A0A077ZGH6_TRITR Loading...

DUF945 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGH6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 476 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	25.7	Very low	30.9	Very low	227 Å²	227	97.2 Å²	97.2	100%	1.118	52%	0.52	S	S	*	.				0	43.2	0	-144.6	171.5	-175.6	0	0	111.1	R3	M1-R3 PolarHBondContact O-N 2.62Å; M1-R3 VanDerWaalsContact O-N 3.1Å
2	I	29.5	Very low	31.3	Very low	100 Å²	100	91 Å²	91	51%	0.513	49%	0.492	S	S	.	.			trans	-83.8	35.1	169.5	-49.3	176.3	0	0	0	108.4	K4 K165 F166	I2-K4 PolarHBondContact O-N 2.91Å; I2-K165 HydrophobicContact CD1-CB 4.48Å; I2-F166 HydrophobicContact CD1-CB 4.19Å
3	R	30.3	Very low	32.1	Very low	199 Å²	199	84.6 Å²	84.6	75%	0.751	46%	0.457	S	S	*	.			trans	-81	112.8	-167.5	-84.2	-176.7	171.4	179.3	-2.7	108.4	M1 S5	M1-R3 PolarHBondContact O-N 2.62Å; M1-R3 VanDerWaalsContact O-N 3.1Å; R3-S5 PolarHBondContact O-N 3.17Å
4	K	34.5	Very low	32.4	Very low	122 Å²	122	79.4 Å²	79.4	53%	0.53	43%	0.432	S	S	.	.	S	Bend	trans	84	-24.6	152.1	-56.1	179.2	177.7	-177.5	0	120.3	I2 G8 L81	I2-K4 PolarHBondContact O-N 2.91Å; K4-G8 PolarHBondContact O-N 3.25Å; K4-L81 HydrophobicContact CB-CD2 3.42Å; K4-L81 VanDerWaalsContact CB-CD2 3.42Å; K4-L81 WeakPolarHBondContact O-CD2 3.42Å
5	S	34.2	Very low	32.9	Very low	58 Å²	58	78.4 Å²	78.4	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-68	-41	-173.4	49.3	0	0	0	0	115.1	R3 L81	R3-S5 PolarHBondContact O-N 3.17Å; S5-L81 WeakPolarHBondContact CB-O 3.4Å
6	A	31	Very low	33.6	Very low	32 Å²	32	74.4 Å²	74.4	26%	0.264	41%	0.407	S	S	.	.	H	α-helix	trans	-78.9	-38	-176.3	0	0	0	0	0	113.6	L130	A6-L130 HydrophobicContact CB-CD2 4.22Å
7	T	31.5	Very low	34.3	Very low	101 Å²	101	72 Å²	72	62%	0.62	39%	0.39	S	S	*	.	H	α-helix	trans	-73.6	-31.9	-175.3	-26	0	0	0	0	112.4	V9	T7-V9 VanDerWaalsContact C-N 3.35Å; T7-V9 PolarHBondContact O-N 2.94Å
8	G	27.5	Very low	34.7	Very low	43 Å²	43	68 Å²	68	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-67.7	-31.3	179.5	0	0	0	0	0	114	K4	K4-G8 PolarHBondContact O-N 3.25Å
9	V	31.6	Very low	35	Very low	23 Å²	23	65.8 Å²	65.8	14%	0.139	36%	0.364	C	S	.	.	H	α-helix	trans	-76.3	-32.5	-179	178.3	0	0	0	0	111.9	T7 A12 V89	T7-V9 VanDerWaalsContact C-N 3.35Å; T7-V9 PolarHBondContact O-N 2.94Å; V9-A12 PolarHBondContact O-N 3.46Å; V9-V89 HydrophobicContact CG1-CG1 3.87Å; V9-V89 HydrophobicContact CG1-CG2 4.4Å; V9-V89 HydrophobicContact CG2-CG2 4.3Å
10	I	32.6	Very low	35.4	Very low	68 Å²	68	63 Å²	63	35%	0.349	35%	0.35	S	S	.	.	H	α-helix	trans	-72.4	-38.6	-178	-62.1	173.3	0	0	0	111.5	A12 L13 L156	I10-A12 VanDerWaalsContact C-N 3.26Å; I10-A12 PolarHBondContact O-N 3.06Å; I10-L13 WeakPolarHBondContact O-CB 3.24Å; I10-L13 PolarHBondContact O-N 3.05Å; I10-L156 HydrophobicContact CG2-CD2 3.76Å
11	V	31.5	Very low	35.8	Very low	96 Å²	96	64.2 Å²	64.2	58%	0.582	36%	0.359	S	S	*	.	H	α-helix	trans	-66.6	-30.1	178.2	179.3	0	0	0	0	111.7	L13 V15	V11-L13 VanDerWaalsContact C-N 3.29Å; V11-L13 PolarHBondContact O-N 3.31Å; V11-V15 HydrophobicContact CG1-CG2 4.46Å; V11-V15 WeakPolarHBondContact O-CG2 3.49Å
12	A	36.3	Very low	36.8	Very low	23 Å²	23	55 Å²	55	19%	0.19	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-32.1	176	0	0	0	0	0	112.5	V9 I10 I16 M72	V9-A12 PolarHBondContact O-N 3.46Å; I10-A12 VanDerWaalsContact C-N 3.26Å; I10-A12 PolarHBondContact O-N 3.06Å; A12-I16 HydrophobicContact CB-CD1 4Å; A12-I16 VanDerWaalsContact O-CB 3.25Å; A12-I16 WeakPolarHBondContact O-CB 3.34Å; A12-I16 WeakPolarHBondContact O-CD1 3.25Å; A12-I16 WeakPolarHBondContact O-CG1 3.4Å; A12-I16 PolarHBondContact O-N 3.2Å; A12-M72 HydrophobicContact CB-CE 4.47Å
13	L	41	Very low	37.8	Very low	8 Å²	8	52.3 Å²	52.3	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-45.9	-176.3	-84.5	167.4	0	0	0	113.8	I10 V11 F91 V119 V140	I10-L13 WeakPolarHBondContact O-CB 3.24Å; I10-L13 PolarHBondContact O-N 3.05Å; V11-L13 VanDerWaalsContact C-N 3.29Å; V11-L13 PolarHBondContact O-N 3.31Å; L13-F91 HydrophobicContact CD1-CE1 4Å; L13-F91 HydrophobicContact CD2-CD1 3.34Å; L13-F91 HydrophobicContact CD2-CE1 3.1Å; L13-F91 HydrophobicContact CD2-CE2 4.48Å; L13-F91 HydrophobicContact CD2-CG 4.13Å; L13-F91 HydrophobicContact CD2-CZ 3.73Å; L13-F91 HydrophobicContact CG-CD1 4.29Å; L13-F91 HydrophobicContact CG-CE1 3.57Å; L13-F91 HydrophobicContact CG-CZ 3.98Å; L13-V119 HydrophobicContact CD2-CG1 3.89Å; L13-V140 HydrophobicContact CD1-CG2 3.7Å
14	A	37	Very low	38.4	Very low	12 Å²	12	46 Å²	46	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-75	-35.6	-178.7	0	0	0	0	0	112.4	F175	A14-F175 HydrophobicContact CB-CD1 3.96Å; A14-F175 HydrophobicContact CB-CD2 3.87Å; A14-F175 HydrophobicContact CB-CE1 4Å; A14-F175 HydrophobicContact CB-CE2 3.91Å; A14-F175 HydrophobicContact CB-CG 3.9Å; A14-F175 HydrophobicContact CB-CZ 3.99Å
15	V	39.9	Very low	39.1	Very low	64 Å²	64	41.2 Å²	41.2	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-76.7	-33.7	-175.1	164	0	0	0	0	112.7	V11 W17 L182	V11-V15 HydrophobicContact CG1-CG2 4.46Å; V11-V15 WeakPolarHBondContact O-CG2 3.49Å; V15-W17 PolarHBondContact O-N 3.44Å; V15-L182 HydrophobicContact CB-CD1 4.28Å; V15-L182 HydrophobicContact CG1-CD1 3.62Å; V15-L182 HydrophobicContact CG2-CD1 4.28Å
16	I	43.9	Very low	40	Very low	15 Å²	15	43.2 Å²	43.2	8%	0.077	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-25.5	-176.5	-78	168	0	0	0	112.8	A12 F35 M72	A12-I16 HydrophobicContact CB-CD1 4Å; A12-I16 VanDerWaalsContact O-CB 3.25Å; A12-I16 WeakPolarHBondContact O-CB 3.34Å; A12-I16 WeakPolarHBondContact O-CD1 3.25Å; A12-I16 WeakPolarHBondContact O-CG1 3.4Å; A12-I16 PolarHBondContact O-N 3.2Å; I16-F35 HydrophobicContact CB-CE1 4.46Å; I16-F35 HydrophobicContact CB-CZ 4.19Å; I16-F35 HydrophobicContact CG1-CZ 4.36Å; I16-F35 HydrophobicContact CG2-CE1 3.73Å; I16-F35 HydrophobicContact CG2-CZ 3.93Å; I16-F35 WeakPolarHBondContact O-CE1 3.44Å; I16-F35 VanDerWaalsContact O-CE2 3.32Å; I16-F35 WeakPolarHBondContact O-CE2 3.38Å; I16-F35 WeakPolarHBondContact O-CZ 3.3Å; I16-M72 HydrophobicContact CD1-CE 3.59Å
17	W	45.3	Very low	41.7	Very low	33 Å²	33	46.3 Å²	46.3	13%	0.125	28%	0.283	C	S	.	.	H	α-helix	trans	-110.9	-30.2	-170.4	-76.1	94.6	0	0	0	115.5	V15 G19 F68 V93 L144 F146	V15-W17 PolarHBondContact O-N 3.44Å; W17-G19 VanDerWaalsContact C-N 3.28Å; W17-G19 PolarHBondContact O-N 3.05Å; W17-F68 HydrophobicContact CH2-CE1 4.45Å; W17-F68 HydrophobicContact CH2-CE2 4.07Å; W17-F68 AromaticContact CH2-CZ 3.53Å; W17-F68 HydrophobicContact CH2-CZ 3.53Å; W17-F68 HydrophobicContact CZ2-CE2 4.22Å; W17-F68 HydrophobicContact CZ2-CZ 4.13Å; W17-V93 HydrophobicContact CH2-CB 4.5Å; W17-V93 HydrophobicContact CH2-CG1 3.42Å; W17-V93 VanDerWaalsContact CH2-CG1 3.42Å; W17-V93 HydrophobicContact CH2-CG2 4.44Å; W17-V93 HydrophobicContact CZ2-CB 4.19Å; W17-V93 HydrophobicContact CZ2-CG1 3.44Å; W17-V93 VanDerWaalsContact CZ2-CG1 3.44Å; W17-V93 HydrophobicContact CZ2-CG2 3.69Å; W17-V93 HydrophobicContact CZ3-CG1 4.45Å; W17-L144 HydrophobicContact CB-CD2 3.25Å; W17-L144 HydrophobicContact CG-CD2 3.91Å; W17-F146 HydrophobicContact CE3-CZ 4.48Å
18	G	40.6	Very low	43.8	Very low	0 Å²	0	42 Å²	42	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.7	-20.9	179.2	0	0	0	0	0	114.6
19	G	40.8	Very low	46.2	Very low	27 Å²	27	42.8 Å²	42.8	28%	0.278	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-4.9	-169.8	0	0	0	0	0	117.3	W17 S180	W17-G19 VanDerWaalsContact C-N 3.28Å; W17-G19 PolarHBondContact O-N 3.05Å; G19-S180 CarbonylContact C-O 3.58Å; G19-S180 VanDerWaalsContact CA-O 3.3Å; G19-S180 WeakPolarHBondContact CA-O 3.41Å
20	G	43.7	Very low	48.6	Very low	8 Å²	8	44.4 Å²	44.4	8%	0.082	26%	0.26	C	S	.	.			trans	-100.8	152.6	-174.1	0	0	0	0	0	114.1	W22 Y23	G20-W22 VanDerWaalsContact C-NE1 3.28Å; G20-Y23 WeakPolarHBondContact O-CE2 3.29Å; G20-Y23 PolarHBondContact O-OH 2.79Å
21	T	44.4	Very low	50.8	Low	90 Å²	90	41.5 Å²	41.5	55%	0.552	25%	0.246	S	C	*	.			trans	-98.7	102.3	162.6	55.3	0	0	0	0	113.8
22	W	45.8	Very low	53.2	Low	32 Å²	32	37 Å²	37	12%	0.121	22%	0.219	C	C	.	.			trans	-140	7.5	-163.7	-59.9	71.2	0	0	0	116.5	G20 T24 G31 V32 K34 F35	G20-W22 VanDerWaalsContact C-NE1 3.28Å; W22-T24 PolarHBondContact O-N 3.24Å; W22-T24 VanDerWaalsContact O-N 3.12Å; W22-G31 VanDerWaalsContact CE3-CA 3.41Å; W22-G31 WeakPolarHBondContact CH2-O 3.06Å; W22-G31 WeakPolarHBondContact CZ2-O 3.31Å; W22-G31 WeakPolarHBondContact CZ3-O 3.26Å; W22-V32 VanDerWaalsContact CE3-CA 3.41Å; W22-V32 HydrophobicContact CE3-CB 4.39Å; W22-V32 HydrophobicContact CE3-CG2 4.03Å; W22-V32 VanDerWaalsContact CH2-N 3.3Å; W22-V32 VanDerWaalsContact CH2-O 3.22Å; W22-V32 WeakPolarHBondContact CH2-O 3.41Å; W22-V32 HydrophobicContact CZ3-CB 4.08Å; W22-V32 HydrophobicContact CZ3-CG2 4.06Å; W22-K34 HydrophobicContact CH2-CB 4.35Å; W22-K34 HydrophobicContact CZ2-CB 3.73Å; W22-K34 HydrophobicContact CZ2-CG 4.24Å; W22-F35 HydrophobicContact CH2-CB 2.77Å; W22-F35 HydrophobicContact CH2-CG 4.04Å; W22-F35 HydrophobicContact CZ2-CB 3.02Å; W22-F35 HydrophobicContact CZ2-CG 4.34Å; W22-F35 HydrophobicContact CZ3-CB 3.48Å; W22-F35 VanDerWaalsContact CZ3-CB 3.48Å; W22-F35 HydrophobicContact CZ3-CG 4.39Å
23	Y	50.8	Low	55.6	Low	45 Å²	45	39.7 Å²	39.7	18%	0.176	23%	0.228	C	C	.	.			trans	-98.4	38.5	-135	-60.7	-61	0	0	0	116.4	G20 L114 F146	G20-Y23 WeakPolarHBondContact O-CE2 3.29Å; G20-Y23 PolarHBondContact O-OH 2.79Å; Y23-L114 VanDerWaalsContact CB-CD1 3.41Å; Y23-L114 HydrophobicContact CD2-CD1 4.29Å; Y23-L114 HydrophobicContact CG-CD1 4.04Å; Y23-L114 WeakPolarHBondContact O-CB 3.43Å; Y23-L114 VanDerWaalsContact O-CD2 3.28Å; Y23-L114 WeakPolarHBondContact O-CD2 3.42Å; Y23-F146 HydrophobicContact CD1-CB 3.79Å; Y23-F146 AromaticContact CD1-CD1 3.95Å; Y23-F146 HydrophobicContact CD1-CD1 3.95Å; Y23-F146 HydrophobicContact CD1-CD2 4.21Å; Y23-F146 AromaticContact CD1-CG 3.71Å; Y23-F146 HydrophobicContact CD1-CG 3.71Å; Y23-F146 HydrophobicContact CE1-CB 3.82Å; Y23-F146 AromaticContact CE1-CD1 3.07Å; Y23-F146 HydrophobicContact CE1-CD1 3.07Å; Y23-F146 AromaticContact CE1-CD2 3.89Å; Y23-F146 HydrophobicContact CE1-CD2 3.89Å; Y23-F146 AromaticContact CE1-CE1 3.46Å; Y23-F146 HydrophobicContact CE1-CE1 3.46Å; Y23-F146 VanDerWaalsContact CE1-CE1 3.46Å; Y23-F146 HydrophobicContact CE1-CE2 4.21Å; Y23-F146 AromaticContact CE1-CG 3.3Å; Y23-F146 HydrophobicContact CE1-CG 3.3Å; Y23-F146 HydrophobicContact CE1-CZ 4.01Å; Y23-F146 HydrophobicContact CE2-CD1 4.45Å; Y23-F146 HydrophobicContact CG-CB 4.43Å; Y23-F146 AromaticContact CZ-CD1 3.37Å; Y23-F146 AromaticContact CZ-CE1 3.73Å; Y23-F146 VanDerWaalsContact OH-CD1 3.26Å; Y23-F146 WeakPolarHBondContact OH-CD1 3.33Å; Y23-F146 VanDerWaalsContact OH-CE1 3.22Å; Y23-F146 WeakPolarHBondContact OH-CE1 3.4Å
24	T	43.5	Very low	57.6	Low	66 Å²	66	44.1 Å²	44.1	41%	0.405	25%	0.247	S	C	.	.	S	Bend	trans	-122.6	146.9	168.3	72.8	0	0	0	0	110.6	W22 T26 Q27 I28	W22-T24 PolarHBondContact O-N 3.24Å; W22-T24 VanDerWaalsContact O-N 3.12Å; T24-T26 PolarHBondContact O-N 3.37Å; T24-Q27 CarbonylContact O-C 3.4Å; T24-Q27 WeakPolarHBondContact O-CA 3.47Å; T24-Q27 PolarHBondContact O-N 2.97Å; T24-Q27 WeakPolarHBondContact OG1-CB 3.09Å; T24-Q27 WeakPolarHBondContact OG1-CG 3.38Å; T24-I28 PolarHBondContact O-N 3.17Å
25	G	47.6	Very low	59.7	Low	21 Å²	21	45.3 Å²	45.3	22%	0.216	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.9	-176.9	0	0	0	0	0	114.1
26	T	52.9	Low	62	Low	100 Å²	100	43 Å²	43	61%	0.613	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-18.3	172.8	52.9	0	0	0	0	114.3	T24	T24-T26 PolarHBondContact O-N 3.37Å
27	Q	68.1	Low	64	Low	97 Å²	97	48.5 Å²	48.5	45%	0.453	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	2.5	-176.4	-61	-69	-14	0	0	114.2	T24 Q29 G31	T24-Q27 CarbonylContact O-C 3.4Å; T24-Q27 WeakPolarHBondContact O-CA 3.47Å; T24-Q27 PolarHBondContact O-N 2.97Å; T24-Q27 WeakPolarHBondContact OG1-CB 3.09Å; T24-Q27 WeakPolarHBondContact OG1-CG 3.38Å; Q27-Q29 PolarHBondContact O-N 3.02Å; Q27-G31 VanDerWaalsContact O-CA 3.29Å; Q27-G31 WeakPolarHBondContact O-CA 3.44Å; Q27-G31 PolarHBondContact O-N 3.26Å
28	I	74.1	Confident	65.7	Low	12 Å²	12	50.5 Å²	50.5	6%	0.062	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-48.2	178.3	-68	161.8	0	0	0	111.1	T24 G31 V32 F59 F68 V95 H97	T24-I28 PolarHBondContact O-N 3.17Å; I28-G31 CarbonylContact O-C 3.35Å; I28-G31 WeakPolarHBondContact O-CA 3.28Å; I28-G31 PolarHBondContact O-N 3.41Å; I28-V32 HydrophobicContact CG2-CG2 4.3Å; I28-V32 VanDerWaalsContact O-CG2 3.23Å; I28-V32 WeakPolarHBondContact O-CG2 3.38Å; I28-V32 PolarHBondContact O-N 2.87Å; I28-F59 HydrophobicContact CG2-CZ 4.13Å; I28-F68 HydrophobicContact CG2-CE1 4.48Å; I28-V95 HydrophobicContact CD1-CB 4.43Å; I28-V95 HydrophobicContact CD1-CG1 3.69Å; I28-V95 HydrophobicContact CG1-CG1 4.36Å; I28-H97 WeakPolarHBondContact CD1-CD2 3.47Å; I28-H97 VanDerWaalsContact CD1-NE2 3.29Å; I28-H97 WeakPolarHBondContact CD1-NE2 3.35Å
29	Q	78.7	Confident	67.7	Low	58 Å²	58	52.1 Å²	52.1	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-70.4	-49	-179.1	-173.7	-172.6	-19.6	0	0	113.4	Q27 G31 V32 E33 Y56 F59	Q27-Q29 PolarHBondContact O-N 3.02Å; Q29-G31 CarbonylContact O-C 3.58Å; Q29-G31 VanDerWaalsContact O-C 3.31Å; Q29-G31 PolarHBondContact O-N 3.34Å; Q29-V32 WeakPolarHBondContact O-CA 3.5Å; Q29-V32 PolarHBondContact O-N 2.84Å; Q29-E33 WeakPolarHBondContact CG-OE1 3.46Å; Q29-E33 PolarHBondContact NE2-OE1 3.29Å; Q29-E33 WeakPolarHBondContact O-CG 3.35Å; Q29-E33 PolarHBondContact O-N 3.13Å; Q29-Y56 PolarHBondContact NE2-OH 2.71Å; Q29-F59 HydrophobicContact CB-CE1 3.84Å; Q29-F59 HydrophobicContact CB-CE2 3.99Å; Q29-F59 HydrophobicContact CB-CZ 3.55Å; Q29-F59 HydrophobicContact CG-CD1 4.43Å; Q29-F59 HydrophobicContact CG-CD2 4.34Å; Q29-F59 HydrophobicContact CG-CE1 4.22Å; Q29-F59 HydrophobicContact CG-CE2 4.11Å; Q29-F59 HydrophobicContact CG-CZ 4.07Å
30	P	81.7	Confident	70	Confident	58 Å²	58	52.6 Å²	52.6	38%	0.377	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-31	173.2	-24.3	33.5	0	0	0	113.3	K34	P30-K34 PolarHBondContact O-N 3.23Å
31	G	78.9	Confident	71.9	Confident	6 Å²	6	54.6 Å²	54.6	6%	0.062	28%	0.284	C	S	.	.	H	α-helix	trans	-45.8	-87.1	153.4	0	0	0	0	0	107	W22 Q27 I28 Q29 E33 K34	W22-G31 VanDerWaalsContact CE3-CA 3.41Å; W22-G31 WeakPolarHBondContact CH2-O 3.06Å; W22-G31 WeakPolarHBondContact CZ2-O 3.31Å; W22-G31 WeakPolarHBondContact CZ3-O 3.26Å; Q27-G31 VanDerWaalsContact O-CA 3.29Å; Q27-G31 WeakPolarHBondContact O-CA 3.44Å; Q27-G31 PolarHBondContact O-N 3.26Å; I28-G31 CarbonylContact O-C 3.35Å; I28-G31 WeakPolarHBondContact O-CA 3.28Å; I28-G31 PolarHBondContact O-N 3.41Å; Q29-G31 CarbonylContact O-C 3.58Å; Q29-G31 VanDerWaalsContact O-C 3.31Å; Q29-G31 PolarHBondContact O-N 3.34Å; G31-E33 CarbonylContact O-C 3.5Å; G31-E33 PolarHBondContact O-N 2.99Å; G31-K34 WeakPolarHBondContact O-CA 3.36Å; G31-K34 VanDerWaalsContact O-CB 3.31Å; G31-K34 WeakPolarHBondContact O-CB 3.17Å; G31-K34 PolarHBondContact O-N 2.93Å
32	V	82.3	Confident	73.4	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-30.5	-47.2	-174	176.7	0	0	0	0	114.9	W22 I28 Q29 I36 Y56 F59 F68 M70	W22-V32 VanDerWaalsContact CE3-CA 3.41Å; W22-V32 HydrophobicContact CE3-CB 4.39Å; W22-V32 HydrophobicContact CE3-CG2 4.03Å; W22-V32 VanDerWaalsContact CH2-N 3.3Å; W22-V32 VanDerWaalsContact CH2-O 3.22Å; W22-V32 WeakPolarHBondContact CH2-O 3.41Å; W22-V32 HydrophobicContact CZ3-CB 4.08Å; W22-V32 HydrophobicContact CZ3-CG2 4.06Å; I28-V32 HydrophobicContact CG2-CG2 4.3Å; I28-V32 VanDerWaalsContact O-CG2 3.23Å; I28-V32 WeakPolarHBondContact O-CG2 3.38Å; I28-V32 PolarHBondContact O-N 2.87Å; Q29-V32 WeakPolarHBondContact O-CA 3.5Å; Q29-V32 PolarHBondContact O-N 2.84Å; V32-I36 HydrophobicContact CG1-CD1 3.75Å; V32-I36 WeakPolarHBondContact O-CB 3.35Å; V32-I36 WeakPolarHBondContact O-CD1 3.5Å; V32-I36 WeakPolarHBondContact O-CG1 3.3Å; V32-I36 PolarHBondContact O-N 2.93Å; V32-Y56 HydrophobicContact CG1-CD1 3.88Å; V32-Y56 HydrophobicContact CG1-CD2 4.37Å; V32-Y56 HydrophobicContact CG1-CE1 4.34Å; V32-Y56 HydrophobicContact CG1-CG 3.88Å; V32-F59 HydrophobicContact CB-CE2 4.44Å; V32-F59 HydrophobicContact CG2-CE2 4.27Å; V32-F68 HydrophobicContact CB-CZ 4.46Å; V32-F68 HydrophobicContact CG1-CE2 4.06Å; V32-F68 HydrophobicContact CG1-CZ 4.23Å; V32-F68 HydrophobicContact CG2-CE1 4.03Å; V32-F68 HydrophobicContact CG2-CE2 4.04Å; V32-F68 HydrophobicContact CG2-CZ 3.38Å; V32-M70 HydrophobicContact CG1-CE 4Å
