContact NE2-CG 3.33Å; H78-P439 WeakPolarHBondContact NE2-CG 3.38Å; H78-E508 WeakPolarHBondContact CA-OE2 3.33Å; H78-E508 IonicContact CE1-OE2 2.6Å; H78-E508 IonicContact CG-OE2 3.98Å; H78-E508 IonicContact ND1-OE2 3.72Å; H78-E508 PolarHBondContact ND1-OE2 3.06Å; H78-I510 WeakPolarHBondContact CE1-CD1 3.47Å
79	S	88.2	Confident	86.6	Confident	4 Å²	4	58.2 Å²	58.2	3%	0.028	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.9	166.6	-65.3	0	0	0	0	109.7	N27 G66 K490 V495	N27-S79 WeakPolarHBondContact CB-O 3.42Å; N27-S79 PolarHBondContact ND2-N 2.94Å; N27-S79 PolarHBondContact ND2-O 2.91Å; N27-S79 VanDerWaalsContact ND2-O 3.16Å; G66-S79 WeakPolarHBondContact O-CA 3.23Å; S79-K490 PolarHBondContact OG-NZ 2.68Å; S79-V495 WeakPolarHBondContact OG-CG2 3.46Å
80	C	89.1	Confident	87.5	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	169.5	172.6	63	0	0	0	0	109.7	I65 G66 A68 H78 F406 D408 F410	I65-C80 WeakPolarHBondContact CA-O 3.46Å; G66-C80 PolarHBondContact N-O 3.32Å; G66-C80 PolarHBondContact O-N 3.21Å; A68-C80 HydrophobicContact CB-CB 4.08Å; A68-C80 PolarHBondContact N-SG 3.42Å; H78-C80 PolarHBondContact O-N 2.81Å; C80-F406 HydrophobicContact CB-CE1 3.65Å; C80-F406 HydrophobicContact CB-CZ 3.84Å; C80-D408 PolarHBondContact SG-OD2 3.42Å; C80-F410 VanDerWaalsContact SG-CB 3.59Å; C80-F410 WeakPolarHBondContact SG-CD1 3.43Å
81	S	91.6	Very high	88.2	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	154.9	-177.7	69.4	0	0	0	0	114.3	E28 L30 E64 R411	E28-S81 PolarHBondContact OE1-OG 3.32Å; E28-S81 WeakPolarHBondContact OE2-CB 3.49Å; E28-S81 PolarHBondContact OE2-N 2.66Å; E28-S81 PolarHBondContact OE2-OG 3.31Å; L30-S81 WeakPolarHBondContact CD2-OG 3.42Å; E64-S81 CarbonylContact O-C 3.58Å; E64-S81 VanDerWaalsContact O-CA 3.23Å; E64-S81 WeakPolarHBondContact O-CA 3.4Å; S81-R411 PolarHBondContact O-NE 2.93Å
82	K	90.3	Very high	89	Confident	30 Å²	30	58 Å²	58	13%	0.13	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.7	173.4	-179.9	178.5	176.3	-178.7	0	109.4	I63 E64 Y84 F410 D414	I63-K82 CarbonylContact C-O 3.51Å; I63-K82 WeakPolarHBondContact CA-O 3.42Å; E64-K82 PolarHBondContact N-O 3.09Å; E64-K82 PolarHBondContact O-N 3.34Å; K82-Y84 PolarHBondContact O-N 2.88Å; K82-F410 HydrophobicContact CB-CD1 3.89Å; K82-F410 HydrophobicContact CB-CE1 3.43Å; K82-F410 VanDerWaalsContact CB-CE1 3.43Å; K82-F410 HydrophobicContact CB-CZ 4.27Å; K82-F410 HydrophobicContact CD-CE1 4.36Å; K82-D414 IonicContact NZ-OD2 3.26Å; K82-D414 PolarHBondContact NZ-OD2 3Å
83	P	91.5	Very high	89.7	Confident	72 Å²	72	53.3 Å²	53.3	47%	0.468	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	128.6	173	-22.6	33.3	0	0	0	110.6
84	Y	92.8	Very high	90.4	Very high	21 Å²	21	55.6 Å²	55.6	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-63.5	176	-176.3	-102.6	0	0	0	109.7	H50 V62 E64 K82 L134 I179	H50-Y84 AromaticContact CD2-CG 3.89Å; H50-Y84 AromaticContact NE2-CD2 3.58Å; H50-Y84 AromaticContact NE2-CE2 3.55Å; H50-Y84 AromaticContact NE2-CG 3.92Å; H50-Y84 AromaticContact NE2-CZ 3.86Å; V62-Y84 HydrophobicContact CB-CD1 4.13Å; V62-Y84 HydrophobicContact CG1-CD1 3.8Å; V62-Y84 HydrophobicContact CG1-CG 4.34Å; V62-Y84 WeakPolarHBondContact O-CA 3.44Å; V62-Y84 VanDerWaalsContact O-CB 3.29Å; V62-Y84 WeakPolarHBondContact O-CB 3.46Å; V62-Y84 PolarHBondContact O-N 2.87Å; E64-Y84 HydrophobicContact CB-CD2 4.38Å; K82-Y84 PolarHBondContact O-N 2.88Å; Y84-L134 HydrophobicContact CD1-CD2 4.14Å; Y84-L134 HydrophobicContact CE1-CB 4.32Å; Y84-L134 HydrophobicContact CE1-CD2 3.9Å; Y84-I179 HydrophobicContact CD1-CD1 3.82Å; Y84-I179 HydrophobicContact CD1-CG2 4.4Å; Y84-I179 HydrophobicContact CD2-CD1 3.49Å; Y84-I179 VanDerWaalsContact CD2-CD1 3.49Å; Y84-I179 HydrophobicContact CD2-CG1 4.44Å; Y84-I179 HydrophobicContact CE1-CD1 3.77Å; Y84-I179 HydrophobicContact CE1-CG1 4.09Å; Y84-I179 HydrophobicContact CE1-CG2 3.7Å; Y84-I179 HydrophobicContact CE2-CD1 3.43Å; Y84-I179 VanDerWaalsContact CE2-CD1 3.43Å; Y84-I179 HydrophobicContact CE2-CG1 3.89Å; Y84-I179 HydrophobicContact CG-CD1 3.69Å; Y84-I179 WeakPolarHBondContact O-CD1 3.43Å
85	Q	94.3	Very high	90.7	Very high	56 Å²	56	56.9 Å²	56.9	26%	0.262	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	145.4	-177.5	-175.8	60.4	45.1	0	0	111.9	V62 F87 L134 I179 V181	V62-Q85 PolarHBondContact N-O 3.36Å; V62-Q85 PolarHBondContact O-N 2.84Å; Q85-F87 HydrophobicContact CG-CD1 4.32Å; Q85-L134 HydrophobicContact CB-CD2 4.18Å; Q85-L134 HydrophobicContact CG-CD2 4.42Å; Q85-I179 HydrophobicContact CB-CD1 4.38Å; Q85-I179 HydrophobicContact CB-CG2 4.03Å; Q85-I179 HydrophobicContact CG-CG2 4.05Å; Q85-V181 HydrophobicContact CG-CG2 3.32Å
86	V	95	Very high	91.2	Very high	47 Å²	47	55.1 Å²	55.1	29%	0.285	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138	172.7	-176.5	0	0	0	0	108.9	I59 F420	I59-V86 HydrophobicContact CG2-CG1 3.43Å; I59-V86 VanDerWaalsContact CG2-CG1 3.43Å; V86-F420 HydrophobicContact CG2-CZ 4.34Å
87	F	96.1	Very high	91.6	Very high	21 Å²	21	58.4 Å²	58.4	9%	0.092	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	149.3	177.3	59.4	-85.7	0	0	0	111.7	V60 V62 Q85 S89 L121 W132 L134 V181	V60-F87 HydrophobicContact CB-CD2 4.42Å; V60-F87 HydrophobicContact CB-CE1 4.08Å; V60-F87 HydrophobicContact CB-CE2 3.83Å; V60-F87 HydrophobicContact CB-CZ 3.65Å; V60-F87 HydrophobicContact CG1-CE1 3.89Å; V60-F87 HydrophobicContact CG1-CE2 4.27Å; V60-F87 HydrophobicContact CG1-CZ 3.58Å; V60-F87 HydrophobicContact CG2-CE2 4.38Å; V60-F87 HydrophobicContact CG2-CZ 4.47Å; V60-F87 PolarHBondContact N-O 2.8Å; V60-F87 PolarHBondContact O-N 3.4Å; V62-F87 HydrophobicContact CG2-CE1 4.27Å; Q85-F87 HydrophobicContact CG-CD1 4.32Å; F87-S89 PolarHBondContact O-N 3.31Å; F87-L121 HydrophobicContact CZ-CD2 4.47Å; F87-W132 HydrophobicContact CD2-CD2 4.07Å; F87-W132 AromaticContact CD2-CE3 3.92Å; F87-W132 HydrophobicContact CD2-CE3 3.92Å; F87-W132 HydrophobicContact CD2-CH2 4.15Å; F87-W132 HydrophobicContact CD2-CZ2 4.34Å; F87-W132 AromaticContact CD2-CZ3 3.93Å; F87-W132 HydrophobicContact CD2-CZ3 3.93Å; F87-W132 HydrophobicContact CE2-CB 4.42Å; F87-W132 AromaticContact CE2-CD2 3.43Å; F87-W132 HydrophobicContact CE2-CD2 3.43Å; F87-W132 VanDerWaalsContact CE2-CD2 3.43Å; F87-W132 AromaticContact CE2-CE2 3.67Å; F87-W132 AromaticContact CE2-CE3 3.71Å; F87-W132 HydrophobicContact CE2-CE3 3.71Å; F87-W132 AromaticContact CE2-CG 3.73Å; F87-W132 HydrophobicContact CE2-CG 3.73Å; F87-W132 HydrophobicContact CE2-CH2 4.39Å; F87-W132 HydrophobicContact CE2-CZ2 4.2Å; F87-W132 HydrophobicContact CE2-CZ3 4.15Å; F87-W132 AromaticContact CE2-NE1 3.96Å; F87-W132 HydrophobicContact CZ-CB 4.31Å; F87-W132 HydrophobicContact CZ-CD2 4.18Å; F87-W132 HydrophobicContact CZ-CE3 4.5Å; F87-W132 HydrophobicContact CZ-CG 4.06Å; F87-L134 HydrophobicContact CE1-CD1 4.22Å; F87-L134 HydrophobicContact CE1-CD2 4.13Å; F87-L134 HydrophobicContact CE1-CG 4.47Å; F87-L134 HydrophobicContact CZ-CD1 4.39Å; F87-V181 HydrophobicContact CB-CG1 4.15Å; F87-V181 HydrophobicContact CD1-CG1 3.85Å; F87-V181 HydrophobicContact CD1-CG2 4.13Å; F87-V181 HydrophobicContact CD2-CG1 4Å; F87-V181 HydrophobicContact CE1-CG1 4.22Å; F87-V181 HydrophobicContact CE2-CG1 4.36Å; F87-V181 HydrophobicContact CG-CG1 3.73Å; F87-V181 HydrophobicContact CZ-CG1 4.45Å
88	L	96.9	Very high	91.7	Very high	88 Å²	88	56.6 Å²	56.6	46%	0.461	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.9	170.8	-175.1	64.3	0	0	0	108.7	I59 H90 E91	I59-L88 HydrophobicContact CG1-CD1 4.06Å; L88-H90 WeakPolarHBondContact CD1-O 3.36Å; L88-E91 HydrophobicContact CD2-CG 3.75Å; L88-E91 HydrophobicContact CG-CG 4.32Å
89	S	97.4	Very high	92	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.021	33%	0.325	C	S	.	.			trans	-90.7	-52.2	-179.5	177	0	0	0	0	111.4	G58 F87 S123 K130 W132	G58-S89 WeakPolarHBondContact O-CA 3.38Å; G58-S89 WeakPolarHBondContact O-CB 3.46Å; G58-S89 PolarHBondContact O-N 2.74Å; F87-S89 PolarHBondContact O-N 3.31Å; S89-S123 PolarHBondContact OG-OG 2.76Å; S89-K130 WeakPolarHBondContact O-CD 3.08Å; S89-K130 WeakPolarHBondContact O-CE 3.15Å; S89-K130 PolarHBondContact O-NZ 3.32Å; S89-W132 VanDerWaalsContact CA-CZ2 3.44Å; S89-W132 WeakPolarHBondContact O-CZ2 3.32Å; S89-W132 PolarHBondContact OG-NE1 3.35Å
90	H	97	Very high	92	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.338	C	S	.	.			trans	-122	149.2	-176.2	-71.2	73.2	0	0	0	110.3	G58 L88 E104 I106 S123 N125 T128	G58-H90 PolarHBondContact O-N 3.12Å; G58-H90 VanDerWaalsContact O-N 3.11Å; L88-H90 WeakPolarHBondContact CD1-O 3.36Å; H90-E104 HydrophobicContact CB-CB 4.37Å; H90-E104 WeakPolarHBondContact CB-O 3.43Å; H90-I106 HydrophobicContact CB-CD1 4.06Å; H90-I106 WeakPolarHBondContact ND1-CD1 3.45Å; H90-S123 PolarHBondContact CE1-OG 2.82Å; H90-N125 HydrophobicContact CB-CB 4.49Å; H90-N125 PolarHBondContact NE2-N 3.43Å; H90-T128 PolarHBondContact NE2-O 3.39Å
91	E	95.3	Very high	92.2	Very high	118 Å²	118	66.6 Å²	66.6	55%	0.551	36%	0.363	S	S	*	.			trans	-121	154	176.4	-73.7	-179.9	168.1	0	0	107.3	L88 E93	L88-E91 HydrophobicContact CD2-CG 3.75Å; L88-E91 HydrophobicContact CG-CG 4.32Å; E91-E93 PolarHBondContact O-N 3.47Å
92	P	94.5	Very high	92.2	Very high	90 Å²	90	67.3 Å²	67.3	58%	0.584	37%	0.367	S	S	*	.			trans	-60.4	129.1	176.3	20.2	-29.9	0	0	0	109.8	E104	P92-E104 WeakPolarHBondContact CB-OE2 3.39Å
93	E	92.3	Very high	92.4	Very high	78 Å²	78	70.7 Å²	70.7	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.5	178.6	-71.1	174.7	-160.8	0	0	109.9	E91 I102	E91-E93 PolarHBondContact O-N 3.47Å; E93-I102 HydrophobicContact CB-CB 4.02Å; E93-I102 HydrophobicContact CB-CD1 4.22Å; E93-I102 HydrophobicContact CB-CG2 4.5Å; E93-I102 PolarHBondContact N-O 3.28Å; E93-I102 PolarHBondContact O-N 2.84Å
94	F	91.3	Very high	92.6	Very high	125 Å²	125	70 Å²	70	55%	0.548	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	118.7	176	-169.8	-96.8	0	0	0	110.8	C96 A101	F94-C96 PolarHBondContact O-N 3.01Å; F94-A101 HydrophobicContact CD2-CB 4.2Å
95	D	86.4	Confident	92.8	Very high	43 Å²	43	72.8 Å²	72.8	23%	0.23	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	99.6	172	-174.1	-17.2	0	0	0	109.3	L97 K98 S99 Q100 I102	D95-L97 PolarHBondContact O-N 3.35Å; D95-L97 WeakPolarHBondContact OD1-CB 3.36Å; D95-L97 PolarHBondContact OD1-N 2.88Å; D95-K98 HydrophobicContact CB-CB 4.42Å; D95-K98 PolarHBondContact O-N 2.68Å; D95-K98 PolarHBondContact OD1-N 2.95Å; D95-K98 WeakPolarHBondContact OD2-CD 3.45Å; D95-S99 VanDerWaalsContact O-CA 3.27Å; D95-S99 WeakPolarHBondContact O-CA 3.47Å; D95-S99 PolarHBondContact O-N 2.94Å; D95-Q100 PolarHBondContact N-O 3.35Å; D95-Q100 PolarHBondContact O-N 2.99Å; D95-Q100 VanDerWaalsContact O-N 3.12Å; D95-I102 HydrophobicContact CB-CD1 4.42Å
96	C	89.4	Confident	93	Very high	100 Å²	100	70.1 Å²	70.1	68%	0.676	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.2	179.8	-63.1	0	0	0	0	113.5	F94	F94-C96 PolarHBondContact O-N 3.01Å
97	L	86.7	Confident	93.1	Very high	168 Å²	168	69.6 Å²	69.6	88%	0.88	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-38	-177.4	-64.2	174	0	0	0	111.1	D95	D95-L97 PolarHBondContact O-N 3.35Å; D95-L97 WeakPolarHBondContact OD1-CB 3.36Å; D95-L97 PolarHBondContact OD1-N 2.88Å
98	K	85.4	Confident	93.2	Very high	114 Å²	114	69.2 Å²	69.2	50%	0.496	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.2	176.7	-64.2	-175.8	-178.2	177.2	0	113.4	D95 Q100	D95-K98 HydrophobicContact CB-CB 4.42Å; D95-K98 PolarHBondContact O-N 2.68Å; D95-K98 PolarHBondContact OD1-N 2.95Å; D95-K98 WeakPolarHBondContact OD2-CD 3.45Å; K98-Q100 HydrophobicContact CB-CB 4.16Å; K98-Q100 PolarHBondContact O-N 2.81Å
99	S	90.6	Very high	93.2	Very high	93 Å²	93	65 Å²	65	65%	0.65	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	41.2	-171.3	-59.8	0	0	0	0	112.1	D95	D95-S99 VanDerWaalsContact O-CA 3.27Å; D95-S99 WeakPolarHBondContact O-CA 3.47Å; D95-S99 PolarHBondContact O-N 2.94Å
100	Q	89.1	Confident	93.2	Very high	66 Å²	66	66.8 Å²	66.8	31%	0.308	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.1	-175	-177.4	172.5	7.2	0	0	110	D95 K98	D95-Q100 PolarHBondContact N-O 3.35Å; D95-Q100 PolarHBondContact O-N 2.99Å; D95-Q100 VanDerWaalsContact O-N 3.12Å; K98-Q100 HydrophobicContact CB-CB 4.16Å; K98-Q100 PolarHBondContact O-N 2.81Å
101	A	92.3	Very high	93.3	Very high	65 Å²	65	67.2 Å²	67.2	54%	0.537	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.5	167.4	0	0	0	0	0	109.6	F94	F94-A101 HydrophobicContact CD2-CB 4.2Å
102	I	92.2	Very high	93.3	Very high	15 Å²	15	62.3 Å²	62.3	8%	0.077	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.5	175.7	-59	171	0	0	0	106.2	E93 D95 N125 R127	E93-I102 HydrophobicContact CB-CB 4.02Å; E93-I102 HydrophobicContact CB-CD1 4.22Å; E93-I102 HydrophobicContact CB-CG2 4.5Å; E93-I102 PolarHBondContact N-O 3.28Å; E93-I102 PolarHBondContact O-N 2.84Å; D95-I102 HydrophobicContact CB-CD1 4.42Å; I102-N125 WeakPolarHBondContact CG2-ND2 3.42Å; I102-R127 HydrophobicContact CB-CG 4.47Å; I102-R127 HydrophobicContact CD1-CB 4.09Å; I102-R127 HydrophobicContact CD1-CG 3.83Å; I102-R127 HydrophobicContact CG1-CG 3.88Å; I102-R127 HydrophobicContact CG2-CB 3.96Å; I102-R127 HydrophobicContact CG2-CG 3.81Å
103	E	94.1	Very high	93.3	Very high	102 Å²	102	59.5 Å²	59.5	48%	0.477	31%	0.313	S	S	.	.			trans	-66.1	146.3	179.3	-61.9	-174.3	177.8	0	0	111.5	K105 N125	E103-K105 VanDerWaalsContact C-N 3.26Å; E103-K105 HydrophobicContact CB-CB 4.34Å; E103-N125 WeakPolarHBondContact O-CB 3.25Å; E103-N125 PolarHBondContact O-ND2 2.99Å
104	E	96.3	Very high	93.2	Very high	57 Å²	57	59.6 Å²	59.6	27%	0.266	31%	0.313	S	S	.	.			trans	-75.5	-15.1	173.5	59.9	-92.1	-131.1	0	0	113	G58 H90 P92 I106	G58-E104 WeakPolarHBondContact CA-O 3.29Å; H90-E104 HydrophobicContact CB-CB 4.37Å; H90-E104 WeakPolarHBondContact CB-O 3.43Å; P92-E104 WeakPolarHBondContact CB-OE2 3.39Å; E104-I106 PolarHBondContact O-N 3.48Å
105	K	97.2	Very high	93.2	Very high	80 Å²	80	57.4 Å²	57.4	35%	0.348	31%	0.313	S	S	.	.			trans	-45.3	126.1	-178.3	173.1	178.8	175.2	-171.6	0	112.2	S56 E103 N107 N125	S56-K105 WeakPolarHBondContact O-CA 3.44Å; S56-K105 PolarHBondContact O-N 2.8Å; E103-K105 VanDerWaalsContact C-N 3.26Å; E103-K105 HydrophobicContact CB-CB 4.34Å; K105-N107 PolarHBondContact O-N 2.86Å; K105-N125 VanDerWaalsContact O-CA 3.29Å; K105-N125 WeakPolarHBondContact O-CA 3.4Å; K105-N125 VanDerWaalsContact O-CB 3.24Å; K105-N125 WeakPolarHBondContact O-CB 3.23Å
106	I	97.9	Very high	93.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.334	C	S	.	.			trans	-76.6	111.1	176.2	-52.4	-56.9	0	0	0	108.7	S40 V41 N55 V60 H90 E104 I109	S40-I106 VanDerWaalsContact CB-O 3.24Å; S40-I106 WeakPolarHBondContact CB-O 3.34Å; S40-I106 PolarHBondContact OG-O 2.89Å; V41-I106 HydrophobicContact CG1-CB 4.46Å; V41-I106 HydrophobicContact CG1-CG2 3.81Å; N55-I106 PolarHBondContact O-N 3.43Å; V60-I106 HydrophobicContact CG2-CD1 4.24Å; V60-I106 HydrophobicContact CG2-CG1 4.08Å; V60-I106 HydrophobicContact CG2-CG2 4.37Å; H90-I106 HydrophobicContact CB-CD1 4.06Å; H90-I106 WeakPolarHBondContact ND1-CD1 3.45Å; E104-I106 PolarHBondContact O-N 3.48Å; I106-I109 HydrophobicContact CG2-CD1 4.12Å; I106-I109 HydrophobicContact CG2-CG1 3.82Å
107	N	96.3	Very high	93.4	Very high	35 Å²	35	58.6 Å²	58.6	19%	0.187	33%	0.327	C	S	.	.			trans	-88.7	-40.5	-179.1	-71.7	-18.7	0	0	0	112	K105 S124 E126	K105-N107 PolarHBondContact O-N 2.86Å; N107-S124 PolarHBondContact N-O 2.85Å; N107-E126 PolarHBondContact ND2-N 3.01Å
108	L	97.8	Very high	93.8	Very high	14 Å²	14	51.2 Å²	51.2	7%	0.073	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.6	-174.4	-58.6	168.7	0	0	0	111	S123 S124 I195 L198	L108-S123 CarbonylContact O-C 3.58Å; L108-S123 WeakPolarHBondContact O-CA 3.14Å; L108-S124 PolarHBondContact N-O 2.98Å; L108-S124 PolarHBondContact O-N 3.43Å; L108-I195 HydrophobicContact CD1-CG2 4.02Å; L108-L198 HydrophobicContact CB-CB 4.2Å; L108-L198 HydrophobicContact CB-CD2 4.32Å; L108-L198 HydrophobicContact CD1-CB 3.64Å
109	I	98.3	Very high	94.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.4	167.8	-65.1	174.8	0	0	0	107.9	V41 E43 A52 V60 I106 L121 L122	V41-I109 HydrophobicContact CG1-CB 4.43Å; V41-I109 HydrophobicContact CG1-CD1 3.84Å; V41-I109 HydrophobicContact CG1-CG1 3.78Å; E43-I109 HydrophobicContact CB-CB 4.4Å; E43-I109 HydrophobicContact CB-CG2 4.26Å; A52-I109 HydrophobicContact CB-CD1 4.19Å; A52-I109 HydrophobicContact CB-CG2 3.95Å; V60-I109 HydrophobicContact CG1-CD1 4.16Å; V60-I109 HydrophobicContact CG2-CD1 4.26Å; I106-I109 HydrophobicContact CG2-CD1 4.12Å; I106-I109 HydrophobicContact CG2-CG1 3.82Å; I109-L121 HydrophobicContact CG2-CD1 4.5Å; I109-L122 CarbonylContact C-O 3.53Å; I109-L122 WeakPolarHBondContact CA-O 3.43Å
110	R	97.7	Very high	94.7	Very high	40 Å²	40	42.8 Å²	42.8	15%	0.151	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	125	174.2	-66.7	-66.2	-180	-116.2	-5.7	110.8	E43 L121 L122 L198 P200	E43-R110 WeakPolarHBondContact OE1-CD 3.47Å; E43-R110 IonicContact OE1-CZ 3.06Å; E43-R110 IonicContact OE1-NE 3.15Å; E43-R110 IonicContact OE1-NH1 3.31Å; E43-R110 PolarHBondContact OE1-NH1 3.33Å; E43-R110 IonicContact OE2-NH1 3.56Å; R110-L121 WeakPolarHBondContact O-CA 3.47Å; R110-L122 PolarHBondContact N-O 3.46Å; R110-L122 PolarHBondContact O-N 2.86Å; R110-L198 HydrophobicContact CB-CD2 4.32Å; R110-L198 HydrophobicContact CB-CG 4.48Å; R110-L198 HydrophobicContact CG-CB 4.2Å; R110-L198 HydrophobicContact CG-CD2 4.09Å; R110-L198 HydrophobicContact CG-CG 4.02Å; R110-L198 VanDerWaalsContact CG-O 3.31Å; R110-L198 WeakPolarHBondContact CG-O 3.19Å; R110-L198 PolarHBondContact NE-O 2.77Å; R110-P200 HydrophobicContact CB-CG 3.87Å
111	W	97.6	Very high	95.1	Very high	9 Å²	9	39.6 Å²	39.6	3%	0.034	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.4	177.3	-67.8	94.2	0	0	0	112	E43 N45 H50 A52 V62 H119 L121	E43-W111 PolarHBondContact O-NE1 2.77Å; N45-W111 VanDerWaalsContact CA-CD1 3.46Å; N45-W111 VanDerWaalsContact CA-CG 3.45Å; N45-W111 HydrophobicContact CB-CB 4.17Å; N45-W111 HydrophobicContact CB-CD2 3.52Å; N45-W111 HydrophobicContact CB-CE3 3.91Å; N45-W111 HydrophobicContact CB-CG 3.68Å; N45-W111 HydrophobicContact CB-CZ2 4.26Å; N45-W111 HydrophobicContact CB-CZ3 4.49Å; H50-W111 HydrophobicContact CB-CH2 4.21Å; H50-W111 HydrophobicContact CB-CZ2 4.21Å; A52-W111 HydrophobicContact CB-CH2 4.3Å; A52-W111 HydrophobicContact CB-CZ2 3.39Å; V62-W111 HydrophobicContact CG1-CH2 3.92Å; V62-W111 HydrophobicContact CG1-CZ2 4.28Å; V62-W111 HydrophobicContact CG2-CH2 4.31Å; W111-H119 HydrophobicContact CZ3-CB 3.83Å; W111-L121 HydrophobicContact CD2-CB 4.06Å; W111-L121 HydrophobicContact CE3-CB 3.78Å; W111-L121 HydrophobicContact CE3-CD2 4.31Å; W111-L121 HydrophobicContact CH2-CD2 3.79Å; W111-L121 HydrophobicContact CZ2-CD2 4.21Å; W111-L121 HydrophobicContact CZ3-CB 4.08Å; W111-L121 HydrophobicContact CZ3-CD2 3.8Å; W111-L121 HydrophobicContact CZ3-CG 4.47Å
112	L	96.4	Very high	95.3	Very high	15 Å²	15	36.5 Å²	36.5	8%	0.079	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	158	164.4	-55.2	178.9	0	0	0	109.1	K114 F120 L122 L131 P200 L220	L112-K114 PolarHBondContact O-N 2.88Å; L112-F120 HydrophobicContact CB-CB 3.89Å; L112-F120 HydrophobicContact CD1-CB 4.16Å; L112-F120 HydrophobicContact CG-CB 4.41Å; L112-F120 PolarHBondContact N-O 2.95Å; L112-L122 HydrophobicContact CD2-CD1 4.19Å; L112-L122 HydrophobicContact CD2-CG 4.5Å; L112-L122 HydrophobicContact CG-CG 4.5Å; L112-L131 HydrophobicContact CD1-CD1 3.56Å; L112-P200 HydrophobicContact CD2-CB 3.61Å; L112-P200 HydrophobicContact CD2-CG 3.7Å; L112-L220 HydrophobicContact CD1-CD1 3.86Å; L112-L220 HydrophobicContact CD1-CD2 3.62Å; L112-L220 HydrophobicContact CD1-CG 4.42Å; L112-L220 HydrophobicContact CD2-CD2 4.45Å
113	P	93.1	Very high	95.6	Very high	30 Å²	30	35.8 Å²	35.8	20%	0.195	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	139.9	175.6	-23.8	33.7	0	0	0	112.1	K46 R204	K46-P113 HydrophobicContact CD-CG 4.17Å; P113-R204 HydrophobicContact CG-CG 4.15Å
114	K	91.9	Very high	95.8	Very high	81 Å²	81	31 Å²	31	35%	0.352	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	138.9	174.9	-173.2	176.6	-177.1	154.2	0	110.8	E47 L112 G116 S118 H119	E47-K114 VanDerWaalsContact OE1-CB 3.3Å; E47-K114 WeakPolarHBondContact OE1-CB 3.44Å; E47-K114 PolarHBondContact OE1-N 3.16Å; L112-K114 PolarHBondContact O-N 2.88Å; K114-G116 WeakPolarHBondContact CE-O 3.27Å; K114-S118 WeakPolarHBondContact CG-O 3.45Å; K114-H119 PolarHBondContact NZ-NE2 2.82Å
115	S	91.3	Very high	95.8	Very high	79 Å²	79	28.2 Å²	28.2	55%	0.552	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.3	172.3	-175.6	0	0	0	0	110.5	L117 S118	S115-L117 PolarHBondContact O-N 3.37Å; S115-S118 PolarHBondContact N-O 3.3Å; S115-S118 VanDerWaalsContact N-O 3.08Å; S115-S118 WeakPolarHBondContact O-CB 2.94Å; S115-S118 PolarHBondContact O-N 2.77Å
116	G	90.2	Very high	95.7	Very high	65 Å²	65	26.2 Å²	26.2	67%	0.67	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	-128	-172.6	0	0	0	0	0	112	K114 S118	K114-G116 WeakPolarHBondContact CE-O 3.27Å; G116-S118 VanDerWaalsContact C-N 3.28Å
117	L	89.4	Confident	95.5	Very high	103 Å²	103	27.3 Å²	27.3	54%	0.539	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	4.4	176.2	-57.8	177.2	0	0	0	113.1	S115 E136	S115-L117 PolarHBondContact O-N 3.37Å; L117-E136 PolarHBondContact O-N 2.75Å
118	S	94.7	Very high	95.4	Very high	12 Å²	12	25.8 Å²	25.8	8%	0.084	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129	-174.1	-60.6	0	0	0	0	112.1	K114 S115 G116 F120 Q133 L134 T135	K114-S118 WeakPolarHBondContact CG-O 3.45Å; S115-S118 PolarHBondContact N-O 3.3Å; S115-S118 VanDerWaalsContact N-O 3.08Å; S115-S118 WeakPolarHBondContact O-CB 2.94Å; S115-S118 PolarHBondContact O-N 2.77Å; G116-S118 VanDerWaalsContact C-N 3.28Å; S118-F120 VanDerWaalsContact CB-CE2 3.43Å; S118-F120 WeakPolarHBondContact O-CE2 3.38Å; S118-Q133 PolarHBondContact OG-NE2 2.72Å; S118-L134 CarbonylContact C-O 3.57Å; S118-L134 VanDerWaalsContact CA-O 3.27Å; S118-L134 WeakPolarHBondContact CA-O 3.5Å; S118-T135 WeakPolarHBondContact OG-CG2 3.33Å; S118-T135 PolarHBondContact OG-OG1 3.33Å
119	H	96.5	Very high	95.4	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.014	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.7	164.8	-65	-90	0	0	0	109.7	H50 W111 K114 Q133 L134	H50-H119 AromaticContact CE1-CE1 3.53Å; H50-H119 AromaticContact CE1-NE2 3.43Å; H50-H119 PolarHBondContact CE1-NE2 2.86Å; H50-H119 AromaticContact ND1-CE1 3.43Å; H50-H119 PolarHBondContact ND1-CE1 2.95Å; H50-H119 AromaticContact ND1-NE2 3.82Å; W111-H119 HydrophobicContact CZ3-CB 3.83Å; K114-H119 PolarHBondContact NZ-NE2 2.82Å; H119-Q133 WeakPolarHBondContact O-CA 3.32Å; H119-L134 HydrophobicContact CB-CB 4.4Å; H119-L134 PolarHBondContact N-O 3.33Å; H119-L134 PolarHBondContact O-N 3.06Å
120	F	97.4	Very high	95.4	Very high	27 Å²	27	26.6 Å²	26.6	12%	0.118	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.2	-178.6	-64.9	-90.5	0	0	0	109.9	L112 S118 L131 W132 Q133 K184	L112-F120 HydrophobicContact CB-CB 3.89Å; L112-F120 HydrophobicContact CD1-CB 4.16Å; L112-F120 HydrophobicContact CG-CB 4.41Å; L112-F120 PolarHBondContact N-O 2.95Å; S118-F120 VanDerWaalsContact CB-CE2 3.43Å; S118-F120 WeakPolarHBondContact O-CE2 3.38Å; F120-L131 HydrophobicContact CB-CD1 4.44Å; F120-W132 VanDerWaalsContact CA-O 3.31Å; F120-W132 WeakPolarHBondContact CA-O 3.19Å; F120-Q133 HydrophobicContact CD1-CB 3.98Å; F120-Q133 HydrophobicContact CD1-CG 4.16Å; F120-Q133 HydrophobicContact CE1-CB 3.75Å; F120-Q133 HydrophobicContact CE1-CG 3.55Å; F120-Q133 HydrophobicContact CZ-CG 3.89Å; F120-K184 HydrophobicContact CD1-CD 4.22Å; F120-K184 HydrophobicContact CE1-CD 3.72Å
121	L	97.7	Very high	95.4	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.7	175.3	66.5	87.6	0	0	0	110.5	A52 V60 V62 F87 I109 R110 W111 W132 L134	A52-L121 HydrophobicContact CB-CD2 4.37Å; V60-L121 HydrophobicContact CG1-CD2 4.46Å; V62-L121 HydrophobicContact CG2-CD2 4.3Å; F87-L121 HydrophobicContact CZ-CD2 4.47Å; I109-L121 HydrophobicContact CG2-CD1 4.5Å; R110-L121 WeakPolarHBondContact O-CA 3.47Å; W111-L121 HydrophobicContact CD2-CB 4.06Å; W111-L121 HydrophobicContact CE3-CB 3.78Å; W111-L121 HydrophobicContact CE3-CD2 4.31Å; W111-L121 HydrophobicContact CH2-CD2 3.79Å; W111-L121 HydrophobicContact CZ2-CD2 4.21Å; W111-L121 HydrophobicContact CZ3-CB 4.08Å; W111-L121 HydrophobicContact CZ3-CD2 3.8Å; W111-L121 HydrophobicContact CZ3-CG 4.47Å; L121-W132 HydrophobicContact CD1-CB 4.02Å; L121-W132 HydrophobicContact CD1-CG 4.19Å; L121-W132 HydrophobicContact CG-CB 4.09Å; L121-W132 PolarHBondContact N-O 3.44Å; L121-W132 VanDerWaalsContact N-O 3.15Å; L121-W132 PolarHBondContact O-N 2.69Å; L121-L134 HydrophobicContact CD2-CD1 4.01Å; L121-L134 HydrophobicContact CG-CD1 4.42Å
122	L	98.4	Very high	95.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.6	164.6	-62.4	169.2	0	0	0	107.9	I109 R110 L112 I129 K130 L131 F187 L198 P200 F207 L220	I109-L122 CarbonylContact C-O 3.53Å; I109-L122 WeakPolarHBondContact CA-O 3.43Å; R110-L122 PolarHBondContact N-O 3.46Å; R110-L122 PolarHBondContact O-N 2.86Å; L112-L122 HydrophobicContact CD2-CD1 4.19Å; L112-L122 HydrophobicContact CD2-CG 4.5Å; L112-L122 HydrophobicContact CG-CG 4.5Å; L122-I129 HydrophobicContact CB-CG2 4.35Å; L122-I129 HydrophobicContact CD2-CG2 4.19Å; L122-K130 WeakPolarHBondContact CA-O 3.41Å; L122-L131 HydrophobicContact CD2-CB 3.87Å; L122-L131 HydrophobicContact CD2-CD1 3.86Å; L122-L131 HydrophobicContact CD2-CG 4.42Å; L122-L131 HydrophobicContact CG-CD1 4.46Å; L122-F187 HydrophobicContact CD2-CE2 4.25Å; L122-L198 HydrophobicContact CB-CD2 3.81Å; L122-L198 HydrophobicContact CD1-CD1 4.42Å; L122-P200 HydrophobicContact CD1-CG 4.41Å; L122-F207 HydrophobicContact CD1-CB 4.02Å; L122-F207 HydrophobicContact CD1-CD1 4.04Å; L122-F207 HydrophobicContact CD1-CD2 3.93Å; L122-F207 HydrophobicContact CD1-CE1 4.5Å; L122-F207 HydrophobicContact CD1-CE2 4.41Å; L122-F207 HydrophobicContact CD1-CG 3.72Å; L122-F207 HydrophobicContact CD2-CE1 4.46Å; L122-L220 HydrophobicContact CD2-CD2 4.29Å
123	S	98.3	Very high	95.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.6	171.8	56.3	0	0	0	0	108.3	S89 H90 L108 I129 K130 W132	S89-S123 PolarHBondContact OG-OG 2.76Å; H90-S123 PolarHBondContact CE1-OG 2.82Å; L108-S123 CarbonylContact O-C 3.58Å; L108-S123 WeakPolarHBondContact O-CA 3.14Å; S123-I129 CarbonylContact O-C 3.56Å; S123-I129 VanDerWaalsContact O-CA 3.31Å; S123-I129 WeakPolarHBondContact O-CA 3.4Å; S123-K130 PolarHBondContact N-O 3.1Å; S123-K130 PolarHBondContact O-N 3.25Å; S123-K130 PolarHBondContact OG-O 2.87Å; S123-W132 PolarHBondContact OG-NE1 3.04Å
124	S	97.7	Very high	95.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.8	172.2	83.4	0	0	0	0	111.5	N107 L108 T128	N107-S124 PolarHBondContact N-O 2.85Å; L108-S124 PolarHBondContact N-O 2.98Å; L108-S124 PolarHBondContact O-N 3.43Å; S124-T128 WeakPolarHBondContact CA-O 3.41Å
125	N	96.4	Very high	95.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.133	C	C	.	.			trans	-94.8	-151.1	155.2	69	-8.4	0	0	0	108.6	H90 I102 E103 K105 R127 T128	H90-N125 HydrophobicContact CB-CB 4.49Å; H90-N125 PolarHBondContact NE2-N 3.43Å; I102-N125 WeakPolarHBondContact CG2-ND2 3.42Å; E103-N125 WeakPolarHBondContact O-CB 3.25Å; E103-N125 PolarHBondContact O-ND2 2.99Å; K105-N125 VanDerWaalsContact O-CA 3.29Å; K105-N125 WeakPolarHBondContact O-CA 3.4Å; K105-N125 VanDerWaalsContact O-CB 3.24Å; K105-N125 WeakPolarHBondContact O-CB 3.23Å; N125-R127 VanDerWaalsContact C-N 3.35Å; N125-R127 PolarHBondContact O-N 2.85Å; N125-R127 PolarHBondContact OD1-N 3.34Å; N125-R127 VanDerWaalsContact OD1-N 3.11Å; N125-T128 PolarHBondContact N-O 2.94Å; N125-T128 WeakPolarHBondContact OD1-CA 3.19Å; N125-T128 WeakPolarHBondContact OD1-CB 3.01Å; N125-T128 PolarHBondContact OD1-N 3Å; N125-T128 PolarHBondContact OD1-O 3.08Å; N125-T128 VanDerWaalsContact OD1-O 3.11Å
126	E	94.4	Very high	95.9	Very high	38 Å²	38	21.4 Å²	21.4	18%	0.178	12%	0.12	C	C	.	.	S	Bend	trans	-68.7	-27.7	179.6	-57.9	-164.4	134.7	0	0	114.2	N107 S194 I195	N107-E126 PolarHBondContact ND2-N 3.01Å; E126-S194 CarbonylContact O-C 3.53Å; E126-S194 VanDerWaalsContact O-CA 3.26Å; E126-S194 WeakPolarHBondContact O-CA 3.5Å; E126-I195 WeakPolarHBondContact O-CG1 3.43Å; E126-I195 PolarHBondContact O-N 3.05Å
127	R	93.2	Very high	95.9	Very high	23 Å²	23	20.1 Å²	20.1	9%	0.087	10%	0.098	C	C	.	.	S	Bend	trans	-130.4	-21.7	-167.7	-62.7	-61.4	-163.4	143	-6	115.1	I102 N125 H191 G192	I102-R127 HydrophobicContact CB-CG 4.47Å; I102-R127 HydrophobicContact CD1-CB 4.09Å; I102-R127 HydrophobicContact CD1-CG 3.83Å; I102-R127 HydrophobicContact CG1-CG 3.88Å; I102-R127 HydrophobicContact CG2-CB 3.96Å; I102-R127 HydrophobicContact CG2-CG 3.81Å; N125-R127 VanDerWaalsContact C-N 3.35Å; N125-R127 PolarHBondContact O-N 2.85Å; N125-R127 PolarHBondContact OD1-N 3.34Å; N125-R127 VanDerWaalsContact OD1-N 3.11Å; R127-H191 PolarHBondContact NH1-O 3.08Å; R127-G192 VanDerWaalsContact CZ-O 3.24Å; R127-G192 PolarHBondContact NH1-O 3.31Å; R127-G192 PolarHBondContact NH2-O 3.43Å
128	T	95.6	Very high	95.9	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.018	8%	0.076	C	C	.	.			trans	-129.7	130.3	-166.6	-60.9	0	0	0	0	110.1	H90 S124 N125 K130 V186 A188	H90-T128 PolarHBondContact NE2-O 3.39Å; S124-T128 WeakPolarHBondContact CA-O 3.41Å; N125-T128 PolarHBondContact N-O 2.94Å; N125-T128 WeakPolarHBondContact OD1-CA 3.19Å; N125-T128 WeakPolarHBondContact OD1-CB 3.01Å; N125-T128 PolarHBondContact OD1-N 3Å; N125-T128 PolarHBondContact OD1-O 3.08Å; N125-T128 VanDerWaalsContact OD1-O 3.11Å; T128-K130 HydrophobicContact CG2-CG 4.29Å; T128-V186 HydrophobicContact CG2-CG1 3.58Å; T128-A188 HydrophobicContact CG2-CB 4.07Å
129	I	97.9	Very high	95.6	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.1	175.9	-54.2	160.3	0	0	0	107.9	L122 S123 F187 I195 L198 F207 S209	L122-I129 HydrophobicContact CB-CG2 4.35Å; L122-I129 HydrophobicContact CD2-CG2 4.19Å; S123-I129 CarbonylContact O-C 3.56Å; S123-I129 VanDerWaalsContact O-CA 3.31Å; S123-I129 WeakPolarHBondContact O-CA 3.4Å; I129-F187 HydrophobicContact CB-CB 4.19Å; I129-F187 HydrophobicContact CB-CD2 4.31Å; I129-F187 HydrophobicContact CG2-CD2 4.2Å; I129-F187 PolarHBondContact N-O 3.09Å; I129-F187 PolarHBondContact O-N 2.94Å; I129-I195 HydrophobicContact CD1-CD1 4.01Å; I129-I195 HydrophobicContact CG1-CD1 3.68Å; I129-L198 HydrophobicContact CD1-CD1 3.91Å; I129-L198 HydrophobicContact CG1-CD1 4.43Å; I129-L198 HydrophobicContact CG2-CD1 4.18Å; I129-L198 HydrophobicContact CG2-CD2 4.37Å; I129-F207 HydrophobicContact CD1-CE2 3.98Å; I129-F207 HydrophobicContact CG2-CE2 4.24Å; I129-F207 HydrophobicContact CG2-CZ 4.42Å; I129-S209 VanDerWaalsContact CD1-CB 3.49Å
130	K	98	Very high	95.2	Very high	29 Å²	29	20.9 Å²	20.9	13%	0.126	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.6	-179.5	-70.8	-176.4	-173.9	-176.2	0	110.1	S89 L122 S123 T128 W132 N183 K185 V186	S89-K130 WeakPolarHBondContact O-CD 3.08Å; S89-K130 WeakPolarHBondContact O-CE 3.15Å; S89-K130 PolarHBondContact O-NZ 3.32Å; L122-K130 WeakPolarHBondContact CA-O 3.41Å; S123-K130 PolarHBondContact N-O 3.1Å; S123-K130 PolarHBondContact O-N 3.25Å; S123-K130 PolarHBondContact OG-O 2.87Å; T128-K130 HydrophobicContact CG2-CG 4.29Å; K130-W132 HydrophobicContact CB-CZ2 4.37Å; K130-W132 HydrophobicContact CD-CZ2 3.88Å; K130-N183 WeakPolarHBondContact CB-ND2 3.4Å; K130-K185 WeakPolarHBondContact CA-O 3.43Å; K130-V186 HydrophobicContact CG-CG1 4.3Å; K130-V186 HydrophobicContact CG-CG2 4.28Å
131	L	98.1	Very high	94.8	Very high	7 Å²	7	22.5 Å²	22.5	4%	0.037	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.1	171.2	175.3	61.3	0	0	0	109.7	L112 F120 L122 K184 K185 F187 L220	L112-L131 HydrophobicContact CD1-CD1 3.56Å; F120-L131 HydrophobicContact CB-CD1 4.44Å; L122-L131 HydrophobicContact CD2-CB 3.87Å; L122-L131 HydrophobicContact CD2-CD1 3.86Å; L122-L131 HydrophobicContact CD2-CG 4.42Å; L122-L131 HydrophobicContact CG-CD1 4.46Å; L131-K184 HydrophobicContact CD2-CB 4.21Å; L131-K184 HydrophobicContact CG-CB 4.19Å; L131-K184 PolarHBondContact O-N 3.15Å; L131-K185 HydrophobicContact CB-CB 4.06Å; L131-K185 HydrophobicContact CD2-CB 4.41Å; L131-K185 HydrophobicContact CD2-CG 4.27Å; L131-K185 PolarHBondContact N-O 3.48Å; L131-F187 HydrophobicContact CB-CE2 4.05Å; L131-L220 HydrophobicContact CD2-CD2 4.4Å
132	W	98.3	Very high	94.3	Very high	22 Å²	22	27.4 Å²	27.4	8%	0.083	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.7	178.6	-64.2	96.7	0	0	0	111.2	F87 S89 F120 L121 S123 K130 L134 V181 Q182 N183	F87-W132 HydrophobicContact CD2-CD2 4.07Å; F87-W132 AromaticContact CD2-CE3 3.92Å; F87-W132 HydrophobicContact CD2-CE3 3.92Å; F87-W132 HydrophobicContact CD2-CH2 4.15Å; F87-W132 HydrophobicContact CD2-CZ2 4.34Å; F87-W132 AromaticContact CD2-CZ3 3.93Å; F87-W132 HydrophobicContact CD2-CZ3 3.93Å; F87-W132 HydrophobicContact CE2-CB 4.42Å; F87-W132 AromaticContact CE2-CD2 3.43Å; F87-W132 HydrophobicContact CE2-CD2 3.43Å; F87-W132 VanDerWaalsContact CE2-CD2 3.43Å; F87-W132 AromaticContact CE2-CE2 3.67Å; F87-W132 AromaticContact CE2-CE3 3.71Å; F87-W132 HydrophobicContact CE2-CE3 3.71Å; F87-W132 AromaticContact CE2-CG 3.73Å; F87-W132 HydrophobicContact CE2-CG 3.73Å; F87-W132 HydrophobicContact CE2-CH2 4.39Å; F87-W132 HydrophobicContact CE2-CZ2 4.2Å; F87-W132 HydrophobicContact CE2-CZ3 4.15Å; F87-W132 AromaticContact CE2-NE1 3.96Å; F87-W132 HydrophobicContact CZ-CB 4.31Å; F87-W132 HydrophobicContact CZ-CD2 4.18Å; F87-W132 HydrophobicContact CZ-CE3 4.5Å; F87-W132 HydrophobicContact CZ-CG 4.06Å; S89-W132 VanDerWaalsContact CA-CZ2 3.44Å; S89-W132 WeakPolarHBondContact O-CZ2 3.32Å; S89-W132 PolarHBondContact OG-NE1 3.35Å; F120-W132 VanDerWaalsContact CA-O 3.31Å; F120-W132 WeakPolarHBondContact CA-O 3.19Å; L121-W132 HydrophobicContact CD1-CB 4.02Å; L121-W132 HydrophobicContact CD1-CG 4.19Å; L121-W132 HydrophobicContact CG-CB 4.09Å; L121-W132 PolarHBondContact N-O 3.44Å; L121-W132 VanDerWaalsContact N-O 3.15Å; L121-W132 PolarHBondContact O-N 2.69Å; S123-W132 PolarHBondContact OG-NE1 3.04Å; K130-W132 HydrophobicContact CB-CZ2 4.37Å; K130-W132 HydrophobicContact CD-CZ2 3.88Å; W132-L134 HydrophobicContact CB-CD1 4.26Å; W132-V181 HydrophobicContact CE3-CG1 3.71Å; W132-V181 HydrophobicContact CZ3-CG1 4.03Å; W132-Q182 WeakPolarHBondContact CA-O 3.31Å; W132-N183 HydrophobicContact CD2-CB 4.46Å; W132-N183 HydrophobicContact CE3-CB 3.92Å; W132-N183 HydrophobicContact CH2-CB 3.73Å; W132-N183 HydrophobicContact CZ2-CB 4.22Å; W132-N183 WeakPolarHBondContact CZ2-ND2 3.37Å; W132-N183 HydrophobicContact CZ3-CB 3.57Å
133	Q	97.4	Very high	93.7	Very high	33 Å²	33	30.2 Å²	30.2	15%	0.154	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.8	170.5	178.7	178.9	11.7	0	0	108.9	S118 H119 F120 T135 V181 Q182 K184	S118-Q133 PolarHBondContact OG-NE2 2.72Å; H119-Q133 WeakPolarHBondContact O-CA 3.32Å; F120-Q133 HydrophobicContact CD1-CB 3.98Å; F120-Q133 HydrophobicContact CD1-CG 4.16Å; F120-Q133 HydrophobicContact CE1-CB 3.75Å; F120-Q133 HydrophobicContact CE1-CG 3.55Å; F120-Q133 HydrophobicContact CZ-CG 3.89Å; Q133-T135 PolarHBondContact NE2-OG1 3.31Å; Q133-V181 CarbonylContact O-C 3.53Å; Q133-V181 WeakPolarHBondContact O-CA 3.48Å; Q133-Q182 PolarHBondContact N-O 3.01Å; Q133-Q182 PolarHBondContact O-N 2.85Å; Q133-K184 HydrophobicContact CB-CD 3.71Å; Q133-K184 HydrophobicContact CB-CG 3.77Å; Q133-K184 HydrophobicContact CG-CD 4.4Å
134	L	97.4	Very high	93.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	111	172	-68.4	81.4	0	0	0	107.3	V62 Y84 Q85 F87 S118 H119 L121 W132 I179 R180 V181	V62-L134 HydrophobicContact CB-CD2 4.32Å; V62-L134 HydrophobicContact CG2-CD2 3.82Å; Y84-L134 HydrophobicContact CD1-CD2 4.14Å; Y84-L134 HydrophobicContact CE1-CB 4.32Å; Y84-L134 HydrophobicContact CE1-CD2 3.9Å; Q85-L134 HydrophobicContact CB-CD2 4.18Å; Q85-L134 HydrophobicContact CG-CD2 4.42Å; F87-L134 HydrophobicContact CE1-CD1 4.22Å; F87-L134 HydrophobicContact CE1-CD2 4.13Å; F87-L134 HydrophobicContact CE1-CG 4.47Å; F87-L134 HydrophobicContact CZ-CD1 4.39Å; S118-L134 CarbonylContact C-O 3.57Å; S118-L134 VanDerWaalsContact CA-O 3.27Å; S118-L134 WeakPolarHBondContact CA-O 3.5Å; H119-L134 HydrophobicContact CB-CB 4.4Å; H119-L134 PolarHBondContact N-O 3.33Å; H119-L134 PolarHBondContact O-N 3.06Å; L121-L134 HydrophobicContact CD2-CD1 4.01Å; L121-L134 HydrophobicContact CG-CD1 4.42Å; W132-L134 HydrophobicContact CB-CD1 4.26Å; L134-I179 HydrophobicContact CB-CG2 4.43Å; L134-R180 WeakPolarHBondContact CA-O 3.21Å; L134-V181 HydrophobicContact CG-CG2 4.31Å
135	T	95.4	Very high	92.6	Very high	19 Å²	19	34.9 Å²	34.9	12%	0.117	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.9	-178.7	-53.3	0	0	0	0	110.1	S118 Q133 L137 R180	S118-T135 WeakPolarHBondContact OG-CG2 3.33Å; S118-T135 PolarHBondContact OG-OG1 3.33Å; Q133-T135 PolarHBondContact NE2-OG1 3.31Å; T135-L137 HydrophobicContact CG2-CD2 3.62Å; T135-L137 HydrophobicContact CG2-CG 3.86Å; T135-L137 PolarHBondContact O-N 3.36Å; T135-R180 PolarHBondContact N-O 3.43Å; T135-R180 PolarHBondContact O-N 2.89Å
136	E	91.5	Very high	92.2	Very high	64 Å²	64	36.9 Å²	36.9	30%	0.299	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	119.8	169.7	-168.7	176.6	-172.6	0	0	109.8	L117 T177	L117-E136 PolarHBondContact O-N 2.75Å; E136-T177 VanDerWaalsContact CG-CB 3.49Å; E136-T177 HydrophobicContact CG-CG2 3.81Å; E136-T177 WeakPolarHBondContact OE1-CB 3.49Å; E136-T177 WeakPolarHBondContact OE1-CG2 3.26Å; E136-T177 PolarHBondContact OE1-OG1 2.84Å
137	L	91.2	Very high	91.4	Very high	38 Å²	38	41.2 Å²	41.2	20%	0.199	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.5	-177.3	-65.3	174.4	0	0	0	110.1	T135 T139 T177 N178 R180	T135-L137 HydrophobicContact CG2-CD2 3.62Å; T135-L137 HydrophobicContact CG2-CG 3.86Å; T135-L137 PolarHBondContact O-N 3.36Å; L137-T139 PolarHBondContact O-N 3.16Å; L137-T177 CarbonylContact O-C 3.5Å; L137-T177 VanDerWaalsContact O-CA 3.28Å; L137-T177 WeakPolarHBondContact O-CA 3.47Å; L137-N178 PolarHBondContact N-O 3.03Å; L137-N178 PolarHBondContact O-N 2.91Å; L137-R180 HydrophobicContact CD1-CB 4Å
138	P	89.4	Confident	90.3	Very high	13 Å²	13	42.2 Å²	42.2	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	140.7	171.9	26.6	-33.9	0	0	0	109.3	Q140 K172 N173 Y174	P138-Q140 WeakPolarHBondContact O-CG 3.41Å; P138-Q140 PolarHBondContact O-N 3.07Å; P138-K172 HydrophobicContact CB-CB 4.27Å; P138-K172 HydrophobicContact CG-CB 4.13Å; P138-K172 HydrophobicContact CG-CD 4.04Å; P138-K172 HydrophobicContact CG-CG 4.25Å; P138-N173 VanDerWaalsContact CB-O 3.3Å; P138-N173 WeakPolarHBondContact CB-O 3.18Å; P138-Y174 HydrophobicContact CB-CD1 3.87Å; P138-Y174 HydrophobicContact CB-CE1 4.13Å; P138-Y174 HydrophobicContact CB-CG 4.36Å; P138-Y174 HydrophobicContact CG-CD1 4.17Å; P138-Y174 HydrophobicContact CG-CE1 3.92Å
139	T	88.1	Confident	88.9	Confident	31 Å²	31	47 Å²	47	19%	0.19	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	137.3	172.8	46.5	0	0	0	0	109.6	L137 N173 N176	L137-T139 PolarHBondContact O-N 3.16Å; T139-N173 PolarHBondContact N-O 3.43Å; T139-N173 PolarHBondContact O-N 3.34Å; T139-N173 WeakPolarHBondContact OG1-CB 3.43Å; T139-N173 PolarHBondContact OG1-O 2.8Å; T139-N176 WeakPolarHBondContact CB-O 3.42Å; T139-N176 HydrophobicContact CG2-CB 3.86Å; T139-N176 VanDerWaalsContact CG2-O 3.29Å; T139-N176 WeakPolarHBondContact CG2-O 3.5Å; T139-N176 PolarHBondContact N-O 3.32Å; T139-N176 PolarHBondContact OG1-O 2.84Å
140	Q	88.3	Confident	87.5	Confident	91 Å²	91	54 Å²	54	43%	0.425	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128	-175	-62.9	-178.1	0.7	0	0	109.1	P138 F142	P138-Q140 WeakPolarHBondContact O-CG 3.41Å; P138-Q140 PolarHBondContact O-N 3.07Å; Q140-F142 HydrophobicContact CB-CE2 3.96Å; Q140-F142 HydrophobicContact CB-CZ 4.22Å
141	S	87.6	Confident	85.8	Confident	60 Å²	60	58.9 Å²	58.9	42%	0.42	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.3	167.3	59.8	0	0	0	0	108.7	L171	S141-L171 PolarHBondContact N-O 3.36Å; S141-L171 PolarHBondContact O-N 3.29Å; S141-L171 PolarHBondContact OG-O 2.9Å
142	F	87.2	Confident	84.2	Confident	103 Å²	103	62.3 Å²	62.3	45%	0.452	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.8	-178.9	-65.1	-90	0	0	0	109.5	Q140 L145 V169 C170	Q140-F142 HydrophobicContact CB-CE2 3.96Å; Q140-F142 HydrophobicContact CB-CZ 4.22Å; F142-L145 HydrophobicContact CB-CD2 4.23Å; F142-V169 WeakPolarHBondContact CA-O 3.43Å; F142-C170 HydrophobicContact CD1-CB 3.99Å; F142-C170 HydrophobicContact CE1-CB 3.73Å
143	T	87.1	Confident	82.4	Confident	59 Å²	59	62.9 Å²	62.9	36%	0.362	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	177.5	174.9	63.1	0	0	0	0	109.5	L145 P168 V169 L171	T143-L145 VanDerWaalsContact C-N 3.28Å; T143-L145 PolarHBondContact O-N 3.29Å; T143-P168 WeakPolarHBondContact O-CA 3.39Å; T143-V169 PolarHBondContact N-O 2.96Å; T143-V169 PolarHBondContact O-N 3.22Å; T143-V169 PolarHBondContact OG1-O 2.91Å; T143-L171 HydrophobicContact CG2-CD1 3.97Å
144	N	87.6	Confident	80.6	Confident	66 Å²	66	73 Å²	73	35%	0.353	40%	0.398	S	S	.	.	S	Bend	trans	60.5	34.4	177.8	-155.8	39.9	0	0	0	113.7	K166 V167 V169	N144-K166 WeakPolarHBondContact O-CB 3.4Å; N144-K166 WeakPolarHBondContact OD1-CD 3.22Å; N144-K166 WeakPolarHBondContact OD1-CG 3.24Å; N144-V167 PolarHBondContact ND2-O 3.08Å; N144-V169 HydrophobicContact CB-CB 4.37Å; N144-V169 HydrophobicContact CB-CG2 3.98Å
145	L	85.3	Confident	78.9	Confident	32 Å²	32	82.3 Å²	82.3	17%	0.168	43%	0.433	C	S	.	.			trans	-76.5	149.8	178.2	-57.1	-177.3	0	0	0	111.2	F142 T143 F147 V149 P168	F142-L145 HydrophobicContact CB-CD2 4.23Å; T143-L145 VanDerWaalsContact C-N 3.28Å; T143-L145 PolarHBondContact O-N 3.29Å; L145-F147 HydrophobicContact CB-CD1 4.49Å; L145-F147 HydrophobicContact CB-CD2 4.43Å; L145-F147 HydrophobicContact CB-CE1 4.34Å; L145-F147 HydrophobicContact CB-CE2 4.3Å; L145-F147 HydrophobicContact CB-CZ 4.25Å; L145-F147 HydrophobicContact CD1-CD2 4.4Å; L145-F147 HydrophobicContact CD1-CE2 3.65Å; L145-F147 HydrophobicContact CD1-CZ 3.82Å; L145-F147 HydrophobicContact CD2-CZ 4.49Å; L145-F147 HydrophobicContact CG-CZ 4.41Å; L145-F147 PolarHBondContact O-N 3.11Å; L145-V149 HydrophobicContact CD1-CG2 3.96Å; L145-V149 HydrophobicContact CG-CG2 4.45Å; L145-P168 HydrophobicContact CD2-CB 3.68Å; L145-P168 HydrophobicContact CD2-CG 3.77Å
146	N	86	Confident	77.3	Confident	42 Å²	42	90.4 Å²	90.4	23%	0.225	47%	0.467	C	S	.	.	S	Bend	trans	-79.5	13.9	173.6	-69.3	-55.6	0	0	0	113.3	V157 I159 K166	N146-V157 VanDerWaalsContact O-CB 3.24Å; N146-V157 WeakPolarHBondContact O-CB 3.23Å; N146-V157 VanDerWaalsContact O-CG2 3.23Å; N146-V157 WeakPolarHBondContact O-CG2 3.44Å; N146-I159 HydrophobicContact CB-CD1 4.25Å; N146-K166 PolarHBondContact ND2-O 2.77Å; N146-K166 WeakPolarHBondContact OD1-CB 3.46Å; N146-K166 PolarHBondContact OD1-N 3.36Å
147	F	79	Confident	76.2	Confident	129 Å²	129	90.1 Å²	90.1	57%	0.566	47%	0.469	S	S	*	.	S	Bend	trans	-144.5	148.9	175.2	48.3	-90.4	0	0	0	108.4	L145 V149	L145-F147 HydrophobicContact CB-CD1 4.49Å; L145-F147 HydrophobicContact CB-CD2 4.43Å; L145-F147 HydrophobicContact CB-CE1 4.34Å; L145-F147 HydrophobicContact CB-CE2 4.3Å; L145-F147 HydrophobicContact CB-CZ 4.25Å; L145-F147 HydrophobicContact CD1-CD2 4.4Å; L145-F147 HydrophobicContact CD1-CE2 3.65Å; L145-F147 HydrophobicContact CD1-CZ 3.82Å; L145-F147 HydrophobicContact CD2-CZ 4.49Å; L145-F147 HydrophobicContact CG-CZ 4.41Å; L145-F147 PolarHBondContact O-N 3.11Å; F147-V149 PolarHBondContact O-N 2.92Å
148	P	70.2	Confident	75.4	Confident	44 Å²	44	92.8 Å²	92.8	29%	0.286	49%	0.487	S	S	.	.			trans	-63.6	135.7	177.9	27.4	-35.3	0	0	0	110.4	C153 R155	P148-C153 HydrophobicContact CB-CB 3.73Å; P148-C153 HydrophobicContact CG-CB 3.81Å; P148-C153 WeakPolarHBondContact CG-O 3.41Å; P148-R155 WeakPolarHBondContact CD-O 3.41Å; P148-R155 WeakPolarHBondContact CG-O 3.5Å
149	V	66.2	Low	74.9	Confident	104 Å²	104	95.9 Å²	95.9	63%	0.63	50%	0.502	S	S	*	.			trans	-84.6	-17.4	-178.2	-157.5	0	0	0	0	111.6	L145 F147 S151	L145-V149 HydrophobicContact CD1-CG2 3.96Å; L145-V149 HydrophobicContact CG-CG2 4.45Å; F147-V149 PolarHBondContact O-N 2.92Å; V149-S151 PolarHBondContact O-N 3.15Å
150	E	68.1	Low	74.7	Confident	149 Å²	149	104.6 Å²	104.6	70%	0.696	53%	0.531	S	S	*	.	S	Bend	trans	-73.4	117.6	178.9	-67.6	172.7	-177.5	0	0	110.6	G152 C153	E150-G152 PolarHBondContact O-N 2.88Å; E150-C153 HydrophobicContact CB-CB 4.24Å; E150-C153 VanDerWaalsContact O-CB 3.25Å; E150-C153 WeakPolarHBondContact O-CB 3.49Å; E150-C153 PolarHBondContact O-N 2.79Å
151	S	62	Low	74.6	Confident	131 Å²	131	103.1 Å²	103.1	92%	0.916	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.2	122.9	174.2	-52.1	0	0	0	0	111.1	V149	V149-S151 PolarHBondContact O-N 3.15Å
152	G	63.8	Low	74.6	Confident	79 Å²	79	107.5 Å²	107.5	81%	0.814	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-7.4	178.7	0	0	0	0	0	115.4	E150 R154	E150-G152 PolarHBondContact O-N 2.88Å; G152-R154 PolarHBondContact O-N 2.89Å
153	C	62	Low	74.6	Confident	34 Å²	34	107.2 Å²	107.2	23%	0.23	56%	0.559	C	S	.	*			trans	-77.2	96	175.5	-159.8	0	0	0	0	110.2	P148 E150 R155	P148-C153 HydrophobicContact CB-CB 3.73Å; P148-C153 HydrophobicContact CG-CB 3.81Å; P148-C153 WeakPolarHBondContact CG-O 3.41Å; E150-C153 HydrophobicContact CB-CB 4.24Å; E150-C153 VanDerWaalsContact O-CB 3.25Å; E150-C153 WeakPolarHBondContact O-CB 3.49Å; E150-C153 PolarHBondContact O-N 2.79Å; C153-R155 PolarHBondContact O-N 2.92Å; C153-R155 VanDerWaalsContact O-N 3.16Å
154	R	59.1	Low	74.4	Confident	246 Å²	246	107 Å²	107	93%	0.928	56%	0.556	S	S	*	*			trans	-76.2	16.1	170.8	-71.6	-172.8	175.7	-174.9	-0.2	113.4	G152 K156	G152-R154 PolarHBondContact O-N 2.89Å; R154-K156 PolarHBondContact O-N 2.99Å
155	R	62.3	Low	74.5	Confident	194 Å²	194	108.1 Å²	108.1	73%	0.732	56%	0.561	S	S	*	*			trans	-68	101.9	178.4	-73.9	-173.7	-179.2	131.5	-1.3	108.7	P148 C153 V157	P148-R155 WeakPolarHBondContact CD-O 3.41Å; P148-R155 WeakPolarHBondContact CG-O 3.5Å; C153-R155 PolarHBondContact O-N 2.92Å; C153-R155 VanDerWaalsContact O-N 3.16Å; R155-V157 PolarHBondContact O-N 3.4Å; R155-V157 VanDerWaalsContact O-N 3.13Å
156	K	62.2	Low	74.5	Confident	190 Å²	190	111.4 Å²	111.4	83%	0.826	57%	0.574	S	S	*	*			trans	-59	115.1	170.5	-153.1	175.5	-173.2	-179.7	0	107	R154 V158	R154-K156 PolarHBondContact O-N 2.99Å; K156-V158 PolarHBondContact O-N 2.8Å
157	V	67.2	Low	74.7	Confident	58 Å²	58	114.7 Å²	114.7	35%	0.352	60%	0.596	S	S	.	*			trans	-62	114.7	168.5	177.4	0	0	0	0	105.7	N146 R155 I159	N146-V157 VanDerWaalsContact O-CB 3.24Å; N146-V157 WeakPolarHBondContact O-CB 3.23Å; N146-V157 VanDerWaalsContact O-CG2 3.23Å; N146-V157 WeakPolarHBondContact O-CG2 3.44Å; R155-V157 PolarHBondContact O-N 3.4Å; R155-V157 VanDerWaalsContact O-N 3.13Å; V157-I159 HydrophobicContact CG1-CG1 4.26Å; V157-I159 PolarHBondContact O-N 2.97Å
158	V	75	Confident	75.3	Confident	93 Å²	93	111.9 Å²	111.9	56%	0.564	59%	0.59	S	S	*	*			trans	-80.2	93.3	-178	-173.1	0	0	0	0	107.4	K156 R160	K156-V158 PolarHBondContact O-N 2.8Å; V158-R160 HydrophobicContact CG1-CG 3.65Å; V158-R160 PolarHBondContact O-N 2.87Å
159	I	79.6	Confident	76.3	Confident	78 Å²	78	113 Å²	113	40%	0.4	60%	0.596	S	S	.	*			trans	-78.5	107.1	170.1	-57.3	172.2	0	0	0	106.7	N146 V157 D164 I165	N146-I159 HydrophobicContact CB-CD1 4.25Å; V157-I159 HydrophobicContact CG1-CG1 4.26Å; V157-I159 PolarHBondContact O-N 2.97Å; I159-D164 HydrophobicContact CB-CB 4.4Å; I159-D164 HydrophobicContact CG2-CB 4.07Å; I159-I165 HydrophobicContact CD1-CG1 4.42Å; I159-I165 HydrophobicContact CG2-CD1 4.39Å; I159-I165 HydrophobicContact CG2-CG1 3.61Å
160	R	83.9	Confident	77.4	Confident	215 Å²	215	110.5 Å²	110.5	81%	0.811	58%	0.583	S	S	*	*			trans	-100.8	-25.1	179.4	-57.9	-173	-175.6	-155.9	0.4	112.2	V158 D164	V158-R160 HydrophobicContact CG1-CG 3.65Å; V158-R160 PolarHBondContact O-N 2.87Å; R160-D164 WeakPolarHBondContact CA-OD2 3.36Å; R160-D164 WeakPolarHBondContact CB-OD2 3.37Å; R160-D164 PolarHBondContact N-OD2 2.86Å
161	S	86.3	Confident	78.5	Confident	60 Å²	60	107.8 Å²	107.8	42%	0.42	57%	0.572	S	S	.	*	S	Bend	trans	-138.6	159.7	-178.1	169.6	0	0	0	0	110.3	S163 D164	S161-S163 VanDerWaalsContact CB-OG 3.29Å; S161-S163 WeakPolarHBondContact CB-OG 3.19Å; S161-S163 PolarHBondContact O-N 2.73Å; S161-S163 VanDerWaalsContact O-N 3.14Å; S161-S163 PolarHBondContact OG-N 2.85Å; S161-S163 PolarHBondContact OG-OG 2.95Å; S161-D164 PolarHBondContact N-OD2 2.89Å; S161-D164 WeakPolarHBondContact O-CB 3.35Å; S161-D164 PolarHBondContact O-N 2.85Å
162	L	86.2	Confident	79.7	Confident	151 Å²	151	106.9 Å²	106.9	79%	0.791	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-55.8	-26.4	170.4	-68.6	171	0	0	0	112.2	D164 I165	L162-D164 PolarHBondContact O-N 2.82Å; L162-I165 HydrophobicContact CD2-CD1 4.01Å; L162-I165 PolarHBondContact O-N 2.84Å
163	S	86.8	Confident	80.8	Confident	97 Å²	97	107.2 Å²	107.2	68%	0.678	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.8	174.6	56	0	0	0	0	114.3	S161	S161-S163 VanDerWaalsContact CB-OG 3.29Å; S161-S163 WeakPolarHBondContact CB-OG 3.19Å; S161-S163 PolarHBondContact O-N 2.73Å; S161-S163 VanDerWaalsContact O-N 3.14Å; S161-S163 PolarHBondContact OG-N 2.85Å; S161-S163 PolarHBondContact OG-OG 2.95Å
164	D	84.6	Confident	81.7	Confident	56 Å²	56	113.7 Å²	113.7	30%	0.299	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-88.1	-12.4	-178.4	-55.2	-27.5	0	0	0	112.2	I159 R160 S161 L162 K166	I159-D164 HydrophobicContact CB-CB 4.4Å; I159-D164 HydrophobicContact CG2-CB 4.07Å; R160-D164 WeakPolarHBondContact CA-OD2 3.36Å; R160-D164 WeakPolarHBondContact CB-OD2 3.37Å; R160-D164 PolarHBondContact N-OD2 2.86Å; S161-D164 PolarHBondContact N-OD2 2.89Å; S161-D164 WeakPolarHBondContact O-CB 3.35Å; S161-D164 PolarHBondContact O-N 2.85Å; L162-D164 PolarHBondContact O-N 2.82Å; D164-K166 PolarHBondContact O-N 2.82Å
165	I	88.6	Confident	82.7	Confident	88 Å²	88	104.6 Å²	104.6	45%	0.451	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-74.4	116.5	178.4	-58.4	177.4	0	0	0	108.5	I159 L162	I159-I165 HydrophobicContact CD1-CG1 4.42Å; I159-I165 HydrophobicContact CG2-CD1 4.39Å; I159-I165 HydrophobicContact CG2-CG1 3.61Å; L162-I165 HydrophobicContact CD2-CD1 4.01Å; L162-I165 PolarHBondContact O-N 2.84Å
166	K	86.1	Confident	83.5	Confident	102 Å²	102	98.8 Å²	98.8	44%	0.443	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-92.8	142.6	175.8	-67.1	167.9	169.4	-166.7	0	110.6	N144 N146 D164	N144-K166 WeakPolarHBondContact O-CB 3.4Å; N144-K166 WeakPolarHBondContact OD1-CD 3.22Å; N144-K166 WeakPolarHBondContact OD1-CG 3.24Å; N146-K166 PolarHBondContact ND2-O 2.77Å; N146-K166 WeakPolarHBondContact OD1-CB 3.46Å; N146-K166 PolarHBondContact OD1-N 3.36Å; D164-K166 PolarHBondContact O-N 2.82Å
167	V	89.8	Confident	84.7	Confident	111 Å²	111	92.5 Å²	92.5	67%	0.673	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-93.1	129.1	168	-178.7	0	0	0	0	107.9	N144 V169	N144-V167 PolarHBondContact ND2-O 3.08Å; V167-V169 PolarHBondContact O-N 2.84Å
168	P	91	Very high	85.8	Confident	70 Å²	70	94.7 Å²	94.7	46%	0.455	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-52.9	130.6	175.7	-27.8	35.7	0	0	0	111.7	T143 L145	T143-P168 WeakPolarHBondContact O-CA 3.39Å; L145-P168 HydrophobicContact CD2-CB 3.68Å; L145-P168 HydrophobicContact CD2-CG 3.77Å
169	V	91.4	Very high	86.6	Confident	68 Å²	68	92.2 Å²	92.2	41%	0.412	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.5	174.1	178	0	0	0	0	108	F142 T143 N144 V167	F142-V169 WeakPolarHBondContact CA-O 3.43Å; T143-V169 PolarHBondContact N-O 2.96Å; T143-V169 PolarHBondContact O-N 3.22Å; T143-V169 PolarHBondContact OG1-O 2.91Å; N144-V169 HydrophobicContact CB-CB 4.37Å; N144-V169 HydrophobicContact CB-CG2 3.98Å; V167-V169 PolarHBondContact O-N 2.84Å
170	C	89.9	Confident	87.3	Confident	51 Å²	51	95.5 Å²	95.5	35%	0.345	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.2	176.9	-177.2	0	0	0	0	109.6	F142	F142-C170 HydrophobicContact CD1-CB 3.99Å; F142-C170 HydrophobicContact CE1-CB 3.73Å
171	L	90.1	Very high	87.9	Confident	91 Å²	91	87.2 Å²	87.2	48%	0.476	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119	169.9	-63.1	172.1	0	0	0	108.1	S141 T143	S141-L171 PolarHBondContact N-O 3.36Å; S141-L171 PolarHBondContact O-N 3.29Å; S141-L171 PolarHBondContact OG-O 2.9Å; T143-L171 HydrophobicContact CG2-CD1 3.97Å
172	K	88.5	Confident	88.4	Confident	113 Å²	113	89.2 Å²	89.2	49%	0.491	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.3	176.6	-65	179.7	179.9	-179	0	109.2	P138 Y174	P138-K172 HydrophobicContact CB-CB 4.27Å; P138-K172 HydrophobicContact CG-CB 4.13Å; P138-K172 HydrophobicContact CG-CD 4.04Å; P138-K172 HydrophobicContact CG-CG 4.25Å; K172-Y174 HydrophobicContact CB-CE2 4.02Å
173	N	85.6	Confident	89	Confident	85 Å²	85	84.5 Å²	84.5	46%	0.455	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.8	171.1	-179.1	8.2	0	0	0	108.6	P138 T139 G175 N176	P138-N173 VanDerWaalsContact CB-O 3.3Å; P138-N173 WeakPolarHBondContact CB-O 3.18Å; T139-N173 PolarHBondContact N-O 3.43Å; T139-N173 PolarHBondContact O-N 3.34Å; T139-N173 WeakPolarHBondContact OG1-CB 3.43Å; T139-N173 PolarHBondContact OG1-O 2.8Å; N173-G175 VanDerWaalsContact C-N 3.31Å; N173-G175 PolarHBondContact OD1-N 2.86Å; N173-N176 VanDerWaalsContact O-O 3.07Å
174	Y	82.8	Confident	89.4	Confident	171 Å²	171	84.1 Å²	84.1	67%	0.671	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	-6.1	-179.5	-66.3	-83.1	0	0	0	113.3	P138 K172	P138-Y174 HydrophobicContact CB-CD1 3.87Å; P138-Y174 HydrophobicContact CB-CE1 4.13Å; P138-Y174 HydrophobicContact CB-CG 4.36Å; P138-Y174 HydrophobicContact CG-CD1 4.17Å; P138-Y174 HydrophobicContact CG-CE1 3.92Å; K172-Y174 HydrophobicContact CB-CE2 4.02Å
175	G	78.8	Confident	90	Very high	54 Å²	54	84.8 Å²	84.8	56%	0.557	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	-26.8	176	0	0	0	0	0	113.5	N173	N173-G175 VanDerWaalsContact C-N 3.31Å; N173-G175 PolarHBondContact OD1-N 2.86Å
176	N	80.2	Confident	90.4	Very high	72 Å²	72	83.5 Å²	83.5	39%	0.385	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.6	175.8	-68.6	25.5	0	0	0	108.9	T139 N173	T139-N176 WeakPolarHBondContact CB-O 3.42Å; T139-N176 HydrophobicContact CG2-CB 3.86Å; T139-N176 VanDerWaalsContact CG2-O 3.29Å; T139-N176 WeakPolarHBondContact CG2-O 3.5Å; T139-N176 PolarHBondContact N-O 3.32Å; T139-N176 PolarHBondContact OG1-O 2.84Å; N173-N176 VanDerWaalsContact O-O 3.07Å
177	T	86.3	Confident	90.9	Very high	59 Å²	59	78.7 Å²	78.7	36%	0.362	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	147.6	174.9	59.2	0	0	0	0	110.5	E136 L137	E136-T177 VanDerWaalsContact CG-CB 3.49Å; E136-T177 HydrophobicContact CG-CG2 3.81Å; E136-T177 WeakPolarHBondContact OE1-CB 3.49Å; E136-T177 WeakPolarHBondContact OE1-CG2 3.26Å; E136-T177 PolarHBondContact OE1-OG1 2.84Å; L137-T177 CarbonylContact O-C 3.5Å; L137-T177 VanDerWaalsContact O-CA 3.28Å; L137-T177 WeakPolarHBondContact O-CA 3.47Å
178	N	89.8	Confident	91	Very high	103 Å²	103	75 Å²	75	55%	0.551	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	137	168.8	-74.3	-33.4	0	0	0	107.9	L137	L137-N178 PolarHBondContact N-O 3.03Å; L137-N178 PolarHBondContact O-N 2.91Å
179	I	92.8	Very high	90.8	Very high	42 Å²	42	83.6 Å²	83.6	22%	0.215	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.7	177.4	-59.9	157.5	0	0	0	108	Y84 Q85 L134	Y84-I179 HydrophobicContact CD1-CD1 3.82Å; Y84-I179 HydrophobicContact CD1-CG2 4.4Å; Y84-I179 HydrophobicContact CD2-CD1 3.49Å; Y84-I179 VanDerWaalsContact CD2-CD1 3.49Å; Y84-I179 HydrophobicContact CD2-CG1 4.44Å; Y84-I179 HydrophobicContact CE1-CD1 3.77Å; Y84-I179 HydrophobicContact CE1-CG1 4.09Å; Y84-I179 HydrophobicContact CE1-CG2 3.7Å; Y84-I179 HydrophobicContact CE2-CD1 3.43Å; Y84-I179 VanDerWaalsContact CE2-CD1 3.43Å; Y84-I179 HydrophobicContact CE2-CG1 3.89Å; Y84-I179 HydrophobicContact CG-CD1 3.69Å; Y84-I179 WeakPolarHBondContact O-CD1 3.43Å; Q85-I179 HydrophobicContact CB-CD1 4.38Å; Q85-I179 HydrophobicContact CB-CG2 4.03Å; Q85-I179 HydrophobicContact CG-CG2 4.05Å; L134-I179 HydrophobicContact CB-CG2 4.43Å
180	R	94.5	Very high	90.8	Very high	147 Å²	147	81.1 Å²	81.1	56%	0.555	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	121	173.8	-174.5	-176.8	-55.3	-176.2	1.7	109.2	L134 T135 L137	L134-R180 WeakPolarHBondContact CA-O 3.21Å; T135-R180 PolarHBondContact N-O 3.43Å; T135-R180 PolarHBondContact O-N 2.89Å; L137-R180 HydrophobicContact CD1-CB 4Å
181	V	96.8	Very high	90.9	Very high	41 Å²	41	79.2 Å²	79.2	25%	0.248	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.7	172.4	-171.6	0	0	0	0	109.5	Q85 F87 W132 Q133 L134	Q85-V181 HydrophobicContact CG-CG2 3.32Å; F87-V181 HydrophobicContact CB-CG1 4.15Å; F87-V181 HydrophobicContact CD1-CG1 3.85Å; F87-V181 HydrophobicContact CD1-CG2 4.13Å; F87-V181 HydrophobicContact CD2-CG1 4Å; F87-V181 HydrophobicContact CE1-CG1 4.22Å; F87-V181 HydrophobicContact CE2-CG1 4.36Å; F87-V181 HydrophobicContact CG-CG1 3.73Å; F87-V181 HydrophobicContact CZ-CG1 4.45Å; W132-V181 HydrophobicContact CE3-CG1 3.71Å; W132-V181 HydrophobicContact CZ3-CG1 4.03Å; Q133-V181 CarbonylContact O-C 3.53Å; Q133-V181 WeakPolarHBondContact O-CA 3.48Å; L134-V181 HydrophobicContact CG-CG2 4.31Å
182	Q	96.7	Very high	90.9	Very high	101 Å²	101	75.9 Å²	75.9	47%	0.472	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.1	175.6	-178.3	174.8	-1.6	0	0	110.6	W132 Q133 K184	W132-Q182 WeakPolarHBondContact CA-O 3.31Å; Q133-Q182 PolarHBondContact N-O 3.01Å; Q133-Q182 PolarHBondContact O-N 2.85Å; Q182-K184 PolarHBondContact O-N 2.88Å
183	N	97.1	Very high	91	Very high	52 Å²	52	74.8 Å²	74.8	28%	0.278	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	107.8	162.7	-170.9	-90.7	0	0	0	108.5	K130 W132 V186	K130-N183 WeakPolarHBondContact CB-ND2 3.4Å; W132-N183 HydrophobicContact CD2-CB 4.46Å; W132-N183 HydrophobicContact CE3-CB 3.92Å; W132-N183 HydrophobicContact CH2-CB 3.73Å; W132-N183 HydrophobicContact CZ2-CB 4.22Å; W132-N183 WeakPolarHBondContact CZ2-ND2 3.37Å; W132-N183 HydrophobicContact CZ3-CB 3.57Å; N183-V186 WeakPolarHBondContact OD1-CG2 3.42Å
184	K	96.1	Very high	91.4	Very high	90 Å²	90	72.7 Å²	72.7	39%	0.391	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-43.3	-177.1	-74.8	-166.2	73.2	176.6	0	112.6	F120 L131 Q133 Q182	F120-K184 HydrophobicContact CD1-CD 4.22Å; F120-K184 HydrophobicContact CE1-CD 3.72Å; L131-K184 HydrophobicContact CD2-CB 4.21Å; L131-K184 HydrophobicContact CG-CB 4.19Å; L131-K184 PolarHBondContact O-N 3.15Å; Q133-K184 HydrophobicContact CB-CD 3.71Å; Q133-K184 HydrophobicContact CB-CG 3.77Å; Q133-K184 HydrophobicContact CG-CD 4.4Å; Q182-K184 PolarHBondContact O-N 2.88Å
185	K	97.3	Very high	92.1	Very high	69 Å²	69	64.9 Å²	64.9	30%	0.3	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.4	-172.1	-62.1	-70	178.7	156.3	0	110.1	K130 L131 F187 E221 T223	K130-K185 WeakPolarHBondContact CA-O 3.43Å; L131-K185 HydrophobicContact CB-CB 4.06Å; L131-K185 HydrophobicContact CD2-CB 4.41Å; L131-K185 HydrophobicContact CD2-CG 4.27Å; L131-K185 PolarHBondContact N-O 3.48Å; K185-F187 HydrophobicContact CB-CE2 3.88Å; K185-F187 HydrophobicContact CB-CZ 3.8Å; K185-F187 HydrophobicContact CG-CZ 4.43Å; K185-E221 PolarHBondContact NZ-O 3.04Å; K185-T223 HydrophobicContact CB-CG2 3.76Å; K185-T223 HydrophobicContact CD-CG2 3.69Å; K185-T223 HydrophobicContact CG-CG2 4.17Å
186	V	97.1	Very high	92.9	Very high	61 Å²	61	64.4 Å²	64.4	37%	0.37	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.7	174.7	-175.1	0	0	0	0	107.7	T128 K130 N183 A188 T223	T128-V186 HydrophobicContact CG2-CG1 3.58Å; K130-V186 HydrophobicContact CG-CG1 4.3Å; K130-V186 HydrophobicContact CG-CG2 4.28Å; N183-V186 WeakPolarHBondContact OD1-CG2 3.42Å; V186-A188 HydrophobicContact CG1-CB 4.32Å; V186-T223 WeakPolarHBondContact O-CB 3.3Å; V186-T223 WeakPolarHBondContact O-CG2 3.16Å
187	F	96.6	Very high	93.7	Very high	1 Å²	1	61.1 Å²	61.1	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	102.8	175.7	-47.1	-90.4	0	0	0	107.5	L122 I129 L131 K185 F207 W218 N219 V222 T223	L122-F187 HydrophobicContact CD2-CE2 4.25Å; I129-F187 HydrophobicContact CB-CB 4.19Å; I129-F187 HydrophobicContact CB-CD2 4.31Å; I129-F187 HydrophobicContact CG2-CD2 4.2Å; I129-F187 PolarHBondContact N-O 3.09Å; I129-F187 PolarHBondContact O-N 2.94Å; L131-F187 HydrophobicContact CB-CE2 4.05Å; K185-F187 HydrophobicContact CB-CE2 3.88Å; K185-F187 HydrophobicContact CB-CZ 3.8Å; K185-F187 HydrophobicContact CG-CZ 4.43Å; F187-F207 HydrophobicContact CB-CZ 4.48Å; F187-F207 HydrophobicContact CD1-CE1 4.28Å; F187-F207 HydrophobicContact CD1-CZ 4.01Å; F187-F207 HydrophobicContact CD2-CE1 4.17Å; F187-F207 AromaticContact CD2-CZ 3.69Å; F187-F207 HydrophobicContact CD2-CZ 3.69Å; F187-F207 AromaticContact CE1-CE1 3.91Å; F187-F207 HydrophobicContact CE1-CE1 3.91Å; F187-F207 HydrophobicContact CE1-CZ 4.11Å; F187-F207 AromaticContact CE2-CE1 3.78Å; F187-F207 HydrophobicContact CE2-CE1 3.78Å; F187-F207 AromaticContact CE2-CZ 3.79Å; F187-F207 HydrophobicContact CE2-CZ 3.79Å; F187-F207 HydrophobicContact CG-CE1 4.41Å; F187-F207 AromaticContact CG-CZ 3.81Å; F187-F207 HydrophobicContact CG-CZ 3.81Å; F187-F207 AromaticContact CZ-CE1 3.65Å; F187-F207 HydrophobicContact CZ-CE1 3.65Å; F187-F207 HydrophobicContact CZ-CZ 4.01Å; F187-W218 HydrophobicContact CB-CD2 4.33Å; F187-W218 HydrophobicContact CB-CE3 3.97Å; F187-W218 HydrophobicContact CB-CH2 3.83Å; F187-W218 HydrophobicContact CB-CZ2 4.23Å; F187-W218 HydrophobicContact CB-CZ3 3.72Å; F187-W218 HydrophobicContact CD1-CD2 4.19Å; F187-W218 AromaticContact CD1-CE3 3.58Å; F187-W218 HydrophobicContact CD1-CE3 3.58Å; F187-W218 AromaticContact CD1-CZ3 3.99Å; F187-W218 HydrophobicContact CD1-CZ3 3.99Å; F187-W218 HydrophobicContact CG-CE3 4.16Å; F187-W218 HydrophobicContact CG-CZ3 4.34Å; F187-N219 WeakPolarHBondContact CE1-O 3.43Å; F187-V222 WeakPolarHBondContact CE1-O 3.32Å; F187-T223 HydrophobicContact CD1-CG2 3.8Å; F187-T223 HydrophobicContact CE1-CG2 3.69Å; F187-T223 HydrophobicContact CG-CG2 4.44Å; F187-T223 HydrophobicContact CZ-CG2 4.27Å
188	A	92.4	Very high	94.3	Very high	35 Å²	35	58.3 Å²	58.3	29%	0.289	29%	0.288	S	S	.	.			trans	-127	165.7	-173.6	0	0	0	0	0	110.7	T128 V186 A190	T128-A188 HydrophobicContact CG2-CB 4.07Å; V186-A188 HydrophobicContact CG1-CB 4.32Å; A188-A190 VanDerWaalsContact C-N 3.26Å; A188-A190 PolarHBondContact O-N 2.77Å
189	R	85.6	Confident	94.6	Very high	249 Å²	249	54 Å²	54	94%	0.94	27%	0.265	S	S	*	.	S	Bend	trans	63.4	18.1	168.5	-53.7	178.4	178.7	166.5	-0.7	116.4
190	A	91.8	Very high	94.9	Very high	16 Å²	16	52.9 Å²	52.9	13%	0.132	26%	0.261	C	S	.	.			trans	-96.1	-19.4	173.9	0	0	0	0	0	114.3	A188 N216 W218 V226	A188-A190 VanDerWaalsContact C-N 3.26Å; A188-A190 PolarHBondContact O-N 2.77Å; A190-N216 PolarHBondContact O-ND2 3.1Å; A190-W218 HydrophobicContact CB-CH2 3.22Å; A190-W218 HydrophobicContact CB-CZ2 3.27Å; A190-W218 HydrophobicContact CB-CZ3 4.36Å; A190-V226 HydrophobicContact CB-CG1 3.94Å