33	E	87	Confident	74.9	Confident	80 Å²	80	52.5 Å²	52.5	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-39.5	178.5	-66.7	166.8	-173.7	0	0	114.1	Q29 G31 K37 Y56	Q29-E33 WeakPolarHBondContact CG-OE1 3.46Å; Q29-E33 PolarHBondContact NE2-OE1 3.29Å; Q29-E33 WeakPolarHBondContact O-CG 3.35Å; Q29-E33 PolarHBondContact O-N 3.13Å; G31-E33 CarbonylContact O-C 3.5Å; G31-E33 PolarHBondContact O-N 2.99Å; E33-K37 VanDerWaalsContact O-CB 3.31Å; E33-K37 WeakPolarHBondContact O-CB 3.25Å; E33-K37 PolarHBondContact O-N 2.73Å; E33-Y56 HydrophobicContact CG-CE1 3.86Å; E33-Y56 PolarHBondContact OE1-OH 3.27Å
34	K	82.8	Confident	76	Confident	101 Å²	101	58.3 Å²	58.3	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-65	-43.3	-177.6	174.5	168.6	169.6	38.5	0	114.9	W22 P30 G31 K37 D38	W22-K34 HydrophobicContact CH2-CB 4.35Å; W22-K34 HydrophobicContact CZ2-CB 3.73Å; W22-K34 HydrophobicContact CZ2-CG 4.24Å; P30-K34 PolarHBondContact O-N 3.23Å; G31-K34 WeakPolarHBondContact O-CA 3.36Å; G31-K34 VanDerWaalsContact O-CB 3.31Å; G31-K34 WeakPolarHBondContact O-CB 3.17Å; G31-K34 PolarHBondContact O-N 2.93Å; K34-K37 CarbonylContact O-C 3.57Å; K34-K37 WeakPolarHBondContact O-CB 3.44Å; K34-K37 PolarHBondContact O-N 2.56Å; K34-D38 IonicContact NZ-OD1 3.53Å; K34-D38 IonicContact NZ-OD2 2.82Å; K34-D38 PolarHBondContact NZ-OD2 2.62Å; K34-D38 WeakPolarHBondContact O-CB 3.31Å; K34-D38 PolarHBondContact O-N 3.3Å
35	F	81.4	Confident	77.4	Confident	37 Å²	37	62.3 Å²	62.3	16%	0.162	31%	0.309	C	S	.	.	H	α-helix	trans	-76.3	-39.7	-179.9	169.2	-94.4	0	0	0	108.7	I16 W22 K37 D38 F39 L54	I16-F35 HydrophobicContact CB-CE1 4.46Å; I16-F35 HydrophobicContact CB-CZ 4.19Å; I16-F35 HydrophobicContact CG1-CZ 4.36Å; I16-F35 HydrophobicContact CG2-CE1 3.73Å; I16-F35 HydrophobicContact CG2-CZ 3.93Å; I16-F35 WeakPolarHBondContact O-CE1 3.44Å; I16-F35 VanDerWaalsContact O-CE2 3.32Å; I16-F35 WeakPolarHBondContact O-CE2 3.38Å; I16-F35 WeakPolarHBondContact O-CZ 3.3Å; W22-F35 HydrophobicContact CH2-CB 2.77Å; W22-F35 HydrophobicContact CH2-CG 4.04Å; W22-F35 HydrophobicContact CZ2-CB 3.02Å; W22-F35 HydrophobicContact CZ2-CG 4.34Å; W22-F35 HydrophobicContact CZ3-CB 3.48Å; W22-F35 VanDerWaalsContact CZ3-CB 3.48Å; W22-F35 HydrophobicContact CZ3-CG 4.39Å; F35-K37 PolarHBondContact O-N 3.44Å; F35-D38 PolarHBondContact O-N 3.29Å; F35-F39 HydrophobicContact CZ-CD2 4.49Å; F35-F39 WeakPolarHBondContact O-CB 3.39Å; F35-F39 PolarHBondContact O-N 3.38Å; F35-L54 HydrophobicContact CD1-CD2 3.6Å; F35-L54 HydrophobicContact CE1-CD2 3.32Å; F35-L54 HydrophobicContact CZ-CD2 4.5Å
36	I	86.7	Confident	78.3	Confident	16 Å²	16	64.4 Å²	64.4	8%	0.082	33%	0.33	C	S	.	.	H	α-helix	trans	-57.1	-45.2	169.6	-73.2	172.9	0	0	0	109.3	V32 N40 L54 Y56 M70	V32-I36 HydrophobicContact CG1-CD1 3.75Å; V32-I36 WeakPolarHBondContact O-CB 3.35Å; V32-I36 WeakPolarHBondContact O-CD1 3.5Å; V32-I36 WeakPolarHBondContact O-CG1 3.3Å; V32-I36 PolarHBondContact O-N 2.93Å; I36-N40 VanDerWaalsContact O-CB 3.24Å; I36-N40 WeakPolarHBondContact O-CB 3.29Å; I36-N40 PolarHBondContact O-N 2.96Å; I36-N40 PolarHBondContact O-ND2 3.44Å; I36-N40 VanDerWaalsContact O-ND2 3.17Å; I36-L54 HydrophobicContact CG1-CB 4.48Å; I36-L54 HydrophobicContact CG1-CD2 3.8Å; I36-L54 HydrophobicContact CG1-CG 4Å; I36-L54 VanDerWaalsContact CG2-O 3.25Å; I36-L54 WeakPolarHBondContact CG2-O 3.37Å; I36-Y56 HydrophobicContact CD1-CD1 3.39Å; I36-Y56 HydrophobicContact CD1-CE1 4.3Å; I36-Y56 HydrophobicContact CD1-CG 4.08Å; I36-M70 HydrophobicContact CD1-CE 3.83Å; I36-M70 HydrophobicContact CD1-SD 3.85Å; I36-M70 HydrophobicContact CG1-CE 4.15Å; I36-M70 HydrophobicContact CG1-SD 4.1Å
37	K	86.7	Confident	78.7	Confident	130 Å²	130	65.4 Å²	65.4	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-61.3	-51.6	173.5	-179.2	-177.2	177.1	-176.5	0	112.3	E33 K34 F35 F39 N40 D41	E33-K37 VanDerWaalsContact O-CB 3.31Å; E33-K37 WeakPolarHBondContact O-CB 3.25Å; E33-K37 PolarHBondContact O-N 2.73Å; K34-K37 CarbonylContact O-C 3.57Å; K34-K37 WeakPolarHBondContact O-CB 3.44Å; K34-K37 PolarHBondContact O-N 2.56Å; F35-K37 PolarHBondContact O-N 3.44Å; K37-F39 VanDerWaalsContact C-N 3.33Å; K37-F39 PolarHBondContact O-N 3.3Å; K37-N40 PolarHBondContact O-N 3.43Å; K37-D41 WeakPolarHBondContact O-CB 3.47Å; K37-D41 PolarHBondContact O-N 3.16Å
38	D	81.4	Confident	78.5	Confident	76 Å²	76	63 Å²	63	41%	0.406	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-40.2	-177.7	-66.8	-21.8	0	0	0	111	K34 F35 D41 A42	K34-D38 IonicContact NZ-OD1 3.53Å; K34-D38 IonicContact NZ-OD2 2.82Å; K34-D38 PolarHBondContact NZ-OD2 2.62Å; K34-D38 WeakPolarHBondContact O-CB 3.31Å; K34-D38 PolarHBondContact O-N 3.3Å; F35-D38 PolarHBondContact O-N 3.29Å; D38-D41 PolarHBondContact O-N 2.98Å; D38-A42 PolarHBondContact O-N 3.42Å
39	F	83.1	Confident	78.1	Confident	33 Å²	33	66.9 Å²	66.9	15%	0.145	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-45.9	174.1	-177.9	-82.4	0	0	0	111.8	F35 K37 D41 A42 K43 H48 M52 L54 M72	F35-F39 HydrophobicContact CZ-CD2 4.49Å; F35-F39 WeakPolarHBondContact O-CB 3.39Å; F35-F39 PolarHBondContact O-N 3.38Å; K37-F39 VanDerWaalsContact C-N 3.33Å; K37-F39 PolarHBondContact O-N 3.3Å; F39-D41 VanDerWaalsContact C-N 3.35Å; F39-A42 PolarHBondContact O-N 3.11Å; F39-K43 PolarHBondContact O-N 2.85Å; F39-H48 AromaticContact CE1-NE2 3.87Å; F39-H48 PolarHBondContact O-NE2 2.91Å; F39-M52 HydrophobicContact CE1-CB 4.4Å; F39-M52 HydrophobicContact CZ-CB 4.44Å; F39-L54 HydrophobicContact CB-CD2 4.41Å; F39-L54 HydrophobicContact CD1-CB 3.47Å; F39-L54 VanDerWaalsContact CD1-CB 3.47Å; F39-L54 HydrophobicContact CD1-CD2 4.49Å; F39-L54 HydrophobicContact CE1-CB 3.84Å; F39-L54 HydrophobicContact CG-CB 4.05Å; F39-L54 HydrophobicContact CG-CD2 4.25Å; F39-M72 HydrophobicContact CE2-CE 4.38Å; F39-M72 HydrophobicContact CZ-CE 4.02Å
40	N	87.7	Confident	77.9	Confident	37 Å²	37	67.2 Å²	67.2	20%	0.198	35%	0.35	C	S	.	.	H	α-helix	trans	-72.7	-27.7	178.9	-69.2	-20.7	0	0	0	112.4	I36 K37 K43 T53 L54	I36-N40 VanDerWaalsContact O-CB 3.24Å; I36-N40 WeakPolarHBondContact O-CB 3.29Å; I36-N40 PolarHBondContact O-N 2.96Å; I36-N40 PolarHBondContact O-ND2 3.44Å; I36-N40 VanDerWaalsContact O-ND2 3.17Å; K37-N40 PolarHBondContact O-N 3.43Å; N40-K43 VanDerWaalsContact O-CB 3.3Å; N40-K43 WeakPolarHBondContact O-CB 3.38Å; N40-T53 WeakPolarHBondContact OD1-CA 3.46Å; N40-T53 WeakPolarHBondContact OD1-CG2 3.09Å; N40-L54 PolarHBondContact ND2-O 2.86Å; N40-L54 PolarHBondContact OD1-N 3.23Å
41	D	84.5	Confident	77.8	Confident	51 Å²	51	67.9 Å²	67.9	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-74.6	-32.7	173.3	-78	-23.6	0	0	0	111.5	K37 D38 F39 K43 K44	K37-D41 WeakPolarHBondContact O-CB 3.47Å; K37-D41 PolarHBondContact O-N 3.16Å; D38-D41 PolarHBondContact O-N 2.98Å; F39-D41 VanDerWaalsContact C-N 3.35Å; D41-K43 VanDerWaalsContact C-N 3.27Å; D41-K43 PolarHBondContact O-N 3.41Å; D41-K44 WeakPolarHBondContact O-CB 3.47Å; D41-K44 PolarHBondContact O-N 2.98Å; D41-K44 IonicContact OD1-NZ 2.81Å; D41-K44 PolarHBondContact OD1-NZ 2.83Å
42	A	76.5	Confident	78.2	Confident	16 Å²	16	68.8 Å²	68.8	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-34.1	171.5	0	0	0	0	0	112.5	D38 F39 K44 K45 E47	D38-A42 PolarHBondContact O-N 3.42Å; F39-A42 PolarHBondContact O-N 3.11Å; A42-K44 VanDerWaalsContact C-N 3.29Å; A42-K44 PolarHBondContact O-N 3.07Å; A42-K45 WeakPolarHBondContact O-CB 3.27Å; A42-K45 PolarHBondContact O-N 2.96Å; A42-E47 PolarHBondContact O-N 3.14Å
43	K	76.1	Confident	78.7	Confident	61 Å²	61	70.6 Å²	70.6	27%	0.265	36%	0.364	S	S	.	.	H	α-helix	trans	-53.7	-45.2	171.6	-175.7	-170.9	169.7	179.6	0	112	F39 N40 D41 K45 G46 H48 D75	F39-K43 PolarHBondContact O-N 2.85Å; N40-K43 VanDerWaalsContact O-CB 3.3Å; N40-K43 WeakPolarHBondContact O-CB 3.38Å; D41-K43 VanDerWaalsContact C-N 3.27Å; D41-K43 PolarHBondContact O-N 3.41Å; K43-K45 PolarHBondContact O-N 3.07Å; K43-K45 VanDerWaalsContact O-N 3.11Å; K43-G46 PolarHBondContact O-N 2.92Å; K43-H48 VanDerWaalsContact CA-CD2 3.41Å; K43-H48 WeakPolarHBondContact CA-CD2 3.43Å; K43-H48 PolarHBondContact N-NE2 3.43Å; K43-D75 IonicContact NZ-OD2 2.73Å; K43-D75 PolarHBondContact NZ-OD2 3.33Å
44	K	74.6	Confident	78.9	Confident	167 Å²	167	66.9 Å²	66.9	73%	0.726	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.4	-178.5	-62.6	173.2	-174.7	156.1	0	113.1	D41 A42	D41-K44 WeakPolarHBondContact O-CB 3.47Å; D41-K44 PolarHBondContact O-N 2.98Å; D41-K44 IonicContact OD1-NZ 2.81Å; D41-K44 PolarHBondContact OD1-NZ 2.83Å; A42-K44 VanDerWaalsContact C-N 3.29Å; A42-K44 PolarHBondContact O-N 3.07Å
45	K	73	Confident	79.5	Confident	151 Å²	151	64 Å²	64	66%	0.657	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-3	177.8	-60.2	177.8	-175.4	171.6	0	113.2	A42 K43 E47	A42-K45 WeakPolarHBondContact O-CB 3.27Å; A42-K45 PolarHBondContact O-N 2.96Å; K43-K45 PolarHBondContact O-N 3.07Å; K43-K45 VanDerWaalsContact O-N 3.11Å; K45-E47 VanDerWaalsContact C-N 3.28Å; K45-E47 HydrophobicContact CB-CG 3.83Å; K45-E47 VanDerWaalsContact CD-OE1 3.27Å; K45-E47 WeakPolarHBondContact CD-OE1 3.2Å
46	G	65.6	Low	80.1	Confident	65 Å²	65	65.2 Å²	65.2	67%	0.67	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	24.7	-175	0	0	0	0	0	113.3	K43 H48	K43-G46 PolarHBondContact O-N 2.92Å; G46-H48 VanDerWaalsContact C-N 3.35Å
47	E	61	Low	80.4	Confident	121 Å²	121	68.1 Å²	68.1	57%	0.565	36%	0.356	S	S	*	.			trans	-82.2	-14.3	-177.8	-69.7	173.5	178.9	0	0	112.9	A42 K45	A42-E47 PolarHBondContact O-N 3.14Å; K45-E47 VanDerWaalsContact C-N 3.28Å; K45-E47 HydrophobicContact CB-CG 3.83Å; K45-E47 VanDerWaalsContact CD-OE1 3.27Å; K45-E47 WeakPolarHBondContact CD-OE1 3.2Å
48	H	64.1	Low	80.7	Confident	47 Å²	47	67.3 Å²	67.3	22%	0.218	36%	0.358	C	S	.	.	S	Bend	trans	-88.5	140.1	178.2	-61.6	-32.9	0	0	0	111.3	F39 K43 G46 Y50	F39-H48 AromaticContact CE1-NE2 3.87Å; F39-H48 PolarHBondContact O-NE2 2.91Å; K43-H48 VanDerWaalsContact CA-CD2 3.41Å; K43-H48 WeakPolarHBondContact CA-CD2 3.43Å; K43-H48 PolarHBondContact N-NE2 3.43Å; G46-H48 VanDerWaalsContact C-N 3.35Å; H48-Y50 WeakPolarHBondContact CB-O 3.31Å; H48-Y50 PolarHBondContact O-N 3.09Å
49	A	67	Low	81.2	Confident	92 Å²	92	65.7 Å²	65.7	76%	0.76	35%	0.348	S	S	*	.	S	Bend	trans	-64.5	-25	173.3	0	0	0	0	0	113
50	Y	73.5	Confident	81.6	Confident	66 Å²	66	69.2 Å²	69.2	26%	0.259	37%	0.368	S	S	.	.	S	Bend	trans	-136.3	151.9	177.6	-57	-76.7	0	0	0	109.9	H48 M52 A78 L81	H48-Y50 WeakPolarHBondContact CB-O 3.31Å; H48-Y50 PolarHBondContact O-N 3.09Å; Y50-M52 PolarHBondContact O-N 2.98Å; Y50-A78 HydrophobicContact CD1-CB 3.69Å; Y50-A78 HydrophobicContact CE1-CB 3.77Å; Y50-A78 HydrophobicContact CG-CB 4.14Å; Y50-L81 HydrophobicContact CE2-CD1 3.95Å
51	D	80.8	Confident	81.6	Confident	71 Å²	71	72.6 Å²	72.6	38%	0.38	38%	0.381	S	S	.	.			trans	-67.1	94.4	171.2	-79.5	-41	0	0	0	110.4	D75 N76	D51-D75 HydrophobicContact CB-CB 4.36Å; D51-D75 PolarHBondContact O-N 3.32Å; D51-N76 HydrophobicContact CB-CB 4.36Å; D51-N76 PolarHBondContact OD2-ND2 3.38Å
52	M	87	Confident	81.6	Confident	26 Å²	26	71.4 Å²	71.4	13%	0.128	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.6	-179.2	-64.2	178.2	-64.7	0	0	111.1	F39 Y50 M72 T73 F74	F39-M52 HydrophobicContact CE1-CB 4.4Å; F39-M52 HydrophobicContact CZ-CB 4.44Å; Y50-M52 PolarHBondContact O-N 2.98Å; M52-M72 HydrophobicContact CB-CG 4.46Å; M52-M72 HydrophobicContact SD-CG 4.31Å; M52-M72 HydrophobicContact SD-SD 3.72Å; M52-T73 VanDerWaalsContact CA-O 3.24Å; M52-T73 WeakPolarHBondContact CA-O 3.36Å; M52-F74 HydrophobicContact CG-CD1 3.82Å; M52-F74 HydrophobicContact CG-CE1 3.93Å; M52-F74 HydrophobicContact CG-CG 4.37Å; M52-F74 HydrophobicContact SD-CD1 4.04Å; M52-F74 HydrophobicContact SD-CE1 3.48Å; M52-F74 WeakPolarHBondContact SD-CE1 3.27Å; M52-F74 HydrophobicContact SD-CZ 3.84Å
53	T	91.6	Very high	81.9	Confident	39 Å²	39	78.9 Å²	78.9	24%	0.239	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.7	173.2	-60.2	0	0	0	0	109.5	N40 T73 D75	N40-T53 WeakPolarHBondContact OD1-CA 3.46Å; N40-T53 WeakPolarHBondContact OD1-CG2 3.09Å; T53-T73 PolarHBondContact N-O 3.4Å; T53-T73 PolarHBondContact O-N 2.88Å; T53-D75 PolarHBondContact OG1-OD1 3.07Å; T53-D75 PolarHBondContact OG1-OD2 2.98Å
54	L	92.1	Very high	82.4	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.005	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.8	172.7	-164	69.4	0	0	0	110.1	F35 I36 F39 N40 M70 Q71 M72	F35-L54 HydrophobicContact CD1-CD2 3.6Å; F35-L54 HydrophobicContact CE1-CD2 3.32Å; F35-L54 HydrophobicContact CZ-CD2 4.5Å; I36-L54 HydrophobicContact CG1-CB 4.48Å; I36-L54 HydrophobicContact CG1-CD2 3.8Å; I36-L54 HydrophobicContact CG1-CG 4Å; I36-L54 VanDerWaalsContact CG2-O 3.25Å; I36-L54 WeakPolarHBondContact CG2-O 3.37Å; F39-L54 HydrophobicContact CB-CD2 4.41Å; F39-L54 HydrophobicContact CD1-CB 3.47Å; F39-L54 VanDerWaalsContact CD1-CB 3.47Å; F39-L54 HydrophobicContact CD1-CD2 4.49Å; F39-L54 HydrophobicContact CE1-CB 3.84Å; F39-L54 HydrophobicContact CG-CB 4.05Å; F39-L54 HydrophobicContact CG-CD2 4.25Å; N40-L54 PolarHBondContact ND2-O 2.86Å; N40-L54 PolarHBondContact OD1-N 3.23Å; L54-M70 HydrophobicContact CD1-CG 3.77Å; L54-M70 HydrophobicContact CD1-SD 3.63Å; L54-M70 HydrophobicContact CD2-SD 3.8Å; L54-M70 HydrophobicContact CG-CG 4.34Å; L54-M70 HydrophobicContact CG-SD 3.52Å; L54-M70 VanDerWaalsContact CG-SD 3.52Å; L54-Q71 WeakPolarHBondContact CA-O 3.5Å; L54-M72 HydrophobicContact CD1-CB 4.23Å
55	S	94.5	Very high	83	Confident	40 Å²	40	77.7 Å²	77.7	28%	0.28	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	165.4	176.1	60.4	0	0	0	0	110.1	Q71	S55-Q71 PolarHBondContact N-O 3.24Å; S55-Q71 PolarHBondContact O-N 3.02Å
56	Y	93.6	Very high	83.9	Confident	64 Å²	64	70.6 Å²	70.6	25%	0.251	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.8	171.7	76.1	-75.6	0	0	0	111	Q29 V32 E33 I36 F59 Q69	Q29-Y56 PolarHBondContact NE2-OH 2.71Å; V32-Y56 HydrophobicContact CG1-CD1 3.88Å; V32-Y56 HydrophobicContact CG1-CD2 4.37Å; V32-Y56 HydrophobicContact CG1-CE1 4.34Å; V32-Y56 HydrophobicContact CG1-CG 3.88Å; E33-Y56 HydrophobicContact CG-CE1 3.86Å; E33-Y56 PolarHBondContact OE1-OH 3.27Å; I36-Y56 HydrophobicContact CD1-CD1 3.39Å; I36-Y56 HydrophobicContact CD1-CE1 4.3Å; I36-Y56 HydrophobicContact CD1-CG 4.08Å; Y56-F59 HydrophobicContact CD2-CB 3.88Å; Y56-F59 AromaticContact CD2-CD2 3.7Å; Y56-F59 HydrophobicContact CD2-CD2 3.7Å; Y56-F59 HydrophobicContact CD2-CG 4.24Å; Y56-F59 HydrophobicContact CE2-CB 3.6Å; Y56-F59 AromaticContact CE2-CD2 3.64Å; Y56-F59 HydrophobicContact CE2-CD2 3.64Å; Y56-F59 AromaticContact CE2-CG 3.92Å; Y56-F59 HydrophobicContact CE2-CG 3.92Å; Y56-Q69 CarbonylContact C-O 3.55Å; Y56-Q69 WeakPolarHBondContact CA-O 3.47Å; Y56-Q69 WeakPolarHBondContact CB-O 3.43Å
57	Q	94.3	Very high	85.2	Confident	76 Å²	76	74.2 Å²	74.2	36%	0.355	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	171.2	174.2	72.2	-177.5	10.6	0	0	111.2	F59 Q69	Q57-F59 VanDerWaalsContact C-N 3.26Å; Q57-F59 PolarHBondContact O-N 3.49Å; Q57-Q69 HydrophobicContact CG-CB 3.79Å; Q57-Q69 PolarHBondContact N-O 2.98Å; Q57-Q69 PolarHBondContact O-N 3.08Å
58	N	92.9	Very high	86.8	Confident	114 Å²	114	68.5 Å²	68.5	61%	0.61	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53	42.3	174.3	-58.2	-27.8	0	0	0	112.9	D60 R67 Q69	N58-D60 PolarHBondContact O-N 3.04Å; N58-D60 VanDerWaalsContact O-N 3.14Å; N58-R67 VanDerWaalsContact O-O 3.14Å; N58-Q69 PolarHBondContact ND2-OE1 3.16Å