191	H	92.8	Very high	94.9	Very high	11 Å²	11	46 Å²	46	5%	0.051	24%	0.235	C	C	.	.			trans	-104.6	131.4	-178.4	-76	-68.7	0	0	0	112.4	R127 I195 S209 D211 N216	R127-H191 PolarHBondContact NH1-O 3.08Å; H191-I195 HydrophobicContact CB-CG1 4.21Å; H191-S209 WeakPolarHBondContact NE2-CB 3.34Å; H191-S209 PolarHBondContact NE2-OG 2.78Å; H191-D211 HydrophobicContact CB-CB 4.26Å; H191-D211 WeakPolarHBondContact CB-OD2 3.46Å; H191-D211 PolarHBondContact CE1-N 2.87Å; H191-D211 IonicContact CG-OD2 2.66Å; H191-D211 VanDerWaalsContact ND1-CB 3.35Å; H191-D211 WeakPolarHBondContact ND1-CB 3.5Å; H191-D211 VanDerWaalsContact ND1-CG 3.26Å; H191-D211 IonicContact ND1-OD2 2.78Å; H191-D211 PolarHBondContact ND1-OD2 3.28Å; H191-N216 PolarHBondContact CE1-ND2 3.31Å; H191-N216 PolarHBondContact NE2-ND2 2.8Å
192	G	89.3	Confident	94.8	Very high	21 Å²	21	45.5 Å²	45.5	22%	0.216	24%	0.236	C	C	.	.	S	Bend	trans	-80.7	-21.9	178.8	0	0	0	0	0	112.8	R127 D211	R127-G192 VanDerWaalsContact CZ-O 3.24Å; R127-G192 PolarHBondContact NH1-O 3.31Å; R127-G192 PolarHBondContact NH2-O 3.43Å; G192-D211 PolarHBondContact N-OD2 3.2Å
193	F	91.8	Very high	94.7	Very high	91 Å²	91	43.7 Å²	43.7	40%	0.399	23%	0.229	S	C	.	.	S	Bend	trans	-131.5	-179.5	-177.4	-62.6	-85.1	0	0	0	110.5	D211 P212 L213 L234	F193-D211 HydrophobicContact CB-CB 4.08Å; F193-P212 HydrophobicContact CB-CG 4.37Å; F193-L213 HydrophobicContact CD2-CD1 4.06Å; F193-L213 HydrophobicContact CD2-CG 4.31Å; F193-L213 HydrophobicContact CE2-CD1 3.4Å; F193-L213 VanDerWaalsContact CE2-CD1 3.4Å; F193-L213 HydrophobicContact CE2-CG 4.12Å; F193-L213 HydrophobicContact CZ-CD1 4.01Å; F193-L234 HydrophobicContact CE2-CD1 4.46Å; F193-L234 HydrophobicContact CZ-CD1 4.01Å
194	S	94.1	Very high	94.5	Very high	41 Å²	41	49.8 Å²	49.8	29%	0.287	25%	0.248	S	C	.	.			trans	-65.7	134.8	178.7	-56.3	0	0	0	0	111.3	E126 V196	E126-S194 CarbonylContact O-C 3.53Å; E126-S194 VanDerWaalsContact O-CA 3.26Å; E126-S194 WeakPolarHBondContact O-CA 3.5Å; S194-V196 PolarHBondContact O-N 2.84Å
195	I	96.9	Very high	94.5	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.031	26%	0.258	C	S	.	.			trans	-66.3	118.5	176.3	-63.4	161.6	0	0	0	108.9	L108 E126 I129 H191 G197 A210	L108-I195 HydrophobicContact CD1-CG2 4.02Å; E126-I195 WeakPolarHBondContact O-CG1 3.43Å; E126-I195 PolarHBondContact O-N 3.05Å; I129-I195 HydrophobicContact CD1-CD1 4.01Å; I129-I195 HydrophobicContact CG1-CD1 3.68Å; H191-I195 HydrophobicContact CB-CG1 4.21Å; I195-G197 WeakPolarHBondContact CG2-O 3.36Å; I195-A210 CarbonylContact C-O 3.55Å; I195-A210 WeakPolarHBondContact CA-O 3.04Å
196	V	96.4	Very high	94.5	Very high	44 Å²	44	49.1 Å²	49.1	27%	0.267	25%	0.249	S	C	.	.			trans	-99.8	-19.6	179.4	-60.5	0	0	0	0	112.5	S194 A210 P212 I244	S194-V196 PolarHBondContact O-N 2.84Å; V196-A210 HydrophobicContact CG2-CB 4.15Å; V196-A210 WeakPolarHBondContact CG2-O 3.48Å; V196-A210 PolarHBondContact N-O 3.13Å; V196-P212 HydrophobicContact CG1-CG 4.18Å; V196-I244 HydrophobicContact CG2-CG2 4.31Å
197	G	96.7	Very high	94.5	Very high	4 Å²	4	46.2 Å²	46.2	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	141.9	-174.3	0	0	0	0	0	113.2	I195 S209 A210	I195-G197 WeakPolarHBondContact CG2-O 3.36Å; G197-S209 CarbonylContact O-C 3.59Å; G197-S209 VanDerWaalsContact O-CA 3.27Å; G197-S209 WeakPolarHBondContact O-CA 3.22Å; G197-A210 PolarHBondContact N-O 2.99Å; G197-A210 PolarHBondContact O-N 2.81Å
198	L	97.6	Very high	94.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	124.3	175.7	-174.6	66.8	0	0	0	108	L108 R110 L122 I129 F207 F208	L108-L198 HydrophobicContact CB-CB 4.2Å; L108-L198 HydrophobicContact CB-CD2 4.32Å; L108-L198 HydrophobicContact CD1-CB 3.64Å; R110-L198 HydrophobicContact CB-CD2 4.32Å; R110-L198 HydrophobicContact CB-CG 4.48Å; R110-L198 HydrophobicContact CG-CB 4.2Å; R110-L198 HydrophobicContact CG-CD2 4.09Å; R110-L198 HydrophobicContact CG-CG 4.02Å; R110-L198 VanDerWaalsContact CG-O 3.31Å; R110-L198 WeakPolarHBondContact CG-O 3.19Å; R110-L198 PolarHBondContact NE-O 2.77Å; L122-L198 HydrophobicContact CB-CD2 3.81Å; L122-L198 HydrophobicContact CD1-CD1 4.42Å; I129-L198 HydrophobicContact CD1-CD1 3.91Å; I129-L198 HydrophobicContact CG1-CD1 4.43Å; I129-L198 HydrophobicContact CG2-CD1 4.18Å; I129-L198 HydrophobicContact CG2-CD2 4.37Å; L198-F207 HydrophobicContact CD1-CD2 3.67Å; L198-F207 HydrophobicContact CD1-CE2 3.89Å; L198-F208 WeakPolarHBondContact CA-O 3.43Å
199	S	97.6	Very high	94.8	Very high	12 Å²	12	44.6 Å²	44.6	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	116.5	-177.8	-158	0	0	0	0	111.9	F207 F208 C249	S199-F207 WeakPolarHBondContact O-CA 3.37Å; S199-F208 PolarHBondContact N-O 2.93Å; S199-F208 PolarHBondContact O-N 3.39Å; S199-C249 PolarHBondContact OG-N 3.11Å
200	P	97.1	Very high	95.4	Very high	18 Å²	18	32.8 Å²	32.8	12%	0.117	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.7	171.3	-20.7	33.3	0	0	0	112.1	R110 L112 L122	R110-P200 HydrophobicContact CB-CG 3.87Å; L112-P200 HydrophobicContact CD2-CB 3.61Å; L112-P200 HydrophobicContact CD2-CG 3.7Å; L122-P200 HydrophobicContact CD1-CG 4.41Å
201	S	96.1	Very high	95.5	Very high	3 Å²	3	32 Å²	32	2%	0.021	17%	0.167	C	C	.	.			trans	-74.2	157.3	173.3	-178.7	0	0	0	0	111.4	D203 T206 P254	S201-D203 WeakPolarHBondContact CB-OD1 3.12Å; S201-D203 PolarHBondContact O-N 3.46Å; S201-D203 VanDerWaalsContact OG-CG 3.3Å; S201-D203 PolarHBondContact OG-N 3.1Å; S201-D203 PolarHBondContact OG-OD1 3.31Å; S201-D203 PolarHBondContact OG-OD2 3.17Å; S201-T206 WeakPolarHBondContact CB-O 3.38Å; S201-T206 WeakPolarHBondContact CB-OG1 3.45Å; S201-T206 PolarHBondContact N-O 3.35Å; S201-P254 PolarHBondContact OG-O 3.12Å
202	A	94.4	Very high	95.7	Very high	31 Å²	31	33 Å²	33	26%	0.256	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.1	174.6	0	0	0	0	0	113.1	R204 P254	A202-R204 PolarHBondContact O-N 3.21Å; A202-P254 HydrophobicContact CB-CB 4.17Å
203	D	94.7	Very high	95.9	Very high	63 Å²	63	32.5 Å²	32.5	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-15.7	179.5	63.9	20.3	0	0	0	114.2	S201 E205 T206 P254	S201-D203 WeakPolarHBondContact CB-OD1 3.12Å; S201-D203 PolarHBondContact O-N 3.46Å; S201-D203 VanDerWaalsContact OG-CG 3.3Å; S201-D203 PolarHBondContact OG-N 3.1Å; S201-D203 PolarHBondContact OG-OD1 3.31Å; S201-D203 PolarHBondContact OG-OD2 3.17Å; D203-E205 PolarHBondContact O-N 3.38Å; D203-E205 PolarHBondContact OD1-N 3.48Å; D203-T206 PolarHBondContact OD1-N 3.48Å; D203-T206 PolarHBondContact OD1-OG1 3.09Å; D203-T206 PolarHBondContact OD2-OG1 2.98Å; D203-P254 HydrophobicContact CB-CB 3.88Å
204	R	93.4	Very high	96	Very high	179 Å²	179	32.6 Å²	32.6	68%	0.675	16%	0.164	S	C	*	.	S	Bend	trans	64.7	13.5	-177.6	-44.5	-178.3	179.4	-172.9	-2.2	115.2	P113 A202 L220	P113-R204 HydrophobicContact CG-CG 4.15Å; A202-R204 PolarHBondContact O-N 3.21Å; R204-L220 WeakPolarHBondContact O-CD1 3.5Å
205	E	95.3	Very high	96.1	Very high	127 Å²	127	30.7 Å²	30.7	59%	0.593	15%	0.151	S	C	*	.	S	Bend	trans	-117.7	-31	177.5	-66.9	-172.3	172.1	0	0	111.5	D203 L220	D203-E205 PolarHBondContact O-N 3.38Å; D203-E205 PolarHBondContact OD1-N 3.48Å; E205-L220 WeakPolarHBondContact O-CG 3.49Å; E205-L220 PolarHBondContact O-N 2.9Å
206	T	96.6	Very high	96	Very high	18 Å²	18	30.6 Å²	30.6	11%	0.11	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	158.9	-176.1	70.3	0	0	0	0	113.1	S201 D203 W218	S201-T206 WeakPolarHBondContact CB-O 3.38Å; S201-T206 WeakPolarHBondContact CB-OG1 3.45Å; S201-T206 PolarHBondContact N-O 3.35Å; D203-T206 PolarHBondContact OD1-N 3.48Å; D203-T206 PolarHBondContact OD1-OG1 3.09Å; D203-T206 PolarHBondContact OD2-OG1 2.98Å; T206-W218 CarbonylContact C-O 3.55Å; T206-W218 WeakPolarHBondContact CA-O 3.24Å; T206-W218 VanDerWaalsContact CB-O 3.23Å; T206-W218 WeakPolarHBondContact CB-O 3.18Å
207	F	97.4	Very high	96	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.2	167.7	70.5	-86.4	0	0	0	109.7	L122 I129 F187 L198 S199 W218 L220	L122-F207 HydrophobicContact CD1-CB 4.02Å; L122-F207 HydrophobicContact CD1-CD1 4.04Å; L122-F207 HydrophobicContact CD1-CD2 3.93Å; L122-F207 HydrophobicContact CD1-CE1 4.5Å; L122-F207 HydrophobicContact CD1-CE2 4.41Å; L122-F207 HydrophobicContact CD1-CG 3.72Å; L122-F207 HydrophobicContact CD2-CE1 4.46Å; I129-F207 HydrophobicContact CD1-CE2 3.98Å; I129-F207 HydrophobicContact CG2-CE2 4.24Å; I129-F207 HydrophobicContact CG2-CZ 4.42Å; F187-F207 HydrophobicContact CB-CZ 4.48Å; F187-F207 HydrophobicContact CD1-CE1 4.28Å; F187-F207 HydrophobicContact CD1-CZ 4.01Å; F187-F207 HydrophobicContact CD2-CE1 4.17Å; F187-F207 AromaticContact CD2-CZ 3.69Å; F187-F207 HydrophobicContact CD2-CZ 3.69Å; F187-F207 AromaticContact CE1-CE1 3.91Å; F187-F207 HydrophobicContact CE1-CE1 3.91Å; F187-F207 HydrophobicContact CE1-CZ 4.11Å; F187-F207 AromaticContact CE2-CE1 3.78Å; F187-F207 HydrophobicContact CE2-CE1 3.78Å; F187-F207 AromaticContact CE2-CZ 3.79Å; F187-F207 HydrophobicContact CE2-CZ 3.79Å; F187-F207 HydrophobicContact CG-CE1 4.41Å; F187-F207 AromaticContact CG-CZ 3.81Å; F187-F207 HydrophobicContact CG-CZ 3.81Å; F187-F207 AromaticContact CZ-CE1 3.65Å; F187-F207 HydrophobicContact CZ-CE1 3.65Å; F187-F207 HydrophobicContact CZ-CZ 4.01Å; L198-F207 HydrophobicContact CD1-CD2 3.67Å; L198-F207 HydrophobicContact CD1-CE2 3.89Å; S199-F207 WeakPolarHBondContact O-CA 3.37Å; F207-W218 HydrophobicContact CD1-CB 3.8Å; F207-W218 HydrophobicContact CD2-CB 4.26Å; F207-W218 AromaticContact CD2-CD1 3.89Å; F207-W218 HydrophobicContact CD2-CG 4.31Å; F207-W218 HydrophobicContact CE1-CB 3.33Å; F207-W218 AromaticContact CE1-CG 3.98Å; F207-W218 HydrophobicContact CE1-CG 3.98Å; F207-W218 HydrophobicContact CE2-CB 3.83Å; F207-W218 AromaticContact CE2-CD1 3.36Å; F207-W218 HydrophobicContact CE2-CD2 4.42Å; F207-W218 AromaticContact CE2-CG 3.62Å; F207-W218 HydrophobicContact CE2-CG 3.62Å; F207-W218 AromaticContact CE2-NE1 3.97Å; F207-W218 HydrophobicContact CG-CB 4.25Å; F207-W218 HydrophobicContact CZ-CB 3.35Å; F207-W218 AromaticContact CZ-CD1 3.71Å; F207-W218 HydrophobicContact CZ-CD2 4.1Å; F207-W218 AromaticContact CZ-CG 3.44Å; F207-W218 HydrophobicContact CZ-CG 3.44Å; F207-W218 VanDerWaalsContact CZ-CG 3.44Å; F207-W218 PolarHBondContact N-O 3Å; F207-W218 PolarHBondContact O-N 2.87Å; F207-L220 HydrophobicContact CD1-CD2 3.54Å; F207-L220 HydrophobicContact CD1-CG 4.13Å; F207-L220 HydrophobicContact CE1-CD2 3.93Å
208	F	97.5	Very high	96	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.013	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142.4	179.2	-64.9	-109	0	0	0	110.1	L198 S199 I215 N216 M217 V229 I247 C249 F257 T271	L198-F208 WeakPolarHBondContact CA-O 3.43Å; S199-F208 PolarHBondContact N-O 2.93Å; S199-F208 PolarHBondContact O-N 3.39Å; F208-I215 HydrophobicContact CD1-CG2 3.92Å; F208-N216 CarbonylContact C-O 3.53Å; F208-N216 WeakPolarHBondContact CA-O 3.49Å; F208-M217 HydrophobicContact CD1-CB 4.08Å; F208-M217 HydrophobicContact CD1-CG 4.41Å; F208-M217 HydrophobicContact CE1-CB 3.88Å; F208-M217 HydrophobicContact CE1-CG 3.98Å; F208-M217 HydrophobicContact CE1-SD 4.15Å; F208-M217 HydrophobicContact CE2-CG 4.18Å; F208-M217 HydrophobicContact CE2-SD 4.4Å; F208-M217 HydrophobicContact CZ-CB 4.27Å; F208-M217 HydrophobicContact CZ-CG 3.83Å; F208-M217 HydrophobicContact CZ-SD 3.73Å; F208-V229 HydrophobicContact CD1-CG2 4.45Å; F208-V229 HydrophobicContact CE1-CG2 3.98Å; F208-I247 HydrophobicContact CB-CD1 3.65Å; F208-I247 HydrophobicContact CD1-CD1 4.33Å; F208-I247 HydrophobicContact CG-CD1 4.27Å; F208-C249 WeakPolarHBondContact CD2-SG 3.33Å; F208-F257 HydrophobicContact CE1-CD1 4.01Å; F208-F257 HydrophobicContact CE1-CE1 4.09Å; F208-F257 HydrophobicContact CZ-CD1 4.26Å; F208-T271 HydrophobicContact CZ-CG2 4.32Å
209	S	97.9	Very high	96	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.3	167.4	64.6	0	0	0	0	110.4	I129 H191 G197 I215 N216 W218	I129-S209 VanDerWaalsContact CD1-CB 3.49Å; H191-S209 WeakPolarHBondContact NE2-CB 3.34Å; H191-S209 PolarHBondContact NE2-OG 2.78Å; G197-S209 CarbonylContact O-C 3.59Å; G197-S209 VanDerWaalsContact O-CA 3.27Å; G197-S209 WeakPolarHBondContact O-CA 3.22Å; S209-I215 WeakPolarHBondContact O-CA 3.42Å; S209-N216 PolarHBondContact N-O 3.37Å; S209-N216 PolarHBondContact O-N 2.94Å; S209-W218 PolarHBondContact OG-NE1 2.78Å
210	A	97.4	Very high	95.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.6	-176.7	0	0	0	0	0	110.8	I195 V196 G197 R214 I215 I244 I247	I195-A210 CarbonylContact C-O 3.55Å; I195-A210 WeakPolarHBondContact CA-O 3.04Å; V196-A210 HydrophobicContact CG2-CB 4.15Å; V196-A210 WeakPolarHBondContact CG2-O 3.48Å; V196-A210 PolarHBondContact N-O 3.13Å; G197-A210 PolarHBondContact N-O 2.99Å; G197-A210 PolarHBondContact O-N 2.81Å; A210-R214 CarbonylContact C-O 3.6Å; A210-R214 VanDerWaalsContact CA-O 3.28Å; A210-R214 WeakPolarHBondContact CA-O 3.39Å; A210-I215 HydrophobicContact CB-CG1 3.88Å; A210-I244 HydrophobicContact CB-CG2 3.96Å; A210-I247 HydrophobicContact CB-CB 4.17Å; A210-I247 HydrophobicContact CB-CG2 4.05Å
211	D	95.7	Very high	95.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	19%	0.193	C	C	.	.			trans	-113.6	177.4	156.9	74.6	29.7	0	0	0	108.5	H191 G192 F193 L213 R214 I244	H191-D211 HydrophobicContact CB-CB 4.26Å; H191-D211 WeakPolarHBondContact CB-OD2 3.46Å; H191-D211 PolarHBondContact CE1-N 2.87Å; H191-D211 IonicContact CG-OD2 2.66Å; H191-D211 VanDerWaalsContact ND1-CB 3.35Å; H191-D211 WeakPolarHBondContact ND1-CB 3.5Å; H191-D211 VanDerWaalsContact ND1-CG 3.26Å; H191-D211 IonicContact ND1-OD2 2.78Å; H191-D211 PolarHBondContact ND1-OD2 3.28Å; G192-D211 PolarHBondContact N-OD2 3.2Å; F193-D211 HydrophobicContact CB-CB 4.08Å; D211-L213 PolarHBondContact O-N 3.09Å; D211-L213 PolarHBondContact OD1-N 3.38Å; D211-R214 PolarHBondContact N-O 3.03Å; D211-R214 PolarHBondContact O-N 2.84Å; D211-R214 PolarHBondContact OD1-N 2.77Å; D211-I244 WeakPolarHBondContact O-CB 3.49Å
212	P	95.2	Very high	95.9	Very high	31 Å²	31	42.8 Å²	42.8	20%	0.201	21%	0.206	C	C	.	.	S	Bend	trans	-54.9	-19.6	-178	-31.1	38.3	0	0	0	116.6	F193 V196 L243 I244	F193-P212 HydrophobicContact CB-CG 4.37Å; V196-P212 HydrophobicContact CG1-CG 4.18Å; P212-L243 HydrophobicContact CB-CB 4.38Å; P212-I244 WeakPolarHBondContact CA-O 3.43Å; P212-I244 PolarHBondContact O-N 2.57Å
213	L	93.4	Very high	95.9	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.058	21%	0.209	C	C	.	.	S	Bend	trans	-121.7	-19	-175.4	-57.1	-175.3	0	0	0	114	F193 D211 H232 L234 L237 L243	F193-L213 HydrophobicContact CD2-CD1 4.06Å; F193-L213 HydrophobicContact CD2-CG 4.31Å; F193-L213 HydrophobicContact CE2-CD1 3.4Å; F193-L213 VanDerWaalsContact CE2-CD1 3.4Å; F193-L213 HydrophobicContact CE2-CG 4.12Å; F193-L213 HydrophobicContact CZ-CD1 4.01Å; D211-L213 PolarHBondContact O-N 3.09Å; D211-L213 PolarHBondContact OD1-N 3.38Å; L213-H232 HydrophobicContact CB-CB 4.29Å; L213-H232 HydrophobicContact CD2-CB 4.41Å; L213-H232 WeakPolarHBondContact O-CB 3.37Å; L213-H232 PolarHBondContact O-CD2 2.65Å; L213-H232 PolarHBondContact O-N 2.97Å; L213-L234 HydrophobicContact CD1-CD1 3.44Å; L213-L234 VanDerWaalsContact CD1-CD1 3.44Å; L213-L237 HydrophobicContact CD1-CD1 4.06Å; L213-L237 HydrophobicContact CD2-CD1 3.53Å; L213-L237 HydrophobicContact CD2-CD2 4.03Å; L213-L237 HydrophobicContact CD2-CG 4.4Å; L213-L237 HydrophobicContact CG-CD1 4.48Å; L213-L243 HydrophobicContact CD2-CD2 3.57Å
214	R	93.9	Very high	95.8	Very high	93 Å²	93	46.9 Å²	46.9	35%	0.351	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.2	-171.4	-63.8	-173.9	179.8	172.5	-1.7	112.7	A210 D211 I230 D231	A210-R214 CarbonylContact C-O 3.6Å; A210-R214 VanDerWaalsContact CA-O 3.28Å; A210-R214 WeakPolarHBondContact CA-O 3.39Å; D211-R214 PolarHBondContact N-O 3.03Å; D211-R214 PolarHBondContact O-N 2.84Å; D211-R214 PolarHBondContact OD1-N 2.77Å; R214-I230 VanDerWaalsContact CA-O 3.3Å; R214-I230 WeakPolarHBondContact CA-O 3.33Å; R214-D231 HydrophobicContact CG-CB 4.39Å; R214-D231 WeakPolarHBondContact CG-OD1 3.08Å; R214-D231 IonicContact CZ-OD1 3.8Å; R214-D231 IonicContact CZ-OD2 3.96Å; R214-D231 VanDerWaalsContact NE-CG 3.33Å; R214-D231 IonicContact NE-OD1 2.8Å; R214-D231 PolarHBondContact NE-OD1 2.79Å; R214-D231 IonicContact NE-OD2 3.66Å; R214-D231 PolarHBondContact NE-OD2 3.47Å; R214-D231 IonicContact NH2-OD1 3.7Å; R214-D231 IonicContact NH2-OD2 2.77Å
215	I	96.1	Very high	95.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.9	164.4	-67.5	165.7	0	0	0	108.2	F208 S209 A210 V229 I230 I244 I247 F257 Y259	F208-I215 HydrophobicContact CD1-CG2 3.92Å; S209-I215 WeakPolarHBondContact O-CA 3.42Å; A210-I215 HydrophobicContact CB-CG1 3.88Å; I215-V229 HydrophobicContact CG2-CB 4.44Å; I215-V229 PolarHBondContact O-N 2.98Å; I215-I230 HydrophobicContact CB-CB 4.18Å; I215-I230 HydrophobicContact CD1-CD1 3.76Å; I215-I230 PolarHBondContact N-O 2.81Å; I215-I230 PolarHBondContact O-N 3.3Å; I215-I244 HydrophobicContact CD1-CD1 3.78Å; I215-I244 HydrophobicContact CD1-CG2 4.47Å; I215-I244 HydrophobicContact CG1-CD1 3.71Å; I215-I247 HydrophobicContact CD1-CD1 4.12Å; I215-I247 HydrophobicContact CG1-CD1 4.22Å; I215-I247 HydrophobicContact CG2-CD1 3.55Å; I215-F257 HydrophobicContact CD1-CE2 4.24Å; I215-F257 HydrophobicContact CG2-CE2 4.45Å; I215-Y259 HydrophobicContact CD1-CD1 3.63Å; I215-Y259 HydrophobicContact CD1-CD2 4.43Å; I215-Y259 HydrophobicContact CD1-CE1 4.24Å; I215-Y259 HydrophobicContact CD1-CG 3.73Å
216	N	96.4	Very high	95.7	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.2	-179.3	-77.3	-33.6	0	0	0	110	A190 H191 F208 S209 V226 F227	A190-N216 PolarHBondContact O-ND2 3.1Å; H191-N216 PolarHBondContact CE1-ND2 3.31Å; H191-N216 PolarHBondContact NE2-ND2 2.8Å; F208-N216 CarbonylContact C-O 3.53Å; F208-N216 WeakPolarHBondContact CA-O 3.49Å; S209-N216 PolarHBondContact N-O 3.37Å; S209-N216 PolarHBondContact O-N 2.94Å; N216-V226 HydrophobicContact CB-CG2 3.55Å; N216-F227 CarbonylContact C-O 3.57Å; N216-F227 WeakPolarHBondContact CA-O 3.31Å
217	M	96.2	Very high	95.6	Very high	56 Å²	56	44.9 Å²	44.9	28%	0.276	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.1	169.4	-174.5	-179.7	75.7	0	0	109.3	F208 F227 V229	F208-M217 HydrophobicContact CD1-CB 4.08Å; F208-M217 HydrophobicContact CD1-CG 4.41Å; F208-M217 HydrophobicContact CE1-CB 3.88Å; F208-M217 HydrophobicContact CE1-CG 3.98Å; F208-M217 HydrophobicContact CE1-SD 4.15Å; F208-M217 HydrophobicContact CE2-CG 4.18Å; F208-M217 HydrophobicContact CE2-SD 4.4Å; F208-M217 HydrophobicContact CZ-CB 4.27Å; F208-M217 HydrophobicContact CZ-CG 3.83Å; F208-M217 HydrophobicContact CZ-SD 3.73Å; M217-F227 HydrophobicContact CB-CD1 4.4Å; M217-F227 HydrophobicContact CE-CB 4.39Å; M217-F227 HydrophobicContact CE-CD1 3.91Å; M217-F227 HydrophobicContact CE-CG 4.48Å; M217-F227 PolarHBondContact N-O 3.04Å; M217-F227 PolarHBondContact O-N 2.88Å; M217-V229 HydrophobicContact CB-CG2 3.63Å
218	W	97.2	Very high	95.5	Very high	6 Å²	6	46.5 Å²	46.5	2%	0.023	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.4	-177.6	-57.9	86.4	0	0	0	110.2	F187 A190 T206 F207 S209 V226	F187-W218 HydrophobicContact CB-CD2 4.33Å; F187-W218 HydrophobicContact CB-CE3 3.97Å; F187-W218 HydrophobicContact CB-CH2 3.83Å; F187-W218 HydrophobicContact CB-CZ2 4.23Å; F187-W218 HydrophobicContact CB-CZ3 3.72Å; F187-W218 HydrophobicContact CD1-CD2 4.19Å; F187-W218 AromaticContact CD1-CE3 3.58Å; F187-W218 HydrophobicContact CD1-CE3 3.58Å; F187-W218 AromaticContact CD1-CZ3 3.99Å; F187-W218 HydrophobicContact CD1-CZ3 3.99Å; F187-W218 HydrophobicContact CG-CE3 4.16Å; F187-W218 HydrophobicContact CG-CZ3 4.34Å; A190-W218 HydrophobicContact CB-CH2 3.22Å; A190-W218 HydrophobicContact CB-CZ2 3.27Å; A190-W218 HydrophobicContact CB-CZ3 4.36Å; T206-W218 CarbonylContact C-O 3.55Å; T206-W218 WeakPolarHBondContact CA-O 3.24Å; T206-W218 VanDerWaalsContact CB-O 3.23Å; T206-W218 WeakPolarHBondContact CB-O 3.18Å; F207-W218 HydrophobicContact CD1-CB 3.8Å; F207-W218 HydrophobicContact CD2-CB 4.26Å; F207-W218 AromaticContact CD2-CD1 3.89Å; F207-W218 HydrophobicContact CD2-CG 4.31Å; F207-W218 HydrophobicContact CE1-CB 3.33Å; F207-W218 AromaticContact CE1-CG 3.98Å; F207-W218 HydrophobicContact CE1-CG 3.98Å; F207-W218 HydrophobicContact CE2-CB 3.83Å; F207-W218 AromaticContact CE2-CD1 3.36Å; F207-W218 HydrophobicContact CE2-CD2 4.42Å; F207-W218 AromaticContact CE2-CG 3.62Å; F207-W218 HydrophobicContact CE2-CG 3.62Å; F207-W218 AromaticContact CE2-NE1 3.97Å; F207-W218 HydrophobicContact CG-CB 4.25Å; F207-W218 HydrophobicContact CZ-CB 3.35Å; F207-W218 AromaticContact CZ-CD1 3.71Å; F207-W218 HydrophobicContact CZ-CD2 4.1Å; F207-W218 AromaticContact CZ-CG 3.44Å; F207-W218 HydrophobicContact CZ-CG 3.44Å; F207-W218 VanDerWaalsContact CZ-CG 3.44Å; F207-W218 PolarHBondContact N-O 3Å; F207-W218 PolarHBondContact O-N 2.87Å; S209-W218 PolarHBondContact OG-NE1 2.78Å; W218-V226 HydrophobicContact CD2-CB 4.14Å; W218-V226 HydrophobicContact CD2-CG2 3.53Å; W218-V226 HydrophobicContact CE3-CB 3.79Å; W218-V226 HydrophobicContact CE3-CG2 3.73Å; W218-V226 HydrophobicContact CG-CG2 4.12Å; W218-V226 HydrophobicContact CH2-CB 4.1Å; W218-V226 HydrophobicContact CH2-CG2 4.09Å; W218-V226 HydrophobicContact CZ2-CB 4.38Å; W218-V226 HydrophobicContact CZ2-CG2 3.86Å; W218-V226 HydrophobicContact CZ3-CB 3.76Å; W218-V226 HydrophobicContact CZ3-CG2 4Å
219	N	97.1	Very high	95.2	Very high	56 Å²	56	46.5 Å²	46.5	30%	0.299	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	135.6	162.6	-176.6	-59.8	0	0	0	108.7	F187 E221 V222	F187-N219 WeakPolarHBondContact CE1-O 3.43Å; N219-E221 PolarHBondContact O-N 2.88Å; N219-E221 PolarHBondContact OD1-N 2.79Å; N219-V222 HydrophobicContact CB-CB 4.12Å; N219-V222 HydrophobicContact CB-CG2 4.08Å; N219-V222 PolarHBondContact O-N 2.93Å; N219-V222 VanDerWaalsContact O-N 3.12Å; N219-V222 VanDerWaalsContact O-O 3.07Å
220	L	95.9	Very high	94.9	Very high	21 Å²	21	46.7 Å²	46.7	11%	0.11	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.3	-177.9	-72.2	168.6	0	0	0	114	L112 L122 L131 R204 E205 F207	L112-L220 HydrophobicContact CD1-CD1 3.86Å; L112-L220 HydrophobicContact CD1-CD2 3.62Å; L112-L220 HydrophobicContact CD1-CG 4.42Å; L112-L220 HydrophobicContact CD2-CD2 4.45Å; L122-L220 HydrophobicContact CD2-CD2 4.29Å; L131-L220 HydrophobicContact CD2-CD2 4.4Å; R204-L220 WeakPolarHBondContact O-CD1 3.5Å; E205-L220 WeakPolarHBondContact O-CG 3.49Å; E205-L220 PolarHBondContact O-N 2.9Å; F207-L220 HydrophobicContact CD1-CD2 3.54Å; F207-L220 HydrophobicContact CD1-CG 4.13Å; F207-L220 HydrophobicContact CE1-CD2 3.93Å
221	E	95.8	Very high	94.4	Very high	149 Å²	149	50 Å²	50	70%	0.696	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-16.7	-179	-56	-161.9	151	0	0	113.7	K185 N219	K185-E221 PolarHBondContact NZ-O 3.04Å; N219-E221 PolarHBondContact O-N 2.88Å; N219-E221 PolarHBondContact OD1-N 2.79Å
222	V	95.8	Very high	93.8	Very high	50 Å²	50	53.3 Å²	53.3	30%	0.303	27%	0.271	S	S	.	.			trans	-110.2	118.1	-174.1	-175.4	0	0	0	0	110.6	F187 N219 N224 E225	F187-V222 WeakPolarHBondContact CE1-O 3.32Å; N219-V222 HydrophobicContact CB-CB 4.12Å; N219-V222 HydrophobicContact CB-CG2 4.08Å; N219-V222 PolarHBondContact O-N 2.93Å; N219-V222 VanDerWaalsContact O-N 3.12Å; N219-V222 VanDerWaalsContact O-O 3.07Å; V222-N224 WeakPolarHBondContact CG1-OD1 3.47Å; V222-E225 HydrophobicContact CG1-CB 4.11Å
223	T	94.7	Very high	93	Very high	52 Å²	52	56.7 Å²	56.7	32%	0.319	29%	0.285	S	S	.	.			trans	-111.7	-14.9	-175.7	52.4	0	0	0	0	114.2	K185 V186 F187	K185-T223 HydrophobicContact CB-CG2 3.76Å; K185-T223 HydrophobicContact CD-CG2 3.69Å; K185-T223 HydrophobicContact CG-CG2 4.17Å; V186-T223 WeakPolarHBondContact O-CB 3.3Å; V186-T223 WeakPolarHBondContact O-CG2 3.16Å; F187-T223 HydrophobicContact CD1-CG2 3.8Å; F187-T223 HydrophobicContact CE1-CG2 3.69Å; F187-T223 HydrophobicContact CG-CG2 4.44Å; F187-T223 HydrophobicContact CZ-CG2 4.27Å
224	N	92.9	Very high	92.1	Very high	128 Å²	128	61.1 Å²	61.1	68%	0.684	31%	0.309	S	S	*	.	S	Bend	trans	-93.6	-11.5	-175.3	60.8	-53.8	0	0	0	113.4	V222	V222-N224 WeakPolarHBondContact CG1-OD1 3.47Å
225	E	93.2	Very high	91	Very high	137 Å²	137	64 Å²	64	64%	0.64	33%	0.331	S	S	*	.			trans	-135.5	145.9	-178.4	-67.5	175.2	172.1	0	0	109.1	V222	V222-E225 HydrophobicContact CG1-CB 4.11Å
226	V	94.3	Very high	90	Very high	61 Å²	61	73.8 Å²	73.8	37%	0.37	37%	0.368	S	S	.	.			trans	-144.1	142.1	179.8	63.2	0	0	0	0	108.5	A190 N216 W218	A190-V226 HydrophobicContact CB-CG1 3.94Å; N216-V226 HydrophobicContact CB-CG2 3.55Å; W218-V226 HydrophobicContact CD2-CB 4.14Å; W218-V226 HydrophobicContact CD2-CG2 3.53Å; W218-V226 HydrophobicContact CE3-CB 3.79Å; W218-V226 HydrophobicContact CE3-CG2 3.73Å; W218-V226 HydrophobicContact CG-CG2 4.12Å; W218-V226 HydrophobicContact CH2-CB 4.1Å; W218-V226 HydrophobicContact CH2-CG2 4.09Å; W218-V226 HydrophobicContact CZ2-CB 4.38Å; W218-V226 HydrophobicContact CZ2-CG2 3.86Å; W218-V226 HydrophobicContact CZ3-CB 3.76Å; W218-V226 HydrophobicContact CZ3-CG2 4Å
227	F	94.4	Very high	89.2	Confident	84 Å²	84	76.4 Å²	76.4	37%	0.368	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.9	175.9	179.7	-111.6	0	0	0	109.6	N216 M217 V229 S275 L276	N216-F227 CarbonylContact C-O 3.57Å; N216-F227 WeakPolarHBondContact CA-O 3.31Å; M217-F227 HydrophobicContact CB-CD1 4.4Å; M217-F227 HydrophobicContact CE-CB 4.39Å; M217-F227 HydrophobicContact CE-CD1 3.91Å; M217-F227 HydrophobicContact CE-CG 4.48Å; M217-F227 PolarHBondContact N-O 3.04Å; M217-F227 PolarHBondContact O-N 2.88Å; F227-V229 HydrophobicContact CD1-CG2 3.65Å; F227-V229 HydrophobicContact CE1-CB 4.44Å; F227-V229 HydrophobicContact CE1-CG2 3.82Å; F227-V229 PolarHBondContact O-N 3.31Å; F227-S275 VanDerWaalsContact CE1-O 3.25Å; F227-S275 WeakPolarHBondContact CE1-O 3.34Å; F227-S275 WeakPolarHBondContact CZ-O 3.39Å; F227-L276 HydrophobicContact CZ-CD2 4.13Å
228	S	93.7	Very high	88.5	Confident	34 Å²	34	78.2 Å²	78.2	24%	0.238	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	109.2	174.2	-160.2	0	0	0	0	109.1	I230	S228-I230 PolarHBondContact OG-O 2.66Å
229	V	92.6	Very high	87.4	Confident	2 Å²	2	85.3 Å²	85.3	1%	0.012	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-36.8	-179.2	-179	0	0	0	0	110.7	F208 I215 M217 F227 F257 C277	F208-V229 HydrophobicContact CD1-CG2 4.45Å; F208-V229 HydrophobicContact CE1-CG2 3.98Å; I215-V229 HydrophobicContact CG2-CB 4.44Å; I215-V229 PolarHBondContact O-N 2.98Å; M217-V229 HydrophobicContact CB-CG2 3.63Å; F227-V229 HydrophobicContact CD1-CG2 3.65Å; F227-V229 HydrophobicContact CE1-CB 4.44Å; F227-V229 HydrophobicContact CE1-CG2 3.82Å; F227-V229 PolarHBondContact O-N 3.31Å; V229-F257 HydrophobicContact CG1-CE1 4.1Å; V229-F257 HydrophobicContact CG1-CZ 3.79Å; V229-C277 HydrophobicContact CG1-CB 3.83Å; V229-C277 WeakPolarHBondContact CG1-SG 3.36Å; V229-C277 PolarHBondContact O-N 2.81Å
230	I	90.7	Very high	86.5	Confident	5 Å²	5	90.3 Å²	90.3	3%	0.026	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.9	174.6	-67.1	164.4	0	0	0	107	R214 I215 S228 H232 F257 Y259 C277	R214-I230 VanDerWaalsContact CA-O 3.3Å; R214-I230 WeakPolarHBondContact CA-O 3.33Å; I215-I230 HydrophobicContact CB-CB 4.18Å; I215-I230 HydrophobicContact CD1-CD1 3.76Å; I215-I230 PolarHBondContact N-O 2.81Å; I215-I230 PolarHBondContact O-N 3.3Å; S228-I230 PolarHBondContact OG-O 2.66Å; I230-H232 WeakPolarHBondContact CG2-NE2 3.43Å; I230-F257 HydrophobicContact CD1-CE2 4.32Å; I230-F257 HydrophobicContact CD1-CZ 4.38Å; I230-Y259 HydrophobicContact CD1-CD1 4.07Å; I230-Y259 HydrophobicContact CD1-CE1 3.43Å; I230-Y259 VanDerWaalsContact CD1-CE1 3.43Å; I230-C277 HydrophobicContact CD1-CB 4.39Å; I230-C277 HydrophobicContact CG1-CB 4.23Å
231	D	88.3	Confident	85.9	Confident	70 Å²	70	90.5 Å²	90.5	37%	0.374	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	100.8	172.7	-169	0.2	0	0	0	110	R214 M233	R214-D231 HydrophobicContact CG-CB 4.39Å; R214-D231 WeakPolarHBondContact CG-OD1 3.08Å; R214-D231 IonicContact CZ-OD1 3.8Å; R214-D231 IonicContact CZ-OD2 3.96Å; R214-D231 VanDerWaalsContact NE-CG 3.33Å; R214-D231 IonicContact NE-OD1 2.8Å; R214-D231 PolarHBondContact NE-OD1 2.79Å; R214-D231 IonicContact NE-OD2 3.66Å; R214-D231 PolarHBondContact NE-OD2 3.47Å; R214-D231 IonicContact NH2-OD1 3.7Å; R214-D231 IonicContact NH2-OD2 2.77Å; D231-M233 PolarHBondContact O-N 2.97Å
232	H	82.8	Confident	85.6	Confident	69 Å²	69	85.9 Å²	85.9	32%	0.319	43%	0.427	S	S	.	.			trans	-79.3	114	173	-65	-57.3	0	0	0	109.9	L213 I230 L234	L213-H232 HydrophobicContact CB-CB 4.29Å; L213-H232 HydrophobicContact CD2-CB 4.41Å; L213-H232 WeakPolarHBondContact O-CB 3.37Å; L213-H232 PolarHBondContact O-CD2 2.65Å; L213-H232 PolarHBondContact O-N 2.97Å; I230-H232 WeakPolarHBondContact CG2-NE2 3.43Å; H232-L234 PolarHBondContact O-N 2.91Å
233	M	78.1	Confident	85.5	Confident	102 Å²	102	86.2 Å²	86.2	50%	0.502	43%	0.426	S	S	.	.			trans	-64.8	123.7	174.6	-68	-87.4	-75.3	0	0	110.4	D231 D235 R236	D231-M233 PolarHBondContact O-N 2.97Å; M233-D235 PolarHBondContact O-N 3.28Å; M233-D235 VanDerWaalsContact O-N 3.17Å; M233-R236 HydrophobicContact CB-CG 4.24Å; M233-R236 PolarHBondContact O-N 2.99Å
234	L	73.4	Confident	85.6	Confident	105 Å²	105	83.8 Å²	83.8	55%	0.55	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-53.4	-38.5	-178	-161.7	78.9	0	0	0	112.7	F193 L213 H232 R236 L237	F193-L234 HydrophobicContact CE2-CD1 4.46Å; F193-L234 HydrophobicContact CZ-CD1 4.01Å; L213-L234 HydrophobicContact CD1-CD1 3.44Å; L213-L234 VanDerWaalsContact CD1-CD1 3.44Å; H232-L234 PolarHBondContact O-N 2.91Å; L234-R236 PolarHBondContact O-N 3.08Å; L234-R236 VanDerWaalsContact O-N 3.12Å; L234-L237 HydrophobicContact CD1-CD1 3.67Å; L234-L237 HydrophobicContact CG-CD1 4.31Å; L234-L237 WeakPolarHBondContact O-CB 3.26Å; L234-L237 WeakPolarHBondContact O-CG 3.36Å; L234-L237 PolarHBondContact O-N 3.2Å; L234-L237 VanDerWaalsContact O-N 3.11Å
235	D	71.8	Confident	85.7	Confident	153 Å²	153	79.2 Å²	79.2	82%	0.818	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-66.2	-13.4	-178.9	-60.5	-24.9	0	0	0	114.3	M233	M233-D235 PolarHBondContact O-N 3.28Å; M233-D235 VanDerWaalsContact O-N 3.17Å
236	R	75.4	Confident	85.9	Confident	205 Å²	205	73 Å²	73	77%	0.774	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-98.3	-2.4	178.7	-64	-175.4	176.7	173.6	-0.8	112.8	M233 L234	M233-R236 HydrophobicContact CB-CG 4.24Å; M233-R236 PolarHBondContact O-N 2.99Å; L234-R236 PolarHBondContact O-N 3.08Å; L234-R236 VanDerWaalsContact O-N 3.12Å
237	L	78.4	Confident	86	Confident	60 Å²	60	70.6 Å²	70.6	31%	0.314	35%	0.346	S	S	.	.			trans	-77.3	139	-177.1	-61.3	173.7	0	0	0	111	L213 L234 S241 L243	L213-L237 HydrophobicContact CD1-CD1 4.06Å; L213-L237 HydrophobicContact CD2-CD1 3.53Å; L213-L237 HydrophobicContact CD2-CD2 4.03Å; L213-L237 HydrophobicContact CD2-CG 4.4Å; L213-L237 HydrophobicContact CG-CD1 4.48Å; L234-L237 HydrophobicContact CD1-CD1 3.67Å; L234-L237 HydrophobicContact CG-CD1 4.31Å; L234-L237 WeakPolarHBondContact O-CB 3.26Å; L234-L237 WeakPolarHBondContact O-CG 3.36Å; L234-L237 PolarHBondContact O-N 3.2Å; L234-L237 VanDerWaalsContact O-N 3.11Å; L237-S241 WeakPolarHBondContact CA-OG 3.47Å; L237-L243 HydrophobicContact CD2-CD2 4.44Å