59	F	92.4	Very high	88.3	Confident	42 Å²	42	68 Å²	68	18%	0.184	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	103.5	-179.7	-161.7	-71.5	0	0	0	110.5	I28 Q29 V32 Y56 Q57 K61 R67 F68	I28-F59 HydrophobicContact CG2-CZ 4.13Å; Q29-F59 HydrophobicContact CB-CE1 3.84Å; Q29-F59 HydrophobicContact CB-CE2 3.99Å; Q29-F59 HydrophobicContact CB-CZ 3.55Å; Q29-F59 HydrophobicContact CG-CD1 4.43Å; Q29-F59 HydrophobicContact CG-CD2 4.34Å; Q29-F59 HydrophobicContact CG-CE1 4.22Å; Q29-F59 HydrophobicContact CG-CE2 4.11Å; Q29-F59 HydrophobicContact CG-CZ 4.07Å; V32-F59 HydrophobicContact CB-CE2 4.44Å; V32-F59 HydrophobicContact CG2-CE2 4.27Å; Y56-F59 HydrophobicContact CD2-CB 3.88Å; Y56-F59 AromaticContact CD2-CD2 3.7Å; Y56-F59 HydrophobicContact CD2-CD2 3.7Å; Y56-F59 HydrophobicContact CD2-CG 4.24Å; Y56-F59 HydrophobicContact CE2-CB 3.6Å; Y56-F59 AromaticContact CE2-CD2 3.64Å; Y56-F59 HydrophobicContact CE2-CD2 3.64Å; Y56-F59 AromaticContact CE2-CG 3.92Å; Y56-F59 HydrophobicContact CE2-CG 3.92Å; Q57-F59 VanDerWaalsContact C-N 3.26Å; Q57-F59 PolarHBondContact O-N 3.49Å; F59-K61 HydrophobicContact CD1-CB 4.17Å; F59-K61 HydrophobicContact CE1-CB 3.88Å; F59-K61 HydrophobicContact CE1-CG 4.31Å; F59-R67 WeakPolarHBondContact CA-O 3.31Å; F59-F68 HydrophobicContact CB-CB 4.07Å; F59-F68 HydrophobicContact CD2-CB 3.58Å; F59-F68 AromaticContact CD2-CD1 3.58Å; F59-F68 HydrophobicContact CD2-CD1 3.58Å; F59-F68 HydrophobicContact CD2-CD2 4.37Å; F59-F68 HydrophobicContact CD2-CE1 4.21Å; F59-F68 AromaticContact CD2-CG 3.62Å; F59-F68 HydrophobicContact CD2-CG 3.62Å; F59-F68 HydrophobicContact CE2-CB 4.29Å; F59-F68 AromaticContact CE2-CD1 3.37Å; F59-F68 HydrophobicContact CE2-CD1 3.37Å; F59-F68 AromaticContact CE2-CE1 3.59Å; F59-F68 HydrophobicContact CE2-CE1 3.59Å; F59-F68 AromaticContact CE2-CG 3.88Å; F59-F68 HydrophobicContact CE2-CG 3.88Å; F59-F68 HydrophobicContact CE2-CZ 4.25Å; F59-F68 HydrophobicContact CG-CB 4.05Å; F59-F68 HydrophobicContact CG-CD1 4.49Å; F59-F68 HydrophobicContact CZ-CD1 4.13Å; F59-F68 HydrophobicContact CZ-CE1 4.31Å
60	D	91.9	Very high	89.5	Confident	106 Å²	106	63.8 Å²	63.8	57%	0.567	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.7	170.2	-172	8.7	0	0	0	109.2	N58 S66 R67	N58-D60 PolarHBondContact O-N 3.04Å; N58-D60 VanDerWaalsContact O-N 3.14Å; D60-S66 CarbonylContact O-C 3.31Å; D60-S66 WeakPolarHBondContact O-CA 3.47Å; D60-R67 PolarHBondContact N-O 3.4Å; D60-R67 PolarHBondContact O-N 3.31Å
61	K	86.3	Confident	90.5	Very high	108 Å²	108	61.1 Å²	61.1	47%	0.47	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	98.5	-178.8	-172.5	-179	177.1	176.7	0	109.3	F59	F59-K61 HydrophobicContact CD1-CB 4.17Å; F59-K61 HydrophobicContact CE1-CB 3.88Å; F59-K61 HydrophobicContact CE1-CG 4.31Å
62	G	85.8	Confident	91.1	Very high	27 Å²	27	58.3 Å²	58.3	28%	0.278	28%	0.283	S	S	.	.			trans	-84.2	175.5	168	0	0	0	0	0	112.7	N65 H97	G62-N65 CarbonylContact C-O 3.56Å; G62-N65 VanDerWaalsContact C-O 3.27Å; G62-N65 WeakPolarHBondContact CA-O 3.12Å; G62-N65 PolarHBondContact N-O 3.34Å; G62-H97 PolarHBondContact O-CE1 3.44Å
63	F	81.4	Confident	91.4	Very high	173 Å²	173	58 Å²	58	76%	0.759	28%	0.282	S	S	*	.	S	Bend	trans	-76.2	-37.7	176.7	-176.4	-92.2	0	0	0	112.8	H97	F63-H97 PolarHBondContact O-ND1 3.02Å
64	F	86.1	Confident	91.4	Very high	121 Å²	121	56.5 Å²	56.5	53%	0.531	27%	0.272	S	S	.	.	S	Bend	trans	-106.1	-16.9	-179.1	-64.3	-69.4	0	0	0	113.5	H97 I102	F64-H97 PolarHBondContact O-N 2.9Å; F64-I102 HydrophobicContact CB-CD1 3.8Å; F64-I102 HydrophobicContact CD1-CD1 4.47Å; F64-I102 HydrophobicContact CD2-CD1 4.49Å; F64-I102 HydrophobicContact CG-CD1 4.03Å
65	N	88.6	Confident	91.3	Very high	82 Å²	82	58.8 Å²	58.8	44%	0.439	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	157.3	-178	60.7	72.6	0	0	0	110.8	G62 V95	G62-N65 CarbonylContact C-O 3.56Å; G62-N65 VanDerWaalsContact C-O 3.27Å; G62-N65 WeakPolarHBondContact CA-O 3.12Å; G62-N65 PolarHBondContact N-O 3.34Å; N65-V95 CarbonylContact C-O 3.46Å; N65-V95 WeakPolarHBondContact CA-O 3.49Å; N65-V95 WeakPolarHBondContact CB-O 3.39Å
66	S	91	Very high	91	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.3	167.6	-59.9	0	0	0	0	108.9	D60 V95 H97	D60-S66 CarbonylContact O-C 3.31Å; D60-S66 WeakPolarHBondContact O-CA 3.47Å; S66-V95 PolarHBondContact N-O 2.98Å; S66-V95 PolarHBondContact O-N 2.88Å; S66-H97 PolarHBondContact N-NE2 3.08Å; S66-H97 PolarHBondContact OG-NE2 2.94Å
67	R	93.5	Very high	90.6	Very high	141 Å²	141	59.4 Å²	59.4	53%	0.532	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.2	174.9	173.9	173.5	-77.1	-174.5	-10.3	109.5	N58 F59 D60 V93 D94	N58-R67 VanDerWaalsContact O-O 3.14Å; F59-R67 WeakPolarHBondContact CA-O 3.31Å; D60-R67 PolarHBondContact N-O 3.4Å; D60-R67 PolarHBondContact O-N 3.31Å; R67-V93 WeakPolarHBondContact CA-O 3.17Å; R67-D94 WeakPolarHBondContact CG-OD1 3.17Å; R67-D94 IonicContact CZ-OD1 3.61Å; R67-D94 VanDerWaalsContact CZ-OD1 3.23Å; R67-D94 IonicContact CZ-OD2 2.61Å; R67-D94 IonicContact NE-OD1 2.77Å; R67-D94 PolarHBondContact NE-OD1 2.87Å; R67-D94 IonicContact NE-OD2 2.97Å; R67-D94 VanDerWaalsContact NH2-CG 3.28Å; R67-D94 IonicContact NH2-OD1 3.11Å; R67-D94 PolarHBondContact NH2-OD1 2.91Å; R67-D94 IonicContact NH2-OD2 2.6Å; R67-D94 PolarHBondContact NH2-OD2 2.91Å
68	F	94.5	Very high	90.1	Very high	1 Å²	1	55.8 Å²	55.8	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	168.5	174.2	58.9	-87.3	0	0	0	111.8	W17 I28 V32 F59 M70 V93 V95	W17-F68 HydrophobicContact CH2-CE1 4.45Å; W17-F68 HydrophobicContact CH2-CE2 4.07Å; W17-F68 AromaticContact CH2-CZ 3.53Å; W17-F68 HydrophobicContact CH2-CZ 3.53Å; W17-F68 HydrophobicContact CZ2-CE2 4.22Å; W17-F68 HydrophobicContact CZ2-CZ 4.13Å; I28-F68 HydrophobicContact CG2-CE1 4.48Å; V32-F68 HydrophobicContact CB-CZ 4.46Å; V32-F68 HydrophobicContact CG1-CE2 4.06Å; V32-F68 HydrophobicContact CG1-CZ 4.23Å; V32-F68 HydrophobicContact CG2-CE1 4.03Å; V32-F68 HydrophobicContact CG2-CE2 4.04Å; V32-F68 HydrophobicContact CG2-CZ 3.38Å; F59-F68 HydrophobicContact CB-CB 4.07Å; F59-F68 HydrophobicContact CD2-CB 3.58Å; F59-F68 AromaticContact CD2-CD1 3.58Å; F59-F68 HydrophobicContact CD2-CD1 3.58Å; F59-F68 HydrophobicContact CD2-CD2 4.37Å; F59-F68 HydrophobicContact CD2-CE1 4.21Å; F59-F68 AromaticContact CD2-CG 3.62Å; F59-F68 HydrophobicContact CD2-CG 3.62Å; F59-F68 HydrophobicContact CE2-CB 4.29Å; F59-F68 AromaticContact CE2-CD1 3.37Å; F59-F68 HydrophobicContact CE2-CD1 3.37Å; F59-F68 AromaticContact CE2-CE1 3.59Å; F59-F68 HydrophobicContact CE2-CE1 3.59Å; F59-F68 AromaticContact CE2-CG 3.88Å; F59-F68 HydrophobicContact CE2-CG 3.88Å; F59-F68 HydrophobicContact CE2-CZ 4.25Å; F59-F68 HydrophobicContact CG-CB 4.05Å; F59-F68 HydrophobicContact CG-CD1 4.49Å; F59-F68 HydrophobicContact CZ-CD1 4.13Å; F59-F68 HydrophobicContact CZ-CE1 4.31Å; F68-M70 HydrophobicContact CE2-CE 3.88Å; F68-V93 HydrophobicContact CD1-CB 4.4Å; F68-V93 HydrophobicContact CD1-CG1 4.5Å; F68-V93 HydrophobicContact CD2-CB 4.12Å; F68-V93 HydrophobicContact CD2-CG2 4.26Å; F68-V93 HydrophobicContact CE1-CB 4.28Å; F68-V93 HydrophobicContact CE1-CG1 3.95Å; F68-V93 HydrophobicContact CE2-CB 3.98Å; F68-V93 HydrophobicContact CE2-CG1 4.12Å; F68-V93 HydrophobicContact CE2-CG2 4.01Å; F68-V93 HydrophobicContact CG-CB 4.37Å; F68-V93 HydrophobicContact CZ-CB 4.13Å; F68-V93 HydrophobicContact CZ-CG1 3.8Å; F68-V93 PolarHBondContact N-O 3.31Å; F68-V93 PolarHBondContact O-N 3.44Å; F68-V95 HydrophobicContact CE1-CG2 3.92Å
69	Q	95	Very high	89.3	Confident	38 Å²	38	55.4 Å²	55.4	18%	0.178	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.4	173.4	-81.2	178.9	-19	0	0	110.8	Y56 Q57 N58 V90 F91 D92	Y56-Q69 CarbonylContact C-O 3.55Å; Y56-Q69 WeakPolarHBondContact CA-O 3.47Å; Y56-Q69 WeakPolarHBondContact CB-O 3.43Å; Q57-Q69 HydrophobicContact CG-CB 3.79Å; Q57-Q69 PolarHBondContact N-O 2.98Å; Q57-Q69 PolarHBondContact O-N 3.08Å; N58-Q69 PolarHBondContact ND2-OE1 3.16Å; Q69-V90 HydrophobicContact CB-CG1 4.26Å; Q69-V90 HydrophobicContact CG-CG1 4.38Å; Q69-F91 CarbonylContact C-O 3.54Å; Q69-F91 VanDerWaalsContact CA-O 3.27Å; Q69-F91 WeakPolarHBondContact CA-O 3.19Å; Q69-D92 WeakPolarHBondContact CG-OD1 3.45Å; Q69-D92 PolarHBondContact NE2-OD1 2.96Å
70	M	93.3	Very high	88.4	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.015	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.4	170.6	-173.6	64.7	69.7	0	0	109.6	V32 I36 L54 F68 V90 F91 V93	V32-M70 HydrophobicContact CG1-CE 4Å; I36-M70 HydrophobicContact CD1-CE 3.83Å; I36-M70 HydrophobicContact CD1-SD 3.85Å; I36-M70 HydrophobicContact CG1-CE 4.15Å; I36-M70 HydrophobicContact CG1-SD 4.1Å; L54-M70 HydrophobicContact CD1-CG 3.77Å; L54-M70 HydrophobicContact CD1-SD 3.63Å; L54-M70 HydrophobicContact CD2-SD 3.8Å; L54-M70 HydrophobicContact CG-CG 4.34Å; L54-M70 HydrophobicContact CG-SD 3.52Å; L54-M70 VanDerWaalsContact CG-SD 3.52Å; F68-M70 HydrophobicContact CE2-CE 3.88Å; M70-V90 CarbonylContact O-C 3.41Å; M70-V90 WeakPolarHBondContact O-CA 3.3Å; M70-F91 HydrophobicContact CB-CB 4.45Å; M70-F91 PolarHBondContact N-O 2.86Å; M70-F91 PolarHBondContact O-N 3.46Å; M70-V93 HydrophobicContact CB-CG2 4.14Å
71	Q	94	Very high	87.8	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	118.9	-176	-66.8	174.5	67.7	0	0	110.5	L54 S55 K88 V89 V90	L54-Q71 WeakPolarHBondContact CA-O 3.5Å; S55-Q71 PolarHBondContact N-O 3.24Å; S55-Q71 PolarHBondContact O-N 3.02Å; Q71-K88 VanDerWaalsContact OE1-CD 3.28Å; Q71-V89 WeakPolarHBondContact CA-O 3.33Å; Q71-V90 HydrophobicContact CG-CB 4.41Å; Q71-V90 HydrophobicContact CG-CG1 3.92Å; Q71-V90 HydrophobicContact CG-CG2 3.92Å
72	M	93.3	Very high	87.5	Confident	13 Å²	13	56 Å²	56	6%	0.064	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115.6	166.7	-179.8	176.8	-71.5	0	0	108.9	A12 I16 F39 M52 L54 F74 K88 V89	A12-M72 HydrophobicContact CB-CE 4.47Å; I16-M72 HydrophobicContact CD1-CE 3.59Å; F39-M72 HydrophobicContact CE2-CE 4.38Å; F39-M72 HydrophobicContact CZ-CE 4.02Å; M52-M72 HydrophobicContact CB-CG 4.46Å; M52-M72 HydrophobicContact SD-CG 4.31Å; M52-M72 HydrophobicContact SD-SD 3.72Å; L54-M72 HydrophobicContact CD1-CB 4.23Å; M72-F74 HydrophobicContact CG-CE2 4.41Å; M72-F74 HydrophobicContact SD-CE2 4.48Å; M72-F74 HydrophobicContact SD-CZ 4.37Å; M72-K88 CarbonylContact O-C 3.49Å; M72-K88 VanDerWaalsContact O-CA 3.25Å; M72-K88 WeakPolarHBondContact O-CA 3.35Å; M72-V89 PolarHBondContact N-O 3.04Å; M72-V89 PolarHBondContact O-N 3.48Å
73	T	93.5	Very high	87.7	Confident	18 Å²	18	55 Å²	55	11%	0.11	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.7	179.6	-54.3	0	0	0	0	109.8	M52 T53 K88	M52-T73 VanDerWaalsContact CA-O 3.24Å; M52-T73 WeakPolarHBondContact CA-O 3.36Å; T53-T73 PolarHBondContact N-O 3.4Å; T53-T73 PolarHBondContact O-N 2.88Å; T73-K88 HydrophobicContact CG2-CG 4.16Å
74	F	91.7	Very high	88.1	Confident	9 Å²	9	52.9 Å²	52.9	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	96.1	172.3	-68.9	-98.6	0	0	0	108.8	M52 M72 N76 G77 A78 I83 G86 Q87 V89	M52-F74 HydrophobicContact CG-CD1 3.82Å; M52-F74 HydrophobicContact CG-CE1 3.93Å; M52-F74 HydrophobicContact CG-CG 4.37Å; M52-F74 HydrophobicContact SD-CD1 4.04Å; M52-F74 HydrophobicContact SD-CE1 3.48Å; M52-F74 WeakPolarHBondContact SD-CE1 3.27Å; M52-F74 HydrophobicContact SD-CZ 3.84Å; M72-F74 HydrophobicContact CG-CE2 4.41Å; M72-F74 HydrophobicContact SD-CE2 4.48Å; M72-F74 HydrophobicContact SD-CZ 4.37Å; F74-N76 PolarHBondContact O-N 2.81Å; F74-G77 PolarHBondContact O-N 2.69Å; F74-G77 VanDerWaalsContact O-N 3.15Å; F74-A78 HydrophobicContact CD1-CB 3.89Å; F74-A78 HydrophobicContact CE1-CB 4.14Å; F74-I83 HydrophobicContact CB-CG2 3.83Å; F74-I83 HydrophobicContact CD1-CD1 4.17Å; F74-I83 HydrophobicContact CD1-CG2 4.33Å; F74-I83 HydrophobicContact CD2-CD1 4.14Å; F74-I83 HydrophobicContact CD2-CG2 3.81Å; F74-I83 HydrophobicContact CE1-CD1 3.8Å; F74-I83 HydrophobicContact CE2-CD1 3.79Å; F74-I83 HydrophobicContact CE2-CG2 4.48Å; F74-I83 HydrophobicContact CG-CD1 4.32Å; F74-I83 HydrophobicContact CG-CG2 3.73Å; F74-I83 HydrophobicContact CZ-CD1 3.6Å; F74-G86 PolarHBondContact O-N 3.31Å; F74-Q87 PolarHBondContact N-O 3.47Å; F74-V89 HydrophobicContact CE2-CG2 4Å
75	D	89.8	Confident	88.4	Confident	48 Å²	48	51.8 Å²	51.8	26%	0.257	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-46.4	-166.5	-59.6	-40.7	0	0	0	111.8	K43 D51 T53	K43-D75 IonicContact NZ-OD2 2.73Å; K43-D75 PolarHBondContact NZ-OD2 3.33Å; D51-D75 HydrophobicContact CB-CB 4.36Å; D51-D75 PolarHBondContact O-N 3.32Å; T53-D75 PolarHBondContact OG1-OD1 3.07Å; T53-D75 PolarHBondContact OG1-OD2 2.98Å
76	N	88.2	Confident	88.6	Confident	110 Å²	110	49.9 Å²	49.9	59%	0.588	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	10.9	176	-68.4	-31.4	0	0	0	112.6	D51 F74	D51-N76 HydrophobicContact CB-CB 4.36Å; D51-N76 PolarHBondContact OD2-ND2 3.38Å; F74-N76 PolarHBondContact O-N 2.81Å
77	G	85.4	Confident	88.8	Confident	7 Å²	7	51.3 Å²	51.3	7%	0.072	28%	0.277	C	S	.	.			trans	73.6	-175.9	-173.2	0	0	0	0	0	112.7	F74 I83	F74-G77 PolarHBondContact O-N 2.69Å; F74-G77 VanDerWaalsContact O-N 3.15Å; G77-I83 CarbonylContact C-O 3.31Å; G77-I83 VanDerWaalsContact CA-O 3.27Å; G77-I83 WeakPolarHBondContact CA-O 3.35Å
78	A	84.1	Confident	88.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-139.8	88.2	170	0	0	0	0	0	107.5	Y50 F74 D80 L81 N82 I83	Y50-A78 HydrophobicContact CD1-CB 3.69Å; Y50-A78 HydrophobicContact CE1-CB 3.77Å; Y50-A78 HydrophobicContact CG-CB 4.14Å; F74-A78 HydrophobicContact CD1-CB 3.89Å; F74-A78 HydrophobicContact CE1-CB 4.14Å; A78-D80 VanDerWaalsContact C-N 3.26Å; A78-D80 PolarHBondContact O-N 2.82Å; A78-L81 HydrophobicContact CB-CB 3.99Å; A78-L81 HydrophobicContact CB-CD1 3.9Å; A78-L81 HydrophobicContact CB-CG 3.99Å; A78-L81 CarbonylContact O-C 3.57Å; A78-L81 WeakPolarHBondContact O-CA 3.39Å; A78-L81 PolarHBondContact O-N 3.02Å; A78-N82 PolarHBondContact O-N 2.89Å; A78-N82 VanDerWaalsContact O-N 3.09Å; A78-I83 CarbonylContact C-O 3.56Å; A78-I83 HydrophobicContact CB-CB 4.11Å; A78-I83 HydrophobicContact CB-CD1 4.34Å; A78-I83 HydrophobicContact CB-CG1 4.49Å; A78-I83 PolarHBondContact N-O 2.81Å; A78-I83 PolarHBondContact O-N 3.42Å
79	P	76	Confident	88.8	Confident	106 Å²	106	48.5 Å²	48.5	69%	0.688	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-55.3	-39.5	-175.3	-27.7	35.4	0	0	0	113.3	L81 N82	P79-L81 PolarHBondContact O-N 2.86Å; P79-L81 VanDerWaalsContact O-N 3.16Å; P79-N82 WeakPolarHBondContact O-CA 3.3Å; P79-N82 PolarHBondContact O-N 3.39Å
80	D	73.6	Confident	88.8	Confident	110 Å²	110	47.3 Å²	47.3	59%	0.588	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-61.8	-22	176.3	-70.6	1.3	0	0	0	113.6	A78	A78-D80 VanDerWaalsContact C-N 3.26Å; A78-D80 PolarHBondContact O-N 2.82Å
81	L	79.1	Confident	88.8	Confident	19 Å²	19	47.4 Å²	47.4	10%	0.099	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-104.2	3.6	176.2	-53	-177	0	0	0	112	K4 S5 Y50 A78 P79 I83	K4-L81 HydrophobicContact CB-CD2 3.42Å; K4-L81 VanDerWaalsContact CB-CD2 3.42Å; K4-L81 WeakPolarHBondContact O-CD2 3.42Å; S5-L81 WeakPolarHBondContact CB-O 3.4Å; Y50-L81 HydrophobicContact CE2-CD1 3.95Å; A78-L81 HydrophobicContact CB-CB 3.99Å; A78-L81 HydrophobicContact CB-CD1 3.9Å; A78-L81 HydrophobicContact CB-CG 3.99Å; A78-L81 CarbonylContact O-C 3.57Å; A78-L81 WeakPolarHBondContact O-CA 3.39Å; A78-L81 PolarHBondContact O-N 3.02Å; P79-L81 PolarHBondContact O-N 2.86Å; P79-L81 VanDerWaalsContact O-N 3.16Å; L81-I83 HydrophobicContact CB-CD1 3.84Å; L81-I83 HydrophobicContact CB-CG1 3.81Å; L81-I83 HydrophobicContact CD1-CD1 4.05Å; L81-I83 PolarHBondContact O-N 2.84Å
82	N	80	Confident	88.9	Confident	139 Å²	139	49.7 Å²	49.7	74%	0.743	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	33.7	-172.5	-160.1	44.2	0	0	0	113.5	A78 P79	A78-N82 PolarHBondContact O-N 2.89Å; A78-N82 VanDerWaalsContact O-N 3.09Å; P79-N82 WeakPolarHBondContact O-CA 3.3Å; P79-N82 PolarHBondContact O-N 3.39Å
83	I	88.7	Confident	88.9	Confident	8 Å²	8	49.1 Å²	49.1	4%	0.041	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-96.9	122.1	176.6	-56.2	178.4	0	0	0	108.3	F74 G77 A78 L81 Q87 L126	F74-I83 HydrophobicContact CB-CG2 3.83Å; F74-I83 HydrophobicContact CD1-CD1 4.17Å; F74-I83 HydrophobicContact CD1-CG2 4.33Å; F74-I83 HydrophobicContact CD2-CD1 4.14Å; F74-I83 HydrophobicContact CD2-CG2 3.81Å; F74-I83 HydrophobicContact CE1-CD1 3.8Å; F74-I83 HydrophobicContact CE2-CD1 3.79Å; F74-I83 HydrophobicContact CE2-CG2 4.48Å; F74-I83 HydrophobicContact CG-CD1 4.32Å; F74-I83 HydrophobicContact CG-CG2 3.73Å; F74-I83 HydrophobicContact CZ-CD1 3.6Å; G77-I83 CarbonylContact C-O 3.31Å; G77-I83 VanDerWaalsContact CA-O 3.27Å; G77-I83 WeakPolarHBondContact CA-O 3.35Å; A78-I83 CarbonylContact C-O 3.56Å; A78-I83 HydrophobicContact CB-CB 4.11Å; A78-I83 HydrophobicContact CB-CD1 4.34Å; A78-I83 HydrophobicContact CB-CG1 4.49Å; A78-I83 PolarHBondContact N-O 2.81Å; A78-I83 PolarHBondContact O-N 3.42Å; L81-I83 HydrophobicContact CB-CD1 3.84Å; L81-I83 HydrophobicContact CB-CG1 3.81Å; L81-I83 HydrophobicContact CD1-CD1 4.05Å; L81-I83 PolarHBondContact O-N 2.84Å; I83-Q87 HydrophobicContact CG2-CB 3.84Å; I83-L126 HydrophobicContact CD1-CD2 4.42Å; I83-L126 HydrophobicContact CG1-CD1 4.07Å; I83-L126 HydrophobicContact CG1-CD2 4.49Å; I83-L126 HydrophobicContact CG2-CD2 4.21Å
84	K	91.1	Very high	88.9	Confident	128 Å²	128	50.1 Å²	50.1	56%	0.557	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-76.9	153.6	177.8	-60.9	174.7	-175.3	169.7	0	110.9	G86 Q87	K84-G86 PolarHBondContact O-N 2.88Å; K84-Q87 HydrophobicContact CB-CG 4.06Å; K84-Q87 WeakPolarHBondContact O-CB 3.29Å; K84-Q87 PolarHBondContact O-N 2.94Å; K84-Q87 VanDerWaalsContact O-N 3.16Å
85	P	93.1	Very high	88.9	Confident	97 Å²	97	50 Å²	50	63%	0.63	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	135.5	172.1	-25.9	33.2	0	0	0	112.9	Q87	P85-Q87 PolarHBondContact O-N 3.4Å
86	G	92.8	Very high	88.9	Confident	42 Å²	42	49.5 Å²	49.5	43%	0.433	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-5.1	179.3	0	0	0	0	0	115.6	F74 K84	F74-G86 PolarHBondContact O-N 3.31Å; K84-G86 PolarHBondContact O-N 2.88Å
87	Q	94.2	Very high	88.7	Confident	31 Å²	31	45 Å²	45	15%	0.145	25%	0.251	C	S	.	.			trans	-66.4	151.6	172	-74.3	-173	-42	0	0	111.1	F74 I83 K84 P85 L126	F74-Q87 PolarHBondContact N-O 3.47Å; I83-Q87 HydrophobicContact CG2-CB 3.84Å; K84-Q87 HydrophobicContact CB-CG 4.06Å; K84-Q87 WeakPolarHBondContact O-CB 3.29Å; K84-Q87 PolarHBondContact O-N 2.94Å; K84-Q87 VanDerWaalsContact O-N 3.16Å; P85-Q87 PolarHBondContact O-N 3.4Å; Q87-L126 HydrophobicContact CB-CD2 4.29Å
88	K	93.7	Very high	88.7	Confident	80 Å²	80	46 Å²	46	35%	0.348	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.5	-169.9	-55.2	-177	176.2	-179.4	0	111.6	Q71 M72 T73 V90 N124	Q71-K88 VanDerWaalsContact OE1-CD 3.28Å; M72-K88 CarbonylContact O-C 3.49Å; M72-K88 VanDerWaalsContact O-CA 3.25Å; M72-K88 WeakPolarHBondContact O-CA 3.35Å; T73-K88 HydrophobicContact CG2-CG 4.16Å; K88-V90 HydrophobicContact CB-CG2 3.99Å; K88-N124 PolarHBondContact O-ND2 2.96Å
89	V	93.6	Very high	88.7	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.9	158.9	-178.3	0	0	0	0	107.1	V9 Q71 M72 F74 F91 L121 L126	V9-V89 HydrophobicContact CG1-CG1 3.87Å; V9-V89 HydrophobicContact CG1-CG2 4.4Å; V9-V89 HydrophobicContact CG2-CG2 4.3Å; Q71-V89 WeakPolarHBondContact CA-O 3.33Å; M72-V89 PolarHBondContact N-O 3.04Å; M72-V89 PolarHBondContact O-N 3.48Å; F74-V89 HydrophobicContact CE2-CG2 4Å; V89-F91 HydrophobicContact CB-CE2 4.47Å; V89-F91 HydrophobicContact CB-CZ 4.46Å; V89-F91 HydrophobicContact CG1-CE1 3.86Å; V89-F91 HydrophobicContact CG1-CE2 3.7Å; V89-F91 HydrophobicContact CG1-CZ 3.33Å; V89-L121 HydrophobicContact CG1-CD1 3.79Å; V89-L126 HydrophobicContact CG2-CD2 3.74Å
90	V	95	Very high	89.1	Confident	13 Å²	13	48.3 Å²	48.3	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.9	-174.2	-172.9	0	0	0	0	109.3	Q69 M70 Q71 K88 V122	Q69-V90 HydrophobicContact CB-CG1 4.26Å; Q69-V90 HydrophobicContact CG-CG1 4.38Å; M70-V90 CarbonylContact O-C 3.41Å; M70-V90 WeakPolarHBondContact O-CA 3.3Å; Q71-V90 HydrophobicContact CG-CB 4.41Å; Q71-V90 HydrophobicContact CG-CG1 3.92Å; Q71-V90 HydrophobicContact CG-CG2 3.92Å; K88-V90 HydrophobicContact CB-CG2 3.99Å; V90-V122 HydrophobicContact CB-CB 3.91Å; V90-V122 HydrophobicContact CB-CG1 4.41Å; V90-V122 HydrophobicContact CB-CG2 4.21Å; V90-V122 HydrophobicContact CG1-CB 4.07Å; V90-V122 HydrophobicContact CG1-CG1 4.47Å; V90-V122 HydrophobicContact CG1-CG2 3.86Å; V90-V122 WeakPolarHBondContact O-CB 3.4Å; V90-V122 PolarHBondContact O-N 3.47Å
91	F	94.6	Very high	89.7	Confident	5 Å²	5	43.1 Å²	43.1	2%	0.022	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.6	179.8	-53.8	-77.1	0	0	0	110.1	L13 Q69 M70 V89 V119 N120 L121	L13-F91 HydrophobicContact CD1-CE1 4Å; L13-F91 HydrophobicContact CD2-CD1 3.34Å; L13-F91 HydrophobicContact CD2-CE1 3.1Å; L13-F91 HydrophobicContact CD2-CE2 4.48Å; L13-F91 HydrophobicContact CD2-CG 4.13Å; L13-F91 HydrophobicContact CD2-CZ 3.73Å; L13-F91 HydrophobicContact CG-CD1 4.29Å; L13-F91 HydrophobicContact CG-CE1 3.57Å; L13-F91 HydrophobicContact CG-CZ 3.98Å; Q69-F91 CarbonylContact C-O 3.54Å; Q69-F91 VanDerWaalsContact CA-O 3.27Å; Q69-F91 WeakPolarHBondContact CA-O 3.19Å; M70-F91 HydrophobicContact CB-CB 4.45Å; M70-F91 PolarHBondContact N-O 2.86Å; M70-F91 PolarHBondContact O-N 3.46Å; V89-F91 HydrophobicContact CB-CE2 4.47Å; V89-F91 HydrophobicContact CB-CZ 4.46Å; V89-F91 HydrophobicContact CG1-CE1 3.86Å; V89-F91 HydrophobicContact CG1-CE2 3.7Å; V89-F91 HydrophobicContact CG1-CZ 3.33Å; F91-V119 HydrophobicContact CB-CG1 3.88Å; F91-V119 HydrophobicContact CD1-CG1 4.33Å; F91-V119 HydrophobicContact CG-CG1 4.34Å; F91-N120 CarbonylContact C-O 3.56Å; F91-N120 WeakPolarHBondContact CA-O 2.94Å; F91-L121 HydrophobicContact CD1-CD1 3.9Å; F91-L121 HydrophobicContact CE1-CD1 3.53Å; F91-L121 HydrophobicContact CZ-CD1 4.37Å
92	D	95.6	Very high	90	Very high	57 Å²	57	45.6 Å²	45.6	31%	0.305	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131	166.1	-74.6	-33.1	0	0	0	108.3	Q69 V119 N120 V122	Q69-D92 WeakPolarHBondContact CG-OD1 3.45Å; Q69-D92 PolarHBondContact NE2-OD1 2.96Å; D92-V119 VanDerWaalsContact O-CA 3.3Å; D92-V119 WeakPolarHBondContact O-CA 3.33Å; D92-N120 PolarHBondContact N-O 2.96Å; D92-N120 PolarHBondContact O-N 3.26Å; D92-V122 HydrophobicContact CB-CG2 4.26Å; D92-V122 VanDerWaalsContact CG-CG2 3.48Å
93	V	93.6	Very high	90.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	116.3	-175.5	-175.2	0	0	0	0	108.6	W17 R67 F68 M70 V95 V119	W17-V93 HydrophobicContact CH2-CB 4.5Å; W17-V93 HydrophobicContact CH2-CG1 3.42Å; W17-V93 VanDerWaalsContact CH2-CG1 3.42Å; W17-V93 HydrophobicContact CH2-CG2 4.44Å; W17-V93 HydrophobicContact CZ2-CB 4.19Å; W17-V93 HydrophobicContact CZ2-CG1 3.44Å; W17-V93 VanDerWaalsContact CZ2-CG1 3.44Å; W17-V93 HydrophobicContact CZ2-CG2 3.69Å; W17-V93 HydrophobicContact CZ3-CG1 4.45Å; R67-V93 WeakPolarHBondContact CA-O 3.17Å; F68-V93 HydrophobicContact CD1-CB 4.4Å; F68-V93 HydrophobicContact CD1-CG1 4.5Å; F68-V93 HydrophobicContact CD2-CB 4.12Å; F68-V93 HydrophobicContact CD2-CG2 4.26Å; F68-V93 HydrophobicContact CE1-CB 4.28Å; F68-V93 HydrophobicContact CE1-CG1 3.95Å; F68-V93 HydrophobicContact CE2-CB 3.98Å; F68-V93 HydrophobicContact CE2-CG1 4.12Å; F68-V93 HydrophobicContact CE2-CG2 4.01Å; F68-V93 HydrophobicContact CG-CB 4.37Å; F68-V93 HydrophobicContact CZ-CB 4.13Å; F68-V93 HydrophobicContact CZ-CG1 3.8Å; F68-V93 PolarHBondContact N-O 3.31Å; F68-V93 PolarHBondContact O-N 3.44Å; M70-V93 HydrophobicContact CB-CG2 4.14Å; V93-V95 HydrophobicContact CG1-CG2 3.72Å; V93-V119 HydrophobicContact CG1-CG2 4.29Å; V93-V119 HydrophobicContact CG2-CG1 4.49Å; V93-V119 HydrophobicContact CG2-CG2 4.43Å
94	D	93.2	Very high	89.7	Confident	39 Å²	39	42.4 Å²	42.4	21%	0.209	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116	172.8	-72.3	-35.9	0	0	0	109.1	R67 A117 K118	R67-D94 WeakPolarHBondContact CG-OD1 3.17Å; R67-D94 IonicContact CZ-OD1 3.61Å; R67-D94 VanDerWaalsContact CZ-OD1 3.23Å; R67-D94 IonicContact CZ-OD2 2.61Å; R67-D94 IonicContact NE-OD1 2.77Å; R67-D94 PolarHBondContact NE-OD1 2.87Å; R67-D94 IonicContact NE-OD2 2.97Å; R67-D94 VanDerWaalsContact NH2-CG 3.28Å; R67-D94 IonicContact NH2-OD1 3.11Å; R67-D94 PolarHBondContact NH2-OD1 2.91Å; R67-D94 IonicContact NH2-OD2 2.6Å; R67-D94 PolarHBondContact NH2-OD2 2.91Å; D94-A117 CarbonylContact O-C 3.5Å; D94-A117 WeakPolarHBondContact O-CA 3.48Å; D94-K118 HydrophobicContact CB-CB 4.35Å; D94-K118 PolarHBondContact N-O 3.43Å; D94-K118 PolarHBondContact O-N 3.27Å
95	V	90.8	Very high	89.2	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.6	-179.4	-171.8	0	0	0	0	109.6	I28 N65 S66 F68 V93 A115 A116 A117	I28-V95 HydrophobicContact CD1-CB 4.43Å; I28-V95 HydrophobicContact CD1-CG1 3.69Å; I28-V95 HydrophobicContact CG1-CG1 4.36Å; N65-V95 CarbonylContact C-O 3.46Å; N65-V95 WeakPolarHBondContact CA-O 3.49Å; N65-V95 WeakPolarHBondContact CB-O 3.39Å; S66-V95 PolarHBondContact N-O 2.98Å; S66-V95 PolarHBondContact O-N 2.88Å; F68-V95 HydrophobicContact CE1-CG2 3.92Å; V93-V95 HydrophobicContact CG1-CG2 3.72Å; V95-A115 HydrophobicContact CG1-CB 4.04Å; V95-A116 CarbonylContact C-O 3.59Å; V95-A116 WeakPolarHBondContact CA-O 3.2Å; V95-A117 HydrophobicContact CG2-CB 4.19Å
96	E	89.7	Confident	88.7	Confident	38 Å²	38	41.6 Å²	41.6	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.4	169.5	-62.5	-169.4	162.9	0	0	110.6	P101 I102 T103 A115 A116	E96-P101 HydrophobicContact CB-CB 3.79Å; E96-P101 VanDerWaalsContact OE2-C 3.31Å; E96-P101 WeakPolarHBondContact OE2-CB 3.49Å; E96-I102 PolarHBondContact OE2-N 3.24Å; E96-T103 VanDerWaalsContact OE1-CB 3.24Å; E96-T103 WeakPolarHBondContact OE1-CB 3.38Å; E96-T103 PolarHBondContact OE1-N 3.42Å; E96-T103 PolarHBondContact OE1-OG1 3.4Å; E96-T103 WeakPolarHBondContact OE2-CB 3.47Å; E96-T103 PolarHBondContact OE2-N 3.27Å; E96-A115 WeakPolarHBondContact O-CA 3.24Å; E96-A115 WeakPolarHBondContact O-CB 3.4Å; E96-A116 HydrophobicContact CB-CB 4.46Å; E96-A116 PolarHBondContact N-O 2.81Å; E96-A116 PolarHBondContact O-N 2.9Å
97	H	86.1	Confident	88.3	Confident	16 Å²	16	46.9 Å²	46.9	7%	0.074	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	142	-175.1	-57.6	-173.9	0	0	0	110.2	I28 G62 F63 F64 S66	I28-H97 WeakPolarHBondContact CD1-CD2 3.47Å; I28-H97 VanDerWaalsContact CD1-NE2 3.29Å; I28-H97 WeakPolarHBondContact CD1-NE2 3.35Å; G62-H97 PolarHBondContact O-CE1 3.44Å; F63-H97 PolarHBondContact O-ND1 3.02Å; F64-H97 PolarHBondContact O-N 2.9Å; S66-H97 PolarHBondContact N-NE2 3.08Å; S66-H97 PolarHBondContact OG-NE2 2.94Å
98	G	83.9	Confident	87.7	Confident	28 Å²	28	48.2 Å²	48.2	29%	0.289	27%	0.27	S	S	.	.	S	Bend	trans	-69.4	175.2	170.9	0	0	0	0	0	114	A113 L114	G98-A113 WeakPolarHBondContact CA-O 3.45Å; G98-L114 VanDerWaalsContact CA-O 3.25Å; G98-L114 WeakPolarHBondContact CA-O 3.38Å; G98-L114 PolarHBondContact N-O 2.83Å
99	P	85	Confident	87.1	Confident	79 Å²	79	47.1 Å²	47.1	51%	0.513	27%	0.268	S	S	.	.	S	Bend	cis	-81.3	-13.6	7.6	31.6	-35.6	0	0	0	114.2	P112 A113 F148	P99-P112 CarbonylContact O-C 3.5Å; P99-P112 WeakPolarHBondContact O-CA 3.29Å; P99-A113 CarbonylContact C-O 3.57Å; P99-A113 VanDerWaalsContact CA-O 3.29Å; P99-A113 WeakPolarHBondContact CA-O 3.37Å; P99-A113 PolarHBondContact O-N 2.84Å; P99-A113 VanDerWaalsContact O-O 3.13Å; P99-F148 HydrophobicContact CB-CE2 4.08Å; P99-F148 HydrophobicContact CB-CZ 3.92Å
100	L	83.8	Confident	86.5	Confident	75 Å²	75	51.9 Å²	51.9	39%	0.393	30%	0.297	S	S	.	.	S	Bend	trans	-129.8	86.8	-176.4	-63.8	171.1	0	0	0	109.5	I102 L105	L100-I102 PolarHBondContact O-N 3.28Å; L100-L105 HydrophobicContact CB-CD1 3.8Å; L100-L105 HydrophobicContact CB-CD2 4.07Å; L100-L105 HydrophobicContact CB-CG 4Å; L100-L105 HydrophobicContact CD1-CD2 4.24Å; L100-L105 HydrophobicContact CD2-CD2 4.22Å; L100-L105 HydrophobicContact CG-CD2 4.41Å
101	P	86	Confident	85.8	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	32%	0.319	C	S	.	.			trans	-51.7	132.4	173.9	-27.7	37.1	0	0	0	111.3	E96 T103 M104 L105 A113 A116	E96-P101 HydrophobicContact CB-CB 3.79Å; E96-P101 VanDerWaalsContact OE2-C 3.31Å; E96-P101 WeakPolarHBondContact OE2-CB 3.49Å; P101-T103 VanDerWaalsContact C-N 3.33Å; P101-T103 PolarHBondContact O-N 2.91Å; P101-M104 HydrophobicContact CB-CB 4.29Å; P101-M104 HydrophobicContact CB-CG 4.01Å; P101-M104 HydrophobicContact CB-SD 4.11Å; P101-M104 HydrophobicContact CG-CG 4.49Å; P101-M104 HydrophobicContact CG-SD 3.93Å; P101-M104 WeakPolarHBondContact O-CB 3.43Å; P101-M104 PolarHBondContact O-N 2.81Å; P101-M104 VanDerWaalsContact O-N 3.12Å; P101-L105 PolarHBondContact O-N 2.74Å; P101-L105 VanDerWaalsContact O-N 3.1Å; P101-A113 HydrophobicContact CG-CB 4.06Å; P101-A116 HydrophobicContact CB-CB 3.84Å; P101-A116 HydrophobicContact CG-CB 3.92Å
102	I	84.8	Confident	85.3	Confident	72 Å²	72	59.2 Å²	59.2	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-41.7	-170.7	-64.4	173.1	0	0	0	111	F64 E96 L100 M104 L105 M106	F64-I102 HydrophobicContact CB-CD1 3.8Å; F64-I102 HydrophobicContact CD1-CD1 4.47Å; F64-I102 HydrophobicContact CD2-CD1 4.49Å; F64-I102 HydrophobicContact CG-CD1 4.03Å; E96-I102 PolarHBondContact OE2-N 3.24Å; L100-I102 PolarHBondContact O-N 3.28Å; I102-M104 PolarHBondContact O-N 3.4Å; I102-L105 WeakPolarHBondContact O-CB 3.42Å; I102-L105 PolarHBondContact O-N 2.91Å; I102-L105 VanDerWaalsContact O-N 3.17Å; I102-M106 HydrophobicContact CG2-CE 4.32Å; I102-M106 HydrophobicContact CG2-CG 4.38Å; I102-M106 HydrophobicContact CG2-SD 4.46Å; I102-M106 WeakPolarHBondContact O-CG 3.35Å; I102-M106 PolarHBondContact O-N 3.15Å
103	T	84.1	Confident	84.8	Confident	57 Å²	57	56.5 Å²	56.5	35%	0.35	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-31.7	179.4	-63.9	0	0	0	0	111.8	E96 P101 H107	E96-T103 VanDerWaalsContact OE1-CB 3.24Å; E96-T103 WeakPolarHBondContact OE1-CB 3.38Å; E96-T103 PolarHBondContact OE1-N 3.42Å; E96-T103 PolarHBondContact OE1-OG1 3.4Å; E96-T103 WeakPolarHBondContact OE2-CB 3.47Å; E96-T103 PolarHBondContact OE2-N 3.27Å; P101-T103 VanDerWaalsContact C-N 3.33Å; P101-T103 PolarHBondContact O-N 2.91Å; T103-H107 PolarHBondContact O-N 3.34Å; T103-H107 PolarHBondContact O-ND1 3.37Å
104	M	79.5	Confident	84.3	Confident	23 Å²	23	57.6 Å²	57.6	11%	0.113	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-43.2	173.5	-65.2	-173.3	69.3	0	0	111.8	P101 I102 M106 H107 G108 N109 A113 A116 R145	P101-M104 HydrophobicContact CB-CB 4.29Å; P101-M104 HydrophobicContact CB-CG 4.01Å; P101-M104 HydrophobicContact CB-SD 4.11Å; P101-M104 HydrophobicContact CG-CG 4.49Å; P101-M104 HydrophobicContact CG-SD 3.93Å; P101-M104 WeakPolarHBondContact O-CB 3.43Å; P101-M104 PolarHBondContact O-N 2.81Å; P101-M104 VanDerWaalsContact O-N 3.12Å; I102-M104 PolarHBondContact O-N 3.4Å; M104-M106 VanDerWaalsContact C-N 3.33Å; M104-M106 PolarHBondContact O-N 3Å; M104-H107 CarbonylContact O-C 3.54Å; M104-H107 PolarHBondContact O-N 2.75Å; M104-G108 PolarHBondContact O-N 2.81Å; M104-N109 CarbonylContact C-O 3.58Å; M104-N109 HydrophobicContact CB-CB 4.27Å; M104-N109 HydrophobicContact CE-CB 4.26Å; M104-N109 WeakPolarHBondContact CE-ND2 3.36Å; M104-N109 WeakPolarHBondContact O-CA 3.19Å; M104-N109 WeakPolarHBondContact O-CB 3.45Å; M104-N109 PolarHBondContact O-N 2.87Å; M104-A113 HydrophobicContact SD-CB 4.23Å; M104-A116 HydrophobicContact SD-CB 4.34Å; M104-R145 HydrophobicContact SD-CG 4.46Å
105	L	81.3	Confident	84	Confident	73 Å²	73	56 Å²	56	38%	0.382	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-42.5	175.6	-71.6	175.8	0	0	0	112.2	L100 P101 I102 H107 G108 V110	L100-L105 HydrophobicContact CB-CD1 3.8Å; L100-L105 HydrophobicContact CB-CD2 4.07Å; L100-L105 HydrophobicContact CB-CG 4Å; L100-L105 HydrophobicContact CD1-CD2 4.24Å; L100-L105 HydrophobicContact CD2-CD2 4.22Å; L100-L105 HydrophobicContact CG-CD2 4.41Å; P101-L105 PolarHBondContact O-N 2.74Å; P101-L105 VanDerWaalsContact O-N 3.1Å; I102-L105 WeakPolarHBondContact O-CB 3.42Å; I102-L105 PolarHBondContact O-N 2.91Å; I102-L105 VanDerWaalsContact O-N 3.17Å; L105-H107 PolarHBondContact O-N 3.19Å; L105-G108 PolarHBondContact O-N 2.92Å; L105-V110 HydrophobicContact CD2-CG1 4.22Å
106	M	81.9	Confident	84	Confident	134 Å²	134	56.3 Å²	56.3	66%	0.66	33%	0.325	S	S	*	.	H	α-helix	trans	-61	-31	177.9	-70.7	-168.5	-63.9	0	0	112.7	I102 M104 G108	I102-M106 HydrophobicContact CG2-CE 4.32Å; I102-M106 HydrophobicContact CG2-CG 4.38Å; I102-M106 HydrophobicContact CG2-SD 4.46Å; I102-M106 WeakPolarHBondContact O-CG 3.35Å; I102-M106 PolarHBondContact O-N 3.15Å; M104-M106 VanDerWaalsContact C-N 3.33Å; M104-M106 PolarHBondContact O-N 3Å; M106-G108 VanDerWaalsContact C-N 3.3Å