238	D	81.4	Confident	86.2	Confident	94 Å²	94	67.1 Å²	67.1	50%	0.503	33%	0.332	S	S	.	.			trans	-131.9	177.5	172.7	68.8	-2	0	0	0	110.1	R240 S241	D238-R240 PolarHBondContact O-N 3.25Å; D238-R240 VanDerWaalsContact OD1-C 3.29Å; D238-R240 WeakPolarHBondContact OD1-CA 3.39Å; D238-R240 WeakPolarHBondContact OD1-CB 3.45Å; D238-R240 PolarHBondContact OD1-N 3.06Å; D238-S241 PolarHBondContact N-OG 2.92Å; D238-S241 VanDerWaalsContact O-CB 3.31Å; D238-S241 WeakPolarHBondContact O-CB 3.47Å; D238-S241 PolarHBondContact O-N 3.45Å; D238-S241 PolarHBondContact O-OG 3.26Å; D238-S241 PolarHBondContact OD1-N 2.81Å; D238-S241 PolarHBondContact OD1-OG 3.32Å
239	D	75.2	Confident	86.3	Confident	155 Å²	155	65.8 Å²	65.8	83%	0.829	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	7.8	175.8	-63.7	-24.6	0	0	0	113.7	R263	D239-R263 VanDerWaalsContact O-CZ 3.3Å; D239-R263 PolarHBondContact O-NH2 3.02Å
240	R	77.9	Confident	86.5	Confident	161 Å²	161	65.8 Å²	65.8	61%	0.608	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-3.9	174.6	-63.2	-179.1	175.6	172.4	-3.8	112.3	D238 H242 R263	D238-R240 PolarHBondContact O-N 3.25Å; D238-R240 VanDerWaalsContact OD1-C 3.29Å; D238-R240 WeakPolarHBondContact OD1-CA 3.39Å; D238-R240 WeakPolarHBondContact OD1-CB 3.45Å; D238-R240 PolarHBondContact OD1-N 3.06Å; R240-H242 PolarHBondContact O-N 3.1Å; R240-R263 VanDerWaalsContact C-CZ 3.46Å; R240-R263 PolarHBondContact O-NH1 2.89Å; R240-R263 VanDerWaalsContact O-NH1 3.11Å
241	S	83.8	Confident	86.6	Confident	24 Å²	24	68.8 Å²	68.8	17%	0.168	34%	0.339	C	S	.	.			trans	-74	119.4	-174.5	-68	0	0	0	0	112.5	L237 D238 L243 R263	L237-S241 WeakPolarHBondContact CA-OG 3.47Å; D238-S241 PolarHBondContact N-OG 2.92Å; D238-S241 VanDerWaalsContact O-CB 3.31Å; D238-S241 WeakPolarHBondContact O-CB 3.47Å; D238-S241 PolarHBondContact O-N 3.45Å; D238-S241 PolarHBondContact O-OG 3.26Å; D238-S241 PolarHBondContact OD1-N 2.81Å; D238-S241 PolarHBondContact OD1-OG 3.32Å; S241-L243 PolarHBondContact O-N 2.88Å; S241-R263 PolarHBondContact O-NH1 3.49Å
242	H	88.9	Confident	86.8	Confident	52 Å²	52	68.8 Å²	68.8	24%	0.241	35%	0.345	C	S	.	.			trans	-66.4	115.6	179.5	-73.6	-100.8	0	0	0	110.8	R240 T261 S265 F267	R240-H242 PolarHBondContact O-N 3.1Å; H242-T261 HydrophobicContact CB-CG2 3.9Å; H242-T261 PolarHBondContact ND1-OG1 2.78Å; H242-T261 VanDerWaalsContact ND1-OG1 3.11Å; H242-S265 PolarHBondContact CE1-OG 2.9Å; H242-F267 HydrophobicContact CB-CE2 4.37Å; H242-F267 AromaticContact ND1-CE2 3.95Å
243	L	93.7	Very high	87.3	Confident	57 Å²	57	66.9 Å²	66.9	30%	0.298	34%	0.339	S	S	.	.			trans	-93.4	136	174.6	-57.3	-179.8	0	0	0	109.6	P212 L213 L237 S241 T261 N262	P212-L243 HydrophobicContact CB-CB 4.38Å; L213-L243 HydrophobicContact CD2-CD2 3.57Å; L237-L243 HydrophobicContact CD2-CD2 4.44Å; S241-L243 PolarHBondContact O-N 2.88Å; L243-T261 CarbonylContact O-C 3.59Å; L243-T261 WeakPolarHBondContact O-CA 3.36Å; L243-T261 WeakPolarHBondContact O-CB 3.31Å; L243-N262 HydrophobicContact CB-CB 4.35Å; L243-N262 PolarHBondContact N-OD1 2.95Å; L243-N262 PolarHBondContact O-N 2.67Å; L243-N262 PolarHBondContact O-OD1 2.93Å
244	I	95.9	Very high	88.1	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.7	-178.7	-57.8	162	0	0	0	109.4	V196 A210 D211 P212 I215 Y259 G260	V196-I244 HydrophobicContact CG2-CG2 4.31Å; A210-I244 HydrophobicContact CB-CG2 3.96Å; D211-I244 WeakPolarHBondContact O-CB 3.49Å; P212-I244 WeakPolarHBondContact CA-O 3.43Å; P212-I244 PolarHBondContact O-N 2.57Å; I215-I244 HydrophobicContact CD1-CD1 3.78Å; I215-I244 HydrophobicContact CD1-CG2 4.47Å; I215-I244 HydrophobicContact CG1-CD1 3.71Å; I244-Y259 HydrophobicContact CG1-CD2 3.89Å; I244-Y259 HydrophobicContact CG1-CE2 4.12Å; I244-Y259 HydrophobicContact CG2-CD2 4.34Å; I244-G260 WeakPolarHBondContact CA-O 3.47Å
245	T	96.5	Very high	89.1	Confident	32 Å²	32	59.7 Å²	59.7	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-13.3	179.2	55.6	0	0	0	0	112.9	G260 T261 N262 V302	T245-G260 PolarHBondContact N-O 2.82Å; T245-G260 PolarHBondContact OG1-O 2.99Å; T245-T261 PolarHBondContact OG1-N 2.87Å; T245-N262 HydrophobicContact CG2-CB 3.95Å; T245-V302 WeakPolarHBondContact CB-O 3.06Å; T245-V302 PolarHBondContact OG1-O 2.83Å
246	G	96.4	Very high	90.2	Very high	7 Å²	7	54 Å²	54	7%	0.072	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	168.7	177.9	0	0	0	0	0	112	Y259 G260 L305	G246-Y259 VanDerWaalsContact O-CA 3.24Å; G246-Y259 WeakPolarHBondContact O-CA 3.49Å; G246-Y259 VanDerWaalsContact O-CB 3.27Å; G246-Y259 WeakPolarHBondContact O-CB 3.4Å; G246-G260 PolarHBondContact O-N 3.07Å; G246-G260 VanDerWaalsContact O-N 3.1Å; G246-L305 VanDerWaalsContact C-CD2 3.42Å
247	I	97.3	Very high	91.2	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.046	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	143.5	177.9	-167.6	170.9	0	0	0	110.6	F208 A210 I215 F257 A258	F208-I247 HydrophobicContact CB-CD1 3.65Å; F208-I247 HydrophobicContact CD1-CD1 4.33Å; F208-I247 HydrophobicContact CG-CD1 4.27Å; A210-I247 HydrophobicContact CB-CB 4.17Å; A210-I247 HydrophobicContact CB-CG2 4.05Å; I215-I247 HydrophobicContact CD1-CD1 4.12Å; I215-I247 HydrophobicContact CG1-CD1 4.22Å; I215-I247 HydrophobicContact CG2-CD1 3.55Å; I247-F257 HydrophobicContact CD1-CD2 3.9Å; I247-F257 HydrophobicContact CD1-CE2 4.42Å; I247-F257 HydrophobicContact CG1-CD2 4.21Å; I247-A258 WeakPolarHBondContact CA-O 3.42Å; I247-A258 WeakPolarHBondContact CG1-O 3.45Å
248	S	97.2	Very high	92	Very high	12 Å²	12	41.4 Å²	41.4	8%	0.084	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	130.3	168.9	-173.4	0	0	0	0	109.3	F257 A258 F307	S248-F257 CarbonylContact O-C 3.59Å; S248-F257 WeakPolarHBondContact O-CA 3.44Å; S248-A258 PolarHBondContact N-O 3.47Å; S248-A258 PolarHBondContact O-N 2.93Å; S248-F307 WeakPolarHBondContact O-CE2 3.29Å; S248-F307 PolarHBondContact OG-N 3.11Å
249	C	96.9	Very high	92.8	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.034	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	155.2	164.5	-64.7	0	0	0	0	109.9	S199 F208 F307	S199-C249 PolarHBondContact OG-N 3.11Å; F208-C249 WeakPolarHBondContact CD2-SG 3.33Å; C249-F307 WeakPolarHBondContact O-CD2 3.44Å
250	S	95.9	Very high	93.8	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	16%	0.163	C	C	.	.			trans	-66.7	143.8	168.5	155.3	0	0	0	0	110.3	S252 S253 L256 D312	S250-S252 VanDerWaalsContact C-N 3.28Å; S250-S252 PolarHBondContact O-N 3.47Å; S250-S252 PolarHBondContact OG-N 3.21Å; S250-S252 VanDerWaalsContact OG-N 3.13Å; S250-S253 WeakPolarHBondContact CB-O 3.15Å; S250-S253 PolarHBondContact OG-N 3.48Å; S250-L256 PolarHBondContact N-O 2.82Å; S250-D312 PolarHBondContact OG-OD1 3.25Å
251	N	92.7	Very high	94.6	Very high	68 Å²	68	22.5 Å²	22.5	36%	0.364	13%	0.134	S	C	.	.	S	Bend	trans	-74	-18.8	177.8	-67.6	-51.3	0	0	0	113.1	G308	N251-G308 PolarHBondContact ND2-O 2.8Å
252	S	92.4	Very high	95.1	Very high	71 Å²	71	23 Å²	23	50%	0.497	14%	0.135	S	C	.	.	S	Bend	trans	-118.7	-39.6	-174.7	-42	0	0	0	0	112.9	S250 P254 D312	S250-S252 VanDerWaalsContact C-N 3.28Å; S250-S252 PolarHBondContact O-N 3.47Å; S250-S252 PolarHBondContact OG-N 3.21Å; S250-S252 VanDerWaalsContact OG-N 3.13Å; S252-P254 WeakPolarHBondContact O-CD 3.49Å; S252-D312 WeakPolarHBondContact CB-OD1 3.41Å; S252-D312 WeakPolarHBondContact CB-OD2 3.13Å; S252-D312 PolarHBondContact OG-OD1 3.28Å
253	S	94.7	Very high	95.3	Very high	29 Å²	29	22.2 Å²	22.2	20%	0.203	13%	0.13	C	C	.	.			trans	-102.5	104.7	-174.5	-73.2	0	0	0	0	111.2	S250 S255 L256 D312	S250-S253 WeakPolarHBondContact CB-O 3.15Å; S250-S253 PolarHBondContact OG-N 3.48Å; S253-S255 PolarHBondContact O-N 3.07Å; S253-S255 VanDerWaalsContact O-N 3.11Å; S253-L256 PolarHBondContact O-N 2.93Å; S253-L256 VanDerWaalsContact O-N 3.11Å; S253-D312 VanDerWaalsContact CB-OD2 3.3Å; S253-D312 WeakPolarHBondContact CB-OD2 3.31Å; S253-D312 PolarHBondContact OG-OD2 2.82Å
254	P	94.6	Very high	95.2	Very high	50 Å²	50	19.6 Å²	19.6	33%	0.325	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.4	-175.2	26.8	-35.6	0	0	0	114.3	S201 A202 D203 S252	S201-P254 PolarHBondContact OG-O 3.12Å; A202-P254 HydrophobicContact CB-CB 4.17Å; D203-P254 HydrophobicContact CB-CB 3.88Å; S252-P254 WeakPolarHBondContact O-CD 3.49Å
255	S	93.6	Very high	95.2	Very high	5 Å²	5	19.6 Å²	19.6	4%	0.035	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-14.6	177.2	70.3	0	0	0	0	114	S253 D270 T271 R272	S253-S255 PolarHBondContact O-N 3.07Å; S253-S255 VanDerWaalsContact O-N 3.11Å; S255-D270 WeakPolarHBondContact CB-OD1 3.15Å; S255-D270 WeakPolarHBondContact O-CA 3.28Å; S255-D270 PolarHBondContact OG-OD1 2.74Å; S255-T271 VanDerWaalsContact CA-OG1 3.29Å; S255-T271 WeakPolarHBondContact CA-OG1 3.36Å; S255-T271 WeakPolarHBondContact CB-OG1 3.21Å; S255-T271 PolarHBondContact O-N 2.9Å; S255-T271 PolarHBondContact O-OG1 2.81Å; S255-R272 WeakPolarHBondContact OG-CD 3.37Å; S255-R272 PolarHBondContact OG-NE 2.78Å; S255-R272 PolarHBondContact OG-NH1 2.96Å
256	L	95	Very high	95.2	Very high	34 Å²	34	18.1 Å²	18.1	18%	0.178	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.9	-175.8	-64.6	-179.8	0	0	0	110.7	S250 S253 C269 D270 D312	S250-L256 PolarHBondContact N-O 2.82Å; S253-L256 PolarHBondContact O-N 2.93Å; S253-L256 VanDerWaalsContact O-N 3.11Å; L256-C269 WeakPolarHBondContact CA-O 3.49Å; L256-D270 HydrophobicContact CD2-CB 3.69Å; L256-D312 HydrophobicContact CD1-CB 4.49Å
257	F	95.9	Very high	95.1	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	157.5	166.9	70.4	-87	0	0	0	109.7	F208 I215 V229 I230 I247 S248 Y259 C269 T271 C277	F208-F257 HydrophobicContact CE1-CD1 4.01Å; F208-F257 HydrophobicContact CE1-CE1 4.09Å; F208-F257 HydrophobicContact CZ-CD1 4.26Å; I215-F257 HydrophobicContact CD1-CE2 4.24Å; I215-F257 HydrophobicContact CG2-CE2 4.45Å; V229-F257 HydrophobicContact CG1-CE1 4.1Å; V229-F257 HydrophobicContact CG1-CZ 3.79Å; I230-F257 HydrophobicContact CD1-CE2 4.32Å; I230-F257 HydrophobicContact CD1-CZ 4.38Å; I247-F257 HydrophobicContact CD1-CD2 3.9Å; I247-F257 HydrophobicContact CD1-CE2 4.42Å; I247-F257 HydrophobicContact CG1-CD2 4.21Å; S248-F257 CarbonylContact O-C 3.59Å; S248-F257 WeakPolarHBondContact O-CA 3.44Å; F257-Y259 HydrophobicContact CE2-CD1 4.17Å; F257-C269 HydrophobicContact CD1-CB 4.08Å; F257-C269 HydrophobicContact CD2-CB 4.23Å; F257-C269 HydrophobicContact CE1-CB 3.53Å; F257-C269 HydrophobicContact CE2-CB 3.7Å; F257-C269 HydrophobicContact CG-CB 4.4Å; F257-C269 HydrophobicContact CZ-CB 3.32Å; F257-C269 PolarHBondContact N-O 2.85Å; F257-C269 VanDerWaalsContact N-O 3.12Å; F257-C269 PolarHBondContact O-N 3.36Å; F257-T271 HydrophobicContact CD1-CG2 4.02Å; F257-T271 HydrophobicContact CE1-CG2 3.7Å; F257-C277 HydrophobicContact CZ-CB 4.24Å
258	A	96.4	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.2	176.3	0	0	0	0	0	109.4	I247 S248 I266 F267 L268 L305 F307 I315	I247-A258 WeakPolarHBondContact CA-O 3.42Å; I247-A258 WeakPolarHBondContact CG1-O 3.45Å; S248-A258 PolarHBondContact N-O 3.47Å; S248-A258 PolarHBondContact O-N 2.93Å; A258-I266 HydrophobicContact CB-CG2 4.2Å; A258-F267 CarbonylContact C-O 3.52Å; A258-F267 WeakPolarHBondContact CA-O 3.47Å; A258-L268 HydrophobicContact CB-CD1 4.26Å; A258-L305 HydrophobicContact CB-CD1 4.1Å; A258-F307 HydrophobicContact CB-CE2 3.59Å; A258-F307 HydrophobicContact CB-CZ 3.83Å; A258-I315 HydrophobicContact CB-CD1 3.91Å
259	Y	96.9	Very high	94.9	Very high	13 Å²	13	18.9 Å²	18.9	5%	0.051	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.2	172.8	66.9	-91.7	0	0	0	111.1	I215 I230 I244 G246 F257 T261 I266 F267	I215-Y259 HydrophobicContact CD1-CD1 3.63Å; I215-Y259 HydrophobicContact CD1-CD2 4.43Å; I215-Y259 HydrophobicContact CD1-CE1 4.24Å; I215-Y259 HydrophobicContact CD1-CG 3.73Å; I230-Y259 HydrophobicContact CD1-CD1 4.07Å; I230-Y259 HydrophobicContact CD1-CE1 3.43Å; I230-Y259 VanDerWaalsContact CD1-CE1 3.43Å; I244-Y259 HydrophobicContact CG1-CD2 3.89Å; I244-Y259 HydrophobicContact CG1-CE2 4.12Å; I244-Y259 HydrophobicContact CG2-CD2 4.34Å; G246-Y259 VanDerWaalsContact O-CA 3.24Å; G246-Y259 WeakPolarHBondContact O-CA 3.49Å; G246-Y259 VanDerWaalsContact O-CB 3.27Å; G246-Y259 WeakPolarHBondContact O-CB 3.4Å; F257-Y259 HydrophobicContact CE2-CD1 4.17Å; Y259-T261 HydrophobicContact CD2-CG2 3.96Å; Y259-T261 HydrophobicContact CE2-CG2 3.9Å; Y259-I266 WeakPolarHBondContact O-CA 3.38Å; Y259-F267 HydrophobicContact CD1-CB 3.84Å; Y259-F267 HydrophobicContact CD2-CB 4.15Å; Y259-F267 HydrophobicContact CD2-CD2 4.19Å; Y259-F267 HydrophobicContact CD2-CG 4.47Å; Y259-F267 HydrophobicContact CE1-CB 3.32Å; Y259-F267 HydrophobicContact CE1-CG 4.08Å; Y259-F267 HydrophobicContact CE2-CB 3.67Å; Y259-F267 AromaticContact CE2-CD2 3.51Å; Y259-F267 HydrophobicContact CE2-CD2 3.51Å; Y259-F267 HydrophobicContact CE2-CE2 4.29Å; Y259-F267 AromaticContact CE2-CG 3.67Å; Y259-F267 HydrophobicContact CE2-CG 3.67Å; Y259-F267 HydrophobicContact CG-CB 4.24Å; Y259-F267 AromaticContact CZ-CD2 3.83Å; Y259-F267 AromaticContact CZ-CG 3.44Å; Y259-F267 VanDerWaalsContact CZ-CG 3.44Å; Y259-F267 PolarHBondContact N-O 2.89Å; Y259-F267 PolarHBondContact O-N 3.04Å; Y259-F267 WeakPolarHBondContact OH-CD1 3.23Å; Y259-F267 WeakPolarHBondContact OH-CG 3.5Å
260	G	96.5	Very high	94.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	159.1	175.7	0	0	0	0	0	110.9	I244 T245 G246	I244-G260 WeakPolarHBondContact CA-O 3.47Å; T245-G260 PolarHBondContact N-O 2.82Å; T245-G260 PolarHBondContact OG1-O 2.99Å; G246-G260 PolarHBondContact O-N 3.07Å; G246-G260 VanDerWaalsContact O-N 3.1Å
261	T	95.5	Very high	94.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	160.4	-178	67.2	0	0	0	0	113	H242 L243 T245 Y259 R263 G264 S265 F267 V302	H242-T261 HydrophobicContact CB-CG2 3.9Å; H242-T261 PolarHBondContact ND1-OG1 2.78Å; H242-T261 VanDerWaalsContact ND1-OG1 3.11Å; L243-T261 CarbonylContact O-C 3.59Å; L243-T261 WeakPolarHBondContact O-CA 3.36Å; L243-T261 WeakPolarHBondContact O-CB 3.31Å; T245-T261 PolarHBondContact OG1-N 2.87Å; Y259-T261 HydrophobicContact CD2-CG2 3.96Å; Y259-T261 HydrophobicContact CE2-CG2 3.9Å; T261-R263 PolarHBondContact O-N 3.47Å; T261-R263 VanDerWaalsContact O-N 3.12Å; T261-G264 PolarHBondContact O-N 2.96Å; T261-S265 PolarHBondContact N-O 2.83Å; T261-S265 PolarHBondContact OG1-N 2.74Å; T261-S265 PolarHBondContact OG1-O 2.8Å; T261-F267 HydrophobicContact CG2-CD2 3.75Å; T261-F267 HydrophobicContact CG2-CE2 3.65Å; T261-V302 PolarHBondContact O-N 2.84Å; T261-V302 VanDerWaalsContact O-N 3.11Å
262	N	94.2	Very high	94.5	Very high	34 Å²	34	27.4 Å²	27.4	18%	0.182	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.8	178.2	71.3	-33.9	0	0	0	114.5	L243 T245 S301	L243-N262 HydrophobicContact CB-CB 4.35Å; L243-N262 PolarHBondContact N-OD1 2.95Å; L243-N262 PolarHBondContact O-N 2.67Å; L243-N262 PolarHBondContact O-OD1 2.93Å; T245-N262 HydrophobicContact CG2-CB 3.95Å; N262-S301 WeakPolarHBondContact CA-OG 3.44Å; N262-S301 WeakPolarHBondContact O-CA 3.21Å; N262-S301 WeakPolarHBondContact O-CB 3.12Å
263	R	93.1	Very high	94.4	Very high	35 Å²	35	28.4 Å²	28.4	13%	0.132	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	14.5	173.7	-66.7	-162.8	173.6	65.4	17.6	113.8	D239 R240 S241 T261 S265 I297	D239-R263 VanDerWaalsContact O-CZ 3.3Å; D239-R263 PolarHBondContact O-NH2 3.02Å; R240-R263 VanDerWaalsContact C-CZ 3.46Å; R240-R263 PolarHBondContact O-NH1 2.89Å; R240-R263 VanDerWaalsContact O-NH1 3.11Å; S241-R263 PolarHBondContact O-NH1 3.49Å; T261-R263 PolarHBondContact O-N 3.47Å; T261-R263 VanDerWaalsContact O-N 3.12Å; R263-S265 PolarHBondContact O-N 2.98Å; R263-I297 HydrophobicContact CG-CG2 4.15Å
264	G	92.6	Very high	94	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.031	16%	0.157	C	C	.	.	S	Bend	trans	76.2	7.6	176.5	0	0	0	0	0	115.3	T261 S286 N300	T261-G264 PolarHBondContact O-N 2.96Å; G264-S286 VanDerWaalsContact O-CB 3.27Å; G264-S286 WeakPolarHBondContact O-CB 3.37Å; G264-N300 WeakPolarHBondContact CA-O 3.32Å; G264-N300 PolarHBondContact N-O 3.43Å
265	S	94.3	Very high	93.3	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.014	17%	0.171	C	C	.	.			trans	-85.8	145.1	172	-62.6	0	0	0	0	111.2	H242 T261 R263 F284 H285	H242-S265 PolarHBondContact CE1-OG 2.9Å; T261-S265 PolarHBondContact N-O 2.83Å; T261-S265 PolarHBondContact OG1-N 2.74Å; T261-S265 PolarHBondContact OG1-O 2.8Å; R263-S265 PolarHBondContact O-N 2.98Å; S265-F284 CarbonylContact C-O 3.54Å; S265-F284 WeakPolarHBondContact CA-O 3.24Å; S265-F284 WeakPolarHBondContact CB-O 3.29Å; S265-H285 PolarHBondContact OG-CD2 2.77Å
266	I	96.5	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.3	173.5	-57.3	168.5	0	0	0	108	A258 Y259 V283 F284 V302 L305 I315 W326	A258-I266 HydrophobicContact CB-CG2 4.2Å; Y259-I266 WeakPolarHBondContact O-CA 3.38Å; I266-V283 WeakPolarHBondContact O-CA 3.17Å; I266-F284 HydrophobicContact CB-CB 4.22Å; I266-F284 HydrophobicContact CB-CD2 3.99Å; I266-F284 HydrophobicContact CG2-CD2 4.11Å; I266-F284 PolarHBondContact N-O 3.26Å; I266-F284 PolarHBondContact O-N 3.12Å; I266-V302 HydrophobicContact CG1-CG2 4.28Å; I266-L305 HydrophobicContact CG2-CD1 4.38Å; I266-I315 HydrophobicContact CD1-CG2 4.42Å; I266-I315 HydrophobicContact CG2-CD1 4.49Å; I266-I315 HydrophobicContact CG2-CG2 4.43Å; I266-W326 HydrophobicContact CD1-CD2 4.45Å; I266-W326 HydrophobicContact CD1-CG 4.23Å; I266-W326 VanDerWaalsContact CD1-NE1 3.3Å
267	F	95.2	Very high	92.1	Very high	32 Å²	32	33.5 Å²	33.5	14%	0.14	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.4	179.8	-68.3	-104	0	0	0	108.3	H242 A258 Y259 T261 A280 V283	H242-F267 HydrophobicContact CB-CE2 4.37Å; H242-F267 AromaticContact ND1-CE2 3.95Å; A258-F267 CarbonylContact C-O 3.52Å; A258-F267 WeakPolarHBondContact CA-O 3.47Å; Y259-F267 HydrophobicContact CD1-CB 3.84Å; Y259-F267 HydrophobicContact CD2-CB 4.15Å; Y259-F267 HydrophobicContact CD2-CD2 4.19Å; Y259-F267 HydrophobicContact CD2-CG 4.47Å; Y259-F267 HydrophobicContact CE1-CB 3.32Å; Y259-F267 HydrophobicContact CE1-CG 4.08Å; Y259-F267 HydrophobicContact CE2-CB 3.67Å; Y259-F267 AromaticContact CE2-CD2 3.51Å; Y259-F267 HydrophobicContact CE2-CD2 3.51Å; Y259-F267 HydrophobicContact CE2-CE2 4.29Å; Y259-F267 AromaticContact CE2-CG 3.67Å; Y259-F267 HydrophobicContact CE2-CG 3.67Å; Y259-F267 HydrophobicContact CG-CB 4.24Å; Y259-F267 AromaticContact CZ-CD2 3.83Å; Y259-F267 AromaticContact CZ-CG 3.44Å; Y259-F267 VanDerWaalsContact CZ-CG 3.44Å; Y259-F267 PolarHBondContact N-O 2.89Å; Y259-F267 PolarHBondContact O-N 3.04Å; Y259-F267 WeakPolarHBondContact OH-CD1 3.23Å; Y259-F267 WeakPolarHBondContact OH-CG 3.5Å; T261-F267 HydrophobicContact CG2-CD2 3.75Å; T261-F267 HydrophobicContact CG2-CE2 3.65Å; F267-A280 HydrophobicContact CB-CB 3.96Å; F267-A280 HydrophobicContact CD1-CB 3.7Å; F267-A280 HydrophobicContact CG-CB 4.33Å; F267-V283 HydrophobicContact CD1-CB 4.39Å; F267-V283 HydrophobicContact CD1-CG1 3.93Å; F267-V283 HydrophobicContact CD1-CG2 3.59Å; F267-V283 HydrophobicContact CD2-CG1 4.42Å; F267-V283 HydrophobicContact CE1-CB 4.47Å; F267-V283 HydrophobicContact CE1-CG1 3.76Å; F267-V283 HydrophobicContact CE1-CG2 3.78Å; F267-V283 HydrophobicContact CE2-CG1 4.25Å; F267-V283 HydrophobicContact CG-CG1 4.25Å; F267-V283 HydrophobicContact CG-CG2 4.41Å; F267-V283 HydrophobicContact CZ-CG1 3.93Å
268	L	95.3	Very high	91.2	Very high	13 Å²	13	38.6 Å²	38.6	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.8	175.4	175.2	65.9	0	0	0	109	A258 A280 S281 L282 F284 F307 I315	A258-L268 HydrophobicContact CB-CD1 4.26Å; L268-A280 CarbonylContact O-C 3.58Å; L268-S281 WeakPolarHBondContact O-CB 3.5Å; L268-S281 PolarHBondContact O-N 2.97Å; L268-L282 HydrophobicContact CB-CB 4.14Å; L268-L282 HydrophobicContact CD2-CB 4.17Å; L268-L282 HydrophobicContact CD2-CD2 4.14Å; L268-L282 PolarHBondContact N-O 2.97Å; L268-L282 PolarHBondContact O-N 2.92Å; L268-L282 VanDerWaalsContact O-N 3.16Å; L268-F284 HydrophobicContact CB-CE2 4.36Å; L268-F307 HydrophobicContact CD1-CE1 4.08Å; L268-F307 HydrophobicContact CD1-CZ 3.56Å; L268-I315 HydrophobicContact CD1-CD1 4.29Å
269	C	94.9	Very high	90.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.6	-175.2	-65.5	0	0	0	0	110.9	L256 F257 C277	L256-C269 WeakPolarHBondContact CA-O 3.49Å; F257-C269 HydrophobicContact CD1-CB 4.08Å; F257-C269 HydrophobicContact CD2-CB 4.23Å; F257-C269 HydrophobicContact CE1-CB 3.53Å; F257-C269 HydrophobicContact CE2-CB 3.7Å; F257-C269 HydrophobicContact CG-CB 4.4Å; F257-C269 HydrophobicContact CZ-CB 3.32Å; F257-C269 PolarHBondContact N-O 2.85Å; F257-C269 VanDerWaalsContact N-O 3.12Å; F257-C269 PolarHBondContact O-N 3.36Å; C269-C277 HydrophobicContact CB-CB 4.15Å
270	D	93.5	Very high	89.8	Confident	34 Å²	34	47.5 Å²	47.5	18%	0.182	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.7	169.4	-170	-13.8	0	0	0	110.2	S255 L256 R272 S273 S281	S255-D270 WeakPolarHBondContact CB-OD1 3.15Å; S255-D270 WeakPolarHBondContact O-CA 3.28Å; S255-D270 PolarHBondContact OG-OD1 2.74Å; L256-D270 HydrophobicContact CD2-CB 3.69Å; D270-R272 PolarHBondContact O-N 3.21Å; D270-R272 VanDerWaalsContact O-N 3.11Å; D270-R272 WeakPolarHBondContact OD1-CB 3.45Å; D270-R272 PolarHBondContact OD1-N 3.07Å; D270-S273 PolarHBondContact O-N 2.64Å; D270-S281 PolarHBondContact N-OG 3.21Å
271	T	92	Very high	89.3	Confident	45 Å²	45	50.6 Å²	50.6	28%	0.276	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.2	179.9	59.4	0	0	0	0	113.6	F208 S255 F257	F208-T271 HydrophobicContact CZ-CG2 4.32Å; S255-T271 VanDerWaalsContact CA-OG1 3.29Å; S255-T271 WeakPolarHBondContact CA-OG1 3.36Å; S255-T271 WeakPolarHBondContact CB-OG1 3.21Å; S255-T271 PolarHBondContact O-N 2.9Å; S255-T271 PolarHBondContact O-OG1 2.81Å; F257-T271 HydrophobicContact CD1-CG2 4.02Å; F257-T271 HydrophobicContact CE1-CG2 3.7Å
272	R	91.8	Very high	89.2	Confident	174 Å²	174	52.6 Å²	52.6	66%	0.657	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-25.8	173.8	-63.2	166	-177.4	156.3	4.8	113	S255 D270	S255-R272 WeakPolarHBondContact OG-CD 3.37Å; S255-R272 PolarHBondContact OG-NE 2.78Å; S255-R272 PolarHBondContact OG-NH1 2.96Å; D270-R272 PolarHBondContact O-N 3.21Å; D270-R272 VanDerWaalsContact O-N 3.11Å; D270-R272 WeakPolarHBondContact OD1-CB 3.45Å; D270-R272 PolarHBondContact OD1-N 3.07Å
273	S	89.7	Confident	89.1	Confident	92 Å²	92	52.9 Å²	52.9	64%	0.643	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-35.9	-177.1	-68.2	0	0	0	0	111.9	D270	D270-S273 PolarHBondContact O-N 2.64Å
274	S	86.5	Confident	89.1	Confident	55 Å²	55	51.2 Å²	51.2	39%	0.385	29%	0.285	S	S	.	.			trans	-155.8	143.2	175.6	-177.9	0	0	0	0	109.9	L276	S274-L276 VanDerWaalsContact C-N 3.29Å; S274-L276 WeakPolarHBondContact CB-O 3.46Å; S274-L276 PolarHBondContact OG-N 2.92Å; S274-L276 PolarHBondContact OG-O 3.29Å
275	S	80	Confident	89.1	Confident	88 Å²	88	55.9 Å²	55.9	62%	0.615	31%	0.305	S	S	*	.	S	Bend	trans	-64.2	-38.1	173.3	53.5	0	0	0	0	111.5	F227	F227-S275 VanDerWaalsContact CE1-O 3.25Å; F227-S275 WeakPolarHBondContact CE1-O 3.34Å; F227-S275 WeakPolarHBondContact CZ-O 3.39Å
276	L	84	Confident	88.7	Confident	77 Å²	77	57.5 Å²	57.5	40%	0.403	32%	0.316	S	S	.	.	S	Bend	trans	-98.5	114.2	169.8	-59.8	175.2	0	0	0	107.3	F227 S274 D278	F227-L276 HydrophobicContact CZ-CD2 4.13Å; S274-L276 VanDerWaalsContact C-N 3.29Å; S274-L276 WeakPolarHBondContact CB-O 3.46Å; S274-L276 PolarHBondContact OG-N 2.92Å; S274-L276 PolarHBondContact OG-O 3.29Å; L276-D278 PolarHBondContact O-N 2.88Å
277	C	80.3	Confident	88.4	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.041	32%	0.324	C	S	.	.			trans	-79.1	43.4	-178.6	-61.3	0	0	0	0	111.7	V229 I230 F257 C269 H279	V229-C277 HydrophobicContact CG1-CB 3.83Å; V229-C277 WeakPolarHBondContact CG1-SG 3.36Å; V229-C277 PolarHBondContact O-N 2.81Å; I230-C277 HydrophobicContact CD1-CB 4.39Å; I230-C277 HydrophobicContact CG1-CB 4.23Å; F257-C277 HydrophobicContact CZ-CB 4.24Å; C269-C277 HydrophobicContact CB-CB 4.15Å; C277-H279 PolarHBondContact O-N 2.87Å; C277-H279 VanDerWaalsContact O-N 3.15Å
278	D	76.5	Confident	88	Confident	108 Å²	108	60.1 Å²	60.1	58%	0.578	34%	0.34	S	S	*	.			trans	-60.5	-24.9	-177.3	-63.1	-22.7	0	0	0	112.5	L276	L276-D278 PolarHBondContact O-N 2.88Å
279	H	80.2	Confident	87.4	Confident	172 Å²	172	63.5 Å²	63.5	80%	0.796	37%	0.37	S	S	*	.	S	Bend	trans	-121.1	115.8	173.3	-59.5	-25.3	0	0	0	108.2	C277	C277-H279 PolarHBondContact O-N 2.87Å; C277-H279 VanDerWaalsContact O-N 3.15Å
280	A	83.2	Confident	87	Confident	28 Å²	28	68.9 Å²	68.9	23%	0.231	40%	0.399	C	S	.	.			trans	-63.2	141.4	172.6	0	0	0	0	0	110	F267 L268 L282 V283	F267-A280 HydrophobicContact CB-CB 3.96Å; F267-A280 HydrophobicContact CD1-CB 3.7Å; F267-A280 HydrophobicContact CG-CB 4.33Å; L268-A280 CarbonylContact O-C 3.58Å; A280-L282 PolarHBondContact O-N 2.86Å; A280-V283 HydrophobicContact CB-CG2 3.9Å
281	S	86.2	Confident	86.8	Confident	65 Å²	65	70.6 Å²	70.6	46%	0.455	41%	0.405	S	S	.	.	S	Bend	trans	-64.2	-33.7	176.6	-53.9	0	0	0	0	111.2	L268 D270	L268-S281 WeakPolarHBondContact O-CB 3.5Å; L268-S281 PolarHBondContact O-N 2.97Å; D270-S281 PolarHBondContact N-OG 3.21Å
282	L	92.6	Very high	86.7	Confident	42 Å²	42	73.4 Å²	73.4	22%	0.22	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	144.8	177.7	-173.1	71.1	0	0	0	110.2	L268 A280 F284 S328 P331	L268-L282 HydrophobicContact CB-CB 4.14Å; L268-L282 HydrophobicContact CD2-CB 4.17Å; L268-L282 HydrophobicContact CD2-CD2 4.14Å; L268-L282 PolarHBondContact N-O 2.97Å; L268-L282 PolarHBondContact O-N 2.92Å; L268-L282 VanDerWaalsContact O-N 3.16Å; A280-L282 PolarHBondContact O-N 2.86Å; L282-F284 HydrophobicContact CD2-CE1 3.94Å; L282-F284 HydrophobicContact CD2-CE2 3.96Å; L282-F284 HydrophobicContact CD2-CZ 3.46Å; L282-F284 VanDerWaalsContact CD2-CZ 3.46Å; L282-F284 HydrophobicContact CG-CE2 4.44Å; L282-F284 HydrophobicContact CG-CZ 4.29Å; L282-S328 WeakPolarHBondContact CD2-O 3.21Å; L282-P331 HydrophobicContact CD1-CB 3.54Å; L282-P331 HydrophobicContact CD1-CG 3.75Å; L282-P331 HydrophobicContact CD2-CB 4.02Å; L282-P331 HydrophobicContact CG-CB 3.94Å
283	V	93.2	Very high	86.7	Confident	40 Å²	40	68.3 Å²	68.3	24%	0.242	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.6	178	-169.6	0	0	0	0	109.7	I266 F267 A280 H285	I266-V283 WeakPolarHBondContact O-CA 3.17Å; F267-V283 HydrophobicContact CD1-CB 4.39Å; F267-V283 HydrophobicContact CD1-CG1 3.93Å; F267-V283 HydrophobicContact CD1-CG2 3.59Å; F267-V283 HydrophobicContact CD2-CG1 4.42Å; F267-V283 HydrophobicContact CE1-CB 4.47Å; F267-V283 HydrophobicContact CE1-CG1 3.76Å; F267-V283 HydrophobicContact CE1-CG2 3.78Å; F267-V283 HydrophobicContact CE2-CG1 4.25Å; F267-V283 HydrophobicContact CG-CG1 4.25Å; F267-V283 HydrophobicContact CG-CG2 4.41Å; F267-V283 HydrophobicContact CZ-CG1 3.93Å; A280-V283 HydrophobicContact CB-CG2 3.9Å; V283-H285 WeakPolarHBondContact CG1-CE1 3.5Å
284	F	93.5	Very high	86.8	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.3	171.4	-53.6	-86	0	0	0	108.3	S265 I266 L268 L282 I315 W326 P331	S265-F284 CarbonylContact C-O 3.54Å; S265-F284 WeakPolarHBondContact CA-O 3.24Å; S265-F284 WeakPolarHBondContact CB-O 3.29Å; I266-F284 HydrophobicContact CB-CB 4.22Å; I266-F284 HydrophobicContact CB-CD2 3.99Å; I266-F284 HydrophobicContact CG2-CD2 4.11Å; I266-F284 PolarHBondContact N-O 3.26Å; I266-F284 PolarHBondContact O-N 3.12Å; L268-F284 HydrophobicContact CB-CE2 4.36Å; L282-F284 HydrophobicContact CD2-CE1 3.94Å; L282-F284 HydrophobicContact CD2-CE2 3.96Å; L282-F284 HydrophobicContact CD2-CZ 3.46Å; L282-F284 VanDerWaalsContact CD2-CZ 3.46Å; L282-F284 HydrophobicContact CG-CE2 4.44Å; L282-F284 HydrophobicContact CG-CZ 4.29Å; F284-I315 HydrophobicContact CE2-CD1 3.9Å; F284-I315 HydrophobicContact CZ-CD1 4.47Å; F284-W326 HydrophobicContact CB-CD2 4.05Å; F284-W326 HydrophobicContact CB-CE3 3.65Å; F284-W326 HydrophobicContact CB-CH2 4.29Å; F284-W326 HydrophobicContact CB-CZ3 3.78Å; F284-W326 HydrophobicContact CD1-CB 4.04Å; F284-W326 HydrophobicContact CD1-CD2 4.17Å; F284-W326 AromaticContact CD1-CE3 3.61Å; F284-W326 HydrophobicContact CD1-CE3 3.61Å; F284-W326 HydrophobicContact CD1-CG 4.39Å; F284-W326 HydrophobicContact CD1-CZ3 4.36Å; F284-W326 HydrophobicContact CE1-CB 3.98Å; F284-W326 HydrophobicContact CG-CB 4.42Å; F284-W326 HydrophobicContact CG-CD2 4.21Å; F284-W326 AromaticContact CG-CE3 3.91Å; F284-W326 HydrophobicContact CG-CE3 3.91Å; F284-W326 HydrophobicContact CG-CG 4.46Å; F284-W326 HydrophobicContact CG-CZ3 4.49Å; F284-W326 HydrophobicContact CZ-CB 4.32Å; F284-P331 HydrophobicContact CD1-CB 4.09Å; F284-P331 HydrophobicContact CE1-CB 4Å
285	H	90.9	Very high	87.1	Confident	101 Å²	101	67.6 Å²	67.6	47%	0.468	40%	0.4	S	S	.	.			trans	-105.6	127.7	178.5	-65.6	91.8	0	0	0	109.7	S265 V283	S265-H285 PolarHBondContact OG-CD2 2.77Å; V283-H285 WeakPolarHBondContact CG1-CE1 3.5Å
286	S	87	Confident	87.7	Confident	35 Å²	35	65.4 Å²	65.4	25%	0.245	38%	0.383	C	S	.	.	S	Bend	trans	-96.1	-22.1	170.4	-171.3	0	0	0	0	113.2	G264 N300 K324	G264-S286 VanDerWaalsContact O-CB 3.27Å; G264-S286 WeakPolarHBondContact O-CB 3.37Å; S286-N300 PolarHBondContact OG-OD1 2.87Å; S286-K324 PolarHBondContact OG-NZ 2.93Å
287	L	89.3	Confident	88.1	Confident	29 Å²	29	63 Å²	63	15%	0.152	37%	0.37	C	S	.	.	S	Bend	trans	-124.5	157.6	-178.2	-69.1	-178.8	0	0	0	110.4	E291 T296 I297 N300	L287-E291 HydrophobicContact CB-CB 4.43Å; L287-E291 HydrophobicContact CD1-CG 4.28Å; L287-E291 HydrophobicContact CD2-CG 4.43Å; L287-T296 HydrophobicContact CD1-CG2 4.37Å; L287-T296 HydrophobicContact CD2-CG2 3.63Å; L287-I297 HydrophobicContact CD1-CG1 4.45Å; L287-N300 HydrophobicContact CD1-CB 3.76Å; L287-N300 HydrophobicContact CD2-CB 4.26Å; L287-N300 HydrophobicContact CG-CB 3.95Å
288	A	87.4	Confident	88.7	Confident	58 Å²	58	64.7 Å²	64.7	48%	0.479	38%	0.379	S	S	.	.			trans	-68.3	147.5	167.9	0	0	0	0	0	110.1	D290 E291	A288-D290 VanDerWaalsContact CB-OD1 3.31Å; A288-D290 WeakPolarHBondContact CB-OD1 3.29Å; A288-D290 PolarHBondContact O-N 2.97Å; A288-E291 WeakPolarHBondContact O-CB 3.29Å; A288-E291 PolarHBondContact O-N 2.86Å; A288-E291 VanDerWaalsContact O-N 3.16Å
289	A	83	Confident	89.6	Confident	84 Å²	84	59.9 Å²	59.9	69%	0.694	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-21	-176.4	0	0	0	0	0	113.5
290	D	86.1	Confident	90.3	Very high	114 Å²	114	53 Å²	53	61%	0.61	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	7.8	179.1	62.5	-34.9	0	0	0	113.5	A288 S292	A288-D290 VanDerWaalsContact CB-OD1 3.31Å; A288-D290 WeakPolarHBondContact CB-OD1 3.29Å; A288-D290 PolarHBondContact O-N 2.97Å; D290-S292 PolarHBondContact O-N 2.84Å
291	E	90.4	Very high	90.9	Very high	69 Å²	69	53.1 Å²	53.1	32%	0.322	32%	0.322	S	S	.	.			trans	-58	125.3	176.6	-170.6	56.3	-114.9	0	0	110.2	L287 A288 D293 T296 I297	L287-E291 HydrophobicContact CB-CB 4.43Å; L287-E291 HydrophobicContact CD1-CG 4.28Å; L287-E291 HydrophobicContact CD2-CG 4.43Å; A288-E291 WeakPolarHBondContact O-CB 3.29Å; A288-E291 PolarHBondContact O-N 2.86Å; A288-E291 VanDerWaalsContact O-N 3.16Å; E291-D293 WeakPolarHBondContact OE1-CB 3.14Å; E291-D293 PolarHBondContact OE1-N 3.24Å; E291-T296 HydrophobicContact CG-CG2 3.94Å; E291-I297 HydrophobicContact CG-CG1 4.38Å
292	S	89.3	Confident	91.4	Very high	104 Å²	104	50.2 Å²	50.2	73%	0.727	30%	0.301	S	S	*	.			trans	-120.4	-10.2	-173.9	59	0	0	0	0	113	D290 V294	D290-S292 PolarHBondContact O-N 2.84Å; S292-V294 PolarHBondContact O-N 3.3Å