107	H	83.9	Confident	84	Confident	153 Å²	153	54.7 Å²	54.7	71%	0.708	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	12.8	175.3	-61.7	135	0	0	0	113.6	T103 M104 L105 N109	T103-H107 PolarHBondContact O-N 3.34Å; T103-H107 PolarHBondContact O-ND1 3.37Å; M104-H107 CarbonylContact O-C 3.54Å; M104-H107 PolarHBondContact O-N 2.75Å; L105-H107 PolarHBondContact O-N 3.19Å; H107-N109 PolarHBondContact O-N 3.5Å
108	G	83	Confident	84.4	Confident	60 Å²	60	57.6 Å²	57.6	62%	0.619	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	8.7	179.5	0	0	0	0	0	114.5	M104 L105 M106 V110	M104-G108 PolarHBondContact O-N 2.81Å; L105-G108 PolarHBondContact O-N 2.92Å; M106-G108 VanDerWaalsContact C-N 3.3Å; G108-V110 PolarHBondContact O-N 2.88Å
109	N	80.1	Confident	84.8	Confident	56 Å²	56	56.4 Å²	56.4	30%	0.299	32%	0.318	S	S	.	.			trans	-89	99.2	177.3	-171	-14	0	0	0	110.2	M104 H107 I111	M104-N109 CarbonylContact C-O 3.58Å; M104-N109 HydrophobicContact CB-CB 4.27Å; M104-N109 HydrophobicContact CE-CB 4.26Å; M104-N109 WeakPolarHBondContact CE-ND2 3.36Å; M104-N109 WeakPolarHBondContact O-CA 3.19Å; M104-N109 WeakPolarHBondContact O-CB 3.45Å; M104-N109 PolarHBondContact O-N 2.87Å; H107-N109 PolarHBondContact O-N 3.5Å; N109-I111 VanDerWaalsContact C-N 3.34Å; N109-I111 VanDerWaalsContact OD1-CB 3.28Å; N109-I111 WeakPolarHBondContact OD1-CB 3.41Å; N109-I111 VanDerWaalsContact OD1-CG1 3.29Å; N109-I111 WeakPolarHBondContact OD1-CG1 3.48Å; N109-I111 PolarHBondContact OD1-N 2.8Å
110	V	81.7	Confident	85.2	Confident	105 Å²	105	53.9 Å²	53.9	64%	0.636	30%	0.3	S	S	*	.			trans	-90.7	8.5	178.7	-62.5	0	0	0	0	113.4	L105 G108 P112	L105-V110 HydrophobicContact CD2-CG1 4.22Å; G108-V110 PolarHBondContact O-N 2.88Å; V110-P112 VanDerWaalsContact O-CD 3.28Å; V110-P112 WeakPolarHBondContact O-CD 3.4Å
111	I	80.4	Confident	85.8	Confident	103 Å²	103	50.8 Å²	50.8	53%	0.528	28%	0.284	S	S	.	.			trans	-71	120.4	179.1	-57.5	174.3	0	0	0	108.6	N109 A113	N109-I111 VanDerWaalsContact C-N 3.34Å; N109-I111 VanDerWaalsContact OD1-CB 3.28Å; N109-I111 WeakPolarHBondContact OD1-CB 3.41Å; N109-I111 VanDerWaalsContact OD1-CG1 3.29Å; N109-I111 WeakPolarHBondContact OD1-CG1 3.48Å; N109-I111 PolarHBondContact OD1-N 2.8Å; I111-A113 PolarHBondContact O-N 2.82Å
112	P	83.8	Confident	86.2	Confident	69 Å²	69	52 Å²	52	45%	0.448	29%	0.292	S	S	.	.			trans	-58	141.8	-180	-25.4	35.1	0	0	0	112.8	P99 V110 R145 F148	P99-P112 CarbonylContact O-C 3.5Å; P99-P112 WeakPolarHBondContact O-CA 3.29Å; V110-P112 VanDerWaalsContact O-CD 3.28Å; V110-P112 WeakPolarHBondContact O-CD 3.4Å; P112-R145 PolarHBondContact O-NH2 3.12Å; P112-F148 HydrophobicContact CB-CD2 4.16Å; P112-F148 HydrophobicContact CB-CE2 3.92Å
113	A	85.2	Confident	86.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.294	C	S	.	.			trans	-137.3	148.9	174.6	0	0	0	0	0	109.2	G98 P99 P101 M104 I111 R145 F146 F148	G98-A113 WeakPolarHBondContact CA-O 3.45Å; P99-A113 CarbonylContact C-O 3.57Å; P99-A113 VanDerWaalsContact CA-O 3.29Å; P99-A113 WeakPolarHBondContact CA-O 3.37Å; P99-A113 PolarHBondContact O-N 2.84Å; P99-A113 VanDerWaalsContact O-O 3.13Å; P101-A113 HydrophobicContact CG-CB 4.06Å; M104-A113 HydrophobicContact SD-CB 4.23Å; I111-A113 PolarHBondContact O-N 2.82Å; A113-R145 HydrophobicContact CB-CG 4.13Å; A113-F146 CarbonylContact C-O 3.38Å; A113-F148 VanDerWaalsContact C-CE2 3.48Å; A113-F148 WeakPolarHBondContact O-CE2 3.42Å
114	L	82.7	Confident	87.2	Confident	23 Å²	23	51.6 Å²	51.6	12%	0.12	29%	0.288	C	S	.	.	S	Bend	trans	-67.8	-42.5	174.7	-73.2	168.4	0	0	0	111.2	Y23 G98 F146 A147 F148	Y23-L114 VanDerWaalsContact CB-CD1 3.41Å; Y23-L114 HydrophobicContact CD2-CD1 4.29Å; Y23-L114 HydrophobicContact CG-CD1 4.04Å; Y23-L114 WeakPolarHBondContact O-CB 3.43Å; Y23-L114 VanDerWaalsContact O-CD2 3.28Å; Y23-L114 WeakPolarHBondContact O-CD2 3.42Å; G98-L114 VanDerWaalsContact CA-O 3.25Å; G98-L114 WeakPolarHBondContact CA-O 3.38Å; G98-L114 PolarHBondContact N-O 2.83Å; L114-F146 HydrophobicContact CB-CB 4.37Å; L114-F146 PolarHBondContact N-O 3.44Å; L114-A147 WeakPolarHBondContact CD1-O 3.2Å; L114-F148 HydrophobicContact CD2-CD1 3.27Å; L114-F148 HydrophobicContact CD2-CD2 4.3Å; L114-F148 HydrophobicContact CD2-CE1 3.28Å; L114-F148 HydrophobicContact CD2-CE2 4.3Å; L114-F148 HydrophobicContact CD2-CG 3.8Å; L114-F148 HydrophobicContact CD2-CZ 3.82Å; L114-F148 HydrophobicContact CG-CB 4.4Å; L114-F148 HydrophobicContact CG-CD1 3.94Å; L114-F148 HydrophobicContact CG-CD2 4.21Å; L114-F148 HydrophobicContact CG-CE1 4.2Å; L114-F148 HydrophobicContact CG-CE2 4.45Å; L114-F148 HydrophobicContact CG-CG 3.93Å; L114-F148 HydrophobicContact CG-CZ 4.44Å
115	A	86.6	Confident	87.8	Confident	5 Å²	5	57.3 Å²	57.3	4%	0.041	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	155.6	174.4	0	0	0	0	0	110	V95 E96 F146	V95-A115 HydrophobicContact CG1-CB 4.04Å; E96-A115 WeakPolarHBondContact O-CA 3.24Å; E96-A115 WeakPolarHBondContact O-CB 3.4Å; A115-F146 HydrophobicContact CB-CD2 4.2Å; A115-F146 PolarHBondContact O-N 3.09Å
116	A	89.8	Confident	88.3	Confident	13 Å²	13	55.7 Å²	55.7	11%	0.107	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.8	161.8	0	0	0	0	0	108	V95 E96 P101 M104 L144	V95-A116 CarbonylContact C-O 3.59Å; V95-A116 WeakPolarHBondContact CA-O 3.2Å; E96-A116 HydrophobicContact CB-CB 4.46Å; E96-A116 PolarHBondContact N-O 2.81Å; E96-A116 PolarHBondContact O-N 2.9Å; P101-A116 HydrophobicContact CB-CB 3.84Å; P101-A116 HydrophobicContact CG-CB 3.92Å; M104-A116 HydrophobicContact SD-CB 4.34Å; A116-L144 CarbonylContact C-O 3.43Å; A116-L144 VanDerWaalsContact CA-O 3.25Å; A116-L144 WeakPolarHBondContact CA-O 3.44Å
117	A	90.7	Very high	88.8	Confident	4 Å²	4	49.4 Å²	49.4	3%	0.033	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146	177.4	0	0	0	0	0	111.5	D94 V95 T143 L144 F146	D94-A117 CarbonylContact O-C 3.5Å; D94-A117 WeakPolarHBondContact O-CA 3.48Å; V95-A117 HydrophobicContact CG2-CB 4.19Å; A117-T143 CarbonylContact O-C 3.54Å; A117-T143 WeakPolarHBondContact O-CA 3.42Å; A117-L144 HydrophobicContact CB-CB 4.29Å; A117-L144 HydrophobicContact CB-CD1 4.41Å; A117-L144 PolarHBondContact N-O 2.83Å; A117-L144 PolarHBondContact O-N 3.22Å; A117-F146 HydrophobicContact CB-CE2 4.49Å
118	K	93.4	Very high	89.3	Confident	77 Å²	77	46.9 Å²	46.9	34%	0.335	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.7	169.6	-179.9	171.6	165.6	140.3	0	108	D94 E141 A142	D94-K118 HydrophobicContact CB-CB 4.35Å; D94-K118 PolarHBondContact N-O 3.43Å; D94-K118 PolarHBondContact O-N 3.27Å; K118-E141 VanDerWaalsContact CE-OE1 3.23Å; K118-E141 WeakPolarHBondContact CE-OE1 3.39Å; K118-E141 WeakPolarHBondContact CE-OE2 3.37Å; K118-E141 HydrophobicContact CG-CG 4.31Å; K118-E141 IonicContact NZ-OE1 3.61Å; K118-E141 PolarHBondContact NZ-OE1 3.16Å; K118-E141 IonicContact NZ-OE2 2.6Å; K118-E141 PolarHBondContact NZ-OE2 3.05Å; K118-A142 CarbonylContact C-O 3.51Å; K118-A142 WeakPolarHBondContact CA-O 3.43Å
119	V	93.7	Very high	89.8	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124	-176.6	-176.7	0	0	0	0	108.7	L13 F91 D92 V93 A142 L144	L13-V119 HydrophobicContact CD2-CG1 3.89Å; F91-V119 HydrophobicContact CB-CG1 3.88Å; F91-V119 HydrophobicContact CD1-CG1 4.33Å; F91-V119 HydrophobicContact CG-CG1 4.34Å; D92-V119 VanDerWaalsContact O-CA 3.3Å; D92-V119 WeakPolarHBondContact O-CA 3.33Å; V93-V119 HydrophobicContact CG1-CG2 4.29Å; V93-V119 HydrophobicContact CG2-CG1 4.49Å; V93-V119 HydrophobicContact CG2-CG2 4.43Å; V119-A142 HydrophobicContact CB-CB 4.27Å; V119-A142 PolarHBondContact N-O 2.8Å; V119-A142 PolarHBondContact O-N 3.05Å; V119-L144 HydrophobicContact CB-CD1 4.43Å; V119-L144 HydrophobicContact CG2-CD1 3.73Å
120	N	94	Very high	90.4	Very high	26 Å²	26	46.4 Å²	46.4	14%	0.139	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.9	178.5	-62.1	-75.1	0	0	0	109.9	F91 D92 E141	F91-N120 CarbonylContact C-O 3.56Å; F91-N120 WeakPolarHBondContact CA-O 2.94Å; D92-N120 PolarHBondContact N-O 2.96Å; D92-N120 PolarHBondContact O-N 3.26Å; N120-E141 WeakPolarHBondContact OD1-CG 3.38Å; N120-E141 PolarHBondContact OD1-OE2 3.36Å
121	L	95.2	Very high	91	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	138.4	168.7	-171	66.3	0	0	0	109.2	V89 F91 T127 L130 F131 P139 V140	V89-L121 HydrophobicContact CG1-CD1 3.79Å; F91-L121 HydrophobicContact CD1-CD1 3.9Å; F91-L121 HydrophobicContact CE1-CD1 3.53Å; F91-L121 HydrophobicContact CZ-CD1 4.37Å; L121-T127 HydrophobicContact CD1-CG2 3.88Å; L121-T127 HydrophobicContact CD2-CG2 4.02Å; L121-T127 HydrophobicContact CG-CG2 4.11Å; L121-L130 HydrophobicContact CD2-CD1 3.82Å; L121-F131 HydrophobicContact CB-CE2 4.42Å; L121-F131 HydrophobicContact CB-CZ 4.23Å; L121-F131 HydrophobicContact CD2-CE2 3.88Å; L121-F131 HydrophobicContact CD2-CZ 4.45Å; L121-F131 HydrophobicContact CG-CE2 4.04Å; L121-F131 HydrophobicContact CG-CZ 4.34Å; L121-F131 WeakPolarHBondContact O-CZ 3.21Å; L121-P139 HydrophobicContact CD2-CG 3.79Å; L121-V140 HydrophobicContact CB-CG2 4.24Å
122	V	95.1	Very high	91.7	Very high	28 Å²	28	42.1 Å²	42.1	17%	0.17	22%	0.223	C	C	.	.			trans	-90.6	134.7	172.1	174.9	0	0	0	0	109.3	V90 D92 N124 T127	V90-V122 HydrophobicContact CB-CB 3.91Å; V90-V122 HydrophobicContact CB-CG1 4.41Å; V90-V122 HydrophobicContact CB-CG2 4.21Å; V90-V122 HydrophobicContact CG1-CB 4.07Å; V90-V122 HydrophobicContact CG1-CG1 4.47Å; V90-V122 HydrophobicContact CG1-CG2 3.86Å; V90-V122 WeakPolarHBondContact O-CB 3.4Å; V90-V122 PolarHBondContact O-N 3.47Å; D92-V122 HydrophobicContact CB-CG2 4.26Å; D92-V122 VanDerWaalsContact CG-CG2 3.48Å; V122-N124 PolarHBondContact O-N 2.9Å; V122-T127 PolarHBondContact O-OG1 3.05Å
123	N	95.1	Very high	92.3	Very high	79 Å²	79	39.3 Å²	39.3	42%	0.422	21%	0.206	S	C	.	.			trans	-76.1	107.3	174	-171.3	-9.1	0	0	0	110.3	Q128 F131	N123-Q128 VanDerWaalsContact OD1-CA 3.29Å; N123-Q128 WeakPolarHBondContact OD1-CA 3.48Å; N123-Q128 WeakPolarHBondContact OD1-CB 3.17Å; N123-F131 VanDerWaalsContact CA-CE2 3.44Å; N123-F131 HydrophobicContact CB-CD1 3.99Å; N123-F131 HydrophobicContact CB-CD2 3.63Å; N123-F131 HydrophobicContact CB-CE1 3.94Å; N123-F131 HydrophobicContact CB-CE2 3.61Å; N123-F131 HydrophobicContact CB-CG 3.85Å; N123-F131 HydrophobicContact CB-CZ 3.77Å
124	N	93.4	Very high	92.8	Very high	40 Å²	40	39.5 Å²	39.5	21%	0.214	21%	0.208	C	C	.	.			trans	-132.4	-179.4	175.1	74.1	11.3	0	0	0	110.2	K88 V122 L126 T127 Q128	K88-N124 PolarHBondContact O-ND2 2.96Å; V122-N124 PolarHBondContact O-N 2.9Å; N124-L126 PolarHBondContact O-N 3.07Å; N124-L126 VanDerWaalsContact O-N 3.09Å; N124-L126 WeakPolarHBondContact OD1-CB 3.16Å; N124-L126 PolarHBondContact OD1-N 3.12Å; N124-T127 PolarHBondContact N-OG1 3.41Å; N124-T127 PolarHBondContact O-N 3.48Å; N124-T127 VanDerWaalsContact O-N 3.11Å; N124-T127 PolarHBondContact OD1-N 2.77Å; N124-T127 PolarHBondContact OD1-OG1 3.43Å; N124-T127 VanDerWaalsContact OD1-OG1 3.14Å; N124-Q128 VanDerWaalsContact O-CB 3.25Å; N124-Q128 WeakPolarHBondContact O-CB 3.24Å; N124-Q128 PolarHBondContact O-N 2.87Å
125	E	92.1	Very high	93.3	Very high	144 Å²	144	46.7 Å²	46.7	67%	0.673	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-37.6	-178.6	-169.6	-171.4	158.8	0	0	113.6
126	L	92.4	Very high	93.6	Very high	39 Å²	39	52.4 Å²	52.4	20%	0.204	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-39.5	-179.2	178	62.2	0	0	0	112.4	I83 Q87 V89 N124	I83-L126 HydrophobicContact CD1-CD2 4.42Å; I83-L126 HydrophobicContact CG1-CD1 4.07Å; I83-L126 HydrophobicContact CG1-CD2 4.49Å; I83-L126 HydrophobicContact CG2-CD2 4.21Å; Q87-L126 HydrophobicContact CB-CD2 4.29Å; V89-L126 HydrophobicContact CG2-CD2 3.74Å; N124-L126 PolarHBondContact O-N 3.07Å; N124-L126 VanDerWaalsContact O-N 3.09Å; N124-L126 WeakPolarHBondContact OD1-CB 3.16Å; N124-L126 PolarHBondContact OD1-N 3.12Å
127	T	93	Very high	93.8	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-12.1	-173.5	59.7	0	0	0	0	113.5	L121 V122 N124 P129 L130 F131	L121-T127 HydrophobicContact CD1-CG2 3.88Å; L121-T127 HydrophobicContact CD2-CG2 4.02Å; L121-T127 HydrophobicContact CG-CG2 4.11Å; V122-T127 PolarHBondContact O-OG1 3.05Å; N124-T127 PolarHBondContact N-OG1 3.41Å; N124-T127 PolarHBondContact O-N 3.48Å; N124-T127 VanDerWaalsContact O-N 3.11Å; N124-T127 PolarHBondContact OD1-N 2.77Å; N124-T127 PolarHBondContact OD1-OG1 3.43Å; N124-T127 VanDerWaalsContact OD1-OG1 3.14Å; T127-P129 VanDerWaalsContact C-N 3.31Å; T127-P129 VanDerWaalsContact O-N 3.17Å; T127-L130 WeakPolarHBondContact O-CA 3.28Å; T127-L130 VanDerWaalsContact O-CB 3.23Å; T127-L130 WeakPolarHBondContact O-CB 3.44Å; T127-L130 PolarHBondContact O-N 3.11Å; T127-F131 WeakPolarHBondContact O-CD2 3.44Å; T127-F131 PolarHBondContact O-N 2.9Å
128	Q	94.3	Very high	93.9	Very high	100 Å²	100	60.7 Å²	60.7	47%	0.467	31%	0.306	S	S	.	.	H	α-helix	trans	-49.3	-41	-179.1	-176.3	-177.4	32.7	0	0	114.1	N123 N124 L130 F131 I132	N123-Q128 VanDerWaalsContact OD1-CA 3.29Å; N123-Q128 WeakPolarHBondContact OD1-CA 3.48Å; N123-Q128 WeakPolarHBondContact OD1-CB 3.17Å; N124-Q128 VanDerWaalsContact O-CB 3.25Å; N124-Q128 WeakPolarHBondContact O-CB 3.24Å; N124-Q128 PolarHBondContact O-N 2.87Å; Q128-L130 PolarHBondContact O-N 3.23Å; Q128-F131 PolarHBondContact O-N 2.83Å; Q128-F131 VanDerWaalsContact O-N 3.13Å; Q128-I132 HydrophobicContact CG-CD1 3.96Å; Q128-I132 HydrophobicContact CG-CG1 4.36Å; Q128-I132 WeakPolarHBondContact O-CG1 3.43Å; Q128-I132 PolarHBondContact O-N 2.81Å
129	P	92.5	Very high	93.9	Very high	76 Å²	76	57.3 Å²	57.3	49%	0.494	29%	0.292	S	S	.	.	H	α-helix	trans	-59.2	-31.2	175.5	-25.5	36.3	0	0	0	113.8	T127 A133	T127-P129 VanDerWaalsContact C-N 3.31Å; T127-P129 VanDerWaalsContact O-N 3.17Å; P129-A133 WeakPolarHBondContact O-CB 3.43Å; P129-A133 PolarHBondContact O-N 2.92Å
130	L	93	Very high	93.9	Very high	30 Å²	30	57.7 Å²	57.7	16%	0.157	29%	0.294	C	S	.	.	H	α-helix	trans	-67.5	-41.5	175.9	-52.5	178.7	0	0	0	111.7	A6 L121 T127 Q128 A133 A134 P139 Y163	A6-L130 HydrophobicContact CB-CD2 4.22Å; L121-L130 HydrophobicContact CD2-CD1 3.82Å; T127-L130 WeakPolarHBondContact O-CA 3.28Å; T127-L130 VanDerWaalsContact O-CB 3.23Å; T127-L130 WeakPolarHBondContact O-CB 3.44Å; T127-L130 PolarHBondContact O-N 3.11Å; Q128-L130 PolarHBondContact O-N 3.23Å; L130-A133 PolarHBondContact O-N 2.8Å; L130-A134 WeakPolarHBondContact O-CB 3.04Å; L130-A134 PolarHBondContact O-N 2.86Å; L130-P139 HydrophobicContact CB-CB 4.3Å; L130-P139 HydrophobicContact CB-CG 4.03Å; L130-Y163 WeakPolarHBondContact CA-OH 3.31Å; L130-Y163 HydrophobicContact CB-CE1 4.44Å; L130-Y163 HydrophobicContact CD2-CD1 4.49Å; L130-Y163 HydrophobicContact CD2-CE1 3.48Å; L130-Y163 VanDerWaalsContact CD2-CE1 3.48Å; L130-Y163 PolarHBondContact O-OH 2.83Å
131	F	95.4	Very high	93.9	Very high	16 Å²	16	59 Å²	59	7%	0.07	30%	0.299	C	S	.	.	H	α-helix	trans	-67.2	-42.4	175.1	-74.6	-95.1	0	0	0	111.7	L121 N123 T127 Q128 A133 A134 K135 N136 K137 P139	L121-F131 HydrophobicContact CB-CE2 4.42Å; L121-F131 HydrophobicContact CB-CZ 4.23Å; L121-F131 HydrophobicContact CD2-CE2 3.88Å; L121-F131 HydrophobicContact CD2-CZ 4.45Å; L121-F131 HydrophobicContact CG-CE2 4.04Å; L121-F131 HydrophobicContact CG-CZ 4.34Å; L121-F131 WeakPolarHBondContact O-CZ 3.21Å; N123-F131 VanDerWaalsContact CA-CE2 3.44Å; N123-F131 HydrophobicContact CB-CD1 3.99Å; N123-F131 HydrophobicContact CB-CD2 3.63Å; N123-F131 HydrophobicContact CB-CE1 3.94Å; N123-F131 HydrophobicContact CB-CE2 3.61Å; N123-F131 HydrophobicContact CB-CG 3.85Å; N123-F131 HydrophobicContact CB-CZ 3.77Å; T127-F131 WeakPolarHBondContact O-CD2 3.44Å; T127-F131 PolarHBondContact O-N 2.9Å; Q128-F131 PolarHBondContact O-N 2.83Å; Q128-F131 VanDerWaalsContact O-N 3.13Å; F131-A133 VanDerWaalsContact C-N 3.32Å; F131-A133 PolarHBondContact O-N 3.02Å; F131-A134 CarbonylContact O-C 3.58Å; F131-A134 VanDerWaalsContact O-C 3.31Å; F131-A134 PolarHBondContact O-N 3.1Å; F131-A134 VanDerWaalsContact O-N 3.16Å; F131-K135 PolarHBondContact O-N 3.1Å; F131-N136 VanDerWaalsContact O-CA 3.28Å; F131-N136 WeakPolarHBondContact O-CA 3.37Å; F131-N136 PolarHBondContact O-N 2.86Å; F131-K137 VanDerWaalsContact CD1-O 3.25Å; F131-K137 WeakPolarHBondContact CD1-O 3.44Å; F131-P139 HydrophobicContact CD2-CG 4.46Å; F131-P139 HydrophobicContact CE2-CG 4.25Å; F131-P139 HydrophobicContact CZ-CG 4.34Å