293	D	91.5	Very high	91.6	Very high	68 Å²	68	48.9 Å²	48.9	36%	0.364	30%	0.295	S	S	.	.			trans	-71.4	114.3	175.7	176.3	36.2	0	0	0	110.8	E291 L295 T296 I297	E291-D293 WeakPolarHBondContact OE1-CB 3.14Å; E291-D293 PolarHBondContact OE1-N 3.24Å; D293-L295 VanDerWaalsContact C-N 3.3Å; D293-L295 PolarHBondContact O-N 3.11Å; D293-L295 PolarHBondContact OD1-N 3.46Å; D293-T296 PolarHBondContact O-N 3.35Å; D293-T296 VanDerWaalsContact OD2-CB 3.23Å; D293-T296 WeakPolarHBondContact OD2-CB 3.33Å; D293-T296 PolarHBondContact OD2-N 3.03Å; D293-T296 PolarHBondContact OD2-OG1 3.33Å; D293-I297 WeakPolarHBondContact O-CG1 3.44Å; D293-I297 PolarHBondContact O-N 2.9Å
294	V	91.2	Very high	91.8	Very high	83 Å²	83	47.6 Å²	47.6	50%	0.503	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-41.7	-177.2	179	0	0	0	0	111.2	S292 I297 L298	S292-V294 PolarHBondContact O-N 3.3Å; V294-I297 PolarHBondContact O-N 2.95Å; V294-L298 HydrophobicContact CG1-CD1 3.91Å; V294-L298 HydrophobicContact CG1-CG 4.3Å; V294-L298 WeakPolarHBondContact O-CB 3.46Å; V294-L298 VanDerWaalsContact O-CG 3.27Å; V294-L298 WeakPolarHBondContact O-CG 3.47Å; V294-L298 PolarHBondContact O-N 2.89Å
295	L	93	Very high	91.9	Very high	49 Å²	49	47.8 Å²	47.8	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-68.4	-39.4	-179.7	-69.2	176.5	0	0	0	111.4	D293 L298 T299 L348 Y352 L357	D293-L295 VanDerWaalsContact C-N 3.3Å; D293-L295 PolarHBondContact O-N 3.11Å; D293-L295 PolarHBondContact OD1-N 3.46Å; L295-L298 PolarHBondContact O-N 2.73Å; L295-T299 WeakPolarHBondContact O-CB 3.48Å; L295-T299 VanDerWaalsContact O-CG2 3.28Å; L295-T299 WeakPolarHBondContact O-CG2 3.31Å; L295-T299 PolarHBondContact O-N 3.16Å; L295-T299 PolarHBondContact O-OG1 3.33Å; L295-L348 HydrophobicContact CD1-CB 4.47Å; L295-Y352 HydrophobicContact CD2-CG 4.24Å; L295-L357 HydrophobicContact CD2-CD1 4Å
296	T	93	Very high	92.2	Very high	42 Å²	42	44.2 Å²	44.2	26%	0.258	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-41.9	173.8	-66.6	0	0	0	0	111.7	L287 E291 D293 T299 N300	L287-T296 HydrophobicContact CD1-CG2 4.37Å; L287-T296 HydrophobicContact CD2-CG2 3.63Å; E291-T296 HydrophobicContact CG-CG2 3.94Å; D293-T296 PolarHBondContact O-N 3.35Å; D293-T296 VanDerWaalsContact OD2-CB 3.23Å; D293-T296 WeakPolarHBondContact OD2-CB 3.33Å; D293-T296 PolarHBondContact OD2-N 3.03Å; D293-T296 PolarHBondContact OD2-OG1 3.33Å; T296-T299 PolarHBondContact O-OG1 3.21Å; T296-N300 WeakPolarHBondContact O-CB 3.47Å; T296-N300 PolarHBondContact O-N 2.93Å; T296-N300 VanDerWaalsContact O-N 3.17Å; T296-N300 PolarHBondContact O-ND2 3.16Å
297	I	93	Very high	92.7	Very high	25 Å²	25	42.6 Å²	42.6	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-53.2	175.2	-67.5	165.5	0	0	0	110.5	R263 L287 E291 D293 V294 T299 N300 S301	R263-I297 HydrophobicContact CG-CG2 4.15Å; L287-I297 HydrophobicContact CD1-CG1 4.45Å; E291-I297 HydrophobicContact CG-CG1 4.38Å; D293-I297 WeakPolarHBondContact O-CG1 3.44Å; D293-I297 PolarHBondContact O-N 2.9Å; V294-I297 PolarHBondContact O-N 2.95Å; I297-T299 VanDerWaalsContact C-N 3.33Å; I297-T299 PolarHBondContact O-N 3.12Å; I297-N300 PolarHBondContact O-N 2.83Å; I297-S301 PolarHBondContact O-N 3.08Å
298	L	93.4	Very high	92.9	Very high	43 Å²	43	41.2 Å²	41.2	23%	0.225	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-42.2	-177.8	-71	174.1	0	0	0	112.2	V294 L295 N300 S301 Y352 F358	V294-L298 HydrophobicContact CG1-CD1 3.91Å; V294-L298 HydrophobicContact CG1-CG 4.3Å; V294-L298 WeakPolarHBondContact O-CB 3.46Å; V294-L298 VanDerWaalsContact O-CG 3.27Å; V294-L298 WeakPolarHBondContact O-CG 3.47Å; V294-L298 PolarHBondContact O-N 2.89Å; L295-L298 PolarHBondContact O-N 2.73Å; L298-N300 VanDerWaalsContact C-N 3.32Å; L298-N300 PolarHBondContact O-N 3Å; L298-S301 WeakPolarHBondContact O-CB 3.4Å; L298-S301 PolarHBondContact O-N 2.84Å; L298-Y352 HydrophobicContact CD1-CD2 3.62Å; L298-Y352 HydrophobicContact CD1-CE2 3.51Å; L298-F358 HydrophobicContact CD2-CE1 3.96Å
299	T	94.6	Very high	93.2	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-72.9	-21.6	-179.1	53	0	0	0	0	114.2	L295 T296 I297 D319 Y320 L321 L348	L295-T299 WeakPolarHBondContact O-CB 3.48Å; L295-T299 VanDerWaalsContact O-CG2 3.28Å; L295-T299 WeakPolarHBondContact O-CG2 3.31Å; L295-T299 PolarHBondContact O-N 3.16Å; L295-T299 PolarHBondContact O-OG1 3.33Å; T296-T299 PolarHBondContact O-OG1 3.21Å; I297-T299 VanDerWaalsContact C-N 3.33Å; I297-T299 PolarHBondContact O-N 3.12Å; T299-D319 WeakPolarHBondContact O-CB 2.92Å; T299-Y320 HydrophobicContact CG2-CD1 4.32Å; T299-Y320 WeakPolarHBondContact O-CB 3.43Å; T299-Y320 PolarHBondContact O-N 3.27Å; T299-L321 HydrophobicContact CG2-CD1 4.45Å; T299-L348 HydrophobicContact CG2-CD1 3.96Å; T299-L348 HydrophobicContact CG2-CD2 3.61Å; T299-L348 HydrophobicContact CG2-CG 4.4Å
300	N	94.5	Very high	93.5	Very high	27 Å²	27	42.5 Å²	42.5	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-96.1	-5.7	175.4	-77.9	-89.3	0	0	0	113.5	G264 S286 L287 T296 I297 L298 V302 K324	G264-N300 WeakPolarHBondContact CA-O 3.32Å; G264-N300 PolarHBondContact N-O 3.43Å; S286-N300 PolarHBondContact OG-OD1 2.87Å; L287-N300 HydrophobicContact CD1-CB 3.76Å; L287-N300 HydrophobicContact CD2-CB 4.26Å; L287-N300 HydrophobicContact CG-CB 3.95Å; T296-N300 WeakPolarHBondContact O-CB 3.47Å; T296-N300 PolarHBondContact O-N 2.93Å; T296-N300 VanDerWaalsContact O-N 3.17Å; T296-N300 PolarHBondContact O-ND2 3.16Å; I297-N300 PolarHBondContact O-N 2.83Å; L298-N300 VanDerWaalsContact C-N 3.32Å; L298-N300 PolarHBondContact O-N 3Å; N300-V302 PolarHBondContact O-N 3.3Å; N300-K324 PolarHBondContact OD1-NZ 3.32Å
301	S	95.4	Very high	93.7	Very high	31 Å²	31	37.4 Å²	37.4	22%	0.217	22%	0.217	C	C	.	.	S	Bend	trans	-51.5	131.8	173	-179.4	0	0	0	0	111.1	N262 I297 L298 S303 D319	N262-S301 WeakPolarHBondContact CA-OG 3.44Å; N262-S301 WeakPolarHBondContact O-CA 3.21Å; N262-S301 WeakPolarHBondContact O-CB 3.12Å; I297-S301 PolarHBondContact O-N 3.08Å; L298-S301 WeakPolarHBondContact O-CB 3.4Å; L298-S301 PolarHBondContact O-N 2.84Å; S301-S303 PolarHBondContact O-N 2.66Å; S301-D319 WeakPolarHBondContact O-CA 3.33Å; S301-D319 WeakPolarHBondContact O-CB 3.26Å
302	V	97.1	Very high	93.8	Very high	4 Å²	4	36 Å²	36	2%	0.024	21%	0.211	C	C	.	.			trans	-75.4	109.5	179.1	-177.9	0	0	0	0	108.9	T245 T261 I266 N300 D304 L305 R318	T245-V302 WeakPolarHBondContact CB-O 3.06Å; T245-V302 PolarHBondContact OG1-O 2.83Å; T261-V302 PolarHBondContact O-N 2.84Å; T261-V302 VanDerWaalsContact O-N 3.11Å; I266-V302 HydrophobicContact CG1-CG2 4.28Å; N300-V302 PolarHBondContact O-N 3.3Å; V302-D304 WeakPolarHBondContact CG1-O 3.4Å; V302-L305 HydrophobicContact CG1-CB 4.23Å; V302-L305 HydrophobicContact CG1-CD2 4.43Å; V302-R318 CarbonylContact C-O 3.54Å; V302-R318 WeakPolarHBondContact CA-O 3.35Å
303	S	96.1	Very high	94	Very high	13 Å²	13	35.4 Å²	35.4	9%	0.091	19%	0.194	C	C	.	.			trans	-82.2	-28.6	177.6	65.8	0	0	0	0	113.2	S301 R318 F361 K362	S301-S303 PolarHBondContact O-N 2.66Å; S303-R318 PolarHBondContact N-O 3.27Å; S303-R318 WeakPolarHBondContact OG-CB 3.42Å; S303-R318 VanDerWaalsContact OG-CG 3.3Å; S303-R318 WeakPolarHBondContact OG-CG 3.48Å; S303-R318 PolarHBondContact OG-O 2.77Å; S303-F361 PolarHBondContact OG-O 2.9Å; S303-K362 PolarHBondContact O-NZ 2.84Å
304	D	97.6	Very high	94.1	Very high	13 Å²	13	33 Å²	33	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	150.1	176.2	-161.9	19.3	0	0	0	110.9	V302 S317 R318 K362 L363	V302-D304 WeakPolarHBondContact CG1-O 3.4Å; D304-S317 WeakPolarHBondContact O-CA 3.26Å; D304-R318 HydrophobicContact CB-CB 4.31Å; D304-R318 PolarHBondContact O-N 2.92Å; D304-K362 HydrophobicContact CB-CD 3.77Å; D304-K362 WeakPolarHBondContact OD2-CA 3.27Å; D304-K362 WeakPolarHBondContact OD2-CB 3.48Å; D304-L363 HydrophobicContact CB-CD2 4.26Å; D304-L363 HydrophobicContact CB-CG 4.35Å; D304-L363 PolarHBondContact OD2-N 2.96Å
305	L	96.9	Very high	94.4	Very high	4 Å²	4	29 Å²	29	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.9	173.9	72.1	156.8	0	0	0	111.3	G246 A258 I266 V302 F316	G246-L305 VanDerWaalsContact C-CD2 3.42Å; A258-L305 HydrophobicContact CB-CD1 4.1Å; I266-L305 HydrophobicContact CG2-CD1 4.38Å; V302-L305 HydrophobicContact CG1-CB 4.23Å; V302-L305 HydrophobicContact CG1-CD2 4.43Å; L305-F316 CarbonylContact C-O 3.56Å; L305-F316 VanDerWaalsContact CA-O 3.25Å; L305-F316 WeakPolarHBondContact CA-O 3.33Å
306	K	96.9	Very high	94.6	Very high	26 Å²	26	26.7 Å²	26.7	11%	0.113	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	138.5	178.1	-66.8	-173.7	175	178.1	0	110.5	F316 L363 I365	K306-F316 PolarHBondContact N-O 2.78Å; K306-F316 PolarHBondContact O-N 3.24Å; K306-L363 HydrophobicContact CB-CD1 4.25Å; K306-L363 HydrophobicContact CD-CD1 4.16Å; K306-L363 WeakPolarHBondContact CD-O 3.43Å; K306-L363 WeakPolarHBondContact CE-O 3.27Å; K306-L363 HydrophobicContact CG-CD1 4.27Å; K306-L363 PolarHBondContact NZ-O 3.49Å; K306-I365 HydrophobicContact CB-CD1 3.46Å; K306-I365 VanDerWaalsContact CB-CD1 3.46Å; K306-I365 HydrophobicContact CD-CD1 3.83Å; K306-I365 HydrophobicContact CG-CD1 4.18Å
307	F	96.8	Very high	94.8	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	155	163.9	-84.7	-93	0	0	0	110.9	S248 C249 A258 L268 I315	S248-F307 WeakPolarHBondContact O-CE2 3.29Å; S248-F307 PolarHBondContact OG-N 3.11Å; C249-F307 WeakPolarHBondContact O-CD2 3.44Å; A258-F307 HydrophobicContact CB-CE2 3.59Å; A258-F307 HydrophobicContact CB-CZ 3.83Å; L268-F307 HydrophobicContact CD1-CE1 4.08Å; L268-F307 HydrophobicContact CD1-CZ 3.56Å; F307-I315 HydrophobicContact CD1-CG1 4.06Å; F307-I315 HydrophobicContact CE1-CD1 4.14Å; F307-I315 HydrophobicContact CE1-CG1 3.96Å; F307-I315 HydrophobicContact CZ-CD1 4.16Å; F307-I315 HydrophobicContact CZ-CG1 4.32Å
308	G	94.5	Very high	95	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.			trans	-54.7	146.4	163.7	0	0	0	0	0	112.1	N251 I314 D369	N251-G308 PolarHBondContact ND2-O 2.8Å; G308-I314 PolarHBondContact N-O 2.89Å; G308-D369 WeakPolarHBondContact CA-OD1 3.31Å; G308-D369 WeakPolarHBondContact CA-OD2 3.37Å
309	Q	93.1	Very high	95.2	Very high	77 Å²	77	21.9 Å²	21.9	36%	0.36	12%	0.118	S	C	.	.	S	Bend	trans	-73.8	-32.1	174.2	-59.2	-59.3	-41.4	0	0	111.2	S367 D369	Q309-S367 WeakPolarHBondContact CB-O 3.33Å; Q309-D369 WeakPolarHBondContact CB-OD1 3.4Å; Q309-D369 PolarHBondContact N-OD1 3.49Å; Q309-D369 PolarHBondContact N-OD2 3.18Å
310	C	90.3	Very high	95.2	Very high	93 Å²	93	22 Å²	22	63%	0.628	12%	0.117	S	C	*	.	S	Bend	trans	-109.3	-7.5	-179.6	-72.8	0	0	0	0	113.4	S367 D369	C310-S367 PolarHBondContact SG-O 3.19Å; C310-D369 PolarHBondContact N-OD2 2.99Å
311	S	90.1	Very high	95.2	Very high	7 Å²	7	22.2 Å²	22.2	5%	0.049	12%	0.118	C	C	.	.			trans	-138.4	130.6	-170.3	55.1	0	0	0	0	112.5	Y313 I314 D369	S311-Y313 VanDerWaalsContact C-N 3.35Å; S311-I314 WeakPolarHBondContact OG-CB 3.38Å; S311-I314 WeakPolarHBondContact OG-CD1 3.14Å; S311-I314 WeakPolarHBondContact OG-CG1 3.5Å; S311-D369 PolarHBondContact N-OD2 3.18Å; S311-D369 PolarHBondContact OG-OD2 2.83Å
312	D	91.3	Very high	95.2	Very high	38 Å²	38	21.4 Å²	21.4	20%	0.203	11%	0.113	C	C	.	.	S	Bend	trans	-87.2	-8.7	176.1	-72.6	-15.1	0	0	0	113	S250 S252 S253 L256	S250-D312 PolarHBondContact OG-OD1 3.25Å; S252-D312 WeakPolarHBondContact CB-OD1 3.41Å; S252-D312 WeakPolarHBondContact CB-OD2 3.13Å; S252-D312 PolarHBondContact OG-OD1 3.28Å; S253-D312 VanDerWaalsContact CB-OD2 3.3Å; S253-D312 WeakPolarHBondContact CB-OD2 3.31Å; S253-D312 PolarHBondContact OG-OD2 2.82Å; L256-D312 HydrophobicContact CD1-CB 4.49Å
313	Y	92.9	Very high	95.2	Very high	93 Å²	93	21.2 Å²	21.2	37%	0.365	11%	0.112	S	C	.	.	S	Bend	trans	-101.4	-9.1	-179.9	58.9	-92	0	0	0	113.2	S311 D327 S328	S311-Y313 VanDerWaalsContact C-N 3.35Å; Y313-D327 CarbonylContact O-C 3.58Å; Y313-D327 WeakPolarHBondContact O-CA 3.49Å; Y313-S328 WeakPolarHBondContact CA-OG 3.33Å; Y313-S328 WeakPolarHBondContact CB-OG 3.43Å; Y313-S328 PolarHBondContact O-N 2.88Å
314	I	95.6	Very high	95.2	Very high	16 Å²	16	21.3 Å²	21.3	8%	0.082	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130	177.2	-53.1	-176.3	0	0	0	109.5	G308 S311 F316 T325 W326	G308-I314 PolarHBondContact N-O 2.89Å; S311-I314 WeakPolarHBondContact OG-CB 3.38Å; S311-I314 WeakPolarHBondContact OG-CD1 3.14Å; S311-I314 WeakPolarHBondContact OG-CG1 3.5Å; I314-F316 HydrophobicContact CG2-CD2 4.34Å; I314-F316 HydrophobicContact CG2-CE1 4.03Å; I314-F316 HydrophobicContact CG2-CE2 3.72Å; I314-F316 HydrophobicContact CG2-CZ 3.56Å; I314-T325 HydrophobicContact CG2-CG2 3.51Å; I314-W326 VanDerWaalsContact CA-O 3.31Å; I314-W326 WeakPolarHBondContact CA-O 3.27Å
315	I	96.9	Very high	95.2	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.3	173.8	-59.4	169.6	0	0	0	108.1	A258 I266 L268 F284 F307 W326	A258-I315 HydrophobicContact CB-CD1 3.91Å; I266-I315 HydrophobicContact CD1-CG2 4.42Å; I266-I315 HydrophobicContact CG2-CD1 4.49Å; I266-I315 HydrophobicContact CG2-CG2 4.43Å; L268-I315 HydrophobicContact CD1-CD1 4.29Å; F284-I315 HydrophobicContact CE2-CD1 3.9Å; F284-I315 HydrophobicContact CZ-CD1 4.47Å; F307-I315 HydrophobicContact CD1-CG1 4.06Å; F307-I315 HydrophobicContact CE1-CD1 4.14Å; F307-I315 HydrophobicContact CE1-CG1 3.96Å; F307-I315 HydrophobicContact CZ-CD1 4.16Å; F307-I315 HydrophobicContact CZ-CG1 4.32Å; I315-W326 HydrophobicContact CB-CB 4.4Å; I315-W326 PolarHBondContact N-O 2.73Å; I315-W326 PolarHBondContact O-N 2.75Å
316	F	97.4	Very high	95.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.9	174.1	-57.5	-83.8	0	0	0	109.1	L305 K306 I314 K324 T325 L363 I365 D369 I372	L305-F316 CarbonylContact C-O 3.56Å; L305-F316 VanDerWaalsContact CA-O 3.25Å; L305-F316 WeakPolarHBondContact CA-O 3.33Å; K306-F316 PolarHBondContact N-O 2.78Å; K306-F316 PolarHBondContact O-N 3.24Å; I314-F316 HydrophobicContact CG2-CD2 4.34Å; I314-F316 HydrophobicContact CG2-CE1 4.03Å; I314-F316 HydrophobicContact CG2-CE2 3.72Å; I314-F316 HydrophobicContact CG2-CZ 3.56Å; F316-K324 WeakPolarHBondContact CA-O 3.34Å; F316-T325 HydrophobicContact CD1-CG2 3.94Å; F316-T325 HydrophobicContact CE1-CG2 3.59Å; F316-T325 HydrophobicContact CZ-CG2 4.33Å; F316-L363 HydrophobicContact CB-CD1 3.95Å; F316-L363 HydrophobicContact CB-CD2 4.48Å; F316-I365 HydrophobicContact CB-CD1 4.18Å; F316-I365 HydrophobicContact CB-CG1 4.3Å; F316-I365 HydrophobicContact CD2-CD1 3.8Å; F316-I365 HydrophobicContact CD2-CG1 3.59Å; F316-I365 HydrophobicContact CD2-CG2 4.44Å; F316-I365 HydrophobicContact CE2-CG1 3.96Å; F316-I365 HydrophobicContact CE2-CG2 3.96Å; F316-I365 HydrophobicContact CG-CD1 4.17Å; F316-I365 HydrophobicContact CG-CG1 3.88Å; F316-I365 HydrophobicContact CZ-CG2 4.21Å; F316-D369 HydrophobicContact CZ-CB 4.35Å; F316-I372 HydrophobicContact CD1-CD1 3.61Å; F316-I372 HydrophobicContact CD1-CG1 4Å; F316-I372 HydrophobicContact CE1-CD1 3.71Å; F316-I372 HydrophobicContact CE1-CG1 3.99Å
317	S	97.5	Very high	95	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.028	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145	175.5	65.5	0	0	0	0	111.7	D304 V323 K324 W326 L363	D304-S317 WeakPolarHBondContact O-CA 3.26Å; S317-V323 WeakPolarHBondContact O-CA 3.36Å; S317-K324 PolarHBondContact N-O 2.66Å; S317-K324 PolarHBondContact O-N 3.29Å; S317-W326 PolarHBondContact OG-NE1 2.91Å; S317-L363 VanDerWaalsContact C-CD2 3.48Å
318	R	97.1	Very high	94.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.8	171.1	-175	72.8	173.1	99	17.6	108	V302 S303 D304 Y320 S322 V340 F361 L363 T374	V302-R318 CarbonylContact C-O 3.54Å; V302-R318 WeakPolarHBondContact CA-O 3.35Å; S303-R318 PolarHBondContact N-O 3.27Å; S303-R318 WeakPolarHBondContact OG-CB 3.42Å; S303-R318 VanDerWaalsContact OG-CG 3.3Å; S303-R318 WeakPolarHBondContact OG-CG 3.48Å; S303-R318 PolarHBondContact OG-O 2.77Å; D304-R318 HydrophobicContact CB-CB 4.31Å; D304-R318 PolarHBondContact O-N 2.92Å; R318-Y320 PolarHBondContact NH1-O 2.85Å; R318-Y320 PolarHBondContact NH2-O 2.94Å; R318-S322 VanDerWaalsContact NH1-C 3.28Å; R318-S322 PolarHBondContact NH1-O 2.88Å; R318-V340 VanDerWaalsContact NH1-CB 3.28Å; R318-V340 VanDerWaalsContact NH1-CG2 3.25Å; R318-F361 HydrophobicContact CG-CB 4.32Å; R318-F361 WeakPolarHBondContact CG-O 3.45Å; R318-L363 HydrophobicContact CB-CB 4.28Å; R318-L363 HydrophobicContact CB-CD2 3.58Å; R318-L363 HydrophobicContact CB-CG 4.46Å; R318-L363 VanDerWaalsContact N-CD2 3.28Å; R318-T374 WeakPolarHBondContact CD-OG1 3.22Å; R318-T374 PolarHBondContact NE-OG1 3.26Å
319	D	96.1	Very high	94.7	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.027	15%	0.149	C	C	.	.			trans	-108.9	-176.1	159.2	64.2	38	0	0	0	108.8	T299 S301 L321 S322 K324	T299-D319 WeakPolarHBondContact O-CB 2.92Å; S301-D319 WeakPolarHBondContact O-CA 3.33Å; S301-D319 WeakPolarHBondContact O-CB 3.26Å; D319-L321 PolarHBondContact O-N 3.46Å; D319-L321 PolarHBondContact OD1-N 3.07Å; D319-S322 VanDerWaalsContact CG-OG 3.24Å; D319-S322 PolarHBondContact N-O 2.86Å; D319-S322 WeakPolarHBondContact OD1-CA 3.45Å; D319-S322 PolarHBondContact OD1-N 2.83Å; D319-S322 PolarHBondContact OD1-OG 3.39Å; D319-S322 PolarHBondContact OD2-OG 3.03Å; D319-K324 WeakPolarHBondContact OD2-CE 3.32Å; D319-K324 IonicContact OD2-NZ 3.89Å; D319-K324 PolarHBondContact OD2-NZ 2.85Å
320	Y	95.2	Very high	94.7	Very high	8 Å²	8	30.7 Å²	30.7	3%	0.031	15%	0.152	C	C	.	.	S	Bend	trans	-57.5	-55.3	-178.8	-166.4	-105.2	0	0	0	110.3	T299 R318 Q341 L348 L351 L356 L357 F361 Y377	T299-Y320 HydrophobicContact CG2-CD1 4.32Å; T299-Y320 WeakPolarHBondContact O-CB 3.43Å; T299-Y320 PolarHBondContact O-N 3.27Å; R318-Y320 PolarHBondContact NH1-O 2.85Å; R318-Y320 PolarHBondContact NH2-O 2.94Å; Y320-Q341 VanDerWaalsContact C-NE2 3.34Å; Y320-Q341 HydrophobicContact CD1-CG 4.3Å; Y320-Q341 HydrophobicContact CE1-CG 4.3Å; Y320-Q341 VanDerWaalsContact O-CD 3.25Å; Y320-Q341 WeakPolarHBondContact O-CG 3.37Å; Y320-Q341 PolarHBondContact O-NE2 3.42Å; Y320-L348 HydrophobicContact CD1-CD2 4.47Å; Y320-L348 HydrophobicContact CE1-CD2 4.32Å; Y320-L351 HydrophobicContact CE1-CD1 4.31Å; Y320-L356 WeakPolarHBondContact CE2-O 3.32Å; Y320-L357 HydrophobicContact CD1-CD2 3.87Å; Y320-L357 HydrophobicContact CD2-CD2 4.42Å; Y320-L357 HydrophobicContact CE1-CD2 3.4Å; Y320-L357 VanDerWaalsContact CE1-CD2 3.4Å; Y320-L357 HydrophobicContact CE2-CD2 4.02Å; Y320-L357 HydrophobicContact CG-CD2 4.37Å; Y320-L357 VanDerWaalsContact CZ-CD2 3.49Å; Y320-F361 HydrophobicContact CE2-CE2 4.26Å; Y320-Y377 HydrophobicContact CE2-CE2 4.39Å; Y320-Y377 WeakPolarHBondContact OH-CE2 3.49Å; Y320-Y377 PolarHBondContact OH-OH 3.1Å
321	L	94.7	Very high	94.7	Very high	32 Å²	32	28.1 Å²	28.1	17%	0.168	14%	0.135	C	C	.	.	S	Bend	trans	-83.7	-22.8	-168.3	-64.1	177.8	0	0	0	114.5	T299 D319 V340 Q341	T299-L321 HydrophobicContact CG2-CD1 4.45Å; D319-L321 PolarHBondContact O-N 3.46Å; D319-L321 PolarHBondContact OD1-N 3.07Å; L321-V340 PolarHBondContact O-N 3.3Å; L321-Q341 HydrophobicContact CD2-CG 4.11Å; L321-Q341 PolarHBondContact O-N 2.59Å; L321-Q341 VanDerWaalsContact O-N 3.14Å
322	S	95.4	Very high	94.7	Very high	14 Å²	14	33.2 Å²	33.2	10%	0.098	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	164.7	-164.1	70.9	0	0	0	0	114.5	R318 D319 K324 Y338	R318-S322 VanDerWaalsContact NH1-C 3.28Å; R318-S322 PolarHBondContact NH1-O 2.88Å; D319-S322 VanDerWaalsContact CG-OG 3.24Å; D319-S322 PolarHBondContact N-O 2.86Å; D319-S322 WeakPolarHBondContact OD1-CA 3.45Å; D319-S322 PolarHBondContact OD1-N 2.83Å; D319-S322 PolarHBondContact OD1-OG 3.39Å; D319-S322 PolarHBondContact OD2-OG 3.03Å; S322-K324 WeakPolarHBondContact OG-CE 3.23Å; S322-Y338 CarbonylContact C-O 3.49Å; S322-Y338 WeakPolarHBondContact CA-O 3.43Å; S322-Y338 WeakPolarHBondContact CB-O 3.43Å
323	V	96.9	Very high	94.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.7	164.8	169.2	0	0	0	0	107.2	S317 V337 Y338 V340 I372 T374 F384	S317-V323 WeakPolarHBondContact O-CA 3.36Å; V323-V337 WeakPolarHBondContact O-CA 3.49Å; V323-Y338 HydrophobicContact CG1-CD2 4.47Å; V323-Y338 PolarHBondContact N-O 2.88Å; V323-Y338 PolarHBondContact O-N 3.36Å; V323-V340 HydrophobicContact CG2-CG2 3.91Å; V323-I372 HydrophobicContact CG1-CD1 4.01Å; V323-I372 HydrophobicContact CG1-CG2 3.88Å; V323-T374 HydrophobicContact CG2-CG2 3.83Å; V323-F384 HydrophobicContact CG2-CE2 4.24Å
324	K	96.3	Very high	94.8	Very high	16 Å²	16	33.6 Å²	33.6	7%	0.07	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.9	-179	-63.3	168.6	178.6	155.4	0	110	S286 N300 F316 S317 D319 S322 W326 P334 E336 V337	S286-K324 PolarHBondContact OG-NZ 2.93Å; N300-K324 PolarHBondContact OD1-NZ 3.32Å; F316-K324 WeakPolarHBondContact CA-O 3.34Å; S317-K324 PolarHBondContact N-O 2.66Å; S317-K324 PolarHBondContact O-N 3.29Å; D319-K324 WeakPolarHBondContact OD2-CE 3.32Å; D319-K324 IonicContact OD2-NZ 3.89Å; D319-K324 PolarHBondContact OD2-NZ 2.85Å; S322-K324 WeakPolarHBondContact OG-CE 3.23Å; K324-W326 HydrophobicContact CB-CZ2 4.25Å; K324-W326 HydrophobicContact CD-CZ2 3.8Å; K324-P334 HydrophobicContact CB-CB 4.06Å; K324-P334 HydrophobicContact CG-CB 4.37Å; K324-E336 WeakPolarHBondContact CA-O 3.06Å; K324-V337 HydrophobicContact CG-CG1 4.32Å; K324-V337 HydrophobicContact CG-CG2 4.31Å
325	T	96.6	Very high	94.7	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.2	170.8	-53	0	0	0	0	108.8	I314 F316 P334 V335 E336	I314-T325 HydrophobicContact CG2-CG2 3.51Å; F316-T325 HydrophobicContact CD1-CG2 3.94Å; F316-T325 HydrophobicContact CE1-CG2 3.59Å; F316-T325 HydrophobicContact CZ-CG2 4.33Å; T325-P334 CarbonylContact O-C 3.11Å; T325-P334 WeakPolarHBondContact O-CA 3.49Å; T325-V335 PolarHBondContact O-N 2.82Å; T325-E336 VanDerWaalsContact CB-OE2 3.31Å; T325-E336 WeakPolarHBondContact CB-OE2 3.46Å; T325-E336 PolarHBondContact N-O 2.69Å; T325-E336 PolarHBondContact O-N 3.47Å; T325-E336 PolarHBondContact OG1-OE2 2.75Å
326	W	96.1	Very high	94.6	Very high	2 Å²	2	38 Å²	38	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.6	-178.9	-54.9	90.1	0	0	0	109.8	I266 F284 I314 I315 S317 K324 P334	I266-W326 HydrophobicContact CD1-CD2 4.45Å; I266-W326 HydrophobicContact CD1-CG 4.23Å; I266-W326 VanDerWaalsContact CD1-NE1 3.3Å; F284-W326 HydrophobicContact CB-CD2 4.05Å; F284-W326 HydrophobicContact CB-CE3 3.65Å; F284-W326 HydrophobicContact CB-CH2 4.29Å; F284-W326 HydrophobicContact CB-CZ3 3.78Å; F284-W326 HydrophobicContact CD1-CB 4.04Å; F284-W326 HydrophobicContact CD1-CD2 4.17Å; F284-W326 AromaticContact CD1-CE3 3.61Å; F284-W326 HydrophobicContact CD1-CE3 3.61Å; F284-W326 HydrophobicContact CD1-CG 4.39Å; F284-W326 HydrophobicContact CD1-CZ3 4.36Å; F284-W326 HydrophobicContact CE1-CB 3.98Å; F284-W326 HydrophobicContact CG-CB 4.42Å; F284-W326 HydrophobicContact CG-CD2 4.21Å; F284-W326 AromaticContact CG-CE3 3.91Å; F284-W326 HydrophobicContact CG-CE3 3.91Å; F284-W326 HydrophobicContact CG-CG 4.46Å; F284-W326 HydrophobicContact CG-CZ3 4.49Å; F284-W326 HydrophobicContact CZ-CB 4.32Å; I314-W326 VanDerWaalsContact CA-O 3.31Å; I314-W326 WeakPolarHBondContact CA-O 3.27Å; I315-W326 HydrophobicContact CB-CB 4.4Å; I315-W326 PolarHBondContact N-O 2.73Å; I315-W326 PolarHBondContact O-N 2.75Å; S317-W326 PolarHBondContact OG-NE1 2.91Å; K324-W326 HydrophobicContact CB-CZ2 4.25Å; K324-W326 HydrophobicContact CD-CZ2 3.8Å; W326-P334 HydrophobicContact CD2-CB 4.16Å; W326-P334 HydrophobicContact CE3-CB 4.03Å; W326-P334 HydrophobicContact CH2-CB 4.19Å; W326-P334 HydrophobicContact CH2-CG 4.24Å; W326-P334 HydrophobicContact CZ2-CB 4.28Å; W326-P334 HydrophobicContact CZ3-CB 4.06Å; W326-P334 HydrophobicContact CZ3-CG 4.3Å
327	D	95.2	Very high	94.4	Very high	22 Å²	22	40.8 Å²	40.8	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.9	173	-172	-33.5	0	0	0	108.3	Y313 R329 M330 V335	Y313-D327 CarbonylContact O-C 3.58Å; Y313-D327 WeakPolarHBondContact O-CA 3.49Å; D327-R329 PolarHBondContact O-N 3.45Å; D327-R329 VanDerWaalsContact O-N 3.11Å; D327-R329 WeakPolarHBondContact OD1-CB 3.25Å; D327-R329 WeakPolarHBondContact OD1-CG 3.37Å; D327-R329 IonicContact OD1-CZ 3.85Å; D327-R329 PolarHBondContact OD1-N 2.86Å; D327-R329 IonicContact OD1-NE 2.97Å; D327-R329 PolarHBondContact OD1-NE 2.68Å; D327-R329 IonicContact OD1-NH2 3.86Å; D327-R329 IonicContact OD2-CZ 3.37Å; D327-R329 IonicContact OD2-NE 3.21Å; D327-R329 PolarHBondContact OD2-NE 3.26Å; D327-R329 IonicContact OD2-NH2 2.7Å; D327-R329 PolarHBondContact OD2-NH2 3.46Å; D327-M330 CarbonylContact O-C 3.58Å; D327-M330 WeakPolarHBondContact O-CA 3.44Å; D327-M330 PolarHBondContact O-N 3.04Å; D327-V335 HydrophobicContact CB-CG2 3.57Å
328	S	92.2	Very high	94.3	Very high	35 Å²	35	41 Å²	41	25%	0.245	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.4	180	68.6	0	0	0	0	113.5	L282 Y313 M330	L282-S328 WeakPolarHBondContact CD2-O 3.21Å; Y313-S328 WeakPolarHBondContact CA-OG 3.33Å; Y313-S328 WeakPolarHBondContact CB-OG 3.43Å; Y313-S328 PolarHBondContact O-N 2.88Å; S328-M330 VanDerWaalsContact C-N 3.33Å
329	R	92.8	Very high	94.1	Very high	170 Å²	170	41.7 Å²	41.7	64%	0.642	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.4	172.7	-55	170.9	-66.4	179.8	4.7	112.4	D327	D327-R329 PolarHBondContact O-N 3.45Å; D327-R329 VanDerWaalsContact O-N 3.11Å; D327-R329 WeakPolarHBondContact OD1-CB 3.25Å; D327-R329 WeakPolarHBondContact OD1-CG 3.37Å; D327-R329 IonicContact OD1-CZ 3.85Å; D327-R329 PolarHBondContact OD1-N 2.86Å; D327-R329 IonicContact OD1-NE 2.97Å; D327-R329 PolarHBondContact OD1-NE 2.68Å; D327-R329 IonicContact OD1-NH2 3.86Å; D327-R329 IonicContact OD2-CZ 3.37Å; D327-R329 IonicContact OD2-NE 3.21Å; D327-R329 PolarHBondContact OD2-NE 3.26Å; D327-R329 IonicContact OD2-NH2 2.7Å; D327-R329 PolarHBondContact OD2-NH2 3.46Å
330	M	92	Very high	94	Very high	86 Å²	86	41.5 Å²	41.5	42%	0.424	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-132.3	70.7	177.4	-167.6	178.1	-164	0	0	110.8	D327 S328 T332 Q333 V335	D327-M330 CarbonylContact O-C 3.58Å; D327-M330 WeakPolarHBondContact O-CA 3.44Å; D327-M330 PolarHBondContact O-N 3.04Å; S328-M330 VanDerWaalsContact C-N 3.33Å; M330-T332 VanDerWaalsContact C-N 3.26Å; M330-T332 PolarHBondContact O-N 3.13Å; M330-Q333 HydrophobicContact CE-CG 4.28Å; M330-V335 HydrophobicContact SD-CG2 4.5Å
331	P	89.5	Confident	93.7	Very high	40 Å²	40	41.1 Å²	41.1	26%	0.26	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.6	-172.4	28.6	-35.8	0	0	0	115.5	L282 F284 Q333	L282-P331 HydrophobicContact CD1-CB 3.54Å; L282-P331 HydrophobicContact CD1-CG 3.75Å; L282-P331 HydrophobicContact CD2-CB 4.02Å; L282-P331 HydrophobicContact CG-CB 3.94Å; F284-P331 HydrophobicContact CD1-CB 4.09Å; F284-P331 HydrophobicContact CE1-CB 4Å; P331-Q333 VanDerWaalsContact C-N 3.3Å; P331-Q333 PolarHBondContact O-N 2.61Å
332	T	90.7	Very high	93.4	Very high	114 Å²	114	45.5 Å²	45.5	70%	0.699	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-24.3	-169.7	52.9	0	0	0	0	113.6	M330	M330-T332 VanDerWaalsContact C-N 3.26Å; M330-T332 PolarHBondContact O-N 3.13Å
333	Q	92.6	Very high	93	Very high	107 Å²	107	50.5 Å²	50.5	50%	0.5	25%	0.253	S	S	.	.	S	Bend	trans	-159.2	157.5	-178	64.9	-179	40.8	0	0	110.1	M330 P331	M330-Q333 HydrophobicContact CE-CG 4.28Å; P331-Q333 VanDerWaalsContact C-N 3.3Å; P331-Q333 PolarHBondContact O-N 2.61Å
334	P	94.3	Very high	92.7	Very high	32 Å²	32	51.1 Å²	51.1	21%	0.208	26%	0.256	C	S	.	.			trans	-63.8	140.3	170.8	28.2	-34.5	0	0	0	110.2	K324 T325 W326 V337	K324-P334 HydrophobicContact CB-CB 4.06Å; K324-P334 HydrophobicContact CG-CB 4.37Å; T325-P334 CarbonylContact O-C 3.11Å; T325-P334 WeakPolarHBondContact O-CA 3.49Å; W326-P334 HydrophobicContact CD2-CB 4.16Å; W326-P334 HydrophobicContact CE3-CB 4.03Å; W326-P334 HydrophobicContact CH2-CB 4.19Å; W326-P334 HydrophobicContact CH2-CG 4.24Å; W326-P334 HydrophobicContact CZ2-CB 4.28Å; W326-P334 HydrophobicContact CZ3-CB 4.06Å; W326-P334 HydrophobicContact CZ3-CG 4.3Å; P334-V337 HydrophobicContact CB-CG2 3.88Å; P334-V337 HydrophobicContact CG-CG2 3.5Å; P334-V337 VanDerWaalsContact CG-CG2 3.5Å
335	V	94	Very high	92.4	Very high	70 Å²	70	56 Å²	56	42%	0.424	28%	0.277	S	S	.	.	S	Bend	trans	-75	-35.3	178.2	-178.7	0	0	0	0	110.7	T325 D327 M330	T325-V335 PolarHBondContact O-N 2.82Å; D327-V335 HydrophobicContact CB-CG2 3.57Å; M330-V335 HydrophobicContact SD-CG2 4.5Å
336	E	93.9	Very high	92.1	Very high	38 Å²	38	65.2 Å²	65.2	18%	0.178	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.7	178.9	-56.5	154	-166.4	0	0	109.5	K324 T325 Y338 R386	K324-E336 WeakPolarHBondContact CA-O 3.06Å; T325-E336 VanDerWaalsContact CB-OE2 3.31Å; T325-E336 WeakPolarHBondContact CB-OE2 3.46Å; T325-E336 PolarHBondContact N-O 2.69Å; T325-E336 PolarHBondContact O-N 3.47Å; T325-E336 PolarHBondContact OG1-OE2 2.75Å; E336-Y338 HydrophobicContact CB-CD2 4.45Å; E336-Y338 HydrophobicContact CB-CE2 3.73Å; E336-Y338 HydrophobicContact CG-CE2 4.49Å; E336-R386 VanDerWaalsContact CD-NE 3.31Å; E336-R386 IonicContact OE1-CZ 3.47Å; E336-R386 IonicContact OE1-NE 3.12Å; E336-R386 PolarHBondContact OE1-NE 2.82Å; E336-R386 IonicContact OE1-NH2 2.84Å; E336-R386 PolarHBondContact OE1-NH2 3.19Å; E336-R386 WeakPolarHBondContact OE2-CD 3.28Å; E336-R386 WeakPolarHBondContact OE2-CG 3.45Å; E336-R386 IonicContact OE2-CZ 3.4Å; E336-R386 IonicContact OE2-NE 3.38Å; E336-R386 PolarHBondContact OE2-NE 2.92Å; E336-R386 IonicContact OE2-NH2 2.65Å
337	V	94.5	Very high	91.9	Very high	59 Å²	59	69.3 Å²	69.3	36%	0.358	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	114	176.9	-174.5	0	0	0	0	109.9	V323 K324 P334 N452	V323-V337 WeakPolarHBondContact O-CA 3.49Å; K324-V337 HydrophobicContact CG-CG1 4.32Å; K324-V337 HydrophobicContact CG-CG2 4.31Å; P334-V337 HydrophobicContact CB-CG2 3.88Å; P334-V337 HydrophobicContact CG-CG2 3.5Å; P334-V337 VanDerWaalsContact CG-CG2 3.5Å; V337-N452 PolarHBondContact O-ND2 2.96Å
338	Y	94.6	Very high	91.8	Very high	8 Å²	8	69.2 Å²	69.2	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.6	-177.9	-62.9	-74.7	0	0	0	111.2	S322 V323 E336 V340 I372 F384 R386 P389 I449	S322-Y338 CarbonylContact C-O 3.49Å; S322-Y338 WeakPolarHBondContact CA-O 3.43Å; S322-Y338 WeakPolarHBondContact CB-O 3.43Å; V323-Y338 HydrophobicContact CG1-CD2 4.47Å; V323-Y338 PolarHBondContact N-O 2.88Å; V323-Y338 PolarHBondContact O-N 3.36Å; E336-Y338 HydrophobicContact CB-CD2 4.45Å; E336-Y338 HydrophobicContact CB-CE2 3.73Å; E336-Y338 HydrophobicContact CG-CE2 4.49Å; Y338-V340 PolarHBondContact O-N 2.93Å; Y338-I372 HydrophobicContact CD2-CD1 4.21Å; Y338-I372 HydrophobicContact CE2-CD1 3.99Å; Y338-F384 HydrophobicContact CD1-CB 3.92Å; Y338-F384 AromaticContact CD1-CD1 3.5Å; Y338-F384 HydrophobicContact CD1-CD1 3.5Å; Y338-F384 HydrophobicContact CD1-CE1 4.17Å; Y338-F384 AromaticContact CD1-CG 3.81Å; Y338-F384 HydrophobicContact CD1-CG 3.81Å; Y338-F384 HydrophobicContact CD2-CB 4.18Å; Y338-F384 HydrophobicContact CD2-CG 4.23Å; Y338-F384 HydrophobicContact CE1-CB 4.07Å; Y338-F384 HydrophobicContact CE1-CD1 4.33Å; Y338-F384 HydrophobicContact CE1-CG 4.46Å; Y338-F384 HydrophobicContact CE2-CB 4.33Å; Y338-F384 HydrophobicContact CG-CB 3.97Å; Y338-F384 AromaticContact CG-CD1 3.7Å; Y338-F384 HydrophobicContact CG-CD1 3.7Å; Y338-F384 HydrophobicContact CG-CD2 4.16Å; Y338-F384 HydrophobicContact CG-CE1 4.19Å; Y338-F384 AromaticContact CG-CG 3.68Å; Y338-F384 HydrophobicContact CG-CG 3.68Å; Y338-R386 HydrophobicContact CE2-CG 4.41Å; Y338-R386 WeakPolarHBondContact OH-CA 3.32Å; Y338-P389 HydrophobicContact CE1-CB 4.39Å; Y338-I449 HydrophobicContact CD1-CD1 4.22Å
339	P	93	Very high	91.7	Very high	16 Å²	16	70.2 Å²	70.2	10%	0.104	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.7	-179.4	30.3	-31.9	0	0	0	111.1	R342 K382	P339-R342 HydrophobicContact CB-CB 4.29Å; P339-K382 PolarHBondContact O-NZ 3.36Å
340	V	93.2	Very high	91.7	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.006	33%	0.33	C	S	.	.	S	Bend	trans	-99.2	-60.3	175.8	-179.3	0	0	0	0	111.1	R318 L321 V323 Y338 T374 K382 F384	R318-V340 VanDerWaalsContact NH1-CB 3.28Å; R318-V340 VanDerWaalsContact NH1-CG2 3.25Å; L321-V340 PolarHBondContact O-N 3.3Å; V323-V340 HydrophobicContact CG2-CG2 3.91Å; Y338-V340 PolarHBondContact O-N 2.93Å; V340-T374 HydrophobicContact CG1-CG2 4.32Å; V340-T374 HydrophobicContact CG2-CG2 3.79Å; V340-K382 HydrophobicContact CB-CD 4.2Å; V340-K382 HydrophobicContact CG1-CD 3.87Å; V340-K382 HydrophobicContact CG1-CG 4.46Å; V340-K382 HydrophobicContact CG2-CD 4.28Å; V340-K382 WeakPolarHBondContact O-CE 3.4Å; V340-K382 PolarHBondContact O-NZ 3.11Å; V340-F384 HydrophobicContact CG2-CE2 3.86Å; V340-F384 HydrophobicContact CG2-CZ 3.86Å
341	Q	90.1	Very high	91.7	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-125.5	43.2	-173.8	56.5	-173	-0.2	0	0	113	Y320 L321 H343 L344	Y320-Q341 VanDerWaalsContact C-NE2 3.34Å; Y320-Q341 HydrophobicContact CD1-CG 4.3Å; Y320-Q341 HydrophobicContact CE1-CG 4.3Å; Y320-Q341 VanDerWaalsContact O-CD 3.25Å; Y320-Q341 WeakPolarHBondContact O-CG 3.37Å; Y320-Q341 PolarHBondContact O-NE2 3.42Å; L321-Q341 HydrophobicContact CD2-CG 4.11Å; L321-Q341 PolarHBondContact O-N 2.59Å; L321-Q341 VanDerWaalsContact O-N 3.14Å; Q341-H343 PolarHBondContact O-N 2.82Å; Q341-L344 HydrophobicContact CB-CD1 3.97Å; Q341-L344 HydrophobicContact CB-CG 4.21Å; Q341-L344 HydrophobicContact CG-CD1 4.39Å; Q341-L344 WeakPolarHBondContact O-CB 3.48Å; Q341-L344 PolarHBondContact O-N 3.23Å
342	R	87.8	Confident	91.8	Very high	123 Å²	123	63.5 Å²	63.5	46%	0.464	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-56.7	-31.8	178.7	-167.9	176.6	-178.1	123	-8.4	113.4	P339 L344 K345	P339-R342 HydrophobicContact CB-CB 4.29Å; R342-L344 PolarHBondContact O-N 3.05Å; R342-K345 WeakPolarHBondContact O-CB 3.24Å; R342-K345 PolarHBondContact O-N 3.3Å; R342-K345 VanDerWaalsContact O-N 3.11Å
343	H	87	Confident	91.9	Very high	120 Å²	120	65.7 Å²	65.7	56%	0.556	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62.3	-26.5	177	62.7	-83.8	0	0	0	113	Q341 K345	Q341-H343 PolarHBondContact O-N 2.82Å; H343-K345 VanDerWaalsContact C-N 3.3Å; H343-K345 PolarHBondContact O-N 3.14Å
344	L	90.1	Very high	91.8	Very high	12 Å²	12	63.2 Å²	63.2	6%	0.063	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-79.4	-8.5	177.7	-63.6	-173	0	0	0	113.8	Q341 R342 K346 H347 L348 L351 Y377	Q341-L344 HydrophobicContact CB-CD1 3.97Å; Q341-L344 HydrophobicContact CB-CG 4.21Å; Q341-L344 HydrophobicContact CG-CD1 4.39Å; Q341-L344 WeakPolarHBondContact O-CB 3.48Å; Q341-L344 PolarHBondContact O-N 3.23Å; R342-L344 PolarHBondContact O-N 3.05Å; L344-K346 PolarHBondContact O-N 3.35Å; L344-K346 VanDerWaalsContact O-N 3.12Å; L344-H347 PolarHBondContact O-N 3.03Å; L344-L348 PolarHBondContact O-N 2.71Å; L344-L351 HydrophobicContact CB-CD1 3.79Å; L344-L351 HydrophobicContact CD1-CD1 4.14Å; L344-L351 HydrophobicContact CG-CD1 4.37Å; L344-Y377 HydrophobicContact CD1-CD2 3.65Å; L344-Y377 HydrophobicContact CD1-CE2 3.8Å
345	K	90.2	Very high	91.7	Very high	120 Å²	120	68.5 Å²	68.5	52%	0.522	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-57.3	-31.1	-177.7	-170.5	177.7	-179.1	-177.5	0	113	R342 H343 H347 L348	R342-K345 WeakPolarHBondContact O-CB 3.24Å; R342-K345 PolarHBondContact O-N 3.3Å; R342-K345 VanDerWaalsContact O-N 3.11Å; H343-K345 VanDerWaalsContact C-N 3.3Å; H343-K345 PolarHBondContact O-N 3.14Å; K345-H347 VanDerWaalsContact C-N 3.27Å; K345-H347 PolarHBondContact O-N 3.03Å; K345-L348 HydrophobicContact CG-CD1 4.27Å; K345-L348 WeakPolarHBondContact O-CG 3.44Å
346	K	91	Very high	91.6	Very high	194 Å²	194	66.1 Å²	66.1	84%	0.843	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-75.4	-14.9	177.6	-63.1	-178.1	-178.5	179.1	0	113.5	L344	L344-K346 PolarHBondContact O-N 3.35Å; L344-K346 VanDerWaalsContact O-N 3.12Å
347	H	91.2	Very high	91.5	Very high	88 Å²	88	65 Å²	65	41%	0.407	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-113.6	13	-172.8	-57.8	-67.4	0	0	0	112.8	L344 K345 A349 V350 L351 V478	L344-H347 PolarHBondContact O-N 3.03Å; K345-H347 VanDerWaalsContact C-N 3.27Å; K345-H347 PolarHBondContact O-N 3.03Å; H347-A349 VanDerWaalsContact C-N 3.27Å; H347-A349 PolarHBondContact O-N 3.33Å; H347-V350 PolarHBondContact O-N 3.44Å; H347-V350 VanDerWaalsContact O-N 3.08Å; H347-L351 HydrophobicContact CB-CD1 4.38Å; H347-L351 WeakPolarHBondContact O-CG 3.48Å; H347-L351 PolarHBondContact O-N 3.21Å; H347-V478 HydrophobicContact CB-CG2 4.48Å
348	L	92.5	Very high	91.4	Very high	21 Å²	21	67.5 Å²	67.5	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-56.8	-36.5	-174.7	-68.7	175	0	0	0	113.7	L295 T299 Y320 L344 K345 L351 Y352 L357	L295-L348 HydrophobicContact CD1-CB 4.47Å; T299-L348 HydrophobicContact CG2-CD1 3.96Å; T299-L348 HydrophobicContact CG2-CD2 3.61Å; T299-L348 HydrophobicContact CG2-CG 4.4Å; Y320-L348 HydrophobicContact CD1-CD2 4.47Å; Y320-L348 HydrophobicContact CE1-CD2 4.32Å; L344-L348 PolarHBondContact O-N 2.71Å; K345-L348 HydrophobicContact CG-CD1 4.27Å; K345-L348 WeakPolarHBondContact O-CG 3.44Å; L348-L351 HydrophobicContact CD2-CD1 4.43Å; L348-L351 PolarHBondContact O-N 3.37Å; L348-Y352 WeakPolarHBondContact O-CB 3.1Å; L348-Y352 PolarHBondContact O-N 3.28Å; L348-L357 HydrophobicContact CD2-CD2 3.88Å
349	A	91.8	Very high	91.3	Very high	56 Å²	56	68.4 Å²	68.4	46%	0.463	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-45.7	176.5	0	0	0	0	0	111.9	H347 Y352 E353	H347-A349 VanDerWaalsContact C-N 3.27Å; H347-A349 PolarHBondContact O-N 3.33Å; A349-Y352 WeakPolarHBondContact O-CB 3.23Å; A349-Y352 PolarHBondContact O-N 3.3Å; A349-E353 WeakPolarHBondContact O-CG 3.17Å; A349-E353 PolarHBondContact O-N 3.21Å; A349-E353 VanDerWaalsContact O-N 3.08Å
350	V	91.8	Very high	91.3	Very high	50 Å²	50	72 Å²	72	30%	0.303	35%	0.345	S	S	.	.	H	α-helix	trans	-68.4	-37.4	178	-175.2	0	0	0	0	111.2	H347 Y352 E353 S354 V478	H347-V350 PolarHBondContact O-N 3.44Å; H347-V350 VanDerWaalsContact O-N 3.08Å; V350-Y352 VanDerWaalsContact C-N 3.29Å; V350-Y352 PolarHBondContact O-N 3.47Å; V350-E353 PolarHBondContact O-N 2.95Å; V350-S354 WeakPolarHBondContact O-CB 3.43Å; V350-S354 PolarHBondContact O-N 3.27Å; V350-S354 PolarHBondContact O-OG 2.7Å; V350-V478 HydrophobicContact CB-CG2 4.27Å; V350-V478 HydrophobicContact CG1-CG2 3.79Å
351	L	91.7	Very high	91.4	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-31.8	176.1	-66.4	168.5	0	0	0	112.3	Y320 L344 H347 L348 S354 E355 L356 L357 V480	Y320-L351 HydrophobicContact CE1-CD1 4.31Å; L344-L351 HydrophobicContact CB-CD1 3.79Å; L344-L351 HydrophobicContact CD1-CD1 4.14Å; L344-L351 HydrophobicContact CG-CD1 4.37Å; H347-L351 HydrophobicContact CB-CD1 4.38Å; H347-L351 WeakPolarHBondContact O-CG 3.48Å; H347-L351 PolarHBondContact O-N 3.21Å; L348-L351 HydrophobicContact CD2-CD1 4.43Å; L348-L351 PolarHBondContact O-N 3.37Å; L351-S354 WeakPolarHBondContact CA-OG 3.49Å; L351-S354 PolarHBondContact O-OG 3.18Å; L351-E355 PolarHBondContact O-N 3.14Å; L351-L356 HydrophobicContact CB-CB 4.49Å; L351-L356 HydrophobicContact CD2-CB 3.99Å; L351-L356 HydrophobicContact CD2-CD1 3.8Å; L351-L356 PolarHBondContact O-N 3.26Å; L351-L357 HydrophobicContact CB-CD2 3.68Å; L351-L357 HydrophobicContact CB-CG 3.93Å; L351-L357 HydrophobicContact CD1-CD2 4.37Å; L351-L357 PolarHBondContact O-N 3.18Å; L351-V480 HydrophobicContact CD2-CG2 4.4Å
352	Y	92.6	Very high	91.7	Very high	105 Å²	105	73.2 Å²	73.2	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-69.2	-48.8	174.5	178.1	-110.1	0	0	0	111	L295 L298 L348 A349 V350 S354 E355 L357 F358	L295-Y352 HydrophobicContact CD2-CG 4.24Å; L298-Y352 HydrophobicContact CD1-CD2 3.62Å; L298-Y352 HydrophobicContact CD1-CE2 3.51Å; L348-Y352 WeakPolarHBondContact O-CB 3.1Å; L348-Y352 PolarHBondContact O-N 3.28Å; A349-Y352 WeakPolarHBondContact O-CB 3.23Å; A349-Y352 PolarHBondContact O-N 3.3Å; V350-Y352 VanDerWaalsContact C-N 3.29Å; V350-Y352 PolarHBondContact O-N 3.47Å; Y352-S354 PolarHBondContact O-N 2.99Å; Y352-E355 PolarHBondContact O-N 3.03Å; Y352-L357 HydrophobicContact CD2-CD1 4.16Å; Y352-L357 HydrophobicContact CG-CD1 4.4Å; Y352-F358 HydrophobicContact CD2-CZ 4.39Å; Y352-F358 HydrophobicContact CE2-CZ 4.07Å
353	E	92.2	Very high	92.2	Very high	159 Å²	159	67.4 Å²	67.4	74%	0.743	33%	0.329	S	S	*	.	H	α-helix	trans	-62.6	-30	178.2	-70.9	176.9	179.3	0	0	113.3	A349 V350 E355	A349-E353 WeakPolarHBondContact O-CG 3.17Å; A349-E353 PolarHBondContact O-N 3.21Å; A349-E353 VanDerWaalsContact O-N 3.08Å; V350-E353 PolarHBondContact O-N 2.95Å; E353-E355 VanDerWaalsContact C-N 3.33Å
354	S	90.4	Very high	92.7	Very high	56 Å²	56	62 Å²	62	39%	0.392	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	7.2	176.2	54.1	0	0	0	0	114.1	V350 L351 Y352 L356	V350-S354 WeakPolarHBondContact O-CB 3.43Å; V350-S354 PolarHBondContact O-N 3.27Å; V350-S354 PolarHBondContact O-OG 2.7Å; L351-S354 WeakPolarHBondContact CA-OG 3.49Å; L351-S354 PolarHBondContact O-OG 3.18Å; Y352-S354 PolarHBondContact O-N 2.99Å; S354-L356 PolarHBondContact O-N 3.46Å; S354-L356 WeakPolarHBondContact OG-CG 3.37Å
355	E	92	Very high	93	Very high	142 Å²	142	61.7 Å²	61.7	66%	0.664	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	10.9	-179	-59.3	-177	167.6	0	0	114.8	L351 Y352 E353 L357 F358	L351-E355 PolarHBondContact O-N 3.14Å; Y352-E355 PolarHBondContact O-N 3.03Å; E353-E355 VanDerWaalsContact C-N 3.33Å; E355-L357 VanDerWaalsContact C-N 3.27Å; E355-L357 PolarHBondContact O-N 2.72Å; E355-F358 HydrophobicContact CB-CD2 3.94Å; E355-F358 HydrophobicContact CB-CE2 4.38Å; E355-F358 HydrophobicContact CG-CD2 4.42Å; E355-F358 HydrophobicContact CG-CE2 4.43Å; E355-F358 WeakPolarHBondContact O-CD2 3.41Å; E355-F358 PolarHBondContact O-N 2.88Å
356	L	91.7	Very high	93.2	Very high	21 Å²	21	56.1 Å²	56.1	11%	0.11	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-72.5	-19.7	179.9	-63.4	-179.3	0	0	0	112.8	Y320 L351 S354 F358 D359 Y377 V480	Y320-L356 WeakPolarHBondContact CE2-O 3.32Å; L351-L356 HydrophobicContact CB-CB 4.49Å; L351-L356 HydrophobicContact CD2-CB 3.99Å; L351-L356 HydrophobicContact CD2-CD1 3.8Å; L351-L356 PolarHBondContact O-N 3.26Å; S354-L356 PolarHBondContact O-N 3.46Å; S354-L356 WeakPolarHBondContact OG-CG 3.37Å; L356-F358 PolarHBondContact O-N 3.22Å; L356-D359 PolarHBondContact O-N 3.46Å; L356-Y377 PolarHBondContact O-OH 2.87Å; L356-V480 HydrophobicContact CD1-CB 4.12Å; L356-V480 HydrophobicContact CD1-CG1 4.44Å; L356-V480 HydrophobicContact CD1-CG2 3.37Å
357	L	92.1	Very high	93.3	Very high	13 Å²	13	47.9 Å²	47.9	7%	0.068	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-64.9	-15.5	172	-67.1	-170.5	0	0	0	113.5	L295 Y320 L348 L351 Y352 E355	L295-L357 HydrophobicContact CD2-CD1 4Å; Y320-L357 HydrophobicContact CD1-CD2 3.87Å; Y320-L357 HydrophobicContact CD2-CD2 4.42Å; Y320-L357 HydrophobicContact CE1-CD2 3.4Å; Y320-L357 VanDerWaalsContact CE1-CD2 3.4Å; Y320-L357 HydrophobicContact CE2-CD2 4.02Å; Y320-L357 HydrophobicContact CG-CD2 4.37Å; Y320-L357 VanDerWaalsContact CZ-CD2 3.49Å; L348-L357 HydrophobicContact CD2-CD2 3.88Å; L351-L357 HydrophobicContact CB-CD2 3.68Å; L351-L357 HydrophobicContact CB-CG 3.93Å; L351-L357 HydrophobicContact CD1-CD2 4.37Å; L351-L357 PolarHBondContact O-N 3.18Å; Y352-L357 HydrophobicContact CD2-CD1 4.16Å; Y352-L357 HydrophobicContact CG-CD1 4.4Å; E355-L357 VanDerWaalsContact C-N 3.27Å; E355-L357 PolarHBondContact O-N 2.72Å
358	F	92.1	Very high	93.3	Very high	112 Å²	112	46 Å²	46	49%	0.491	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-94.7	5.7	-180	-53.3	-68.6	0	0	0	113.4	L298 Y352 E355 L356 D360	L298-F358 HydrophobicContact CD2-CE1 3.96Å; Y352-F358 HydrophobicContact CD2-CZ 4.39Å; Y352-F358 HydrophobicContact CE2-CZ 4.07Å; E355-F358 HydrophobicContact CB-CD2 3.94Å; E355-F358 HydrophobicContact CB-CE2 4.38Å; E355-F358 HydrophobicContact CG-CD2 4.42Å; E355-F358 HydrophobicContact CG-CE2 4.43Å; E355-F358 WeakPolarHBondContact O-CD2 3.41Å; E355-F358 PolarHBondContact O-N 2.88Å; L356-F358 PolarHBondContact O-N 3.22Å; F358-D360 PolarHBondContact O-N 3.02Å
359	D	93.5	Very high	93.4	Very high	27 Å²	27	45.5 Å²	45.5	14%	0.144	24%	0.236	C	C	.	.			trans	-69.9	118.9	175.1	-78.1	-29.6	0	0	0	111.2	L356 F361 Y377 K483 L485	L356-D359 PolarHBondContact O-N 3.46Å; D359-F361 HydrophobicContact CB-CD2 4.39Å; D359-F361 HydrophobicContact CB-CE2 3.81Å; D359-F361 HydrophobicContact CB-CZ 4.29Å; D359-F361 WeakPolarHBondContact O-CD2 3.29Å; D359-F361 PolarHBondContact O-N 2.68Å; D359-F361 VanDerWaalsContact O-N 3.08Å; D359-Y377 VanDerWaalsContact OD2-CE1 3.31Å; D359-Y377 WeakPolarHBondContact OD2-CE1 3.35Å; D359-Y377 PolarHBondContact OD2-OH 2.91Å; D359-K483 IonicContact OD1-NZ 2.75Å; D359-K483 PolarHBondContact OD1-NZ 2.93Å; D359-K483 VanDerWaalsContact OD2-CD 3.29Å; D359-K483 WeakPolarHBondContact OD2-CD 3.33Å; D359-K483 WeakPolarHBondContact OD2-CE 3.38Å; D359-K483 IonicContact OD2-NZ 3.16Å; D359-K483 PolarHBondContact OD2-NZ 3.33Å; D359-L485 HydrophobicContact CB-CD2 3.99Å
360	D	91.5	Very high	93.4	Very high	92 Å²	92	43.4 Å²	43.4	49%	0.492	22%	0.216	S	C	.	.			trans	-83.9	78.7	-176	-83.8	-16.6	0	0	0	112.9	F358 K362	F358-D360 PolarHBondContact O-N 3.02Å; D360-K362 PolarHBondContact O-N 3.07Å; D360-K362 IonicContact OD2-NZ 3.42Å
361	F	96.2	Very high	93.5	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	20%	0.202	C	C	.	.			trans	-64.3	122	172.8	-67	-79.5	0	0	0	111.4	S303 R318 Y320 D359 G375 S376 Y377 W484 L485	S303-F361 PolarHBondContact OG-O 2.9Å; R318-F361 HydrophobicContact CG-CB 4.32Å; R318-F361 WeakPolarHBondContact CG-O 3.45Å; Y320-F361 HydrophobicContact CE2-CE2 4.26Å; D359-F361 HydrophobicContact CB-CD2 4.39Å; D359-F361 HydrophobicContact CB-CE2 3.81Å; D359-F361 HydrophobicContact CB-CZ 4.29Å; D359-F361 WeakPolarHBondContact O-CD2 3.29Å; D359-F361 PolarHBondContact O-N 2.68Å; D359-F361 VanDerWaalsContact O-N 3.08Å; F361-G375 WeakPolarHBondContact CD1-O 3.3Å; F361-S376 VanDerWaalsContact CE1-CA 3.44Å; F361-Y377 HydrophobicContact CE2-CE1 4.12Å; F361-Y377 AromaticContact CE2-CE2 3.84Å; F361-Y377 HydrophobicContact CE2-CE2 3.84Å; F361-Y377 AromaticContact CE2-CZ 3.64Å; F361-Y377 AromaticContact CZ-CD1 3.77Å; F361-Y377 HydrophobicContact CZ-CD1 3.77Å; F361-Y377 AromaticContact CZ-CD2 4Å; F361-Y377 HydrophobicContact CZ-CD2 4Å; F361-Y377 AromaticContact CZ-CE1 3.48Å; F361-Y377 HydrophobicContact CZ-CE1 3.48Å; F361-Y377 VanDerWaalsContact CZ-CE1 3.48Å; F361-Y377 AromaticContact CZ-CE2 3.67Å; F361-Y377 HydrophobicContact CZ-CE2 3.67Å; F361-Y377 HydrophobicContact CZ-CG 4.09Å; F361-Y377 AromaticContact CZ-CZ 3.44Å; F361-Y377 VanDerWaalsContact CZ-CZ 3.44Å; F361-W484 WeakPolarHBondContact CD1-O 3.41Å; F361-W484 WeakPolarHBondContact CE1-O 3.37Å; F361-L485 HydrophobicContact CD1-CD2 4Å; F361-L485 HydrophobicContact CE1-CD2 3.75Å; F361-L485 HydrophobicContact CE2-CD2 4.5Å; F361-L485 HydrophobicContact CG-CD2 4.48Å; F361-L485 HydrophobicContact CZ-CD2 4.02Å
362	K	97.2	Very high	93.7	Very high	26 Å²	26	41.1 Å²	41.1	11%	0.113	20%	0.202	C	C	.	.			trans	-90	160.9	174.9	-55.3	-52.8	175.1	-174.7	0	111.9	S303 D304 D360 T374 L485 V487	S303-K362 PolarHBondContact O-NZ 2.84Å; D304-K362 HydrophobicContact CB-CD 3.77Å; D304-K362 WeakPolarHBondContact OD2-CA 3.27Å; D304-K362 WeakPolarHBondContact OD2-CB 3.48Å; D360-K362 PolarHBondContact O-N 3.07Å; D360-K362 IonicContact OD2-NZ 3.42Å; K362-T374 PolarHBondContact O-OG1 3.19Å; K362-L485 WeakPolarHBondContact CB-O 3.31Å; K362-L485 PolarHBondContact N-O 2.85Å; K362-V487 WeakPolarHBondContact O-CG2 3.21Å
363	L	97.4	Very high	93.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	155.5	175.9	76.4	92.4	0	0	0	110.4	D304 K306 F316 S317 R318 I365 M373	D304-L363 HydrophobicContact CB-CD2 4.26Å; D304-L363 HydrophobicContact CB-CG 4.35Å; D304-L363 PolarHBondContact OD2-N 2.96Å; K306-L363 HydrophobicContact CB-CD1 4.25Å; K306-L363 HydrophobicContact CD-CD1 4.16Å; K306-L363 WeakPolarHBondContact CD-O 3.43Å; K306-L363 WeakPolarHBondContact CE-O 3.27Å; K306-L363 HydrophobicContact CG-CD1 4.27Å; K306-L363 PolarHBondContact NZ-O 3.49Å; F316-L363 HydrophobicContact CB-CD1 3.95Å; F316-L363 HydrophobicContact CB-CD2 4.48Å; S317-L363 VanDerWaalsContact C-CD2 3.48Å; R318-L363 HydrophobicContact CB-CB 4.28Å; R318-L363 HydrophobicContact CB-CD2 3.58Å; R318-L363 HydrophobicContact CB-CG 4.46Å; R318-L363 VanDerWaalsContact N-CD2 3.28Å; L363-I365 HydrophobicContact CD1-CD1 3.36Å; L363-I365 HydrophobicContact CD1-CG1 3.99Å; L363-M373 CarbonylContact C-O 3.3Å; L363-M373 WeakPolarHBondContact CA-O 3.37Å
364	T	97.3	Very high	94.1	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.043	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.5	171.2	-167.3	0	0	0	0	110.3	M373 V487 W489	T364-M373 HydrophobicContact CG2-CB 3.87Å; T364-M373 HydrophobicContact CG2-CG 4.46Å; T364-M373 PolarHBondContact N-O 3.08Å; T364-M373 PolarHBondContact O-N 3.02Å; T364-V487 HydrophobicContact CG2-CB 3.83Å; T364-V487 HydrophobicContact CG2-CG2 3.76Å; T364-W489 HydrophobicContact CG2-CB 3.87Å; T364-W489 HydrophobicContact CG2-CE3 4.29Å; T364-W489 VanDerWaalsContact OG1-CB 3.31Å; T364-W489 WeakPolarHBondContact OG1-CB 3.36Å; T364-W489 PolarHBondContact OG1-N 3.38Å
365	I	96.3	Very high	94.4	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.2	-175.6	-54.1	98.6	0	0	0	108.9	K306 F316 L363 D369 C371	K306-I365 HydrophobicContact CB-CD1 3.46Å; K306-I365 VanDerWaalsContact CB-CD1 3.46Å; K306-I365 HydrophobicContact CD-CD1 3.83Å; K306-I365 HydrophobicContact CG-CD1 4.18Å; F316-I365 HydrophobicContact CB-CD1 4.18Å; F316-I365 HydrophobicContact CB-CG1 4.3Å; F316-I365 HydrophobicContact CD2-CD1 3.8Å; F316-I365 HydrophobicContact CD2-CG1 3.59Å; F316-I365 HydrophobicContact CD2-CG2 4.44Å; F316-I365 HydrophobicContact CE2-CG1 3.96Å; F316-I365 HydrophobicContact CE2-CG2 3.96Å; F316-I365 HydrophobicContact CG-CD1 4.17Å; F316-I365 HydrophobicContact CG-CG1 3.88Å; F316-I365 HydrophobicContact CZ-CG2 4.21Å; L363-I365 HydrophobicContact CD1-CD1 3.36Å; L363-I365 HydrophobicContact CD1-CG1 3.99Å; I365-D369 HydrophobicContact CG2-CB 4.45Å; I365-C371 WeakPolarHBondContact CA-O 3.49Å
366	S	94.7	Very high	94.5	Very high	4 Å²	4	19.1 Å²	19.1	3%	0.028	10%	0.097	C	C	.	.			trans	-63.1	155.2	171.1	65	0	0	0	0	111.4	N368 D369 R370 C371	S366-N368 WeakPolarHBondContact CB-OD1 3.38Å; S366-N368 PolarHBondContact O-N 2.67Å; S366-N368 PolarHBondContact OG-OD1 2.87Å; S366-D369 PolarHBondContact O-N 2.9Å; S366-R370 PolarHBondContact OG-N 2.63Å; S366-C371 PolarHBondContact N-O 2.9Å; S366-C371 PolarHBondContact OG-N 2.87Å; S366-C371 PolarHBondContact OG-O 2.82Å
367	S	93.2	Very high	94.5	Very high	21 Å²	21	18.3 Å²	18.3	15%	0.147	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15	-174.7	-55	0	0	0	0	115.3	Q309 C310 P491 W492	Q309-S367 WeakPolarHBondContact CB-O 3.33Å; C310-S367 PolarHBondContact SG-O 3.19Å; S367-P491 WeakPolarHBondContact OG-CA 3.27Å; S367-W492 PolarHBondContact OG-N 2.61Å
368	N	91.9	Very high	94.3	Very high	49 Å²	49	21.7 Å²	21.7	26%	0.262	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	12.7	177.5	64.4	-5.2	0	0	0	113.4	S366 R370	S366-N368 WeakPolarHBondContact CB-OD1 3.38Å; S366-N368 PolarHBondContact O-N 2.67Å; S366-N368 PolarHBondContact OG-OD1 2.87Å; N368-R370 PolarHBondContact O-N 3.06Å; N368-R370 VanDerWaalsContact O-N 3.07Å; N368-R370 VanDerWaalsContact OD1-CB 3.31Å; N368-R370 WeakPolarHBondContact OD1-CB 3.37Å; N368-R370 PolarHBondContact OD1-N 2.89Å
369	D	93.6	Very high	94.2	Very high	9 Å²	9	17.7 Å²	17.7	5%	0.048	9%	0.094	C	C	.	.	S	Bend	trans	58.6	16.9	-177.8	-62.9	-23.1	0	0	0	115.2	G308 Q309 C310 S311 F316 I365 S366 R386	G308-D369 WeakPolarHBondContact CA-OD1 3.31Å; G308-D369 WeakPolarHBondContact CA-OD2 3.37Å; Q309-D369 WeakPolarHBondContact CB-OD1 3.4Å; Q309-D369 PolarHBondContact N-OD1 3.49Å; Q309-D369 PolarHBondContact N-OD2 3.18Å; C310-D369 PolarHBondContact N-OD2 2.99Å; S311-D369 PolarHBondContact N-OD2 3.18Å; S311-D369 PolarHBondContact OG-OD2 2.83Å; F316-D369 HydrophobicContact CZ-CB 4.35Å; I365-D369 HydrophobicContact CG2-CB 4.45Å; S366-D369 PolarHBondContact O-N 2.9Å; D369-R386 VanDerWaalsContact O-CD 3.24Å; D369-R386 WeakPolarHBondContact O-CD 3.47Å; D369-R386 PolarHBondContact O-NH1 3.3Å
370	R	92.1	Very high	94.1	Very high	12 Å²	12	16.8 Å²	16.8	5%	0.045	9%	0.09	C	C	.	.			trans	-85	-46.5	-177.7	179.1	177.9	172.2	175.9	-23.8	113.3	V16 S366 N368 D385 R386 Q387	V16-R370 PolarHBondContact O-NH1 2.84Å; S366-R370 PolarHBondContact OG-N 2.63Å; N368-R370 PolarHBondContact O-N 3.06Å; N368-R370 VanDerWaalsContact O-N 3.07Å; N368-R370 VanDerWaalsContact OD1-CB 3.31Å; N368-R370 WeakPolarHBondContact OD1-CB 3.37Å; N368-R370 PolarHBondContact OD1-N 2.89Å; R370-D385 VanDerWaalsContact CG-OD1 3.26Å; R370-D385 WeakPolarHBondContact CG-OD1 3.48Å; R370-D385 IonicContact CZ-OD1 3.57Å; R370-D385 IonicContact CZ-OD2 3.65Å; R370-D385 VanDerWaalsContact CZ-OD2 3.26Å; R370-D385 VanDerWaalsContact NE-CG 3.3Å; R370-D385 IonicContact NE-OD1 3.57Å; R370-D385 PolarHBondContact NE-OD1 2.79Å; R370-D385 IonicContact NE-OD2 3.64Å; R370-D385 PolarHBondContact NE-OD2 3.11Å; R370-D385 IonicContact NH2-OD1 3.52Å; R370-D385 IonicContact NH2-OD2 2.75Å; R370-D385 PolarHBondContact NH2-OD2 2.92Å; R370-R386 WeakPolarHBondContact O-CB 3.47Å; R370-R386 VanDerWaalsContact O-CG 3.27Å; R370-R386 WeakPolarHBondContact O-CG 3.14Å; R370-R386 PolarHBondContact O-N 3.31Å; R370-Q387 VanDerWaalsContact CD-OE1 3.29Å; R370-Q387 HydrophobicContact CG-CB 4.33Å; R370-Q387 HydrophobicContact CG-CG 4.01Å; R370-Q387 VanDerWaalsContact NH1-OE1 3.12Å
371	C	93.8	Very high	94.3	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.3	-173.3	-62.5	0	0	0	0	110.1	I365 S366 V383 F384 W489	I365-C371 WeakPolarHBondContact CA-O 3.49Å; S366-C371 PolarHBondContact N-O 2.9Å; S366-C371 PolarHBondContact OG-N 2.87Å; S366-C371 PolarHBondContact OG-O 2.82Å; C371-V383 HydrophobicContact CB-CG1 4.37Å; C371-F384 CarbonylContact C-O 3.56Å; C371-F384 VanDerWaalsContact CA-O 3.32Å; C371-F384 WeakPolarHBondContact CA-O 3.41Å; C371-W489 HydrophobicContact CB-CH2 3.51Å; C371-W489 HydrophobicContact CB-CZ2 4.38Å; C371-W489 HydrophobicContact CB-CZ3 3.78Å
372	I	96.1	Very high	94.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132	172.6	-49.5	163	0	0	0	107.9	F316 V323 Y338 V383 F384 R386	F316-I372 HydrophobicContact CD1-CD1 3.61Å; F316-I372 HydrophobicContact CD1-CG1 4Å; F316-I372 HydrophobicContact CE1-CD1 3.71Å; F316-I372 HydrophobicContact CE1-CG1 3.99Å; V323-I372 HydrophobicContact CG1-CD1 4.01Å; V323-I372 HydrophobicContact CG1-CG2 3.88Å; Y338-I372 HydrophobicContact CD2-CD1 4.21Å; Y338-I372 HydrophobicContact CE2-CD1 3.99Å; I372-V383 CarbonylContact O-C 3.54Å; I372-V383 VanDerWaalsContact O-CA 3.29Å; I372-V383 WeakPolarHBondContact O-CA 3.44Å; I372-F384 HydrophobicContact CB-CB 4.46Å; I372-F384 PolarHBondContact N-O 3.19Å; I372-F384 PolarHBondContact O-N 2.85Å; I372-R386 HydrophobicContact CD1-CG 4.11Å; I372-R386 HydrophobicContact CG1-CG 4.4Å
373	M	96.4	Very high	94.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.3	176.5	-179.6	-178.1	-74	0	0	110.4	W24 L363 T364 V381 K382 V383 V487 W489 A496 V498 I507	W24-M373 HydrophobicContact CH2-CE 3.4Å; W24-M373 HydrophobicContact CZ2-CE 4.05Å; W24-M373 HydrophobicContact CZ3-CE 3.71Å; L363-M373 CarbonylContact C-O 3.3Å; L363-M373 WeakPolarHBondContact CA-O 3.37Å; T364-M373 HydrophobicContact CG2-CB 3.87Å; T364-M373 HydrophobicContact CG2-CG 4.46Å; T364-M373 PolarHBondContact N-O 3.08Å; T364-M373 PolarHBondContact O-N 3.02Å; M373-V381 HydrophobicContact CG-CG1 3.76Å; M373-V381 HydrophobicContact SD-CG1 4.14Å; M373-K382 VanDerWaalsContact CA-O 3.29Å; M373-K382 WeakPolarHBondContact CA-O 3.3Å; M373-V383 HydrophobicContact CB-CG2 4.47Å; M373-V383 HydrophobicContact CE-CG2 3.58Å; M373-V383 HydrophobicContact CG-CG2 4.22Å; M373-V487 HydrophobicContact CG-CG1 4.29Å; M373-W489 HydrophobicContact CB-CE3 4.13Å; M373-W489 HydrophobicContact CB-CZ3 4.06Å; M373-W489 HydrophobicContact CE-CE3 4.49Å; M373-W489 HydrophobicContact CE-CZ3 4.1Å; M373-A496 HydrophobicContact CE-CB 3.76Å; M373-A496 HydrophobicContact SD-CB 3.59Å; M373-A496 VanDerWaalsContact SD-CB 3.59Å; M373-V498 HydrophobicContact SD-CG2 3.88Å; M373-I507 HydrophobicContact CE-CD1 3.66Å; M373-I507 HydrophobicContact SD-CD1 4.12Å
374	T	97.4	Very high	93.9	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	148.1	174.7	-171.7	0	0	0	0	110.2	R318 V323 V340 K362 K382 F384	R318-T374 WeakPolarHBondContact CD-OG1 3.22Å; R318-T374 PolarHBondContact NE-OG1 3.26Å; V323-T374 HydrophobicContact CG2-CG2 3.83Å; V340-T374 HydrophobicContact CG1-CG2 4.32Å; V340-T374 HydrophobicContact CG2-CG2 3.79Å; K362-T374 PolarHBondContact O-OG1 3.19Å; T374-K382 HydrophobicContact CG2-CB 4.38Å; T374-K382 PolarHBondContact N-O 3.1Å; T374-K382 PolarHBondContact O-N 3.36Å; T374-F384 HydrophobicContact CG2-CE2 4.23Å
375	G	95.1	Very high	93.7	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	169.5	175.5	0	0	0	0	0	113	F361 W484	F361-G375 WeakPolarHBondContact CD1-O 3.3Å; G375-W484 CarbonylContact C-O 3.51Å; G375-W484 VanDerWaalsContact CA-O 3.23Å; G375-W484 WeakPolarHBondContact CA-O 3.48Å
376	S	94.5	Very high	93.5	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.073	C	C	.	.			trans	-151.5	-161.3	171.5	-172	0	0	0	0	108.1	F361 T380 W484	F361-S376 VanDerWaalsContact CE1-CA 3.44Å; S376-T380 CarbonylContact C-O 3.54Å; S376-T380 WeakPolarHBondContact CB-OG1 3.47Å; S376-T380 PolarHBondContact N-O 2.77Å; S376-W484 WeakPolarHBondContact O-CB 3.46Å; S376-W484 PolarHBondContact O-N 3.15Å; S376-W484 VanDerWaalsContact O-N 3.1Å
377	Y	92.8	Very high	93.2	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.016	10%	0.102	C	C	.	.	S	Bend	trans	-89	178.9	-178	-63.7	-61.8	0	0	0	112.2	Y320 L344 L356 D359 F361 N379 T380 V480 R482 K483	Y320-Y377 HydrophobicContact CE2-CE2 4.39Å; Y320-Y377 WeakPolarHBondContact OH-CE2 3.49Å; Y320-Y377 PolarHBondContact OH-OH 3.1Å; L344-Y377 HydrophobicContact CD1-CD2 3.65Å; L344-Y377 HydrophobicContact CD1-CE2 3.8Å; L356-Y377 PolarHBondContact O-OH 2.87Å; D359-Y377 VanDerWaalsContact OD2-CE1 3.31Å; D359-Y377 WeakPolarHBondContact OD2-CE1 3.35Å; D359-Y377 PolarHBondContact OD2-OH 2.91Å; F361-Y377 HydrophobicContact CE2-CE1 4.12Å; F361-Y377 AromaticContact CE2-CE2 3.84Å; F361-Y377 HydrophobicContact CE2-CE2 3.84Å; F361-Y377 AromaticContact CE2-CZ 3.64Å; F361-Y377 AromaticContact CZ-CD1 3.77Å; F361-Y377 HydrophobicContact CZ-CD1 3.77Å; F361-Y377 AromaticContact CZ-CD2 4Å; F361-Y377 HydrophobicContact CZ-CD2 4Å; F361-Y377 AromaticContact CZ-CE1 3.48Å; F361-Y377 HydrophobicContact CZ-CE1 3.48Å; F361-Y377 VanDerWaalsContact CZ-CE1 3.48Å; F361-Y377 AromaticContact CZ-CE2 3.67Å; F361-Y377 HydrophobicContact CZ-CE2 3.67Å; F361-Y377 HydrophobicContact CZ-CG 4.09Å; F361-Y377 AromaticContact CZ-CZ 3.44Å; F361-Y377 VanDerWaalsContact CZ-CZ 3.44Å; Y377-N379 PolarHBondContact O-N 2.73Å; Y377-T380 VanDerWaalsContact O-CB 3.28Å; Y377-T380 WeakPolarHBondContact O-CB 3.47Å; Y377-T380 WeakPolarHBondContact O-CG2 3.49Å; Y377-T380 PolarHBondContact O-N 2.83Å; Y377-T380 PolarHBondContact O-OG1 2.88Å; Y377-V480 WeakPolarHBondContact CB-O 3.49Å; Y377-V480 HydrophobicContact CD1-CB 4.32Å; Y377-V480 HydrophobicContact CD1-CG1 2.98Å; Y377-V480 HydrophobicContact CD2-CG1 3.59Å; Y377-V480 HydrophobicContact CE1-CG1 3.4Å; Y377-V480 VanDerWaalsContact CE1-CG1 3.4Å; Y377-V480 HydrophobicContact CE2-CG1 3.99Å; Y377-V480 HydrophobicContact CG-CB 4.47Å; Y377-V480 HydrophobicContact CG-CG1 3Å; Y377-R482 CarbonylContact C-O 3.56Å; Y377-K483 HydrophobicContact CD1-CB 4.48Å; Y377-K483 HydrophobicContact CD1-CG 4.03Å; Y377-K483 HydrophobicContact CE1-CD 4.37Å; Y377-K483 HydrophobicContact CE1-CG 4.01Å
378	N	87.5	Confident	92.9	Very high	84 Å²	84	21.3 Å²	21.3	45%	0.449	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	41.8	170.2	-79	-24	0	0	0	115.8	T380 V480 G481 R482	N378-T380 VanDerWaalsContact C-N 3.32Å; N378-T380 HydrophobicContact CB-CG2 4.35Å; N378-T380 WeakPolarHBondContact O-CG2 3.15Å; N378-T380 PolarHBondContact O-N 2.93Å; N378-V480 PolarHBondContact N-O 3.41Å; N378-V480 PolarHBondContact OD1-O 3.37Å; N378-G481 WeakPolarHBondContact OD1-CA 3.11Å; N378-G481 PolarHBondContact OD1-N 3.28Å; N378-R482 PolarHBondContact N-O 3.11Å
379	N	89.1	Confident	92.5	Very high	28 Å²	28	20.2 Å²	20.2	15%	0.15	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	31.2	-178.5	-62.1	-16.1	0	0	0	114	Y377 I397 M398 D400 R482	Y377-N379 PolarHBondContact O-N 2.73Å; N379-I397 CarbonylContact O-C 3.56Å; N379-I397 WeakPolarHBondContact O-CA 3.15Å; N379-M398 HydrophobicContact CB-CB 4.3Å; N379-M398 WeakPolarHBondContact CB-O 3.4Å; N379-M398 WeakPolarHBondContact O-CG 3.46Å; N379-M398 PolarHBondContact O-N 3.45Å; N379-D400 PolarHBondContact ND2-OD1 2.94Å; N379-R482 WeakPolarHBondContact OD1-CB 3.46Å; N379-R482 WeakPolarHBondContact OD1-CD 3.3Å; N379-R482 WeakPolarHBondContact OD1-CG 3.15Å
380	T	92.4	Very high	91.7	Very high	9 Å²	9	25 Å²	25	6%	0.055	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.7	-172.1	76.9	0	0	0	0	111.9	S376 Y377 N378 K395 L396	S376-T380 CarbonylContact C-O 3.54Å; S376-T380 WeakPolarHBondContact CB-OG1 3.47Å; S376-T380 PolarHBondContact N-O 2.77Å; Y377-T380 VanDerWaalsContact O-CB 3.28Å; Y377-T380 WeakPolarHBondContact O-CB 3.47Å; Y377-T380 WeakPolarHBondContact O-CG2 3.49Å; Y377-T380 PolarHBondContact O-N 2.83Å; Y377-T380 PolarHBondContact O-OG1 2.88Å; N378-T380 VanDerWaalsContact C-N 3.32Å; N378-T380 HydrophobicContact CB-CG2 4.35Å; N378-T380 WeakPolarHBondContact O-CG2 3.15Å; N378-T380 PolarHBondContact O-N 2.93Å; T380-K395 HydrophobicContact CG2-CD 4.24Å; T380-K395 HydrophobicContact CG2-CG 4.4Å; T380-L396 WeakPolarHBondContact CA-O 3.2Å
381	V	94.8	Very high	90.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.3	170.7	177.9	0	0	0	0	107.2	M373 K395 L396 M398 W484 V498	M373-V381 HydrophobicContact CG-CG1 3.76Å; M373-V381 HydrophobicContact SD-CG1 4.14Å; V381-K395 CarbonylContact O-C 3.5Å; V381-K395 WeakPolarHBondContact O-CA 3.38Å; V381-L396 HydrophobicContact CB-CB 4.32Å; V381-L396 PolarHBondContact N-O 2.89Å; V381-L396 WeakPolarHBondContact O-CB 3.39Å; V381-L396 PolarHBondContact O-N 3.46Å; V381-M398 HydrophobicContact CB-CG 4.42Å; V381-M398 HydrophobicContact CB-SD 4.16Å; V381-M398 HydrophobicContact CG2-CE 4.36Å; V381-M398 HydrophobicContact CG2-CG 3.66Å; V381-M398 HydrophobicContact CG2-SD 3.76Å; V381-W484 HydrophobicContact CG2-CB 4.3Å; V381-W484 HydrophobicContact CG2-CD2 4.26Å; V381-W484 HydrophobicContact CG2-CE3 4.37Å; V381-W484 HydrophobicContact CG2-CG 4.27Å; V381-V498 HydrophobicContact CG1-CG1 4.3Å; V381-V498 HydrophobicContact CG1-CG2 4.32Å; V381-V498 HydrophobicContact CG2-CB 4.42Å; V381-V498 HydrophobicContact CG2-CG1 3.43Å; V381-V498 VanDerWaalsContact CG2-CG1 3.43Å; V381-V498 HydrophobicContact CG2-CG2 4.5Å