132	I	95.3	Very high	93.8	Very high	101 Å²	101	58.7 Å²	58.7	52%	0.518	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-46.6	176.9	-68.6	169.2	0	0	0	110.3	Q128 A134 K135	Q128-I132 HydrophobicContact CG-CD1 3.96Å; Q128-I132 HydrophobicContact CG-CG1 4.36Å; Q128-I132 WeakPolarHBondContact O-CG1 3.43Å; Q128-I132 PolarHBondContact O-N 2.81Å; I132-A134 VanDerWaalsContact C-N 3.27Å; I132-A134 PolarHBondContact O-N 2.89Å; I132-K135 PolarHBondContact O-N 2.82Å
133	A	94.8	Very high	93.7	Very high	11 Å²	11	60.3 Å²	60.3	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-37.6	176.6	0	0	0	0	0	112.5	P129 L130 F131 K135 A161 E162 Y163	P129-A133 WeakPolarHBondContact O-CB 3.43Å; P129-A133 PolarHBondContact O-N 2.92Å; L130-A133 PolarHBondContact O-N 2.8Å; F131-A133 VanDerWaalsContact C-N 3.32Å; F131-A133 PolarHBondContact O-N 3.02Å; A133-K135 PolarHBondContact O-N 2.7Å; A133-A161 HydrophobicContact CB-CB 4.2Å; A133-A161 VanDerWaalsContact O-CA 3.31Å; A133-A161 WeakPolarHBondContact O-CA 3.39Å; A133-E162 WeakPolarHBondContact CA-O 3.32Å; A133-E162 WeakPolarHBondContact CB-O 3.41Å; A133-E162 PolarHBondContact O-N 3.27Å; A133-Y163 HydrophobicContact CB-CD1 3.45Å; A133-Y163 VanDerWaalsContact CB-CD1 3.45Å; A133-Y163 HydrophobicContact CB-CD2 4.24Å; A133-Y163 HydrophobicContact CB-CE1 3.15Å; A133-Y163 HydrophobicContact CB-CE2 4.01Å; A133-Y163 HydrophobicContact CB-CG 3.98Å; A133-Y163 VanDerWaalsContact CB-CZ 3.45Å
134	A	95.6	Very high	93.5	Very high	3 Å²	3	56.7 Å²	56.7	3%	0.025	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	23	174.7	0	0	0	0	0	113.8	L130 F131 I132 N136 K137 P139 A161	L130-A134 WeakPolarHBondContact O-CB 3.04Å; L130-A134 PolarHBondContact O-N 2.86Å; F131-A134 CarbonylContact O-C 3.58Å; F131-A134 VanDerWaalsContact O-C 3.31Å; F131-A134 PolarHBondContact O-N 3.1Å; F131-A134 VanDerWaalsContact O-N 3.16Å; I132-A134 VanDerWaalsContact C-N 3.27Å; I132-A134 PolarHBondContact O-N 2.89Å; A134-N136 VanDerWaalsContact C-N 3.29Å; A134-N136 PolarHBondContact O-N 2.82Å; A134-K137 WeakPolarHBondContact O-CB 3.41Å; A134-K137 PolarHBondContact O-N 3.45Å; A134-P139 HydrophobicContact CB-CB 4Å; A134-A161 HydrophobicContact CB-CB 4.47Å
135	K	94.1	Very high	93.2	Very high	175 Å²	175	58 Å²	58	76%	0.761	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	42.2	178.5	-57.6	178	-179	174	0	113.3	F131 I132 A133 K137	F131-K135 PolarHBondContact O-N 3.1Å; I132-K135 PolarHBondContact O-N 2.82Å; A133-K135 PolarHBondContact O-N 2.7Å; K135-K137 PolarHBondContact O-N 3.49Å
136	N	93.6	Very high	92.9	Very high	125 Å²	125	51.4 Å²	51.4	67%	0.668	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	18	-177.3	-57.7	-50.9	0	0	0	115.1	F131 A134	F131-N136 VanDerWaalsContact O-CA 3.28Å; F131-N136 WeakPolarHBondContact O-CA 3.37Å; F131-N136 PolarHBondContact O-N 2.86Å; A134-N136 VanDerWaalsContact C-N 3.29Å; A134-N136 PolarHBondContact O-N 2.82Å
137	K	92.6	Very high	92.5	Very high	149 Å²	149	50.1 Å²	50.1	65%	0.648	26%	0.255	S	S	*	.	S	Bend	trans	-91.3	166.6	167.4	-60.9	-177	179.2	-177.8	0	110.2	F131 A134 K135 P139	F131-K137 VanDerWaalsContact CD1-O 3.25Å; F131-K137 WeakPolarHBondContact CD1-O 3.44Å; A134-K137 WeakPolarHBondContact O-CB 3.41Å; A134-K137 PolarHBondContact O-N 3.45Å; K135-K137 PolarHBondContact O-N 3.49Å; K137-P139 WeakPolarHBondContact O-CD 3.46Å
138	S	93.1	Very high	91.9	Very high	42 Å²	42	55.9 Å²	55.9	29%	0.294	28%	0.28	S	S	.	.			trans	-60	123.3	170.7	-166.3	0	0	0	0	109	V140 A159	S138-V140 VanDerWaalsContact C-N 3.27Å; S138-V140 PolarHBondContact O-N 3.03Å; S138-V140 PolarHBondContact OG-O 3.36Å; S138-A159 VanDerWaalsContact O-CB 3.3Å; S138-A159 WeakPolarHBondContact O-CB 3.38Å
139	P	93.9	Very high	91.1	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.032	30%	0.296	C	S	.	.	S	Bend	trans	-70.9	-27.7	-178.7	27.4	-33.7	0	0	0	112	L121 L130 F131 A134 K137 A159	L121-P139 HydrophobicContact CD2-CG 3.79Å; L130-P139 HydrophobicContact CB-CB 4.3Å; L130-P139 HydrophobicContact CB-CG 4.03Å; F131-P139 HydrophobicContact CD2-CG 4.46Å; F131-P139 HydrophobicContact CE2-CG 4.25Å; F131-P139 HydrophobicContact CZ-CG 4.34Å; A134-P139 HydrophobicContact CB-CB 4Å; K137-P139 WeakPolarHBondContact O-CD 3.46Å; P139-A159 PolarHBondContact O-N 2.74Å
140	V	93.5	Very high	90.4	Very high	11 Å²	11	52.4 Å²	52.4	7%	0.067	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	146.1	178.7	-67.9	0	0	0	0	110.8	L13 L121 S138 L156 D157 V158	L13-V140 HydrophobicContact CD1-CG2 3.7Å; L121-V140 HydrophobicContact CB-CG2 4.24Å; S138-V140 VanDerWaalsContact C-N 3.27Å; S138-V140 PolarHBondContact O-N 3.03Å; S138-V140 PolarHBondContact OG-O 3.36Å; V140-L156 HydrophobicContact CB-CD1 4.05Å; V140-L156 HydrophobicContact CG1-CD1 4.47Å; V140-D157 CarbonylContact C-O 3.54Å; V140-D157 VanDerWaalsContact CA-O 3.27Å; V140-D157 WeakPolarHBondContact CA-O 3.43Å; V140-V158 HydrophobicContact CG1-CG1 4.33Å; V140-V158 HydrophobicContact CG1-CG2 4.37Å
141	E	93.9	Very high	90	Very high	54 Å²	54	53.3 Å²	53.3	25%	0.252	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	127.8	171.9	178.2	173.5	128.1	0	0	108.4	K118 N120 L156 D157	K118-E141 VanDerWaalsContact CE-OE1 3.23Å; K118-E141 WeakPolarHBondContact CE-OE1 3.39Å; K118-E141 WeakPolarHBondContact CE-OE2 3.37Å; K118-E141 HydrophobicContact CG-CG 4.31Å; K118-E141 IonicContact NZ-OE1 3.61Å; K118-E141 PolarHBondContact NZ-OE1 3.16Å; K118-E141 IonicContact NZ-OE2 2.6Å; K118-E141 PolarHBondContact NZ-OE2 3.05Å; N120-E141 WeakPolarHBondContact OD1-CG 3.38Å; N120-E141 PolarHBondContact OD1-OE2 3.36Å; E141-L156 CarbonylContact O-C 3.58Å; E141-L156 WeakPolarHBondContact O-CA 3.48Å; E141-D157 PolarHBondContact N-O 3.23Å; E141-D157 PolarHBondContact O-N 3.21Å
142	A	94	Very high	89.6	Confident	3 Å²	3	53 Å²	53	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.1	176	0	0	0	0	0	110.5	K118 V119 L144 T154 T155 L156	K118-A142 CarbonylContact C-O 3.51Å; K118-A142 WeakPolarHBondContact CA-O 3.43Å; V119-A142 HydrophobicContact CB-CB 4.27Å; V119-A142 PolarHBondContact N-O 2.8Å; V119-A142 PolarHBondContact O-N 3.05Å; A142-L144 HydrophobicContact CB-CD1 4.1Å; A142-T154 HydrophobicContact CB-CG2 4.29Å; A142-T155 CarbonylContact C-O 3.59Å; A142-T155 VanDerWaalsContact CA-O 3.28Å; A142-T155 WeakPolarHBondContact CA-O 3.09Å; A142-L156 HydrophobicContact CB-CD1 3.97Å
143	T	92.9	Very high	89.3	Confident	62 Å²	62	50.1 Å²	50.1	38%	0.38	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.9	171.8	-61.9	0	0	0	0	109	A117 T154 T155	A117-T143 CarbonylContact O-C 3.54Å; A117-T143 WeakPolarHBondContact O-CA 3.42Å; T143-T154 CarbonylContact O-C 3.55Å; T143-T154 VanDerWaalsContact O-CA 3.3Å; T143-T154 WeakPolarHBondContact O-CA 3.38Å; T143-T155 PolarHBondContact N-O 3.27Å; T143-T155 PolarHBondContact O-N 3.04Å
144	L	90	Very high	89.1	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	144.9	-177.6	-58	87.2	0	0	0	110.7	W17 A116 A117 V119 A142 F146 S153 T154	W17-L144 HydrophobicContact CB-CD2 3.25Å; W17-L144 HydrophobicContact CG-CD2 3.91Å; A116-L144 CarbonylContact C-O 3.43Å; A116-L144 VanDerWaalsContact CA-O 3.25Å; A116-L144 WeakPolarHBondContact CA-O 3.44Å; A117-L144 HydrophobicContact CB-CB 4.29Å; A117-L144 HydrophobicContact CB-CD1 4.41Å; A117-L144 PolarHBondContact N-O 2.83Å; A117-L144 PolarHBondContact O-N 3.22Å; V119-L144 HydrophobicContact CB-CD1 4.43Å; V119-L144 HydrophobicContact CG2-CD1 3.73Å; A142-L144 HydrophobicContact CB-CD1 4.1Å; L144-F146 HydrophobicContact CB-CE2 3.93Å; L144-F146 HydrophobicContact CB-CZ 4.05Å; L144-F146 HydrophobicContact CD2-CE2 4.47Å; L144-F146 HydrophobicContact CD2-CZ 3.87Å; L144-S153 CarbonylContact C-O 3.42Å; L144-S153 VanDerWaalsContact CA-O 3.3Å; L144-S153 WeakPolarHBondContact CA-O 3.35Å; L144-T154 HydrophobicContact CD1-CG2 4.42Å; L144-T154 HydrophobicContact CD2-CG2 4.38Å; L144-T154 HydrophobicContact CG-CG2 3.87Å; L144-T154 WeakPolarHBondContact CG-OG1 3.34Å
145	R	87.1	Confident	89.1	Confident	66 Å²	66	51.3 Å²	51.3	25%	0.249	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.6	172.5	180	179.1	172.3	-87.4	-4	109.7	M104 P112 A113 F152 S153	M104-R145 HydrophobicContact SD-CG 4.46Å; P112-R145 PolarHBondContact O-NH2 3.12Å; A113-R145 HydrophobicContact CB-CG 4.13Å; R145-F152 CarbonylContact O-C 3.56Å; R145-F152 WeakPolarHBondContact O-CA 3.36Å; R145-S153 PolarHBondContact N-O 3.42Å; R145-S153 PolarHBondContact O-N 3.32Å
146	F	85.5	Confident	89.2	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.4	177.6	-57	-79.2	0	0	0	109.9	W17 Y23 A113 L114 A115 A117 L144 F152	W17-F146 HydrophobicContact CE3-CZ 4.48Å; Y23-F146 HydrophobicContact CD1-CB 3.79Å; Y23-F146 AromaticContact CD1-CD1 3.95Å; Y23-F146 HydrophobicContact CD1-CD1 3.95Å; Y23-F146 HydrophobicContact CD1-CD2 4.21Å; Y23-F146 AromaticContact CD1-CG 3.71Å; Y23-F146 HydrophobicContact CD1-CG 3.71Å; Y23-F146 HydrophobicContact CE1-CB 3.82Å; Y23-F146 AromaticContact CE1-CD1 3.07Å; Y23-F146 HydrophobicContact CE1-CD1 3.07Å; Y23-F146 AromaticContact CE1-CD2 3.89Å; Y23-F146 HydrophobicContact CE1-CD2 3.89Å; Y23-F146 AromaticContact CE1-CE1 3.46Å; Y23-F146 HydrophobicContact CE1-CE1 3.46Å; Y23-F146 VanDerWaalsContact CE1-CE1 3.46Å; Y23-F146 HydrophobicContact CE1-CE2 4.21Å; Y23-F146 AromaticContact CE1-CG 3.3Å; Y23-F146 HydrophobicContact CE1-CG 3.3Å; Y23-F146 HydrophobicContact CE1-CZ 4.01Å; Y23-F146 HydrophobicContact CE2-CD1 4.45Å; Y23-F146 HydrophobicContact CG-CB 4.43Å; Y23-F146 AromaticContact CZ-CD1 3.37Å; Y23-F146 AromaticContact CZ-CE1 3.73Å; Y23-F146 VanDerWaalsContact OH-CD1 3.26Å; Y23-F146 WeakPolarHBondContact OH-CD1 3.33Å; Y23-F146 VanDerWaalsContact OH-CE1 3.22Å; Y23-F146 WeakPolarHBondContact OH-CE1 3.4Å; A113-F146 CarbonylContact C-O 3.38Å; L114-F146 HydrophobicContact CB-CB 4.37Å; L114-F146 PolarHBondContact N-O 3.44Å; A115-F146 HydrophobicContact CB-CD2 4.2Å; A115-F146 PolarHBondContact O-N 3.09Å; A117-F146 HydrophobicContact CB-CE2 4.49Å; L144-F146 HydrophobicContact CB-CE2 3.93Å; L144-F146 HydrophobicContact CB-CZ 4.05Å; L144-F146 HydrophobicContact CD2-CE2 4.47Å; L144-F146 HydrophobicContact CD2-CZ 3.87Å; F146-F152 HydrophobicContact CD1-CB 3.63Å; F146-F152 HydrophobicContact CE1-CB 3.85Å
147	A	84.9	Confident	89.3	Confident	12 Å²	12	39.8 Å²	39.8	10%	0.099	23%	0.234	C	C	.	.			trans	-88.3	154.5	-179.5	0	0	0	0	0	111.8	L114 G149 G150 S151	L114-A147 WeakPolarHBondContact CD1-O 3.2Å; A147-G149 PolarHBondContact O-N 3.3Å; A147-G149 VanDerWaalsContact O-N 3.11Å; A147-G150 PolarHBondContact O-N 2.78Å; A147-S151 WeakPolarHBondContact CB-OG 3.23Å; A147-S151 PolarHBondContact N-O 2.82Å
148	F	80.8	Confident	89.5	Confident	123 Å²	123	33.4 Å²	33.4	54%	0.539	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.6	175.7	-80.6	-89.5	0	0	0	114	P99 P112 A113 L114 G150	P99-F148 HydrophobicContact CB-CE2 4.08Å; P99-F148 HydrophobicContact CB-CZ 3.92Å; P112-F148 HydrophobicContact CB-CD2 4.16Å; P112-F148 HydrophobicContact CB-CE2 3.92Å; A113-F148 VanDerWaalsContact C-CE2 3.48Å; A113-F148 WeakPolarHBondContact O-CE2 3.42Å; L114-F148 HydrophobicContact CD2-CD1 3.27Å; L114-F148 HydrophobicContact CD2-CD2 4.3Å; L114-F148 HydrophobicContact CD2-CE1 3.28Å; L114-F148 HydrophobicContact CD2-CE2 4.3Å; L114-F148 HydrophobicContact CD2-CG 3.8Å; L114-F148 HydrophobicContact CD2-CZ 3.82Å; L114-F148 HydrophobicContact CG-CB 4.4Å; L114-F148 HydrophobicContact CG-CD1 3.94Å; L114-F148 HydrophobicContact CG-CD2 4.21Å; L114-F148 HydrophobicContact CG-CE1 4.2Å; L114-F148 HydrophobicContact CG-CE2 4.45Å; L114-F148 HydrophobicContact CG-CG 3.93Å; L114-F148 HydrophobicContact CG-CZ 4.44Å; F148-G150 PolarHBondContact O-N 2.89Å
149	G	77.7	Confident	89.7	Confident	79 Å²	79	32.4 Å²	32.4	81%	0.814	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	1.8	176.1	0	0	0	0	0	115.1	A147 S151	A147-G149 PolarHBondContact O-N 3.3Å; A147-G149 VanDerWaalsContact O-N 3.11Å; G149-S151 VanDerWaalsContact C-N 3.32Å
150	G	77.4	Confident	89.8	Confident	24 Å²	24	35 Å²	35	25%	0.247	22%	0.219	C	C	.	.	S	Bend	trans	83.3	1.9	-179	0	0	0	0	0	114.8	A147 F148 G179	A147-G150 PolarHBondContact O-N 2.78Å; F148-G150 PolarHBondContact O-N 2.89Å; G150-G179 WeakPolarHBondContact O-CA 3.18Å; G150-G179 PolarHBondContact O-N 2.83Å
151	S	84.6	Confident	90	Very high	50 Å²	50	34.8 Å²	34.8	35%	0.35	22%	0.218	S	C	.	.			trans	-76.6	151.1	168.3	59.9	0	0	0	0	111.5	A147 G149 G177	A147-S151 WeakPolarHBondContact CB-OG 3.23Å; A147-S151 PolarHBondContact N-O 2.82Å; G149-S151 VanDerWaalsContact C-N 3.32Å; S151-G177 CarbonylContact C-O 3.5Å; S151-G177 WeakPolarHBondContact CA-O 3.28Å; S151-G177 VanDerWaalsContact CB-O 3.28Å; S151-G177 WeakPolarHBondContact CB-O 3.49Å
152	F	85.6	Confident	90.1	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.035	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	155.2	173.5	72.2	-89.7	0	0	0	110.4	R145 F146 N176 G177 L185	R145-F152 CarbonylContact O-C 3.56Å; R145-F152 WeakPolarHBondContact O-CA 3.36Å; F146-F152 HydrophobicContact CD1-CB 3.63Å; F146-F152 HydrophobicContact CE1-CB 3.85Å; F152-N176 WeakPolarHBondContact O-CA 3.23Å; F152-G177 PolarHBondContact N-O 3.05Å; F152-G177 PolarHBondContact O-N 2.85Å; F152-L185 HydrophobicContact CE2-CD1 4.43Å; F152-L185 HydrophobicContact CZ-CD1 4Å
153	S	89.6	Confident	89.8	Confident	41 Å²	41	40.6 Å²	40.6	29%	0.287	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.2	171.5	179.9	0	0	0	0	107.8	L144 R145 F175 N176	L144-S153 CarbonylContact C-O 3.42Å; L144-S153 VanDerWaalsContact CA-O 3.3Å; L144-S153 WeakPolarHBondContact CA-O 3.35Å; R145-S153 PolarHBondContact N-O 3.42Å; R145-S153 PolarHBondContact O-N 3.32Å; S153-F175 CarbonylContact C-O 3.56Å; S153-F175 WeakPolarHBondContact CA-O 3.41Å; S153-N176 WeakPolarHBondContact CA-OD1 3.34Å; S153-N176 WeakPolarHBondContact CB-OD1 3.42Å; S153-N176 PolarHBondContact OG-OD1 3.27Å
154	T	90.8	Very high	89.7	Confident	1 Å²	1	41 Å²	41	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.7	175.4	-57.6	0	0	0	0	108.7	A142 T143 L144 T174 F175	A142-T154 HydrophobicContact CB-CG2 4.29Å; T143-T154 CarbonylContact O-C 3.55Å; T143-T154 VanDerWaalsContact O-CA 3.3Å; T143-T154 WeakPolarHBondContact O-CA 3.38Å; L144-T154 HydrophobicContact CD1-CG2 4.42Å; L144-T154 HydrophobicContact CD2-CG2 4.38Å; L144-T154 HydrophobicContact CG-CG2 3.87Å; L144-T154 WeakPolarHBondContact CG-OG1 3.34Å; T154-T174 CarbonylContact O-C 3.45Å; T154-T174 WeakPolarHBondContact O-CA 3.43Å; T154-F175 HydrophobicContact CG2-CD2 4.31Å; T154-F175 PolarHBondContact N-O 2.84Å; T154-F175 PolarHBondContact O-N 3.03Å
155	T	95.5	Very high	89.9	Confident	38 Å²	38	46.3 Å²	46.3	23%	0.233	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.1	165.5	-57.7	0	0	0	0	108	A142 T143 Q172 F173	A142-T155 CarbonylContact C-O 3.59Å; A142-T155 VanDerWaalsContact CA-O 3.28Å; A142-T155 WeakPolarHBondContact CA-O 3.09Å; T143-T155 PolarHBondContact N-O 3.27Å; T143-T155 PolarHBondContact O-N 3.04Å; T155-Q172 HydrophobicContact CG2-CG 3.6Å; T155-F173 CarbonylContact C-O 3.56Å; T155-F173 WeakPolarHBondContact CA-O 3.34Å
156	L	95.8	Very high	90.3	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107.4	174.3	177.9	74.2	0	0	0	108.4	I10 V140 E141 A142 V158 Q172 F173 F175	I10-L156 HydrophobicContact CG2-CD2 3.76Å; V140-L156 HydrophobicContact CB-CD1 4.05Å; V140-L156 HydrophobicContact CG1-CD1 4.47Å; E141-L156 CarbonylContact O-C 3.58Å; E141-L156 WeakPolarHBondContact O-CA 3.48Å; A142-L156 HydrophobicContact CB-CD1 3.97Å; L156-V158 HydrophobicContact CD2-CG2 4.39Å; L156-V158 HydrophobicContact CG-CG2 4.3Å; L156-Q172 CarbonylContact O-C 3.55Å; L156-Q172 WeakPolarHBondContact O-CA 3.26Å; L156-F173 HydrophobicContact CB-CB 4.29Å; L156-F173 HydrophobicContact CD2-CD2 4.47Å; L156-F173 PolarHBondContact N-O 3.04Å; L156-F173 PolarHBondContact O-N 2.61Å; L156-F175 HydrophobicContact CB-CE2 4.01Å; L156-F175 HydrophobicContact CD2-CE2 4.3Å
157	D	96.7	Very high	90.9	Very high	54 Å²	54	47.8 Å²	47.8	29%	0.289	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.1	172.2	-62.9	-62.8	0	0	0	109.4	V140 E141 Q172	V140-D157 CarbonylContact C-O 3.54Å; V140-D157 VanDerWaalsContact CA-O 3.27Å; V140-D157 WeakPolarHBondContact CA-O 3.43Å; E141-D157 PolarHBondContact N-O 3.23Å; E141-D157 PolarHBondContact O-N 3.21Å; D157-Q172 PolarHBondContact OD1-NE2 3.18Å