382	K	94.8	Very high	90	Very high	22 Å²	22	29.5 Å²	29.5	10%	0.096	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.8	-179.9	-65.6	-160.9	176.9	-156.7	0	111	P339 V340 M373 T374 F384 I447	P339-K382 PolarHBondContact O-NZ 3.36Å; V340-K382 HydrophobicContact CB-CD 4.2Å; V340-K382 HydrophobicContact CG1-CD 3.87Å; V340-K382 HydrophobicContact CG1-CG 4.46Å; V340-K382 HydrophobicContact CG2-CD 4.28Å; V340-K382 WeakPolarHBondContact O-CE 3.4Å; V340-K382 PolarHBondContact O-NZ 3.11Å; M373-K382 VanDerWaalsContact CA-O 3.29Å; M373-K382 WeakPolarHBondContact CA-O 3.3Å; T374-K382 HydrophobicContact CG2-CB 4.38Å; T374-K382 PolarHBondContact N-O 3.1Å; T374-K382 PolarHBondContact O-N 3.36Å; K382-F384 HydrophobicContact CB-CE2 3.91Å; K382-F384 HydrophobicContact CB-CZ 3.89Å; K382-F384 HydrophobicContact CD-CE1 4.37Å; K382-F384 HydrophobicContact CD-CE2 4.4Å; K382-F384 HydrophobicContact CD-CZ 3.68Å; K382-F384 HydrophobicContact CG-CZ 4.48Å; K382-I447 HydrophobicContact CB-CD1 4.22Å; K382-I447 HydrophobicContact CD-CD1 3.71Å; K382-I447 HydrophobicContact CG-CD1 4.08Å
383	V	94.7	Very high	89.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.5	171	-172	0	0	0	0	108.2	W24 C371 I372 M373 S393 Y394 L396	W24-V383 HydrophobicContact CZ2-CG1 4.17Å; W24-V383 HydrophobicContact CZ2-CG2 4.1Å; C371-V383 HydrophobicContact CB-CG1 4.37Å; I372-V383 CarbonylContact O-C 3.54Å; I372-V383 VanDerWaalsContact O-CA 3.29Å; I372-V383 WeakPolarHBondContact O-CA 3.44Å; M373-V383 HydrophobicContact CB-CG2 4.47Å; M373-V383 HydrophobicContact CE-CG2 3.58Å; M373-V383 HydrophobicContact CG-CG2 4.22Å; V383-S393 WeakPolarHBondContact O-CA 3.48Å; V383-Y394 HydrophobicContact CB-CD2 4.02Å; V383-Y394 HydrophobicContact CB-CE2 3.39Å; V383-Y394 HydrophobicContact CG1-CE2 3.97Å; V383-Y394 WeakPolarHBondContact CG1-OH 3.44Å; V383-Y394 HydrophobicContact CG2-CD2 4.33Å; V383-Y394 HydrophobicContact CG2-CE2 3.66Å; V383-Y394 PolarHBondContact N-O 3.08Å; V383-Y394 PolarHBondContact O-N 2.97Å; V383-L396 HydrophobicContact CG2-CD1 3.92Å; V383-L396 HydrophobicContact CG2-CG 4.33Å
384	F	94.4	Very high	89	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.7	178.4	-56.5	-72.3	0	0	0	109	V323 Y338 V340 C371 I372 T374 K382 I447	V323-F384 HydrophobicContact CG2-CE2 4.24Å; Y338-F384 HydrophobicContact CD1-CB 3.92Å; Y338-F384 AromaticContact CD1-CD1 3.5Å; Y338-F384 HydrophobicContact CD1-CD1 3.5Å; Y338-F384 HydrophobicContact CD1-CE1 4.17Å; Y338-F384 AromaticContact CD1-CG 3.81Å; Y338-F384 HydrophobicContact CD1-CG 3.81Å; Y338-F384 HydrophobicContact CD2-CB 4.18Å; Y338-F384 HydrophobicContact CD2-CG 4.23Å; Y338-F384 HydrophobicContact CE1-CB 4.07Å; Y338-F384 HydrophobicContact CE1-CD1 4.33Å; Y338-F384 HydrophobicContact CE1-CG 4.46Å; Y338-F384 HydrophobicContact CE2-CB 4.33Å; Y338-F384 HydrophobicContact CG-CB 3.97Å; Y338-F384 AromaticContact CG-CD1 3.7Å; Y338-F384 HydrophobicContact CG-CD1 3.7Å; Y338-F384 HydrophobicContact CG-CD2 4.16Å; Y338-F384 HydrophobicContact CG-CE1 4.19Å; Y338-F384 AromaticContact CG-CG 3.68Å; Y338-F384 HydrophobicContact CG-CG 3.68Å; V340-F384 HydrophobicContact CG2-CE2 3.86Å; V340-F384 HydrophobicContact CG2-CZ 3.86Å; C371-F384 CarbonylContact C-O 3.56Å; C371-F384 VanDerWaalsContact CA-O 3.32Å; C371-F384 WeakPolarHBondContact CA-O 3.41Å; I372-F384 HydrophobicContact CB-CB 4.46Å; I372-F384 PolarHBondContact N-O 3.19Å; I372-F384 PolarHBondContact O-N 2.85Å; T374-F384 HydrophobicContact CG2-CE2 4.23Å; K382-F384 HydrophobicContact CB-CE2 3.91Å; K382-F384 HydrophobicContact CB-CZ 3.89Å; K382-F384 HydrophobicContact CD-CE1 4.37Å; K382-F384 HydrophobicContact CD-CE2 4.4Å; K382-F384 HydrophobicContact CD-CZ 3.68Å; K382-F384 HydrophobicContact CG-CZ 4.48Å; F384-I447 HydrophobicContact CD1-CD1 4.21Å; F384-I447 HydrophobicContact CE1-CD1 3.56Å; F384-I447 HydrophobicContact CZ-CD1 4.16Å
385	D	92.6	Very high	88.7	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	116.1	170.2	-171.9	-20.7	0	0	0	109.6	R370 Q387 N388 P389 G392	R370-D385 VanDerWaalsContact CG-OD1 3.26Å; R370-D385 WeakPolarHBondContact CG-OD1 3.48Å; R370-D385 IonicContact CZ-OD1 3.57Å; R370-D385 IonicContact CZ-OD2 3.65Å; R370-D385 VanDerWaalsContact CZ-OD2 3.26Å; R370-D385 VanDerWaalsContact NE-CG 3.3Å; R370-D385 IonicContact NE-OD1 3.57Å; R370-D385 PolarHBondContact NE-OD1 2.79Å; R370-D385 IonicContact NE-OD2 3.64Å; R370-D385 PolarHBondContact NE-OD2 3.11Å; R370-D385 IonicContact NH2-OD1 3.52Å; R370-D385 IonicContact NH2-OD2 2.75Å; R370-D385 PolarHBondContact NH2-OD2 2.92Å; D385-Q387 VanDerWaalsContact C-N 3.31Å; D385-Q387 PolarHBondContact O-N 2.94Å; D385-Q387 PolarHBondContact OD1-N 2.75Å; D385-N388 CarbonylContact O-C 3.51Å; D385-N388 VanDerWaalsContact O-C 3.3Å; D385-N388 PolarHBondContact OD1-N 3.12Å; D385-P389 VanDerWaalsContact O-CA 3.25Å; D385-P389 WeakPolarHBondContact O-CA 3.42Å; D385-G392 WeakPolarHBondContact CB-O 3.24Å; D385-G392 PolarHBondContact N-O 2.88Å
386	R	91.8	Very high	88.6	Confident	52 Å²	52	32.7 Å²	32.7	20%	0.196	16%	0.16	C	C	.	.	S	Bend	trans	-71.3	-26.4	-178.9	-62	173	66.2	-145.9	-4.8	113.2	E336 Y338 D369 R370 I372	E336-R386 VanDerWaalsContact CD-NE 3.31Å; E336-R386 IonicContact OE1-CZ 3.47Å; E336-R386 IonicContact OE1-NE 3.12Å; E336-R386 PolarHBondContact OE1-NE 2.82Å; E336-R386 IonicContact OE1-NH2 2.84Å; E336-R386 PolarHBondContact OE1-NH2 3.19Å; E336-R386 WeakPolarHBondContact OE2-CD 3.28Å; E336-R386 WeakPolarHBondContact OE2-CG 3.45Å; E336-R386 IonicContact OE2-CZ 3.4Å; E336-R386 IonicContact OE2-NE 3.38Å; E336-R386 PolarHBondContact OE2-NE 2.92Å; E336-R386 IonicContact OE2-NH2 2.65Å; Y338-R386 HydrophobicContact CE2-CG 4.41Å; Y338-R386 WeakPolarHBondContact OH-CA 3.32Å; D369-R386 VanDerWaalsContact O-CD 3.24Å; D369-R386 WeakPolarHBondContact O-CD 3.47Å; D369-R386 PolarHBondContact O-NH1 3.3Å; R370-R386 WeakPolarHBondContact O-CB 3.47Å; R370-R386 VanDerWaalsContact O-CG 3.27Å; R370-R386 WeakPolarHBondContact O-CG 3.14Å; R370-R386 PolarHBondContact O-N 3.31Å; I372-R386 HydrophobicContact CD1-CG 4.11Å; I372-R386 HydrophobicContact CG1-CG 4.4Å
387	Q	88.5	Confident	88.5	Confident	139 Å²	139	35.4 Å²	35.4	65%	0.65	17%	0.174	S	C	*	.	S	Bend	trans	-85.1	-28.2	179.9	-69.1	179.9	-7.7	0	0	112.3	R370 D385	R370-Q387 VanDerWaalsContact CD-OE1 3.29Å; R370-Q387 HydrophobicContact CG-CB 4.33Å; R370-Q387 HydrophobicContact CG-CG 4.01Å; R370-Q387 VanDerWaalsContact NH1-OE1 3.12Å; D385-Q387 VanDerWaalsContact C-N 3.31Å; D385-Q387 PolarHBondContact O-N 2.94Å; D385-Q387 PolarHBondContact OD1-N 2.75Å
388	N	86.4	Confident	88.3	Confident	33 Å²	33	35.4 Å²	35.4	18%	0.176	17%	0.174	C	C	.	.	S	Bend	trans	-131.1	73.4	174.8	-170.1	-3.1	0	0	0	110.4	D385 I390 E391 G392	D385-N388 CarbonylContact O-C 3.51Å; D385-N388 VanDerWaalsContact O-C 3.3Å; D385-N388 PolarHBondContact OD1-N 3.12Å; N388-I390 VanDerWaalsContact C-N 3.29Å; N388-I390 PolarHBondContact O-N 3.27Å; N388-E391 PolarHBondContact ND2-OE2 2.84Å; N388-E391 PolarHBondContact OD1-N 3.08Å; N388-G392 WeakPolarHBondContact O-CA 3.27Å; N388-G392 PolarHBondContact O-N 3.27Å
389	P	83	Confident	88	Confident	26 Å²	26	33.6 Å²	33.6	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.5	-171.8	23.3	-33.4	0	0	0	113.6	Y338 D385 S393 I449 F453	Y338-P389 HydrophobicContact CE1-CB 4.39Å; D385-P389 VanDerWaalsContact O-CA 3.25Å; D385-P389 WeakPolarHBondContact O-CA 3.42Å; P389-S393 VanDerWaalsContact O-CB 3.23Å; P389-S393 WeakPolarHBondContact O-CB 3.25Å; P389-S393 PolarHBondContact O-OG 3.37Å; P389-I449 VanDerWaalsContact O-CD1 3.32Å; P389-I449 WeakPolarHBondContact O-CD1 3.38Å; P389-F453 HydrophobicContact CB-CE2 4.4Å; P389-F453 HydrophobicContact CB-CZ 4.25Å; P389-F453 HydrophobicContact CG-CE2 4.35Å; P389-F453 HydrophobicContact CG-CZ 4Å
390	I	78.5	Confident	87.3	Confident	111 Å²	111	36.2 Å²	36.2	57%	0.569	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-50.5	-175.5	-61.5	174	0	0	0	111.1	N388	N388-I390 VanDerWaalsContact C-N 3.29Å; N388-I390 PolarHBondContact O-N 3.27Å
391	E	75.4	Confident	86.1	Confident	105 Å²	105	37.5 Å²	37.5	49%	0.491	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-21.6	-175.7	-58.3	179.7	154.3	0	0	113.1	N388 L446	N388-E391 PolarHBondContact ND2-OE2 2.84Å; N388-E391 PolarHBondContact OD1-N 3.08Å; E391-L446 WeakPolarHBondContact O-CD2 3.5Å
392	G	75	Confident	84.4	Confident	3 Å²	3	41.8 Å²	41.8	3%	0.031	21%	0.205	C	C	.	.	S	Bend	trans	-96.1	7.6	-177.1	0	0	0	0	0	114	D385 N388 Y394	D385-G392 WeakPolarHBondContact CB-O 3.24Å; D385-G392 PolarHBondContact N-O 2.88Å; N388-G392 WeakPolarHBondContact O-CA 3.27Å; N388-G392 PolarHBondContact O-N 3.27Å; G392-Y394 WeakPolarHBondContact O-CD1 3.37Å; G392-Y394 WeakPolarHBondContact O-CE1 3.48Å
393	S	85.8	Confident	82.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.3	170.8	-58.8	0	0	0	0	111.1	V383 P389 I447 I449	V383-S393 WeakPolarHBondContact O-CA 3.48Å; P389-S393 VanDerWaalsContact O-CB 3.23Å; P389-S393 WeakPolarHBondContact O-CB 3.25Å; P389-S393 PolarHBondContact O-OG 3.37Å; S393-I447 PolarHBondContact O-N 3.11Å; S393-I449 WeakPolarHBondContact OG-CD1 3.37Å
394	Y	85.7	Confident	80.3	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	154.6	-174.5	44.7	-92.4	0	0	0	112.1	W24 V383 G392 L396 D445 I447	W24-Y394 AromaticContact CD1-CE2 3.37Å; W24-Y394 AromaticContact CD1-CZ 3.82Å; W24-Y394 AromaticContact CE2-CE2 3.83Å; W24-Y394 HydrophobicContact CG-CE2 4.39Å; W24-Y394 HydrophobicContact CZ2-CE2 4.47Å; W24-Y394 AromaticContact NE1-CE2 2.97Å; W24-Y394 AromaticContact NE1-CZ 3.11Å; W24-Y394 PolarHBondContact NE1-OH 3.21Å; V383-Y394 HydrophobicContact CB-CD2 4.02Å; V383-Y394 HydrophobicContact CB-CE2 3.39Å; V383-Y394 HydrophobicContact CG1-CE2 3.97Å; V383-Y394 WeakPolarHBondContact CG1-OH 3.44Å; V383-Y394 HydrophobicContact CG2-CD2 4.33Å; V383-Y394 HydrophobicContact CG2-CE2 3.66Å; V383-Y394 PolarHBondContact N-O 3.08Å; V383-Y394 PolarHBondContact O-N 2.97Å; G392-Y394 WeakPolarHBondContact O-CD1 3.37Å; G392-Y394 WeakPolarHBondContact O-CE1 3.48Å; Y394-L396 HydrophobicContact CD2-CD2 3.62Å; Y394-L396 HydrophobicContact CD2-CG 4.14Å; Y394-L396 HydrophobicContact CE2-CD2 3.89Å; Y394-L396 HydrophobicContact CE2-CG 4.34Å; Y394-D445 CarbonylContact C-O 3.59Å; Y394-D445 WeakPolarHBondContact CA-O 3.45Å; Y394-D445 WeakPolarHBondContact CB-O 3.49Å; Y394-I447 VanDerWaalsContact C-CD1 3.45Å; Y394-I447 WeakPolarHBondContact O-CD1 3.48Å
395	K	91	Very high	78.6	Confident	65 Å²	65	55 Å²	55	28%	0.283	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.3	174.2	177	-159.4	177.8	-167.2	0	107.5	T380 V381 D444 D445 I447	T380-K395 HydrophobicContact CG2-CD 4.24Å; T380-K395 HydrophobicContact CG2-CG 4.4Å; V381-K395 CarbonylContact O-C 3.5Å; V381-K395 WeakPolarHBondContact O-CA 3.38Å; K395-D444 WeakPolarHBondContact O-CA 3.45Å; K395-D445 PolarHBondContact N-O 2.98Å; K395-D445 PolarHBondContact O-N 3.04Å; K395-I447 HydrophobicContact CB-CG1 4.22Å
396	L	91.8	Very high	76.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.8	171.4	-57	-178	0	0	0	108.9	W24 T380 V381 V383 Y394 M398 I442 D444 I507	W24-L396 HydrophobicContact CB-CD1 4.29Å; W24-L396 HydrophobicContact CB-CD2 3.84Å; W24-L396 HydrophobicContact CD2-CD1 3.93Å; W24-L396 HydrophobicContact CE3-CD1 4.27Å; W24-L396 HydrophobicContact CG-CD1 3.93Å; W24-L396 HydrophobicContact CG-CD2 3.74Å; T380-L396 WeakPolarHBondContact CA-O 3.2Å; V381-L396 HydrophobicContact CB-CB 4.32Å; V381-L396 PolarHBondContact N-O 2.89Å; V381-L396 WeakPolarHBondContact O-CB 3.39Å; V381-L396 PolarHBondContact O-N 3.46Å; V383-L396 HydrophobicContact CG2-CD1 3.92Å; V383-L396 HydrophobicContact CG2-CG 4.33Å; Y394-L396 HydrophobicContact CD2-CD2 3.62Å; Y394-L396 HydrophobicContact CD2-CG 4.14Å; Y394-L396 HydrophobicContact CE2-CD2 3.89Å; Y394-L396 HydrophobicContact CE2-CG 4.34Å; L396-M398 HydrophobicContact CB-SD 4.2Å; L396-I442 HydrophobicContact CB-CG2 3.95Å; L396-I442 HydrophobicContact CD2-CG2 4.2Å; L396-D444 HydrophobicContact CD2-CB 3.8Å; L396-I507 HydrophobicContact CD1-CD1 3.91Å
397	I	91.9	Very high	75	Confident	57 Å²	57	60.9 Å²	60.9	29%	0.292	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	106.3	171.2	-53.3	-170	0	0	0	107.9	N379 I442 H443	N379-I397 CarbonylContact O-C 3.56Å; N379-I397 WeakPolarHBondContact O-CA 3.15Å; I397-I442 WeakPolarHBondContact O-CG2 3.31Å; I397-H443 HydrophobicContact CB-CB 4.4Å; I397-H443 PolarHBondContact N-O 3.12Å
398	M	90.1	Very high	73.6	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.02	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-71.8	140.1	-178.4	-53.1	-57	-74.3	0	0	110.1	N379 V381 L396 W484 V498 H505 I507	N379-M398 HydrophobicContact CB-CB 4.3Å; N379-M398 WeakPolarHBondContact CB-O 3.4Å; N379-M398 WeakPolarHBondContact O-CG 3.46Å; N379-M398 PolarHBondContact O-N 3.45Å; V381-M398 HydrophobicContact CB-CG 4.42Å; V381-M398 HydrophobicContact CB-SD 4.16Å; V381-M398 HydrophobicContact CG2-CE 4.36Å; V381-M398 HydrophobicContact CG2-CG 3.66Å; V381-M398 HydrophobicContact CG2-SD 3.76Å; L396-M398 HydrophobicContact CB-SD 4.2Å; M398-W484 HydrophobicContact CB-CH2 3.73Å; M398-W484 HydrophobicContact CB-CZ2 3.25Å; M398-W484 HydrophobicContact CE-CH2 3.66Å; M398-W484 HydrophobicContact CE-CZ2 4.37Å; M398-W484 HydrophobicContact CE-CZ3 3.8Å; M398-W484 HydrophobicContact CG-CD2 4.25Å; M398-W484 HydrophobicContact CG-CH2 3.88Å; M398-W484 HydrophobicContact CG-CZ2 3.62Å; M398-W484 HydrophobicContact CG-CZ3 4.38Å; M398-V498 HydrophobicContact CE-CB 4.44Å; M398-H505 HydrophobicContact CE-CB 3.78Å; M398-I507 HydrophobicContact CE-CG2 3.98Å
399	Q	80.5	Confident	72.1	Confident	47 Å²	47	57 Å²	57	22%	0.22	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-76.4	152.3	178.7	-61.8	177.8	11	0	0	110.2	R441 H505	Q399-R441 PolarHBondContact NE2-O 3.11Å; Q399-H505 PolarHBondContact O-CE1 3Å; Q399-H505 VanDerWaalsContact O-CE1 3.29Å
400	D	74.8	Confident	70.9	Confident	82 Å²	82	57.8 Å²	57.8	44%	0.439	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-70.6	156.1	166.3	-72	-50.3	0	0	0	110.2	N379 D402 R482	N379-D400 PolarHBondContact ND2-OD1 2.94Å; D400-D402 PolarHBondContact O-N 3.24Å; D400-R482 IonicContact OD1-CZ 3.23Å; D400-R482 IonicContact OD1-NE 2.73Å; D400-R482 PolarHBondContact OD1-NE 3.36Å; D400-R482 VanDerWaalsContact OD1-NE 3.16Å; D400-R482 IonicContact OD1-NH2 3.57Å; D400-R482 PolarHBondContact OD1-NH2 3.17Å
401	E	66	Low	70.1	Confident	36 Å²	36	56.7 Å²	56.7	17%	0.168	28%	0.282	C	S	.	.			trans	-71.8	91	178.2	-59.4	-175.2	-175.8	0	0	111.1	I29 R31 H500 G503	I29-E401 HydrophobicContact CG2-CG 4Å; R31-E401 WeakPolarHBondContact CD-OE2 3.18Å; R31-E401 WeakPolarHBondContact CG-OE2 3.37Å; R31-E401 IonicContact CZ-OE2 2.74Å; R31-E401 IonicContact NE-OE2 2.98Å; R31-E401 PolarHBondContact NE-OE2 3.43Å; R31-E401 PolarHBondContact NH2-O 2.82Å; E401-H500 IonicContact OE1-CE1 2.95Å; E401-H500 PolarHBondContact OE1-CE1 2.94Å; E401-H500 IonicContact OE1-NE2 2.9Å; E401-H500 PolarHBondContact OE1-NE2 3.37Å; E401-G503 WeakPolarHBondContact OE1-CA 3.41Å
402	D	60.1	Low	69	Low	90 Å²	90	55.5 Å²	55.5	48%	0.481	28%	0.282	S	S	.	.			trans	-66.3	153.5	168.2	-65.9	-37.3	0	0	0	111.3	R31 D400 N404 R440	R31-D402 PolarHBondContact NH2-O 3.05Å; R31-D402 VanDerWaalsContact NH2-O 3.08Å; D400-D402 PolarHBondContact O-N 3.24Å; D402-N404 PolarHBondContact O-N 3.17Å; D402-R440 IonicContact OD2-NH1 3.83Å; D402-R440 PolarHBondContact OD2-NH1 3.37Å
403	M	50.8	Low	67.8	Low	142 Å²	142	59.8 Å²	59.8	70%	0.7	31%	0.308	S	S	*	.	S	Bend	trans	-66.4	-2.7	-178.9	-70	-67.6	151	0	0	115	R31 T405	R31-M403 PolarHBondContact NH1-SD 3.2Å; M403-T405 PolarHBondContact O-N 3.38Å; M403-T405 VanDerWaalsContact O-N 3.17Å
404	N	53	Low	65.9	Low	72 Å²	72	63.9 Å²	63.9	39%	0.385	33%	0.33	S	S	.	.			trans	-83.9	99.4	-175.4	-68.9	11.3	0	0	0	110.4	D402	D402-N404 PolarHBondContact O-N 3.17Å
405	T	57.2	Low	63.5	Low	87 Å²	87	69.1 Å²	69.1	53%	0.534	36%	0.358	S	S	.	.			trans	-61.8	132.2	174.8	42.9	0	0	0	0	111.7	M403 H407	M403-T405 PolarHBondContact O-N 3.38Å; M403-T405 VanDerWaalsContact O-N 3.17Å; T405-H407 PolarHBondContact O-N 2.84Å
406	F	55.7	Low	60.9	Low	21 Å²	21	73.7 Å²	73.7	9%	0.092	39%	0.385	C	S	.	.			trans	-61.1	119.6	168.9	-179.7	-100.2	0	0	0	110	N27 E28 A68 C80 D408 W438	N27-F406 WeakPolarHBondContact O-CD2 3.41Å; N27-F406 WeakPolarHBondContact O-CE2 3.36Å; E28-F406 HydrophobicContact CB-CG 4.39Å; E28-F406 HydrophobicContact CG-CB 4.03Å; E28-F406 HydrophobicContact CG-CD1 4.05Å; E28-F406 HydrophobicContact CG-CG 4.04Å; A68-F406 HydrophobicContact CB-CZ 4.42Å; C80-F406 HydrophobicContact CB-CE1 3.65Å; C80-F406 HydrophobicContact CB-CZ 3.84Å; F406-D408 HydrophobicContact CD1-CB 4.08Å; F406-D408 HydrophobicContact CE1-CB 3.26Å; F406-D408 HydrophobicContact CZ-CB 3.55Å; F406-W438 HydrophobicContact CD2-CB 3.76Å; F406-W438 AromaticContact CD2-CD1 3.59Å; F406-W438 AromaticContact CD2-CD2 3.79Å; F406-W438 HydrophobicContact CD2-CD2 3.79Å; F406-W438 HydrophobicContact CD2-CE3 4.47Å; F406-W438 AromaticContact CD2-CG 3.45Å; F406-W438 HydrophobicContact CD2-CG 3.45Å; F406-W438 VanDerWaalsContact CD2-CG 3.45Å; F406-W438 AromaticContact CD2-NE1 3.98Å; F406-W438 HydrophobicContact CE2-CB 3.75Å; F406-W438 AromaticContact CE2-CG 4Å; F406-W438 HydrophobicContact CE2-CG 4Å
407	H	53.9	Low	58.4	Low	158 Å²	158	78.8 Å²	78.8	73%	0.731	42%	0.417	S	S	*	.			trans	-110.8	125.9	171.9	-85.3	-51.5	0	0	0	109.4	T405	T405-H407 PolarHBondContact O-N 2.84Å
408	D	58.7	Low	55.7	Low	20 Å²	20	79.7 Å²	79.7	11%	0.107	43%	0.428	C	S	.	.			trans	-148.1	149.4	179.6	-175.5	17	0	0	0	110.6	A68 C80 F406 F410 R411	A68-D408 WeakPolarHBondContact CA-OD2 3.29Å; A68-D408 WeakPolarHBondContact CB-OD2 3.47Å; C80-D408 PolarHBondContact SG-OD2 3.42Å; F406-D408 HydrophobicContact CD1-CB 4.08Å; F406-D408 HydrophobicContact CE1-CB 3.26Å; F406-D408 HydrophobicContact CZ-CB 3.55Å; D408-F410 PolarHBondContact O-N 3.45Å; D408-R411 PolarHBondContact O-N 2.97Å; D408-R411 VanDerWaalsContact O-N 3.16Å
409	T	54.5	Low	53	Low	70 Å²	70	86.1 Å²	86.1	43%	0.429	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-30	-178.7	56.2	0	0	0	0	111.5	D69 R411 T412 T413	D69-T409 WeakPolarHBondContact OD2-CG2 3.19Å; D69-T409 PolarHBondContact OD2-OG1 2.77Å; T409-R411 PolarHBondContact O-N 2.78Å; T409-R411 VanDerWaalsContact O-N 3.12Å; T409-T412 WeakPolarHBondContact CA-OG1 3.47Å; T409-T412 PolarHBondContact O-N 3.31Å; T409-T412 PolarHBondContact O-OG1 2.92Å; T409-T413 PolarHBondContact O-N 3.11Å
410	F	58.4	Low	50.8	Low	42 Å²	42	90 Å²	90	18%	0.184	48%	0.484	C	S	.	.	H	α-helix	trans	-54	-32.9	175.5	-174.6	-111.7	0	0	0	113.1	G66 C80 K82 D408 T413	G66-F410 VanDerWaalsContact CA-CZ 3.48Å; C80-F410 VanDerWaalsContact SG-CB 3.59Å; C80-F410 WeakPolarHBondContact SG-CD1 3.43Å; K82-F410 HydrophobicContact CB-CD1 3.89Å; K82-F410 HydrophobicContact CB-CE1 3.43Å; K82-F410 VanDerWaalsContact CB-CE1 3.43Å; K82-F410 HydrophobicContact CB-CZ 4.27Å; K82-F410 HydrophobicContact CD-CE1 4.36Å; D408-F410 PolarHBondContact O-N 3.45Å; F410-T413 PolarHBondContact O-OG1 2.85Å; F410-T413 VanDerWaalsContact O-OG1 3.12Å
411	R	61.7	Low	48.7	Very low	89 Å²	89	92.4 Å²	92.4	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-75.9	-33.5	175.1	-70.3	-179.6	169.6	-156.2	-3.5	112.9	E28 S81 D408 T409 T413	E28-R411 IonicContact OE1-CZ 3.61Å; E28-R411 IonicContact OE1-NE 2.62Å; E28-R411 IonicContact OE1-NH2 3.38Å; E28-R411 PolarHBondContact OE1-NH2 2.95Å; S81-R411 PolarHBondContact O-NE 2.93Å; D408-R411 PolarHBondContact O-N 2.97Å; D408-R411 VanDerWaalsContact O-N 3.16Å; T409-R411 PolarHBondContact O-N 2.78Å; T409-R411 VanDerWaalsContact O-N 3.12Å; R411-T413 VanDerWaalsContact C-N 3.32Å; R411-T413 PolarHBondContact O-N 3.04Å
412	T	52.2	Low	47	Very low	79 Å²	79	94.8 Å²	94.8	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-79.6	-7.4	-172.7	62	0	0	0	0	114.9	T409 D414	T409-T412 WeakPolarHBondContact CA-OG1 3.47Å; T409-T412 PolarHBondContact O-N 3.31Å; T409-T412 PolarHBondContact O-OG1 2.92Å; T412-D414 PolarHBondContact O-N 3.49Å
413	T	50.4	Low	45.7	Very low	93 Å²	93	95.8 Å²	95.8	57%	0.571	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-13	-173.2	47.8	0	0	0	0	114.8	T409 F410 R411	T409-T413 PolarHBondContact O-N 3.11Å; F410-T413 PolarHBondContact O-OG1 2.85Å; F410-T413 VanDerWaalsContact O-OG1 3.12Å; R411-T413 VanDerWaalsContact C-N 3.32Å; R411-T413 PolarHBondContact O-N 3.04Å
414	D	44.6	Very low	44.7	Very low	87 Å²	87	96.5 Å²	96.5	47%	0.465	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	30.4	-179.3	-73	-26.9	0	0	0	114.6	K82 T412 N416	K82-D414 IonicContact NZ-OD2 3.26Å; K82-D414 PolarHBondContact NZ-OD2 3Å; T412-D414 PolarHBondContact O-N 3.49Å; D414-N416 VanDerWaalsContact C-N 3.27Å; D414-N416 PolarHBondContact O-N 2.66Å
415	D	35.9	Very low	43.8	Very low	110 Å²	110	97 Å²	97	59%	0.588	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	82.4	173.4	-81	-22.6	0	0	0	110.9
416	N	36.7	Very low	42.3	Very low	161 Å²	161	97.8 Å²	97.8	86%	0.861	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.7	-3	153.2	-91.4	-38.6	0	0	0	114.7	D414	D414-N416 VanDerWaalsContact C-N 3.27Å; D414-N416 PolarHBondContact O-N 2.66Å
417	T	38.4	Very low	41.3	Very low	108 Å²	108	101.6 Å²	101.6	66%	0.663	59%	0.585	S	S	*	*	S	Bend	trans	-145.5	1.1	-175.7	54.7	0	0	0	0	117.9
418	S	35.2	Very low	40.1	Very low	75 Å²	75	100.4 Å²	100.4	52%	0.524	59%	0.589	S	S	.	*			trans	-91.6	126.9	179.7	71.3	0	0	0	0	111.8	F420	S418-F420 PolarHBondContact O-N 2.76Å
419	V	33.7	Very low	39	Very low	140 Å²	140	104.6 Å²	104.6	85%	0.848	62%	0.62	S	S	*	*			trans	-78.8	26.3	-179.8	-176	0	0	0	0	111.4	V421	V419-V421 PolarHBondContact O-N 2.92Å
420	F	35.2	Very low	37.8	Very low	129 Å²	129	105.8 Å²	105.8	57%	0.566	63%	0.631	S	S	*	*			trans	-93.3	97.2	174.6	-74.6	-75.1	0	0	0	108.9	V86 S418 S422	V86-F420 HydrophobicContact CG2-CZ 4.34Å; S418-F420 PolarHBondContact O-N 2.76Å; F420-S422 PolarHBondContact O-N 3.4Å
421	V	30	Very low	36.6	Very low	132 Å²	132	109.8 Å²	109.8	80%	0.8	66%	0.661	S	S	*	*			trans	-59.8	104.5	168.1	178.4	0	0	0	0	107.5	V419	V419-V421 PolarHBondContact O-N 2.92Å
422	S	30.8	Very low	35.3	Very low	85 Å²	85	113.3 Å²	113.3	59%	0.594	69%	0.687	S	S	*	*			trans	-60.6	130.4	152.2	43.8	0	0	0	0	107	F420 I424	F420-S422 PolarHBondContact O-N 3.4Å; S422-I424 PolarHBondContact O-N 2.97Å
423	P	32.2	Very low	34.5	Very low	111 Å²	111	112 Å²	112	72%	0.721	69%	0.689	S	S	*	*			trans	-63.9	114.3	161.7	25	-23.9	0	0	0	105.3	S425	P423-S425 PolarHBondContact O-N 3.18Å
424	I	30.1	Very low	34.1	Very low	158 Å²	158	114.1 Å²	114.1	81%	0.81	70%	0.702	S	S	*	*			trans	-61.4	90.7	163.1	-62.3	169.4	0	0	0	105.2	S422 S426	S422-I424 PolarHBondContact O-N 2.97Å; I424-S426 PolarHBondContact O-N 2.87Å
425	S	33.5	Very low	34.5	Very low	83 Å²	83	117 Å²	117	58%	0.58	71%	0.713	S	S	*	*			trans	-77.5	103	159.3	45.5	0	0	0	0	106.2	P423 S427	P423-S425 PolarHBondContact O-N 3.18Å; S425-S427 PolarHBondContact O-N 3.45Å
426	S	26.8	Very low	35.5	Very low	102 Å²	102	116.8 Å²	116.8	71%	0.713	71%	0.711	S	S	*	*			trans	-59.7	93.8	157	52.1	0	0	0	0	107.7	I424 T428	I424-S426 PolarHBondContact O-N 2.87Å; S426-T428 VanDerWaalsContact C-N 3.28Å; S426-T428 PolarHBondContact O-N 2.95Å
427	S	34.3	Very low	37.2	Very low	101 Å²	101	113.6 Å²	113.6	71%	0.706	70%	0.697	S	S	*	*			trans	-72	91	166.3	49.6	0	0	0	0	108	S425 S429	S425-S427 PolarHBondContact O-N 3.45Å; S427-S429 VanDerWaalsContact C-N 3.3Å; S427-S429 PolarHBondContact O-N 3.44Å
428	T	28.8	Very low	39	Very low	133 Å²	133	110.7 Å²	110.7	82%	0.816	67%	0.674	S	S	*	*			trans	-57.6	103.1	146.6	25.5	0	0	0	0	106.9	S426 S430	S426-T428 VanDerWaalsContact C-N 3.28Å; S426-T428 PolarHBondContact O-N 2.95Å; T428-S430 PolarHBondContact O-N 2.93Å
429	S	35.6	Very low	41.3	Very low	108 Å²	108	107.3 Å²	107.3	76%	0.755	65%	0.651	S	S	*	*			trans	-56.1	103.5	172.9	54.5	0	0	0	0	109.8	S427	S427-S429 VanDerWaalsContact C-N 3.3Å; S427-S429 PolarHBondContact O-N 3.44Å
430	S	28.8	Very low	43.8	Very low	96 Å²	96	101.2 Å²	101.2	67%	0.671	61%	0.612	S	S	*	*			trans	-71.6	127	159.1	52.5	0	0	0	0	108.1	T428 D432	T428-S430 PolarHBondContact O-N 2.93Å; S430-D432 VanDerWaalsContact C-N 3.28Å; S430-D432 PolarHBondContact O-N 3.28Å; S430-D432 VanDerWaalsContact O-N 3.13Å
431	P	34.4	Very low	46.4	Very low	125 Å²	125	99.4 Å²	99.4	81%	0.812	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	1.7	-168.3	-16	30.5	0	0	0	117.2
432	D	34.5	Very low	49.2	Very low	164 Å²	164	93.2 Å²	93.2	88%	0.877	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	19.9	-165.9	-79.2	-30.4	0	0	0	115.6	S430	S430-D432 VanDerWaalsContact C-N 3.28Å; S430-D432 PolarHBondContact O-N 3.28Å; S430-D432 VanDerWaalsContact O-N 3.13Å
433	G	34.8	Very low	51.9	Low	51 Å²	51	94.6 Å²	94.6	53%	0.526	56%	0.561	S	S	.	*			trans	-113	111.1	168.8	0	0	0	0	0	110.2	E435	G433-E435 PolarHBondContact O-N 2.81Å
434	T	42.6	Very low	54.5	Low	137 Å²	137	90 Å²	90	84%	0.84	53%	0.53	S	S	*	.			trans	-61.1	96.6	170.6	46.8	0	0	0	0	109.2	L436	T434-L436 PolarHBondContact O-N 3.2Å; T434-L436 VanDerWaalsContact O-N 3.1Å
435	E	52.4	Low	57.2	Low	149 Å²	149	85.8 Å²	85.8	70%	0.696	51%	0.51	S	S	*	.			trans	-60.4	112.9	173.8	-74.2	-175.4	159.3	0	0	108.9	G433 T437	G433-E435 PolarHBondContact O-N 2.81Å; E435-T437 PolarHBondContact O-N 2.84Å
436	L	57.8	Low	59.5	Low	105 Å²	105	86.5 Å²	86.5	55%	0.55	51%	0.506	S	S	.	.			trans	-69.8	112.1	174.1	-72.4	168	0	0	0	108.9	T434 R440	T434-L436 PolarHBondContact O-N 3.2Å; T434-L436 VanDerWaalsContact O-N 3.1Å; L436-R440 HydrophobicContact CB-CG 4.46Å
437	T	71.7	Confident	62	Low	94 Å²	94	82.4 Å²	82.4	58%	0.577	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-66.9	150.9	175.1	48.3	0	0	0	0	111	I73 E435	I73-T437 WeakPolarHBondContact CD1-O 3.44Å; I73-T437 WeakPolarHBondContact CD1-OG1 3.34Å; E435-T437 PolarHBondContact O-N 2.84Å
438	W	75.7	Confident	63.8	Low	47 Å²	47	83.2 Å²	83.2	18%	0.178	47%	0.472	C	S	.	.	S	Bend	trans	-85	145.9	178.2	-67.4	99.3	0	0	0	111	C26 N27 I29 S71 F406 R440	C26-W438 HydrophobicContact CB-CZ3 4.4Å; C26-W438 WeakPolarHBondContact O-CZ3 3.37Å; N27-W438 VanDerWaalsContact C-CE3 3.47Å; I29-W438 HydrophobicContact CB-CH2 4.3Å; I29-W438 HydrophobicContact CD1-CH2 3.96Å; I29-W438 HydrophobicContact CG1-CH2 3.84Å; I29-W438 HydrophobicContact CG1-CZ3 4.46Å; S71-W438 PolarHBondContact OG-O 2.83Å; F406-W438 HydrophobicContact CD2-CB 3.76Å; F406-W438 AromaticContact CD2-CD1 3.59Å; F406-W438 AromaticContact CD2-CD2 3.79Å; F406-W438 HydrophobicContact CD2-CD2 3.79Å; F406-W438 HydrophobicContact CD2-CE3 4.47Å; F406-W438 AromaticContact CD2-CG 3.45Å; F406-W438 HydrophobicContact CD2-CG 3.45Å; F406-W438 VanDerWaalsContact CD2-CG 3.45Å; F406-W438 AromaticContact CD2-NE1 3.98Å; F406-W438 HydrophobicContact CE2-CB 3.75Å; F406-W438 AromaticContact CE2-CG 4Å; F406-W438 HydrophobicContact CE2-CG 4Å; W438-R440 HydrophobicContact CD2-CG 4.48Å; W438-R440 HydrophobicContact CE3-CG 4.08Å; W438-R440 HydrophobicContact CZ3-CG 4.27Å
439	P	84.4	Confident	65.8	Low	4 Å²	4	77.3 Å²	77.3	3%	0.026	44%	0.436	C	S	.	.	S	Bend	cis	-80.4	160.9	-2.8	42.8	-44.4	0	0	0	111.8	Y25 C26 S71 I73 T74 H78	Y25-P439 HydrophobicContact CD1-CG 4.09Å; Y25-P439 HydrophobicContact CG-CG 4.44Å; C26-P439 CarbonylContact O-C 3.51Å; C26-P439 WeakPolarHBondContact O-CA 3.36Å; C26-P439 WeakPolarHBondContact O-CB 3.39Å; S71-P439 WeakPolarHBondContact OG-CD 3.33Å; I73-P439 WeakPolarHBondContact CD1-O 3.47Å; T74-P439 HydrophobicContact CG2-CG 3.67Å; H78-P439 VanDerWaalsContact CE1-CG 3.46Å; H78-P439 WeakPolarHBondContact CE1-CG 3.28Å; H78-P439 VanDerWaalsContact NE2-CG 3.33Å; H78-P439 WeakPolarHBondContact NE2-CG 3.38Å
440	R	86.2	Confident	66.8	Low	11 Å²	11	76.5 Å²	76.5	4%	0.042	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.2	-178.9	-59.9	179.1	-178.6	-170.1	-0.8	111.1	Y25 C26 D402 L436 W438 I442	Y25-R440 CarbonylContact C-O 3.57Å; Y25-R440 VanDerWaalsContact CA-O 3.25Å; Y25-R440 WeakPolarHBondContact CA-O 3.22Å; C26-R440 PolarHBondContact N-O 3.3Å; C26-R440 PolarHBondContact O-N 2.79Å; D402-R440 IonicContact OD2-NH1 3.83Å; D402-R440 PolarHBondContact OD2-NH1 3.37Å; L436-R440 HydrophobicContact CB-CG 4.46Å; W438-R440 HydrophobicContact CD2-CG 4.48Å; W438-R440 HydrophobicContact CE3-CG 4.08Å; W438-R440 HydrophobicContact CZ3-CG 4.27Å; R440-I442 PolarHBondContact O-N 3.21Å
441	R	88.1	Confident	67.6	Low	92 Å²	92	78.5 Å²	78.5	35%	0.347	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	128.1	174.1	-173.9	70.2	175.4	88.9	11.9	109.8	W24 Y25 Q399 D444	W24-R441 WeakPolarHBondContact O-CD 3.43Å; W24-R441 PolarHBondContact O-NH1 3.16Å; Y25-R441 HydrophobicContact CD1-CB 4.17Å; Y25-R441 HydrophobicContact CE1-CB 3.96Å; Y25-R441 HydrophobicContact CE1-CG 4.36Å; Q399-R441 PolarHBondContact NE2-O 3.11Å; R441-D444 IonicContact CZ-OD1 3.94Å; R441-D444 IonicContact NH1-OD1 3.96Å; R441-D444 PolarHBondContact NH1-OD1 2.83Å; R441-D444 IonicContact NH2-OD1 2.87Å; R441-D444 PolarHBondContact NH2-OD1 2.7Å; R441-D444 IonicContact NH2-OD2 2.75Å
442	I	90	Very high	68.2	Low	2 Å²	2	75.4 Å²	75.4	1%	0.01	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-85.5	132.5	174.3	-62.2	171.9	0	0	0	108.6	W24 C26 L396 I397 R440 I507	W24-I442 HydrophobicContact CB-CB 4.22Å; W24-I442 HydrophobicContact CB-CD1 4.23Å; W24-I442 PolarHBondContact O-N 2.86Å; C26-I442 HydrophobicContact CB-CD1 3.92Å; C26-I442 HydrophobicContact CB-CG1 3.92Å; L396-I442 HydrophobicContact CB-CG2 3.95Å; L396-I442 HydrophobicContact CD2-CG2 4.2Å; I397-I442 WeakPolarHBondContact O-CG2 3.31Å; R440-I442 PolarHBondContact O-N 3.21Å; I442-I507 HydrophobicContact CD1-CB 3.97Å; I442-I507 HydrophobicContact CD1-CG2 3.48Å; I442-I507 VanDerWaalsContact CD1-CG2 3.48Å
443	H	87.6	Confident	68.4	Low	113 Å²	113	74.4 Å²	74.4	52%	0.523	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134	173.7	-173.3	80.8	0	0	0	109.9	I397 D445	I397-H443 HydrophobicContact CB-CB 4.4Å; I397-H443 PolarHBondContact N-O 3.12Å; H443-D445 IonicContact NE2-OD1 2.72Å; H443-D445 PolarHBondContact NE2-OD1 3.11Å
444	D	87.4	Confident	68.1	Low	15 Å²	15	77.1 Å²	77.1	8%	0.08	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	131.3	-176.1	63.1	-61	0	0	0	112.3	R21 K395 L396 R441	R21-D444 IonicContact CZ-OD2 3.99Å; R21-D444 IonicContact NE-OD2 3.33Å; R21-D444 PolarHBondContact NE-OD2 2.97Å; R21-D444 PolarHBondContact NH2-O 3.21Å; R21-D444 IonicContact NH2-OD1 3.04Å; R21-D444 IonicContact NH2-OD2 3.63Å; R21-D444 PolarHBondContact NH2-OD2 2.85Å; K395-D444 WeakPolarHBondContact O-CA 3.45Å; L396-D444 HydrophobicContact CD2-CB 3.8Å; R441-D444 IonicContact CZ-OD1 3.94Å; R441-D444 IonicContact NH1-OD1 3.96Å; R441-D444 PolarHBondContact NH1-OD1 2.83Å; R441-D444 IonicContact NH2-OD1 2.87Å; R441-D444 PolarHBondContact NH2-OD1 2.7Å; R441-D444 IonicContact NH2-OD2 2.75Å
445	D	85.7	Confident	67.5	Low	70 Å²	70	75.2 Å²	75.2	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.4	176.8	-72.4	-37	0	0	0	110.2	Y394 K395 H443	Y394-D445 CarbonylContact C-O 3.59Å; Y394-D445 WeakPolarHBondContact CA-O 3.45Å; Y394-D445 WeakPolarHBondContact CB-O 3.49Å; K395-D445 PolarHBondContact N-O 2.98Å; K395-D445 PolarHBondContact O-N 3.04Å; H443-D445 IonicContact NE2-OD1 2.72Å; H443-D445 PolarHBondContact NE2-OD1 3.11Å
446	L	81.9	Confident	66.2	Low	98 Å²	98	73.7 Å²	73.7	51%	0.513	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	144.1	174.5	-72.2	170.9	0	0	0	110.9	E391	E391-L446 WeakPolarHBondContact O-CD2 3.5Å
447	I	78.5	Confident	64.8	Low	16 Å²	16	73.7 Å²	73.7	8%	0.082	40%	0.403	C	S	.	.			trans	-94	122.3	173.2	-59.9	165.6	0	0	0	107.7	K382 F384 S393 Y394 K395 I449	K382-I447 HydrophobicContact CB-CD1 4.22Å; K382-I447 HydrophobicContact CD-CD1 3.71Å; K382-I447 HydrophobicContact CG-CD1 4.08Å; F384-I447 HydrophobicContact CD1-CD1 4.21Å; F384-I447 HydrophobicContact CE1-CD1 3.56Å; F384-I447 HydrophobicContact CZ-CD1 4.16Å; S393-I447 PolarHBondContact O-N 3.11Å; Y394-I447 VanDerWaalsContact C-CD1 3.45Å; Y394-I447 WeakPolarHBondContact O-CD1 3.48Å; K395-I447 HydrophobicContact CB-CG1 4.22Å; I447-I449 HydrophobicContact CB-CG1 4.48Å; I447-I449 HydrophobicContact CG2-CD1 4.43Å; I447-I449 HydrophobicContact CG2-CG1 4Å; I447-I449 PolarHBondContact O-N 2.91Å
448	D	72	Confident	62.8	Low	117 Å²	117	77.7 Å²	77.7	63%	0.626	41%	0.413	S	S	*	.			trans	-69.2	113.1	172.6	-166.3	-4.8	0	0	0	110.2	T450	D448-T450 WeakPolarHBondContact OD1-CB 2.94Å; D448-T450 PolarHBondContact OD1-N 3.33Å; D448-T450 VanDerWaalsContact OD1-N 3.08Å; D448-T450 PolarHBondContact OD1-OG1 2.77Å
449	I	70.9	Confident	60.5	Low	10 Å²	10	79.6 Å²	79.6	5%	0.051	43%	0.434	C	S	.	.			trans	-113.3	-0.9	179.4	-62.4	164.1	0	0	0	110.7	Y338 P389 S393 I447 E451 N452 F453	Y338-I449 HydrophobicContact CD1-CD1 4.22Å; P389-I449 VanDerWaalsContact O-CD1 3.32Å; P389-I449 WeakPolarHBondContact O-CD1 3.38Å; S393-I449 WeakPolarHBondContact OG-CD1 3.37Å; I447-I449 HydrophobicContact CB-CG1 4.48Å; I447-I449 HydrophobicContact CG2-CD1 4.43Å; I447-I449 HydrophobicContact CG2-CG1 4Å; I447-I449 PolarHBondContact O-N 2.91Å; I449-E451 PolarHBondContact O-N 3.2Å; I449-E451 VanDerWaalsContact O-N 3.1Å; I449-N452 HydrophobicContact CG2-CB 4.38Å; I449-N452 PolarHBondContact O-N 3.47Å; I449-F453 HydrophobicContact CG2-CD2 4.36Å; I449-F453 HydrophobicContact CG2-CE2 3.88Å
450	T	58	Low	58.1	Low	91 Å²	91	86.1 Å²	86.1	56%	0.558	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-64.2	-24.4	-167.5	58.3	0	0	0	0	114.1	D448 N452	D448-T450 WeakPolarHBondContact OD1-CB 2.94Å; D448-T450 PolarHBondContact OD1-N 3.33Å; D448-T450 VanDerWaalsContact OD1-N 3.08Å; D448-T450 PolarHBondContact OD1-OG1 2.77Å; T450-N452 VanDerWaalsContact C-N 3.31Å; T450-N452 PolarHBondContact O-N 2.94Å
451	E	44.5	Very low	55.4	Low	138 Å²	138	92.4 Å²	92.4	65%	0.645	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-74.2	-12.9	175.8	-66.4	-169.8	164.1	0	0	114.7	I449	I449-E451 PolarHBondContact O-N 3.2Å; I449-E451 VanDerWaalsContact O-N 3.1Å
452	N	46.6	Very low	52.6	Low	59 Å²	59	96 Å²	96	32%	0.316	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-93.5	-11.8	-171.6	-77.8	0.6	0	0	0	115	V337 I449 T450	V337-N452 PolarHBondContact O-ND2 2.96Å; I449-N452 HydrophobicContact CG2-CB 4.38Å; I449-N452 PolarHBondContact O-N 3.47Å; T450-N452 VanDerWaalsContact C-N 3.31Å; T450-N452 PolarHBondContact O-N 2.94Å
453	F	39.5	Very low	49.9	Very low	143 Å²	143	101.7 Å²	101.7	63%	0.627	56%	0.564	S	S	*	*	S	Bend	trans	-91.4	-2.1	-178	-77.3	-76.5	0	0	0	114.3	P389 I449	P389-F453 HydrophobicContact CB-CE2 4.4Å; P389-F453 HydrophobicContact CB-CZ 4.25Å; P389-F453 HydrophobicContact CG-CE2 4.35Å; P389-F453 HydrophobicContact CG-CZ 4Å; I449-F453 HydrophobicContact CG2-CD2 4.36Å; I449-F453 HydrophobicContact CG2-CE2 3.88Å
454	T	28.6	Very low	47.1	Very low	108 Å²	108	101.7 Å²	101.7	66%	0.663	58%	0.576	S	S	*	*	S	Bend	trans	-94.1	106.3	172.7	49.9	0	0	0	0	110.8
455	S	29	Very low	44.5	Very low	98 Å²	98	107.5 Å²	107.5	69%	0.685	61%	0.613	S	S	*	*			trans	-6.5	119	160.4	56.3	0	0	0	0	117.9
456	S	26.9	Very low	41.9	Very low	117 Å²	117	111.1 Å²	111.1	82%	0.818	63%	0.632	S	S	*	*			trans	31.1	91.3	132.4	62.7	0	0	0	0	117.7
457	S	26.8	Very low	39.6	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	65%	0.645	S	S	*	*			trans	-172.3	91.1	141.9	42	0	0	0	0	110.2	S459	S457-S459 PolarHBondContact O-N 3.03Å
458	F	30.6	Very low	37.5	Very low	179 Å²	179	119.8 Å²	119.8	79%	0.785	68%	0.679	S	S	*	*			trans	-81.1	93.5	160.6	-88.6	-79.7	0	0	0	108
459	S	27.8	Very low	35.6	Very low	87 Å²	87	119.9 Å²	119.9	61%	0.608	69%	0.686	S	S	*	*			trans	-130.5	79.1	157.6	59.2	0	0	0	0	107.1	S457 N461	S457-S459 PolarHBondContact O-N 3.03Å; S459-N461 PolarHBondContact O-N 3.19Å; S459-N461 VanDerWaalsContact O-N 3.14Å
460	D	33.3	Very low	33.6	Very low	141 Å²	141	126.8 Å²	126.8	75%	0.754	72%	0.723	S	S	*	*			trans	-76.8	97.4	168.2	-81.2	-25.8	0	0	0	107.7	N462	D460-N462 PolarHBondContact O-N 3.33Å
461	N	30.7	Very low	32.4	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	74%	0.74	S	S	*	*			trans	-61.1	112.3	168.5	-82.6	-36	0	0	0	109.1	S459 T463	S459-N461 PolarHBondContact O-N 3.19Å; S459-N461 VanDerWaalsContact O-N 3.14Å; N461-T463 PolarHBondContact O-N 2.88Å
462	N	29.2	Very low	31.7	Very low	167 Å²	167	133.3 Å²	133.3	89%	0.893	75%	0.749	S	S	*	*			trans	-58.9	100.5	161.5	-84.5	-31	0	0	0	109.6	D460	D460-N462 PolarHBondContact O-N 3.33Å
463	T	32.4	Very low	30.8	Very low	122 Å²	122	140.1 Å²	140.1	75%	0.748	78%	0.779	S	S	*	*			trans	-104.3	104	159.2	42.9	0	0	0	0	109.3	N461 T465	N461-T463 PolarHBondContact O-N 2.88Å; T463-T465 PolarHBondContact O-N 3.49Å
464	S	28.5	Very low	30.7	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	77%	0.774	S	S	*	*			trans	-54.1	121.5	166.2	53.3	0	0	0	0	111.5
465	T	34.2	Very low	31.3	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	78%	0.782	S	S	*	*			trans	-134.5	114.2	153.7	47.7	0	0	0	0	110	T463	T463-T465 PolarHBondContact O-N 3.49Å
466	N	31	Very low	32	Very low	146 Å²	146	142.5 Å²	142.5	78%	0.781	78%	0.784	S	S	*	*			trans	-52.3	138.7	167.8	-66.3	-38.8	0	0	0	110.8
467	N	33	Very low	33.4	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	78%	0.779	S	S	*	*				170.9	138.1	114.4	-83.1	-27.4	0	0	0	113.4
468	N	33.5	Very low	35	Very low	148 Å²	148	139.8 Å²	139.8	79%	0.791	76%	0.757	S	S	*	*			trans	84.4	100.8	162.4	-68.8	-12.1	0	0	0	119.5
469	P	32.6	Very low	36.8	Very low	118 Å²	118	137.5 Å²	137.5	77%	0.766	75%	0.754	S	S	*	*			trans	-84.8	107.5	155.9	33.1	-22.1	0	0	0	107.5
470	N	29.3	Very low	39	Very low	156 Å²	156	133.9 Å²	133.9	83%	0.834	73%	0.728	S	S	*	*			trans	-174.9	73.4	160.6	-91	-21.1	0	0	0	108.2
471	F	32.5	Very low	41.3	Very low	209 Å²	209	129 Å²	129	92%	0.917	71%	0.711	S	S	*	*			trans	-132.1	119.6	159.2	-96.8	-85.1	0	0	0	107.4	E473	F471-E473 PolarHBondContact O-N 2.64Å
472	N	29.1	Very low	44	Very low	157 Å²	157	125.7 Å²	125.7	84%	0.84	69%	0.688	S	S	*	*			trans	-46.9	122.7	-180	-71.2	-29.7	0	0	0	111.1	S474	N472-S474 PolarHBondContact O-N 3.25Å
473	E	29.4	Very low	47	Very low	202 Å²	202	120.9 Å²	120.9	94%	0.944	66%	0.659	S	S	*	*			trans	-64.5	78.9	163.3	-71.4	178.4	161.7	0	0	109.2	F471	F471-E473 PolarHBondContact O-N 2.64Å
474	S	36.6	Very low	49.9	Very low	74 Å²	74	115 Å²	115	52%	0.517	62%	0.623	S	S	.	*			trans	-84.4	118.4	152.3	55.3	0	0	0	0	106.9	N472 F476	N472-S474 PolarHBondContact O-N 3.25Å; S474-F476 VanDerWaalsContact O-CD2 3.29Å; S474-F476 WeakPolarHBondContact O-CD2 3.44Å; S474-F476 PolarHBondContact O-N 2.86Å
475	I	41.9	Very low	53.1	Low	161 Å²	161	111.7 Å²	111.7	83%	0.826	60%	0.596	S	S	*	*			trans	-44.5	100.2	173.7	-65	165.6	0	0	0	108.8	T477	I475-T477 HydrophobicContact CG2-CG2 4.27Å; I475-T477 PolarHBondContact O-N 3.12Å; I475-T477 VanDerWaalsContact O-N 3.14Å
476	F	43.7	Very low	56.1	Low	164 Å²	164	106.4 Å²	106.4	72%	0.719	56%	0.562	S	S	*	*			trans	-78.8	94.4	172.7	-90.8	-85.8	0	0	0	106.9	S474 V478	S474-F476 VanDerWaalsContact O-CD2 3.29Å; S474-F476 WeakPolarHBondContact O-CD2 3.44Å; S474-F476 PolarHBondContact O-N 2.86Å; F476-V478 PolarHBondContact O-N 3.28Å
477	T	55	Low	59.2	Low	117 Å²	117	99.6 Å²	99.6	72%	0.718	53%	0.525	S	S	*	.			trans	-67.2	111.9	159.3	51.6	0	0	0	0	106.8	I475 D479	I475-T477 HydrophobicContact CG2-CG2 4.27Å; I475-T477 PolarHBondContact O-N 3.12Å; I475-T477 VanDerWaalsContact O-N 3.14Å; T477-D479 PolarHBondContact O-N 3.34Å
478	V	60.8	Low	62.3	Low	46 Å²	46	92.7 Å²	92.7	28%	0.279	49%	0.489	S	S	.	.			trans	-65.4	107.8	168.6	-172.5	0	0	0	0	105.6	H347 V350 F476 V480	H347-V478 HydrophobicContact CB-CG2 4.48Å; V350-V478 HydrophobicContact CB-CG2 4.27Å; V350-V478 HydrophobicContact CG1-CG2 3.79Å; F476-V478 PolarHBondContact O-N 3.28Å; V478-V480 HydrophobicContact CB-CG2 4.04Å; V478-V480 HydrophobicContact CG1-CG2 3.75Å; V478-V480 WeakPolarHBondContact O-CG2 3.36Å; V478-V480 PolarHBondContact O-N 3.35Å; V478-V480 VanDerWaalsContact O-N 3.16Å
479	D	68.9	Low	65.3	Low	132 Å²	132	86.5 Å²	86.5	71%	0.706	46%	0.455	S	S	*	.			trans	-74.1	107.3	171.9	-173.4	3.8	0	0	0	107.9	T477 G481	T477-D479 PolarHBondContact O-N 3.34Å; D479-G481 PolarHBondContact OD1-N 3.19Å; D479-G481 VanDerWaalsContact OD1-N 3.08Å
480	V	72.5	Confident	68.3	Low	11 Å²	11	82.5 Å²	82.5	7%	0.067	43%	0.425	C	S	.	.			trans	-96.3	-4.2	-173.4	-170	0	0	0	0	110.7	L351 L356 Y377 N378 V478	L351-V480 HydrophobicContact CD2-CG2 4.4Å; L356-V480 HydrophobicContact CD1-CB 4.12Å; L356-V480 HydrophobicContact CD1-CG1 4.44Å; L356-V480 HydrophobicContact CD1-CG2 3.37Å; Y377-V480 WeakPolarHBondContact CB-O 3.49Å; Y377-V480 HydrophobicContact CD1-CB 4.32Å; Y377-V480 HydrophobicContact CD1-CG1 2.98Å; Y377-V480 HydrophobicContact CD2-CG1 3.59Å; Y377-V480 HydrophobicContact CE1-CG1 3.4Å; Y377-V480 VanDerWaalsContact CE1-CG1 3.4Å; Y377-V480 HydrophobicContact CE2-CG1 3.99Å; Y377-V480 HydrophobicContact CG-CB 4.47Å; Y377-V480 HydrophobicContact CG-CG1 3Å; N378-V480 PolarHBondContact N-O 3.41Å; N378-V480 PolarHBondContact OD1-O 3.37Å; V478-V480 HydrophobicContact CB-CG2 4.04Å; V478-V480 HydrophobicContact CG1-CG2 3.75Å; V478-V480 WeakPolarHBondContact O-CG2 3.36Å; V478-V480 PolarHBondContact O-N 3.35Å; V478-V480 VanDerWaalsContact O-N 3.16Å
481	G	82.9	Confident	71.4	Confident	39 Å²	39	76.4 Å²	76.4	40%	0.402	39%	0.394	S	S	.	.			trans	57.7	-151.6	177.8	0	0	0	0	0	112.8	N378 D479	N378-G481 WeakPolarHBondContact OD1-CA 3.11Å; N378-G481 PolarHBondContact OD1-N 3.28Å; D479-G481 PolarHBondContact OD1-N 3.19Å; D479-G481 VanDerWaalsContact OD1-N 3.08Å
482	R	87.1	Confident	74.2	Confident	73 Å²	73	73.4 Å²	73.4	28%	0.275	38%	0.377	S	S	.	.	S	Bend	trans	-70.7	138.5	178.8	-57.1	-173.4	-164.2	-155	-1.8	111.5	Y377 N378 N379 D400 H500	Y377-R482 CarbonylContact C-O 3.56Å; N378-R482 PolarHBondContact N-O 3.11Å; N379-R482 WeakPolarHBondContact OD1-CB 3.46Å; N379-R482 WeakPolarHBondContact OD1-CD 3.3Å; N379-R482 WeakPolarHBondContact OD1-CG 3.15Å; D400-R482 IonicContact OD1-CZ 3.23Å; D400-R482 IonicContact OD1-NE 2.73Å; D400-R482 PolarHBondContact OD1-NE 3.36Å; D400-R482 VanDerWaalsContact OD1-NE 3.16Å; D400-R482 IonicContact OD1-NH2 3.57Å; D400-R482 PolarHBondContact OD1-NH2 3.17Å; R482-H500 PolarHBondContact NH1-CE1 3.38Å; R482-H500 VanDerWaalsContact NH1-CE1 3.33Å; R482-H500 PolarHBondContact NH1-NE2 2.86Å
483	K	92.1	Very high	77.2	Confident	65 Å²	65	67.4 Å²	67.4	28%	0.283	35%	0.347	S	S	.	.			trans	-94.5	115.9	176.9	-52.8	-178.9	175.6	-163.8	0	110.4	D359 Y377 L485 H500	D359-K483 IonicContact OD1-NZ 2.75Å; D359-K483 PolarHBondContact OD1-NZ 2.93Å; D359-K483 VanDerWaalsContact OD2-CD 3.29Å; D359-K483 WeakPolarHBondContact OD2-CD 3.33Å; D359-K483 WeakPolarHBondContact OD2-CE 3.38Å; D359-K483 IonicContact OD2-NZ 3.16Å; D359-K483 PolarHBondContact OD2-NZ 3.33Å; Y377-K483 HydrophobicContact CD1-CB 4.48Å; Y377-K483 HydrophobicContact CD1-CG 4.03Å; Y377-K483 HydrophobicContact CE1-CD 4.37Å; Y377-K483 HydrophobicContact CE1-CG 4.01Å; K483-L485 HydrophobicContact CB-CD1 4.41Å; K483-L485 HydrophobicContact CB-CD2 4.05Å; K483-L485 HydrophobicContact CB-CG 3.99Å; K483-L485 PolarHBondContact O-N 2.86Å; K483-H500 WeakPolarHBondContact O-CA 3.17Å; K483-H500 WeakPolarHBondContact O-CB 3.45Å
484	W	94.4	Very high	80.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.312	C	S	.	.			trans	-96.5	92.3	174.3	-66.3	80.4	0	0	0	108.7	F361 G375 S376 V381 M398 V498 H500 H505	F361-W484 WeakPolarHBondContact CD1-O 3.41Å; F361-W484 WeakPolarHBondContact CE1-O 3.37Å; G375-W484 CarbonylContact C-O 3.51Å; G375-W484 VanDerWaalsContact CA-O 3.23Å; G375-W484 WeakPolarHBondContact CA-O 3.48Å; S376-W484 WeakPolarHBondContact O-CB 3.46Å; S376-W484 PolarHBondContact O-N 3.15Å; S376-W484 VanDerWaalsContact O-N 3.1Å; V381-W484 HydrophobicContact CG2-CB 4.3Å; V381-W484 HydrophobicContact CG2-CD2 4.26Å; V381-W484 HydrophobicContact CG2-CE3 4.37Å; V381-W484 HydrophobicContact CG2-CG 4.27Å; M398-W484 HydrophobicContact CB-CH2 3.73Å; M398-W484 HydrophobicContact CB-CZ2 3.25Å; M398-W484 HydrophobicContact CE-CH2 3.66Å; M398-W484 HydrophobicContact CE-CZ2 4.37Å; M398-W484 HydrophobicContact CE-CZ3 3.8Å; M398-W484 HydrophobicContact CG-CD2 4.25Å; M398-W484 HydrophobicContact CG-CH2 3.88Å; M398-W484 HydrophobicContact CG-CZ2 3.62Å; M398-W484 HydrophobicContact CG-CZ3 4.38Å; W484-V498 HydrophobicContact CB-CG1 4.46Å; W484-V498 HydrophobicContact CD2-CG1 4.21Å; W484-V498 HydrophobicContact CE3-CB 4.01Å; W484-V498 HydrophobicContact CE3-CG1 3.3Å; W484-V498 HydrophobicContact CZ3-CB 4.01Å; W484-V498 HydrophobicContact CZ3-CG1 3.82Å; W484-H500 HydrophobicContact CD2-CB 4.34Å; W484-H500 HydrophobicContact CE3-CB 4.45Å; W484-H500 AromaticContact CH2-CD2 3.6Å; W484-H500 AromaticContact CZ2-CD2 3.68Å; W484-H500 AromaticContact CZ3-CD2 3.89Å; W484-H505 HydrophobicContact CH2-CB 4.29Å; W484-H505 AromaticContact CH2-CD2 3.5Å; W484-H505 VanDerWaalsContact CH2-CD2 3.5Å; W484-H505 WeakPolarHBondContact CH2-CD2 3.47Å; W484-H505 AromaticContact CH2-CE1 3.74Å; W484-H505 AromaticContact CH2-CG 3.6Å; W484-H505 AromaticContact CH2-ND1 3.74Å; W484-H505 AromaticContact CH2-NE2 3.6Å; W484-H505 HydrophobicContact CZ3-CB 4.23Å; W484-H505 AromaticContact CZ3-CD2 3.95Å; W484-H505 AromaticContact CZ3-CG 3.99Å
485	L	94.1	Very high	82.9	Confident	42 Å²	42	56 Å²	56	22%	0.22	29%	0.288	C	S	.	.			trans	-94	-32.8	-168.7	-61.2	178.1	0	0	0	112.5	D359 F361 K362 K483 S499	D359-L485 HydrophobicContact CB-CD2 3.99Å; F361-L485 HydrophobicContact CD1-CD2 4Å; F361-L485 HydrophobicContact CE1-CD2 3.75Å; F361-L485 HydrophobicContact CE2-CD2 4.5Å; F361-L485 HydrophobicContact CG-CD2 4.48Å; F361-L485 HydrophobicContact CZ-CD2 4.02Å; K362-L485 WeakPolarHBondContact CB-O 3.31Å; K362-L485 PolarHBondContact N-O 2.85Å; K483-L485 HydrophobicContact CB-CD1 4.41Å; K483-L485 HydrophobicContact CB-CD2 4.05Å; K483-L485 HydrophobicContact CB-CG 3.99Å; K483-L485 PolarHBondContact O-N 2.86Å; L485-S499 PolarHBondContact N-O 2.68Å
486	Q	97	Very high	85.5	Confident	26 Å²	26	48.3 Å²	48.3	12%	0.121	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.2	-172.1	-57.9	-74.1	-27.6	0	0	111.7	S40 I42 V498 S499	S40-Q486 WeakPolarHBondContact O-CG 3.46Å; S40-Q486 PolarHBondContact O-NE2 3.04Å; I42-Q486 HydrophobicContact CD1-CB 4.15Å; I42-Q486 HydrophobicContact CG1-CB 3.9Å; Q486-V498 WeakPolarHBondContact O-CA 3.29Å; Q486-S499 WeakPolarHBondContact CB-OG 3.5Å; Q486-S499 PolarHBondContact O-N 3.12Å
487	V	97.3	Very high	88.1	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139.8	177.5	-68.7	0	0	0	0	109.2	K362 T364 M373 A497 V498	K362-V487 WeakPolarHBondContact O-CG2 3.21Å; T364-V487 HydrophobicContact CG2-CB 3.83Å; T364-V487 HydrophobicContact CG2-CG2 3.76Å; M373-V487 HydrophobicContact CG-CG1 4.29Å; V487-A497 CarbonylContact C-O 3.53Å; V487-A497 WeakPolarHBondContact CA-O 3.33Å; V487-V498 HydrophobicContact CG1-CB 4.35Å; V487-V498 HydrophobicContact CG1-CG1 3.7Å; V487-V498 HydrophobicContact CG1-CG2 4.21Å
488	S	97.4	Very high	90	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.028	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	129.2	173.8	-163	0	0	0	0	109.5	E43 F44 A496 A497	E43-S488 PolarHBondContact OE2-OG 3.13Å; F44-S488 WeakPolarHBondContact CD2-O 3.25Å; F44-S488 VanDerWaalsContact CE2-O 3.26Å; F44-S488 WeakPolarHBondContact CE2-O 3.46Å; F44-S488 PolarHBondContact N-OG 3.3Å; S488-A496 CarbonylContact O-C 3.49Å; S488-A496 WeakPolarHBondContact O-CA 3.5Å; S488-A497 PolarHBondContact N-O 3.11Å; S488-A497 PolarHBondContact O-N 3.25Å
489	W	96.8	Very high	91.7	Very high	19 Å²	19	32.8 Å²	32.8	7%	0.072	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130	179.8	-160.6	-64.8	0	0	0	109.3	W24 T364 C371 M373 P491 S493	W24-W489 AromaticContact CH2-CH2 3.87Å; W24-W489 HydrophobicContact CH2-CH2 3.87Å; W24-W489 HydrophobicContact CH2-CZ2 4.39Å; W24-W489 HydrophobicContact CH2-CZ3 4.34Å; W24-W489 HydrophobicContact CZ2-CH2 4.23Å; T364-W489 HydrophobicContact CG2-CB 3.87Å; T364-W489 HydrophobicContact CG2-CE3 4.29Å; T364-W489 VanDerWaalsContact OG1-CB 3.31Å; T364-W489 WeakPolarHBondContact OG1-CB 3.36Å; T364-W489 PolarHBondContact OG1-N 3.38Å; C371-W489 HydrophobicContact CB-CH2 3.51Å; C371-W489 HydrophobicContact CB-CZ2 4.38Å; C371-W489 HydrophobicContact CB-CZ3 3.78Å; M373-W489 HydrophobicContact CB-CE3 4.13Å; M373-W489 HydrophobicContact CB-CZ3 4.06Å; M373-W489 HydrophobicContact CE-CE3 4.49Å; M373-W489 HydrophobicContact CE-CZ3 4.1Å; W489-P491 WeakPolarHBondContact O-CD 3.21Å; W489-S493 PolarHBondContact NE1-O 3.26Å
490	K	96.1	Very high	92.8	Very high	34 Å²	34	26.7 Å²	26.7	15%	0.148	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-70.8	122.5	178.9	-177.1	-172.5	170.5	-153	0	109.9	F44 G48 I65 S79 W492 S493 V495	F44-K490 HydrophobicContact CD1-CB 4.28Å; F44-K490 HydrophobicContact CD1-CG 4.28Å; F44-K490 HydrophobicContact CD2-CB 4.07Å; F44-K490 HydrophobicContact CE1-CB 4.17Å; F44-K490 HydrophobicContact CE1-CG 4.28Å; F44-K490 HydrophobicContact CE2-CB 3.93Å; F44-K490 HydrophobicContact CG-CB 4.24Å; F44-K490 HydrophobicContact CZ-CB 3.99Å; G48-K490 WeakPolarHBondContact O-CE 3.34Å; I65-K490 HydrophobicContact CG2-CD 4.41Å; S79-K490 PolarHBondContact OG-NZ 2.68Å; K490-W492 PolarHBondContact O-N 3.41Å; K490-S493 PolarHBondContact O-N 3.41Å; K490-V495 HydrophobicContact CB-CB 4.09Å; K490-V495 HydrophobicContact CB-CG1 4.42Å; K490-V495 VanDerWaalsContact CB-O 3.26Å; K490-V495 WeakPolarHBondContact CB-O 3.44Å; K490-V495 HydrophobicContact CD-CB 3.97Å; K490-V495 HydrophobicContact CD-CG1 4.29Å; K490-V495 PolarHBondContact N-O 2.58Å
491	P	93.8	Very high	93.7	Very high	28 Å²	28	29 Å²	29	18%	0.182	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	137.2	179.6	-30.4	38	0	0	0	113.7	N45 K46 S367 W489 S493	N45-P491 WeakPolarHBondContact O-CG 3.36Å; K46-P491 WeakPolarHBondContact O-CB 3.23Å; K46-P491 WeakPolarHBondContact O-CG 3.44Å; S367-P491 WeakPolarHBondContact OG-CA 3.27Å; W489-P491 WeakPolarHBondContact O-CD 3.21Å; P491-S493 PolarHBondContact O-N 3.38Å
492	W	91.6	Very high	94.1	Very high	145 Å²	145	30.1 Å²	30.1	55%	0.549	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	31.9	178.8	-41.2	-69.9	0	0	0	114.7	K46 S367 K490	K46-W492 WeakPolarHBondContact O-CH2 3.29Å; K46-W492 WeakPolarHBondContact O-CZ3 3.42Å; S367-W492 PolarHBondContact OG-N 2.61Å; K490-W492 PolarHBondContact O-N 3.41Å
493	S	91.8	Very high	94.3	Very high	31 Å²	31	26.6 Å²	26.6	22%	0.217	13%	0.132	C	C	.	.	S	Bend	trans	-141.2	166.1	-178.8	-172.7	0	0	0	0	110.9	W489 K490 P491 V495	W489-S493 PolarHBondContact NE1-O 3.26Å; K490-S493 PolarHBondContact O-N 3.41Å; P491-S493 PolarHBondContact O-N 3.38Å; S493-V495 VanDerWaalsContact C-N 3.29Å; S493-V495 WeakPolarHBondContact OG-CG2 3.27Å; S493-V495 PolarHBondContact OG-N 3.2Å
494	T	91.6	Very high	94.4	Very high	35 Å²	35	23.6 Å²	23.6	22%	0.215	12%	0.119	C	C	.	.	S	Bend	trans	-92.6	10.3	171.5	54.9	0	0	0	0	112.6	V16 A509	V16-T494 HydrophobicContact CG2-CG2 4.19Å; T494-A509 WeakPolarHBondContact CB-O 3.31Å; T494-A509 PolarHBondContact O-N 3.25Å; T494-A509 PolarHBondContact OG1-O 3.14Å
495	V	94.3	Very high	94.4	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	139.3	-179.3	177.9	0	0	0	0	110.6	S79 K490 S493 I507 E508	S79-V495 WeakPolarHBondContact OG-CG2 3.46Å; K490-V495 HydrophobicContact CB-CB 4.09Å; K490-V495 HydrophobicContact CB-CG1 4.42Å; K490-V495 VanDerWaalsContact CB-O 3.26Å; K490-V495 WeakPolarHBondContact CB-O 3.44Å; K490-V495 HydrophobicContact CD-CB 3.97Å; K490-V495 HydrophobicContact CD-CG1 4.29Å; K490-V495 PolarHBondContact N-O 2.58Å; S493-V495 VanDerWaalsContact C-N 3.29Å; S493-V495 WeakPolarHBondContact OG-CG2 3.27Å; S493-V495 PolarHBondContact OG-N 3.2Å; V495-I507 CarbonylContact C-O 3.58Å; V495-I507 VanDerWaalsContact CA-O 3.24Å; V495-I507 WeakPolarHBondContact CA-O 3.31Å; V495-E508 HydrophobicContact CG2-CB 3.97Å; V495-E508 HydrophobicContact CG2-CG 3.69Å
496	A	96.6	Very high	94.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152	170.4	0	0	0	0	0	110.5	M373 S488 I507	M373-A496 HydrophobicContact CE-CB 3.76Å; M373-A496 HydrophobicContact SD-CB 3.59Å; M373-A496 VanDerWaalsContact SD-CB 3.59Å; S488-A496 CarbonylContact O-C 3.49Å; S488-A496 WeakPolarHBondContact O-CA 3.5Å; A496-I507 HydrophobicContact CB-CD1 4.44Å; A496-I507 HydrophobicContact CB-CG1 4.04Å; A496-I507 PolarHBondContact N-O 3.43Å; A496-I507 WeakPolarHBondContact O-CG1 3.42Å; A496-I507 PolarHBondContact O-N 3.22Å
497	A	97	Very high	94.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.2	169.5	0	0	0	0	0	107.8	I42 F44 L51 V487 S488 I504 H505 L506	I42-A497 HydrophobicContact CD1-CB 3.96Å; I42-A497 WeakPolarHBondContact CD1-O 3.44Å; F44-A497 HydrophobicContact CD2-CB 4.47Å; F44-A497 HydrophobicContact CE2-CB 3.51Å; F44-A497 HydrophobicContact CZ-CB 3.76Å; L51-A497 HydrophobicContact CD1-CB 4.09Å; L51-A497 HydrophobicContact CD2-CB 3.81Å; V487-A497 CarbonylContact C-O 3.53Å; V487-A497 WeakPolarHBondContact CA-O 3.33Å; S488-A497 PolarHBondContact N-O 3.11Å; S488-A497 PolarHBondContact O-N 3.25Å; A497-I504 HydrophobicContact CB-CG2 4.06Å; A497-H505 WeakPolarHBondContact CA-O 3.41Å; A497-L506 HydrophobicContact CB-CD2 3.88Å
498	V	96.4	Very high	94.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.1	177.8	-167.4	0	0	0	0	107.1	M373 V381 M398 W484 Q486 V487 I504 H505 I507	M373-V498 HydrophobicContact SD-CG2 3.88Å; V381-V498 HydrophobicContact CG1-CG1 4.3Å; V381-V498 HydrophobicContact CG1-CG2 4.32Å; V381-V498 HydrophobicContact CG2-CB 4.42Å; V381-V498 HydrophobicContact CG2-CG1 3.43Å; V381-V498 VanDerWaalsContact CG2-CG1 3.43Å; V381-V498 HydrophobicContact CG2-CG2 4.5Å; M398-V498 HydrophobicContact CE-CB 4.44Å; W484-V498 HydrophobicContact CB-CG1 4.46Å; W484-V498 HydrophobicContact CD2-CG1 4.21Å; W484-V498 HydrophobicContact CE3-CB 4.01Å; W484-V498 HydrophobicContact CE3-CG1 3.3Å; W484-V498 HydrophobicContact CZ3-CB 4.01Å; W484-V498 HydrophobicContact CZ3-CG1 3.82Å; Q486-V498 WeakPolarHBondContact O-CA 3.29Å; V487-V498 HydrophobicContact CG1-CB 4.35Å; V487-V498 HydrophobicContact CG1-CG1 3.7Å; V487-V498 HydrophobicContact CG1-CG2 4.21Å; V498-I504 WeakPolarHBondContact O-CA 3.44Å; V498-H505 PolarHBondContact N-O 3.17Å; V498-H505 PolarHBondContact O-N 3.23Å; V498-I507 HydrophobicContact CG2-CD1 3.65Å; V498-I507 HydrophobicContact CG2-CG1 4.16Å
499	S	95.1	Very high	93.7	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.7	-179	77.1	0	0	0	0	113.6	L485 Q486 G503	L485-S499 PolarHBondContact N-O 2.68Å; Q486-S499 WeakPolarHBondContact CB-OG 3.5Å; Q486-S499 PolarHBondContact O-N 3.12Å; S499-G503 VanDerWaalsContact CA-O 3.32Å; S499-G503 WeakPolarHBondContact CA-O 3.36Å; S499-G503 WeakPolarHBondContact CB-O 3.49Å
500	H	93.4	Very high	93.1	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.019	11%	0.108	C	C	.	.			trans	-109.8	-171.5	157.6	61.8	91.4	0	0	0	108.5	E401 R482 K483 W484 D502 G503 H505	E401-H500 IonicContact OE1-CE1 2.95Å; E401-H500 PolarHBondContact OE1-CE1 2.94Å; E401-H500 IonicContact OE1-NE2 2.9Å; E401-H500 PolarHBondContact OE1-NE2 3.37Å; R482-H500 PolarHBondContact NH1-CE1 3.38Å; R482-H500 VanDerWaalsContact NH1-CE1 3.33Å; R482-H500 PolarHBondContact NH1-NE2 2.86Å; K483-H500 WeakPolarHBondContact O-CA 3.17Å; K483-H500 WeakPolarHBondContact O-CB 3.45Å; W484-H500 HydrophobicContact CD2-CB 4.34Å; W484-H500 HydrophobicContact CE3-CB 4.45Å; W484-H500 AromaticContact CH2-CD2 3.6Å; W484-H500 AromaticContact CZ2-CD2 3.68Å; W484-H500 AromaticContact CZ3-CD2 3.89Å; H500-D502 PolarHBondContact ND1-N 2.83Å; H500-D502 IonicContact ND1-OD2 3.99Å; H500-D502 PolarHBondContact O-N 2.92Å; H500-G503 PolarHBondContact CE1-N 3.02Å; H500-G503 VanDerWaalsContact CE1-N 3.33Å; H500-G503 PolarHBondContact N-O 3.11Å; H500-G503 VanDerWaalsContact N-O 3.08Å; H500-H505 AromaticContact NE2-NE2 3.9Å
501	T	91.7	Very high	92	Very high	59 Å²	59	24.5 Å²	24.5	36%	0.362	13%	0.128	S	C	.	.	S	Bend	trans	-60.2	-28.3	-175.7	43.2	0	0	0	0	114.9	P38 I39	P38-T501 WeakPolarHBondContact CA-O 3.12Å; P38-T501 HydrophobicContact CB-CG2 4.09Å; I39-T501 PolarHBondContact N-O 2.91Å
502	D	90.1	Very high	91.9	Very high	62 Å²	62	24.4 Å²	24.4	33%	0.332	13%	0.125	S	C	.	.	S	Bend	trans	-116.1	-8.8	-167.7	-52.4	-71.6	0	0	0	113.4	R32 H500	R32-D502 WeakPolarHBondContact CB-O 3.45Å; R32-D502 IonicContact CZ-OD1 3.88Å; R32-D502 VanDerWaalsContact CZ-OD1 3.23Å; R32-D502 PolarHBondContact N-O 3.41Å; R32-D502 IonicContact NE-OD1 2.99Å; R32-D502 IonicContact NH1-OD1 2.94Å; R32-D502 IonicContact NH2-OD1 2.92Å; R32-D502 PolarHBondContact NH2-OD1 2.59Å; H500-D502 PolarHBondContact ND1-N 2.83Å; H500-D502 IonicContact ND1-OD2 3.99Å; H500-D502 PolarHBondContact O-N 2.92Å
503	G	91.2	Very high	91.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	161.2	-176.7	0	0	0	0	0	114.9	L30 E401 S499 H500	L30-G503 CarbonylContact O-C 3.58Å; L30-G503 WeakPolarHBondContact O-CA 3.39Å; E401-G503 WeakPolarHBondContact OE1-CA 3.41Å; S499-G503 VanDerWaalsContact CA-O 3.32Å; S499-G503 WeakPolarHBondContact CA-O 3.36Å; S499-G503 WeakPolarHBondContact CB-O 3.49Å; H500-G503 PolarHBondContact CE1-N 3.02Å; H500-G503 VanDerWaalsContact CE1-N 3.33Å; H500-G503 PolarHBondContact N-O 3.11Å; H500-G503 VanDerWaalsContact N-O 3.08Å
504	I	94.5	Very high	91.9	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.1	176.7	-50.3	174.9	0	0	0	108.1	L30 I39 I42 L51 Y53 A497 V498	L30-I504 HydrophobicContact CB-CB 4.26Å; L30-I504 PolarHBondContact N-O 2.89Å; L30-I504 PolarHBondContact O-N 3.37Å; I39-I504 HydrophobicContact CD1-CD1 4.08Å; I39-I504 HydrophobicContact CD1-CG1 3.63Å; I42-I504 HydrophobicContact CG2-CD1 3.83Å; I42-I504 HydrophobicContact CG2-CG1 4.21Å; L51-I504 HydrophobicContact CD2-CG2 4.17Å; Y53-I504 HydrophobicContact CD1-CD1 3.56Å; Y53-I504 HydrophobicContact CD2-CD1 4.15Å; Y53-I504 HydrophobicContact CE1-CD1 4.16Å; Y53-I504 HydrophobicContact CG-CD1 3.55Å; A497-I504 HydrophobicContact CB-CG2 4.06Å; V498-I504 WeakPolarHBondContact O-CA 3.44Å
505	H	94.1	Very high	91.9	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.6	175.5	-70.7	-138	0	0	0	108.8	I29 M398 Q399 W484 A497 V498 H500 I507	I29-H505 WeakPolarHBondContact CD1-CE1 3.47Å; M398-H505 HydrophobicContact CE-CB 3.78Å; Q399-H505 PolarHBondContact O-CE1 3Å; Q399-H505 VanDerWaalsContact O-CE1 3.29Å; W484-H505 HydrophobicContact CH2-CB 4.29Å; W484-H505 AromaticContact CH2-CD2 3.5Å; W484-H505 VanDerWaalsContact CH2-CD2 3.5Å; W484-H505 WeakPolarHBondContact CH2-CD2 3.47Å; W484-H505 AromaticContact CH2-CE1 3.74Å; W484-H505 AromaticContact CH2-CG 3.6Å; W484-H505 AromaticContact CH2-ND1 3.74Å; W484-H505 AromaticContact CH2-NE2 3.6Å; W484-H505 HydrophobicContact CZ3-CB 4.23Å; W484-H505 AromaticContact CZ3-CD2 3.95Å; W484-H505 AromaticContact CZ3-CG 3.99Å; A497-H505 WeakPolarHBondContact CA-O 3.41Å; V498-H505 PolarHBondContact N-O 3.17Å; V498-H505 PolarHBondContact O-N 3.23Å; H500-H505 AromaticContact NE2-NE2 3.9Å; H505-I507 HydrophobicContact CB-CG2 4.24Å
506	L	94.4	Very high	91.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	117.3	166.4	-65.4	-179.5	0	0	0	108.2	N27 E28 F44 L51 I65 A497	N27-L506 PolarHBondContact N-O 3.35Å; E28-L506 HydrophobicContact CB-CB 4.41Å; E28-L506 HydrophobicContact CB-CD1 4.36Å; E28-L506 PolarHBondContact O-N 3.42Å; F44-L506 HydrophobicContact CZ-CD2 4.15Å; L51-L506 HydrophobicContact CD2-CD2 4.36Å; I65-L506 HydrophobicContact CD1-CD1 4.24Å; A497-L506 HydrophobicContact CB-CD2 3.88Å
507	I	94.2	Very high	91.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.8	-178.1	63.4	171.4	0	0	0	110.5	W24 Y25 C26 M373 L396 M398 I442 V495 A496 V498 H505	W24-I507 HydrophobicContact CE3-CB 4.14Å; W24-I507 HydrophobicContact CE3-CD1 3.85Å; W24-I507 HydrophobicContact CE3-CG1 3.98Å; W24-I507 HydrophobicContact CZ3-CB 4.47Å; W24-I507 HydrophobicContact CZ3-CD1 3.86Å; W24-I507 HydrophobicContact CZ3-CG1 3.87Å; Y25-I507 CarbonylContact O-C 3.57Å; Y25-I507 VanDerWaalsContact O-CA 3.22Å; Y25-I507 WeakPolarHBondContact O-CA 3.35Å; C26-I507 HydrophobicContact CB-CG2 4.48Å; M373-I507 HydrophobicContact CE-CD1 3.66Å; M373-I507 HydrophobicContact SD-CD1 4.12Å; L396-I507 HydrophobicContact CD1-CD1 3.91Å; M398-I507 HydrophobicContact CE-CG2 3.98Å; I442-I507 HydrophobicContact CD1-CB 3.97Å; I442-I507 HydrophobicContact CD1-CG2 3.48Å; I442-I507 VanDerWaalsContact CD1-CG2 3.48Å; V495-I507 CarbonylContact C-O 3.58Å; V495-I507 VanDerWaalsContact CA-O 3.24Å; V495-I507 WeakPolarHBondContact CA-O 3.31Å; A496-I507 HydrophobicContact CB-CD1 4.44Å; A496-I507 HydrophobicContact CB-CG1 4.04Å; A496-I507 PolarHBondContact N-O 3.43Å; A496-I507 WeakPolarHBondContact O-CG1 3.42Å; A496-I507 PolarHBondContact O-N 3.22Å; V498-I507 HydrophobicContact CG2-CD1 3.65Å; V498-I507 HydrophobicContact CG2-CG1 4.16Å; H505-I507 HydrophobicContact CB-CG2 4.24Å
508	E	93.1	Very high	91.1	Very high	21 Å²	21	19.6 Å²	19.6	10%	0.098	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.7	-175.6	-174.3	167.3	-147.9	0	0	110.6	W24 Y25 N27 H78 V495 I510	W24-E508 WeakPolarHBondContact CA-O 3.33Å; Y25-E508 PolarHBondContact N-O 3.17Å; Y25-E508 PolarHBondContact O-N 3Å; N27-E508 WeakPolarHBondContact ND2-CB 3.23Å; N27-E508 PolarHBondContact ND2-OE2 3.14Å; H78-E508 WeakPolarHBondContact CA-OE2 3.33Å; H78-E508 IonicContact CE1-OE2 2.6Å; H78-E508 IonicContact CG-OE2 3.98Å; H78-E508 IonicContact ND1-OE2 3.72Å; H78-E508 PolarHBondContact ND1-OE2 3.06Å; V495-E508 HydrophobicContact CG2-CB 3.97Å; V495-E508 HydrophobicContact CG2-CG 3.69Å; E508-I510 HydrophobicContact CG-CD1 4.43Å; E508-I510 HydrophobicContact CG-CG1 4.06Å
509	A	90.5	Very high	90.6	Very high	4 Å²	4	21.2 Å²	21.2	3%	0.033	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	127.3	171.8	0	0	0	0	0	109.8	L22 W24 T494	L22-A509 HydrophobicContact CB-CB 4.2Å; L22-A509 HydrophobicContact CD1-CB 4.08Å; W24-A509 HydrophobicContact CD2-CB 3.86Å; W24-A509 HydrophobicContact CE3-CB 4.01Å; W24-A509 HydrophobicContact CH2-CB 3.78Å; W24-A509 HydrophobicContact CZ2-CB 3.58Å; W24-A509 HydrophobicContact CZ3-CB 3.96Å; T494-A509 WeakPolarHBondContact CB-O 3.31Å; T494-A509 PolarHBondContact O-N 3.25Å; T494-A509 PolarHBondContact OG1-O 3.14Å
510	I	84.2	Confident	90.3	Very high	16 Å²	16	22.8 Å²	22.8	8%	0.082	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.2	179.6	-56.5	178.3	0	0	0	108	K23 Y25 T74 H78 E508	K23-I510 WeakPolarHBondContact CB-O 3.19Å; K23-I510 PolarHBondContact N-O 3.23Å; K23-I510 PolarHBondContact O-N 2.83Å; K23-I510 VanDerWaalsContact O-O 3.14Å; Y25-I510 HydrophobicContact CD2-CB 4.12Å; Y25-I510 HydrophobicContact CD2-CD1 3.85Å; Y25-I510 HydrophobicContact CD2-CG1 4.13Å; Y25-I510 HydrophobicContact CE2-CB 4.06Å; Y25-I510 HydrophobicContact CE2-CD1 4.29Å; Y25-I510 HydrophobicContact CG-CD1 4.46Å; T74-I510 HydrophobicContact CG2-CD1 4.27Å; H78-I510 WeakPolarHBondContact CE1-CD1 3.47Å; E508-I510 HydrophobicContact CG-CD1 4.43Å; E508-I510 HydrophobicContact CG-CG1 4.06Å
511	N	71.8	Confident	90	Very high	105 Å²	105	24.5 Å²	24.5	56%	0.561	13%	0.134	S	C	*	.			trans	-74.9	0	177	-68.3	-15.6	0	0	0	111.7	A15 L22	A15-N511 PolarHBondContact O-ND2 3.16Å; A15-N511 VanDerWaalsContact O-ND2 3.13Å; L22-N511 WeakPolarHBondContact CD2-OD1 3.25Å

Retrieved 511 of 511 residues in 815.1 ms (Link to these results)

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