158	V	96.2	Very high	91.5	Very high	15 Å²	15	48.7 Å²	48.7	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	119	-178.9	-170.4	0	0	0	0	108.4	V140 L156 F168 G171 F173	V140-V158 HydrophobicContact CG1-CG1 4.33Å; V140-V158 HydrophobicContact CG1-CG2 4.37Å; L156-V158 HydrophobicContact CD2-CG2 4.39Å; L156-V158 HydrophobicContact CG-CG2 4.3Å; V158-F168 HydrophobicContact CG1-CE2 3.63Å; V158-F168 HydrophobicContact CG1-CZ 4.2Å; V158-G171 PolarHBondContact N-O 2.86Å; V158-G171 PolarHBondContact O-N 3.31Å; V158-F173 HydrophobicContact CG2-CD2 3.88Å; V158-F173 HydrophobicContact CG2-CE2 3.85Å
159	A	96.6	Very high	92.3	Very high	22 Å²	22	43.4 Å²	43.4	18%	0.182	28%	0.277	C	S	.	.			trans	-75.3	151.5	178.7	0	0	0	0	0	111.2	S138 P139 A161 F168	S138-A159 VanDerWaalsContact O-CB 3.3Å; S138-A159 WeakPolarHBondContact O-CB 3.38Å; P139-A159 PolarHBondContact O-N 2.74Å; A159-A161 PolarHBondContact O-N 2.81Å; A159-F168 WeakPolarHBondContact O-CE2 3.43Å
160	P	97.9	Very high	93.2	Very high	59 Å²	59	46.3 Å²	46.3	38%	0.383	27%	0.269	S	S	.	.			trans	-59.6	137.4	174.3	-20.9	34.3	0	0	0	110.3	F168 G169 E170	P160-F168 WeakPolarHBondContact CA-O 3.49Å; P160-G169 WeakPolarHBondContact CA-O 3.46Å; P160-E170 HydrophobicContact CG-CB 4.43Å; P160-E170 HydrophobicContact CG-CG 3.41Å; P160-E170 VanDerWaalsContact CG-CG 3.41Å
161	A	96.8	Very high	94.2	Very high	7 Å²	7	45.7 Å²	45.7	6%	0.058	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.9	-175.7	0	0	0	0	0	113.2	A133 A134 A159 Y163 S167 F168	A133-A161 HydrophobicContact CB-CB 4.2Å; A133-A161 VanDerWaalsContact O-CA 3.31Å; A133-A161 WeakPolarHBondContact O-CA 3.39Å; A134-A161 HydrophobicContact CB-CB 4.47Å; A159-A161 PolarHBondContact O-N 2.81Å; A161-Y163 HydrophobicContact CB-CD2 3.96Å; A161-Y163 HydrophobicContact CB-CE2 3.32Å; A161-S167 WeakPolarHBondContact O-CA 3.29Å; A161-S167 WeakPolarHBondContact O-CB 3.23Å; A161-F168 HydrophobicContact CB-CE1 4.13Å; A161-F168 HydrophobicContact CB-CE2 4.21Å; A161-F168 HydrophobicContact CB-CZ 3.75Å; A161-F168 PolarHBondContact N-O 3.28Å; A161-F168 VanDerWaalsContact N-O 3.12Å; A161-F168 PolarHBondContact O-N 2.79Å; A161-F168 VanDerWaalsContact O-N 3.09Å
162	E	96.1	Very high	94.8	Very high	131 Å²	131	48 Å²	48	61%	0.612	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	107.5	175	-174	178.7	169.7	0	0	110.6	A133	A133-E162 WeakPolarHBondContact CA-O 3.32Å; A133-E162 WeakPolarHBondContact CB-O 3.41Å; A133-E162 PolarHBondContact O-N 3.27Å
163	Y	88.1	Confident	95.4	Very high	48 Å²	48	49.3 Å²	49.3	19%	0.188	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	83.6	-179.1	-68	-73.8	0	0	0	111.5	L130 A133 A161 K165 F166 F168	L130-Y163 WeakPolarHBondContact CA-OH 3.31Å; L130-Y163 HydrophobicContact CB-CE1 4.44Å; L130-Y163 HydrophobicContact CD2-CD1 4.49Å; L130-Y163 HydrophobicContact CD2-CE1 3.48Å; L130-Y163 VanDerWaalsContact CD2-CE1 3.48Å; L130-Y163 PolarHBondContact O-OH 2.83Å; A133-Y163 HydrophobicContact CB-CD1 3.45Å; A133-Y163 VanDerWaalsContact CB-CD1 3.45Å; A133-Y163 HydrophobicContact CB-CD2 4.24Å; A133-Y163 HydrophobicContact CB-CE1 3.15Å; A133-Y163 HydrophobicContact CB-CE2 4.01Å; A133-Y163 HydrophobicContact CB-CG 3.98Å; A133-Y163 VanDerWaalsContact CB-CZ 3.45Å; A161-Y163 HydrophobicContact CB-CD2 3.96Å; A161-Y163 HydrophobicContact CB-CE2 3.32Å; Y163-K165 PolarHBondContact O-N 3.21Å; Y163-F166 CarbonylContact C-O 3.46Å; Y163-F166 WeakPolarHBondContact CA-O 3.35Å; Y163-F166 PolarHBondContact N-O 2.79Å; Y163-F166 PolarHBondContact O-N 3.15Å; Y163-F168 AromaticContact CD2-CE1 3.84Å; Y163-F168 HydrophobicContact CD2-CE1 3.84Å; Y163-F168 HydrophobicContact CD2-CZ 4.46Å; Y163-F168 AromaticContact CE2-CE1 3.76Å; Y163-F168 HydrophobicContact CE2-CE1 3.76Å; Y163-F168 AromaticContact CE2-CZ 3.93Å; Y163-F168 HydrophobicContact CE2-CZ 3.93Å
164	G	89.3	Confident	95.7	Very high	70 Å²	70	48.6 Å²	48.6	72%	0.722	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-93.9	177.6	0	0	0	0	0	111.9
165	K	94.3	Very high	95.8	Very high	114 Å²	114	50 Å²	50	50%	0.496	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	1.9	179.3	-73.6	-174.4	175.8	-170.3	0	113.7	I2 Y163 Q197 L198	I2-K165 HydrophobicContact CD1-CB 4.48Å; Y163-K165 PolarHBondContact O-N 3.21Å; K165-Q197 HydrophobicContact CB-CB 4.04Å; K165-Q197 WeakPolarHBondContact CB-O 3.3Å; K165-Q197 WeakPolarHBondContact CD-O 3.25Å; K165-Q197 HydrophobicContact CG-CB 4.29Å; K165-Q197 WeakPolarHBondContact O-CB 3.39Å; K165-Q197 PolarHBondContact O-N 3Å; K165-L198 PolarHBondContact NZ-O 3.42Å
166	F	96	Very high	95.6	Very high	68 Å²	68	50.5 Å²	50.5	30%	0.298	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.6	-177.4	176.8	-110.7	0	0	0	109.5	I2 Y163 F168 I194 V195 L196	I2-F166 HydrophobicContact CD1-CB 4.19Å; Y163-F166 CarbonylContact C-O 3.46Å; Y163-F166 WeakPolarHBondContact CA-O 3.35Å; Y163-F166 PolarHBondContact N-O 2.79Å; Y163-F166 PolarHBondContact O-N 3.15Å; F166-F168 HydrophobicContact CD1-CD1 4.03Å; F166-F168 HydrophobicContact CD1-CE1 4.3Å; F166-F168 AromaticContact CE1-CD1 3.37Å; F166-F168 HydrophobicContact CE1-CD1 3.37Å; F166-F168 AromaticContact CE1-CE1 3.75Å; F166-F168 HydrophobicContact CE1-CE1 3.75Å; F166-F168 HydrophobicContact CE1-CG 4.49Å; F166-F168 AromaticContact CZ-CD1 3.92Å; F166-F168 HydrophobicContact CZ-CD1 3.92Å; F166-I194 HydrophobicContact CE2-CG2 3.61Å; F166-I194 HydrophobicContact CZ-CG2 4.14Å; F166-V195 CarbonylContact C-O 3.56Å; F166-V195 WeakPolarHBondContact CA-O 3.46Å; F166-V195 WeakPolarHBondContact CD2-O 3.45Å; F166-L196 HydrophobicContact CB-CD1 4.39Å; F166-L196 HydrophobicContact CD2-CB 4.5Å; F166-L196 HydrophobicContact CD2-CD1 4.34Å
167	S	97.6	Very high	95.2	Very high	35 Å²	35	50.7 Å²	50.7	25%	0.245	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.9	173.7	66.9	0	0	0	0	111.3	A161 I194 V195	A161-S167 WeakPolarHBondContact O-CA 3.29Å; A161-S167 WeakPolarHBondContact O-CB 3.23Å; S167-I194 WeakPolarHBondContact O-CA 3.44Å; S167-V195 PolarHBondContact N-O 3.32Å; S167-V195 PolarHBondContact O-N 3.13Å; S167-V195 WeakPolarHBondContact OG-CB 3.33Å
168	F	98	Very high	94.3	Very high	32 Å²	32	51.9 Å²	51.9	14%	0.14	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	157	175.9	55.7	-89.1	0	0	0	110.6	V158 A159 P160 A161 Y163 F166 V191 D193 I194	V158-F168 HydrophobicContact CG1-CE2 3.63Å; V158-F168 HydrophobicContact CG1-CZ 4.2Å; A159-F168 WeakPolarHBondContact O-CE2 3.43Å; P160-F168 WeakPolarHBondContact CA-O 3.49Å; A161-F168 HydrophobicContact CB-CE1 4.13Å; A161-F168 HydrophobicContact CB-CE2 4.21Å; A161-F168 HydrophobicContact CB-CZ 3.75Å; A161-F168 PolarHBondContact N-O 3.28Å; A161-F168 VanDerWaalsContact N-O 3.12Å; A161-F168 PolarHBondContact O-N 2.79Å; A161-F168 VanDerWaalsContact O-N 3.09Å; Y163-F168 AromaticContact CD2-CE1 3.84Å; Y163-F168 HydrophobicContact CD2-CE1 3.84Å; Y163-F168 HydrophobicContact CD2-CZ 4.46Å; Y163-F168 AromaticContact CE2-CE1 3.76Å; Y163-F168 HydrophobicContact CE2-CE1 3.76Å; Y163-F168 AromaticContact CE2-CZ 3.93Å; Y163-F168 HydrophobicContact CE2-CZ 3.93Å; F166-F168 HydrophobicContact CD1-CD1 4.03Å; F166-F168 HydrophobicContact CD1-CE1 4.3Å; F166-F168 AromaticContact CE1-CD1 3.37Å; F166-F168 HydrophobicContact CE1-CD1 3.37Å; F166-F168 AromaticContact CE1-CE1 3.75Å; F166-F168 HydrophobicContact CE1-CE1 3.75Å; F166-F168 HydrophobicContact CE1-CG 4.49Å; F166-F168 AromaticContact CZ-CD1 3.92Å; F166-F168 HydrophobicContact CZ-CD1 3.92Å; F168-V191 HydrophobicContact CB-CG1 3.7Å; F168-V191 HydrophobicContact CD2-CG1 3.79Å; F168-V191 HydrophobicContact CG-CG1 4.02Å; F168-D193 WeakPolarHBondContact CA-O 3.36Å; F168-I194 HydrophobicContact CB-CG1 4.23Å
169	G	98	Very high	92.8	Very high	11 Å²	11	52.6 Å²	52.6	11%	0.113	30%	0.295	C	S	.	.			trans	-78.7	-156.2	175.2	0	0	0	0	0	113	P160 E192	P160-G169 WeakPolarHBondContact CA-O 3.46Å; G169-E192 WeakPolarHBondContact CA-O 3.41Å; G169-E192 PolarHBondContact N-O 3.11Å
170	E	96.9	Very high	90.7	Very high	141 Å²	141	54.4 Å²	54.4	66%	0.659	31%	0.306	S	S	*	.			trans	-70.4	151.8	176.9	-64.1	-174	166.3	0	0	110.7	P160 E192	P160-E170 HydrophobicContact CG-CB 4.43Å; P160-E170 HydrophobicContact CG-CG 3.41Å; P160-E170 VanDerWaalsContact CG-CG 3.41Å; E170-E192 PolarHBondContact O-N 2.79Å
171	G	97.9	Very high	89	Confident	11 Å²	11	53.4 Å²	53.4	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.5	173.7	0	0	0	0	0	112.7	V158 K190	V158-G171 PolarHBondContact N-O 2.86Å; V158-G171 PolarHBondContact O-N 3.31Å; G171-K190 CarbonylContact C-O 3.57Å; G171-K190 WeakPolarHBondContact CA-O 3.43Å
172	Q	98.1	Very high	87.6	Confident	97 Å²	97	56.3 Å²	56.3	45%	0.453	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	138.5	175	-174	175.1	91	0	0	109.1	T155 L156 D157 G189 K190	T155-Q172 HydrophobicContact CG2-CG 3.6Å; L156-Q172 CarbonylContact O-C 3.55Å; L156-Q172 WeakPolarHBondContact O-CA 3.26Å; D157-Q172 PolarHBondContact OD1-NE2 3.18Å; Q172-G189 CarbonylContact O-C 3.6Å; Q172-G189 WeakPolarHBondContact O-CA 3.32Å; Q172-K190 PolarHBondContact N-O 2.82Å; Q172-K190 PolarHBondContact O-N 2.86Å
173	F	97.4	Very high	86.4	Confident	36 Å²	36	51.8 Å²	51.8	16%	0.158	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.9	173.4	-61.2	-101.9	0	0	0	109	T155 L156 V158 F175 E188 V191 I211	T155-F173 CarbonylContact C-O 3.56Å; T155-F173 WeakPolarHBondContact CA-O 3.34Å; L156-F173 HydrophobicContact CB-CB 4.29Å; L156-F173 HydrophobicContact CD2-CD2 4.47Å; L156-F173 PolarHBondContact N-O 3.04Å; L156-F173 PolarHBondContact O-N 2.61Å; V158-F173 HydrophobicContact CG2-CD2 3.88Å; V158-F173 HydrophobicContact CG2-CE2 3.85Å; F173-F175 HydrophobicContact CB-CE2 3.62Å; F173-F175 HydrophobicContact CB-CZ 3.89Å; F173-E188 CarbonylContact C-O 3.38Å; F173-E188 VanDerWaalsContact CA-O 3.27Å; F173-E188 WeakPolarHBondContact CA-O 3.37Å; F173-V191 HydrophobicContact CE2-CG2 3.61Å; F173-V191 HydrophobicContact CZ-CG2 3.56Å; F173-I211 HydrophobicContact CD1-CG2 3.95Å; F173-I211 HydrophobicContact CE1-CG2 3.82Å
174	T	95.7	Very high	86.3	Confident	26 Å²	26	50.9 Å²	50.9	16%	0.16	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.1	170.9	73.5	0	0	0	0	109.5	T154 I187 E188	T154-T174 CarbonylContact O-C 3.45Å; T154-T174 WeakPolarHBondContact O-CA 3.43Å; T174-I187 VanDerWaalsContact O-CA 3.29Å; T174-I187 WeakPolarHBondContact O-CA 3.38Å; T174-E188 PolarHBondContact N-O 2.82Å; T174-E188 PolarHBondContact O-N 2.73Å; T174-E188 VanDerWaalsContact O-N 3.13Å
175	F	92.4	Very high	86.3	Confident	31 Å²	31	48.9 Å²	48.9	14%	0.136	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	108.5	176.9	-52.8	-97.4	0	0	0	107.7	A14 S153 T154 L156 F173 L185 D186 I187	A14-F175 HydrophobicContact CB-CD1 3.96Å; A14-F175 HydrophobicContact CB-CD2 3.87Å; A14-F175 HydrophobicContact CB-CE1 4Å; A14-F175 HydrophobicContact CB-CE2 3.91Å; A14-F175 HydrophobicContact CB-CG 3.9Å; A14-F175 HydrophobicContact CB-CZ 3.99Å; S153-F175 CarbonylContact C-O 3.56Å; S153-F175 WeakPolarHBondContact CA-O 3.41Å; T154-F175 HydrophobicContact CG2-CD2 4.31Å; T154-F175 PolarHBondContact N-O 2.84Å; T154-F175 PolarHBondContact O-N 3.03Å; L156-F175 HydrophobicContact CB-CE2 4.01Å; L156-F175 HydrophobicContact CD2-CE2 4.3Å; F173-F175 HydrophobicContact CB-CE2 3.62Å; F173-F175 HydrophobicContact CB-CZ 3.89Å; F175-L185 HydrophobicContact CB-CD1 4.33Å; F175-D186 CarbonylContact C-O 3.51Å; F175-D186 WeakPolarHBondContact CA-O 3.25Å; F175-I187 HydrophobicContact CD1-CB 4.41Å; F175-I187 HydrophobicContact CD1-CD1 4.07Å; F175-I187 HydrophobicContact CD1-CG1 3.9Å; F175-I187 HydrophobicContact CD1-CG2 3.85Å; F175-I187 HydrophobicContact CE1-CD1 4.19Å; F175-I187 HydrophobicContact CE1-CG1 4.37Å; F175-I187 HydrophobicContact CE1-CG2 3.71Å; F175-I187 HydrophobicContact CZ-CG2 4.42Å
176	N	91.7	Very high	86.3	Confident	48 Å²	48	45.4 Å²	45.4	26%	0.257	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132	-176.9	-53.8	-57.1	0	0	0	109.6	F152 S153 L185 D186	F152-N176 WeakPolarHBondContact O-CA 3.23Å; S153-N176 WeakPolarHBondContact CA-OD1 3.34Å; S153-N176 WeakPolarHBondContact CB-OD1 3.42Å; S153-N176 PolarHBondContact OG-OD1 3.27Å; N176-L185 CarbonylContact O-C 3.56Å; N176-L185 WeakPolarHBondContact O-CA 3.34Å; N176-D186 HydrophobicContact CB-CB 4.23Å; N176-D186 PolarHBondContact N-O 2.81Å; N176-D186 PolarHBondContact O-N 2.77Å
177	G	86.6	Confident	86.2	Confident	8 Å²	8	43.7 Å²	43.7	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.2	178.9	0	0	0	0	0	112.1	S151 F152 N184	S151-G177 CarbonylContact C-O 3.5Å; S151-G177 WeakPolarHBondContact CA-O 3.28Å; S151-G177 VanDerWaalsContact CB-O 3.28Å; S151-G177 WeakPolarHBondContact CB-O 3.49Å; F152-G177 PolarHBondContact N-O 3.05Å; F152-G177 PolarHBondContact O-N 2.85Å; G177-N184 VanDerWaalsContact CA-O 3.25Å; G177-N184 WeakPolarHBondContact CA-O 3.24Å
178	D	78.6	Confident	86.2	Confident	79 Å²	79	46.7 Å²	46.7	42%	0.422	26%	0.259	S	S	.	.	S	Bend	trans	-111.7	129.2	171.2	64.3	-5.2	0	0	0	111.1	N184	D178-N184 WeakPolarHBondContact OD1-CB 3.07Å; D178-N184 VanDerWaalsContact OD1-CG 3.22Å; D178-N184 PolarHBondContact OD1-ND2 3Å
179	G	64.6	Low	86.2	Confident	31 Å²	31	45.7 Å²	45.7	32%	0.32	26%	0.258	S	S	.	.	S	Bend	trans	73.7	179.3	-174.3	0	0	0	0	0	113.5	G150 S181	G150-G179 WeakPolarHBondContact O-CA 3.18Å; G150-G179 PolarHBondContact O-N 2.83Å; G179-S181 PolarHBondContact O-N 3.33Å
180	S	53.1	Low	86.3	Confident	59 Å²	59	49.5 Å²	49.5	41%	0.413	27%	0.272	S	S	.	.	S	Bend	trans	-82.4	7.3	-174.5	62.9	0	0	0	0	114	G19	G19-S180 CarbonylContact C-O 3.58Å; G19-S180 VanDerWaalsContact CA-O 3.3Å; G19-S180 WeakPolarHBondContact CA-O 3.41Å
181	S	61.6	Low	86.3	Confident	39 Å²	39	43.4 Å²	43.4	27%	0.273	24%	0.244	S	C	.	.			trans	-104.4	128.8	-179.5	69.5	0	0	0	0	110.5	G179 S183 N184	G179-S181 PolarHBondContact O-N 3.33Å; S181-S183 PolarHBondContact O-N 2.85Å; S181-N184 PolarHBondContact O-N 3.27Å
182	L	66.6	Low	86.3	Confident	67 Å²	67	46.6 Å²	46.6	35%	0.351	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	1.9	169.3	-59.9	167.9	0	0	0	113.2	V15 N184	V15-L182 HydrophobicContact CB-CD1 4.28Å; V15-L182 HydrophobicContact CG1-CD1 3.62Å; V15-L182 HydrophobicContact CG2-CD1 4.28Å; L182-N184 VanDerWaalsContact C-N 3.33Å
183	S	72	Confident	86.4	Confident	36 Å²	36	46.9 Å²	46.9	25%	0.252	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-22	-180	-46.7	0	0	0	0	113.2	S181 R216 L217	S181-S183 PolarHBondContact O-N 2.85Å; S183-R216 CarbonylContact O-C 3.43Å; S183-R216 WeakPolarHBondContact O-CA 3.3Å; S183-L217 PolarHBondContact O-N 2.83Å
184	N	85.2	Confident	86.4	Confident	30 Å²	30	46 Å²	46	16%	0.16	26%	0.258	C	S	.	.	S	Bend	trans	-112.3	99.2	169.7	-67.9	-14	0	0	0	108	G177 D178 S181 L182 A215 R216 L217	G177-N184 VanDerWaalsContact CA-O 3.25Å; G177-N184 WeakPolarHBondContact CA-O 3.24Å; D178-N184 WeakPolarHBondContact OD1-CB 3.07Å; D178-N184 VanDerWaalsContact OD1-CG 3.22Å; D178-N184 PolarHBondContact OD1-ND2 3Å; S181-N184 PolarHBondContact O-N 3.27Å; L182-N184 VanDerWaalsContact C-N 3.33Å; N184-A215 CarbonylContact C-O 3.41Å; N184-A215 WeakPolarHBondContact CA-O 2.99Å; N184-R216 WeakPolarHBondContact OD1-CA 3.19Å; N184-L217 WeakPolarHBondContact OD1-CB 3.47Å; N184-L217 PolarHBondContact OD1-N 3.27Å
185	L	89.8	Confident	86.5	Confident	27 Å²	27	46.5 Å²	46.5	14%	0.141	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	131.2	-172.4	-167.8	64.3	0	0	0	109.7	F152 F175 N176 I187 A215	F152-L185 HydrophobicContact CE2-CD1 4.43Å; F152-L185 HydrophobicContact CZ-CD1 4Å; F175-L185 HydrophobicContact CB-CD1 4.33Å; N176-L185 CarbonylContact O-C 3.56Å; N176-L185 WeakPolarHBondContact O-CA 3.34Å; L185-I187 HydrophobicContact CD2-CD1 3.66Å; L185-I187 HydrophobicContact CD2-CG1 3.85Å; L185-I187 HydrophobicContact CG-CD1 4.15Å; L185-I187 HydrophobicContact CG-CG1 3.75Å; L185-A215 PolarHBondContact N-O 2.86Å; L185-A215 PolarHBondContact O-N 2.84Å
186	D	93.4	Very high	86.8	Confident	42 Å²	42	48.3 Å²	48.3	23%	0.225	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.9	172.7	179.8	-11.4	0	0	0	106.6	F175 N176 S213 L214	F175-D186 CarbonylContact C-O 3.51Å; F175-D186 WeakPolarHBondContact CA-O 3.25Å; N176-D186 HydrophobicContact CB-CB 4.23Å; N176-D186 PolarHBondContact N-O 2.81Å; N176-D186 PolarHBondContact O-N 2.77Å; D186-S213 CarbonylContact C-O 3.58Å; D186-S213 WeakPolarHBondContact CA-O 3.48Å; D186-L214 HydrophobicContact CB-CD1 4Å
187	I	95.3	Very high	87.1	Confident	31 Å²	31	48.7 Å²	48.7	16%	0.159	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.4	-177.4	-47.1	178.7	0	0	0	108.2	T174 F175 L185 D212 S213	T174-I187 VanDerWaalsContact O-CA 3.29Å; T174-I187 WeakPolarHBondContact O-CA 3.38Å; F175-I187 HydrophobicContact CD1-CB 4.41Å; F175-I187 HydrophobicContact CD1-CD1 4.07Å; F175-I187 HydrophobicContact CD1-CG1 3.9Å; F175-I187 HydrophobicContact CD1-CG2 3.85Å; F175-I187 HydrophobicContact CE1-CD1 4.19Å; F175-I187 HydrophobicContact CE1-CG1 4.37Å; F175-I187 HydrophobicContact CE1-CG2 3.71Å; F175-I187 HydrophobicContact CZ-CG2 4.42Å; L185-I187 HydrophobicContact CD2-CD1 3.66Å; L185-I187 HydrophobicContact CD2-CG1 3.85Å; L185-I187 HydrophobicContact CG-CD1 4.15Å; L185-I187 HydrophobicContact CG-CG1 3.75Å; I187-D212 CarbonylContact O-C 3.54Å; I187-D212 VanDerWaalsContact O-CA 3.32Å; I187-D212 WeakPolarHBondContact O-CA 3.43Å; I187-S213 PolarHBondContact N-O 2.6Å; I187-S213 PolarHBondContact O-N 2.85Å
188	E	97.9	Very high	87.5	Confident	98 Å²	98	52.8 Å²	52.8	46%	0.458	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147.2	166.4	-64.3	179.9	-175.5	0	0	108.5	F173 T174 I211	F173-E188 CarbonylContact C-O 3.38Å; F173-E188 VanDerWaalsContact CA-O 3.27Å; F173-E188 WeakPolarHBondContact CA-O 3.37Å; T174-E188 PolarHBondContact N-O 2.82Å; T174-E188 PolarHBondContact O-N 2.73Å; T174-E188 VanDerWaalsContact O-N 3.13Å; E188-I211 CarbonylContact C-O 3.56Å; E188-I211 VanDerWaalsContact CA-O 3.31Å; E188-I211 WeakPolarHBondContact CA-O 3.44Å
189	G	98.1	Very high	88.3	Confident	12 Å²	12	50.9 Å²	50.9	12%	0.124	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	159.4	175.1	0	0	0	0	0	114.4	Q172 T210 I211	Q172-G189 CarbonylContact O-C 3.6Å; Q172-G189 WeakPolarHBondContact O-CA 3.32Å; G189-T210 CarbonylContact O-C 3.57Å; G189-T210 WeakPolarHBondContact O-CA 3.41Å; G189-I211 PolarHBondContact N-O 3.14Å; G189-I211 PolarHBondContact O-N 3.18Å
190	K	98.4	Very high	89.6	Confident	90 Å²	90	55.1 Å²	55.1	39%	0.391	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	141.6	-179.1	-178.2	177.8	170.9	-160.4	0	110.9	G171 Q172 E192 F209 T210	G171-K190 CarbonylContact C-O 3.57Å; G171-K190 WeakPolarHBondContact CA-O 3.43Å; Q172-K190 PolarHBondContact N-O 2.82Å; Q172-K190 PolarHBondContact O-N 2.86Å; K190-E192 WeakPolarHBondContact CE-OE1 3.24Å; K190-E192 IonicContact NZ-OE1 2.86Å; K190-E192 PolarHBondContact NZ-OE1 3.09Å; K190-F209 CarbonylContact C-O 3.56Å; K190-F209 VanDerWaalsContact CA-O 3.23Å; K190-F209 WeakPolarHBondContact CA-O 3.42Å; K190-T210 HydrophobicContact CB-CG2 4.17Å; K190-T210 HydrophobicContact CD-CG2 4.33Å; K190-T210 HydrophobicContact CG-CG2 3.95Å
191	V	98.4	Very high	91.6	Very high	14 Å²	14	56.4 Å²	56.4	9%	0.085	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.9	168.1	177.6	0	0	0	0	108.1	F168 F173 I194 S208 F209	F168-V191 HydrophobicContact CB-CG1 3.7Å; F168-V191 HydrophobicContact CD2-CG1 3.79Å; F168-V191 HydrophobicContact CG-CG1 4.02Å; F173-V191 HydrophobicContact CE2-CG2 3.61Å; F173-V191 HydrophobicContact CZ-CG2 3.56Å; V191-I194 HydrophobicContact CG1-CD1 4.44Å; V191-I194 HydrophobicContact CG1-CG1 4.21Å; V191-S208 CarbonylContact O-C 3.44Å; V191-S208 WeakPolarHBondContact O-CA 3.37Å; V191-S208 WeakPolarHBondContact O-CB 3.45Å; V191-F209 PolarHBondContact N-O 3Å; V191-F209 PolarHBondContact O-N 3.33Å
192	E	98.3	Very high	93.3	Very high	77 Å²	77	57.1 Å²	57.1	36%	0.36	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	166.7	-179.5	-60.7	-166.1	150.8	0	0	113.1	G169 E170 K190 I194 K207	G169-E192 WeakPolarHBondContact CA-O 3.41Å; G169-E192 PolarHBondContact N-O 3.11Å; E170-E192 PolarHBondContact O-N 2.79Å; K190-E192 WeakPolarHBondContact CE-OE1 3.24Å; K190-E192 IonicContact NZ-OE1 2.86Å; K190-E192 PolarHBondContact NZ-OE1 3.09Å; E192-I194 PolarHBondContact O-N 2.85Å; E192-K207 CarbonylContact C-O 3.55Å; E192-K207 WeakPolarHBondContact CA-O 3.27Å
193	D	98.4	Very high	94.7	Very high	103 Å²	103	57.5 Å²	57.5	55%	0.551	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.5	54.5	167.1	-62.4	-33.1	0	0	0	115.1	F168 K207	F168-D193 WeakPolarHBondContact CA-O 3.36Å; D193-K207 PolarHBondContact N-O 3.24Å
194	I	98.6	Very high	96	Very high	18 Å²	18	57.8 Å²	57.8	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.7	-176	-57.2	169.8	0	0	0	109.4	F166 S167 F168 V191 E192 T205 A206 F209 F231	F166-I194 HydrophobicContact CE2-CG2 3.61Å; F166-I194 HydrophobicContact CZ-CG2 4.14Å; S167-I194 WeakPolarHBondContact O-CA 3.44Å; F168-I194 HydrophobicContact CB-CG1 4.23Å; V191-I194 HydrophobicContact CG1-CD1 4.44Å; V191-I194 HydrophobicContact CG1-CG1 4.21Å; E192-I194 PolarHBondContact O-N 2.85Å; I194-T205 CarbonylContact O-C 3.54Å; I194-T205 WeakPolarHBondContact O-CA 3.38Å; I194-A206 HydrophobicContact CB-CB 4.36Å; I194-A206 PolarHBondContact N-O 3.47Å; I194-A206 PolarHBondContact O-N 2.81Å; I194-F209 HydrophobicContact CD1-CB 3.33Å; I194-F231 HydrophobicContact CD1-CD1 4.23Å; I194-F231 HydrophobicContact CD1-CE1 3.88Å
195	V	98.4	Very high	96.6	Very high	36 Å²	36	57.5 Å²	57.5	22%	0.218	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128.3	178.5	-175.6	0	0	0	0	109.7	F166 S167 K203 T205	F166-V195 CarbonylContact C-O 3.56Å; F166-V195 WeakPolarHBondContact CA-O 3.46Å; F166-V195 WeakPolarHBondContact CD2-O 3.45Å; S167-V195 PolarHBondContact N-O 3.32Å; S167-V195 PolarHBondContact O-N 3.13Å; S167-V195 WeakPolarHBondContact OG-CB 3.33Å; V195-K203 HydrophobicContact CG1-CD 4.3Å; V195-T205 HydrophobicContact CB-CG2 4.45Å; V195-T205 HydrophobicContact CG1-CG2 4.14Å; V195-T205 HydrophobicContact CG2-CG2 4.04Å
196	L	98	Very high	97	Very high	69 Å²	69	56.6 Å²	56.6	36%	0.361	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	107.1	170.6	178.9	64.9	0	0	0	109.7	F166 L198 K203 V204	F166-L196 HydrophobicContact CB-CD1 4.39Å; F166-L196 HydrophobicContact CD2-CB 4.5Å; F166-L196 HydrophobicContact CD2-CD1 4.34Å; L196-L198 HydrophobicContact CD2-CD2 3.91Å; L196-L198 HydrophobicContact CG-CD2 4.04Å; L196-K203 CarbonylContact O-C 3.51Å; L196-K203 VanDerWaalsContact O-CA 3.27Å; L196-K203 WeakPolarHBondContact O-CA 3.33Å; L196-V204 PolarHBondContact N-O 2.96Å; L196-V204 PolarHBondContact O-N 3.45Å
197	Q	97.3	Very high	97.3	Very high	56 Å²	56	60.3 Å²	60.3	26%	0.262	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	119.4	171.7	-160.4	73.4	34	0	0	109.6	K165 S199 N202	K165-Q197 HydrophobicContact CB-CB 4.04Å; K165-Q197 WeakPolarHBondContact CB-O 3.3Å; K165-Q197 WeakPolarHBondContact CD-O 3.25Å; K165-Q197 HydrophobicContact CG-CB 4.29Å; K165-Q197 WeakPolarHBondContact O-CB 3.39Å; K165-Q197 PolarHBondContact O-N 3Å; Q197-S199 PolarHBondContact NE2-O 2.84Å; Q197-N202 PolarHBondContact NE2-O 2.98Å
198	L	95.8	Very high	97.5	Very high	95 Å²	95	59.4 Å²	59.4	50%	0.497	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-50.3	176.1	-60.1	174.8	0	0	0	110	K165 L196 N202 V204	K165-L198 PolarHBondContact NZ-O 3.42Å; L196-L198 HydrophobicContact CD2-CD2 3.91Å; L196-L198 HydrophobicContact CG-CD2 4.04Å; L198-N202 HydrophobicContact CB-CB 4.04Å; L198-N202 PolarHBondContact N-O 3.47Å; L198-V204 HydrophobicContact CD1-CG2 4.14Å
199	S	95.1	Very high	97.5	Very high	38 Å²	38	56.7 Å²	56.7	27%	0.266	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	171.4	174.6	79	0	0	0	0	109.5	Q197 M201 N202	Q197-S199 PolarHBondContact NE2-O 2.84Å; S199-M201 PolarHBondContact O-N 2.84Å; S199-M201 PolarHBondContact OG-N 3.42Å; S199-N202 PolarHBondContact N-O 2.84Å; S199-N202 VanDerWaalsContact N-O 3.16Å; S199-N202 PolarHBondContact O-N 3.18Å; S199-N202 VanDerWaalsContact O-N 3.07Å; S199-N202 PolarHBondContact OG-N 2.82Å; S199-N202 PolarHBondContact OG-ND2 2.9Å
200	P	92.8	Very high	97.5	Very high	121 Å²	121	58 Å²	58	79%	0.786	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-27.2	176.7	-28.3	36.4	0	0	0	114.8
201	M	94.1	Very high	97.5	Very high	86 Å²	86	55.8 Å²	55.8	42%	0.424	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-12.3	-178.5	-51.9	-48.6	-74.9	0	0	114	S199 N238 H239	S199-M201 PolarHBondContact O-N 2.84Å; S199-M201 PolarHBondContact OG-N 3.42Å; M201-N238 CarbonylContact O-C 3.53Å; M201-N238 WeakPolarHBondContact O-CA 3.21Å; M201-H239 HydrophobicContact CE-CB 4.05Å; M201-H239 WeakPolarHBondContact CE-CD2 3.45Å; M201-H239 PolarHBondContact O-N 2.99Å
202	N	97	Very high	97.5	Very high	53 Å²	53	58.8 Å²	58.8	28%	0.283	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.4	-174	-65.2	-67	0	0	0	110.7	Q197 L198 S199 I237 N238	Q197-N202 PolarHBondContact NE2-O 2.98Å; L198-N202 HydrophobicContact CB-CB 4.04Å; L198-N202 PolarHBondContact N-O 3.47Å; S199-N202 PolarHBondContact N-O 2.84Å; S199-N202 VanDerWaalsContact N-O 3.16Å; S199-N202 PolarHBondContact O-N 3.18Å; S199-N202 VanDerWaalsContact O-N 3.07Å; S199-N202 PolarHBondContact OG-N 2.82Å; S199-N202 PolarHBondContact OG-ND2 2.9Å; N202-I237 WeakPolarHBondContact CA-O 3.36Å; N202-N238 PolarHBondContact OD1-ND2 3.31Å
203	K	97.3	Very high	97.4	Very high	75 Å²	75	56.1 Å²	56.1	33%	0.326	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.7	170.3	68.7	180	-175.3	178.5	0	111.3	V195 L196 T205 I237	V195-K203 HydrophobicContact CG1-CD 4.3Å; L196-K203 CarbonylContact O-C 3.51Å; L196-K203 VanDerWaalsContact O-CA 3.27Å; L196-K203 WeakPolarHBondContact O-CA 3.33Å; K203-T205 HydrophobicContact CD-CG2 4.25Å; K203-T205 HydrophobicContact CG-CG2 4.44Å; K203-I237 HydrophobicContact CD-CD1 4.33Å; K203-I237 HydrophobicContact CG-CB 3.78Å; K203-I237 HydrophobicContact CG-CD1 4.09Å; K203-I237 HydrophobicContact CG-CG1 4.49Å; K203-I237 HydrophobicContact CG-CG2 4.12Å; K203-I237 PolarHBondContact N-O 2.79Å; K203-I237 PolarHBondContact O-N 3.22Å
204	V	98.4	Very high	97.2	Very high	42 Å²	42	54.1 Å²	54.1	26%	0.255	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.7	168.9	-179.6	0	0	0	0	107.2	L196 L198 I234 N235	L196-V204 PolarHBondContact N-O 2.96Å; L196-V204 PolarHBondContact O-N 3.45Å; L198-V204 HydrophobicContact CD1-CG2 4.14Å; V204-I234 HydrophobicContact CG1-CG2 3.71Å; V204-N235 CarbonylContact C-O 3.55Å; V204-N235 WeakPolarHBondContact CA-O 3.49Å
205	T	98.5	Very high	96.8	Very high	25 Å²	25	54.5 Å²	54.5	15%	0.153	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150	174.6	62.4	0	0	0	0	110.1	I194 V195 K203 I234 N235 I237	I194-T205 CarbonylContact O-C 3.54Å; I194-T205 WeakPolarHBondContact O-CA 3.38Å; V195-T205 HydrophobicContact CB-CG2 4.45Å; V195-T205 HydrophobicContact CG1-CG2 4.14Å; V195-T205 HydrophobicContact CG2-CG2 4.04Å; K203-T205 HydrophobicContact CD-CG2 4.25Å; K203-T205 HydrophobicContact CG-CG2 4.44Å; T205-I234 CarbonylContact O-C 3.49Å; T205-I234 WeakPolarHBondContact O-CA 3.39Å; T205-N235 PolarHBondContact N-O 3.02Å; T205-N235 PolarHBondContact O-N 2.88Å; T205-I237 HydrophobicContact CG2-CD1 4Å
206	A	98.7	Very high	96.4	Very high	8 Å²	8	57.5 Å²	57.5	7%	0.066	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.5	167.1	0	0	0	0	0	108.8	I194 S208 F231 Q233 I234	I194-A206 HydrophobicContact CB-CB 4.36Å; I194-A206 PolarHBondContact N-O 3.47Å; I194-A206 PolarHBondContact O-N 2.81Å; A206-S208 VanDerWaalsContact C-N 3.31Å; A206-S208 PolarHBondContact O-N 2.86Å; A206-F231 HydrophobicContact CB-CD1 4Å; A206-Q233 WeakPolarHBondContact CA-O 3.47Å; A206-I234 HydrophobicContact CB-CG1 4.09Å
207	K	98.7	Very high	95.7	Very high	119 Å²	119	56.8 Å²	56.8	52%	0.517	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-40.1	178.2	177.1	172.7	176.2	179.6	0	111.8	E192 D193 N232 Q233	E192-K207 CarbonylContact C-O 3.55Å; E192-K207 WeakPolarHBondContact CA-O 3.27Å; D193-K207 PolarHBondContact N-O 3.24Å; K207-N232 PolarHBondContact N-O 3.42Å; K207-Q233 HydrophobicContact CB-CB 3.93Å; K207-Q233 PolarHBondContact N-O 2.86Å
208	S	98.6	Very high	94.8	Very high	13 Å²	13	57.3 Å²	57.3	9%	0.091	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	156	176.6	64.4	0	0	0	0	112.5	V191 A206 F231 N232	V191-S208 CarbonylContact O-C 3.44Å; V191-S208 WeakPolarHBondContact O-CA 3.37Å; V191-S208 WeakPolarHBondContact O-CB 3.45Å; A206-S208 VanDerWaalsContact C-N 3.31Å; A206-S208 PolarHBondContact O-N 2.86Å; S208-F231 CarbonylContact O-C 3.47Å; S208-F231 WeakPolarHBondContact O-CA 3.31Å; S208-N232 PolarHBondContact O-N 2.82Å; S208-N232 PolarHBondContact OG-ND2 2.78Å
209	F	98.8	Very high	93.8	Very high	40 Å²	40	58.1 Å²	58.1	18%	0.175	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.4	160	171.8	-103.3	0	0	0	108.3	K190 V191 I194 I211 K230 F231	K190-F209 CarbonylContact C-O 3.56Å; K190-F209 VanDerWaalsContact CA-O 3.23Å; K190-F209 WeakPolarHBondContact CA-O 3.42Å; V191-F209 PolarHBondContact N-O 3Å; V191-F209 PolarHBondContact O-N 3.33Å; I194-F209 HydrophobicContact CD1-CB 3.33Å; F209-I211 HydrophobicContact CE1-CB 4.14Å; F209-I211 HydrophobicContact CE1-CG2 4.41Å; F209-I211 HydrophobicContact CZ-CB 4.22Å; F209-K230 CarbonylContact C-O 3.44Å; F209-K230 VanDerWaalsContact CA-O 3.28Å; F209-K230 WeakPolarHBondContact CA-O 3.4Å; F209-F231 HydrophobicContact CB-CD1 4.02Å; F209-F231 HydrophobicContact CB-CE1 3.85Å; F209-F231 HydrophobicContact CB-CZ 4.41Å; F209-F231 HydrophobicContact CD2-CD1 4.02Å; F209-F231 AromaticContact CD2-CD2 3.83Å; F209-F231 HydrophobicContact CD2-CD2 3.83Å; F209-F231 AromaticContact CD2-CE1 3.71Å; F209-F231 HydrophobicContact CD2-CE1 3.71Å; F209-F231 AromaticContact CD2-CE2 3.5Å; F209-F231 HydrophobicContact CD2-CE2 3.5Å; F209-F231 HydrophobicContact CD2-CG 4.07Å; F209-F231 AromaticContact CD2-CZ 3.44Å; F209-F231 HydrophobicContact CD2-CZ 3.44Å; F209-F231 VanDerWaalsContact CD2-CZ 3.44Å; F209-F231 HydrophobicContact CE2-CD2 4.3Å; F209-F231 AromaticContact CE2-CE2 3.78Å; F209-F231 HydrophobicContact CE2-CE2 3.78Å; F209-F231 AromaticContact CE2-CZ 3.98Å; F209-F231 HydrophobicContact CE2-CZ 3.98Å; F209-F231 HydrophobicContact CG-CD1 4.49Å; F209-F231 HydrophobicContact CG-CE1 4.11Å; F209-F231 HydrophobicContact CG-CZ 4.17Å
210	T	98.7	Very high	92.5	Very high	41 Å²	41	65.5 Å²	65.5	25%	0.252	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.7	170.4	57.3	0	0	0	0	110.4	G189 K190 S229 K230	G189-T210 CarbonylContact O-C 3.57Å; G189-T210 WeakPolarHBondContact O-CA 3.41Å; K190-T210 HydrophobicContact CB-CG2 4.17Å; K190-T210 HydrophobicContact CD-CG2 4.33Å; K190-T210 HydrophobicContact CG-CG2 3.95Å; T210-S229 CarbonylContact O-C 3.48Å; T210-S229 VanDerWaalsContact O-CA 3.31Å; T210-S229 WeakPolarHBondContact O-CA 3.34Å; T210-K230 PolarHBondContact N-O 3.03Å; T210-K230 PolarHBondContact O-N 2.93Å
211	I	98.4	Very high	91.6	Very high	43 Å²	43	64.2 Å²	64.2	22%	0.221	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.1	169.4	-172.3	166.5	0	0	0	108.8	F173 E188 G189 F209 E228	F173-I211 HydrophobicContact CD1-CG2 3.95Å; F173-I211 HydrophobicContact CE1-CG2 3.82Å; E188-I211 CarbonylContact C-O 3.56Å; E188-I211 VanDerWaalsContact CA-O 3.31Å; E188-I211 WeakPolarHBondContact CA-O 3.44Å; G189-I211 PolarHBondContact N-O 3.14Å; G189-I211 PolarHBondContact O-N 3.18Å; F209-I211 HydrophobicContact CE1-CB 4.14Å; F209-I211 HydrophobicContact CE1-CG2 4.41Å; F209-I211 HydrophobicContact CZ-CB 4.22Å; I211-E228 CarbonylContact C-O 3.59Å; I211-E228 WeakPolarHBondContact CA-O 3.09Å
212	D	98.1	Very high	90.7	Very high	77 Å²	77	63.1 Å²	63.1	41%	0.412	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.2	170	-172.1	-62.9	0	0	0	106	I187 S227 E228	I187-D212 CarbonylContact O-C 3.54Å; I187-D212 VanDerWaalsContact O-CA 3.32Å; I187-D212 WeakPolarHBondContact O-CA 3.43Å; D212-S227 CarbonylContact O-C 3.47Å; D212-S227 WeakPolarHBondContact O-CA 3.31Å; D212-S227 PolarHBondContact O-OG 3.35Å; D212-E228 PolarHBondContact N-O 2.89Å; D212-E228 PolarHBondContact O-N 3.05Å; D212-E228 VanDerWaalsContact O-O 3.13Å
213	S	96.2	Very high	90	Very high	21 Å²	21	63.6 Å²	63.6	15%	0.147	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	125.3	-179.1	-175.3	0	0	0	0	110.7	D186 I187 E226 S227	D186-S213 CarbonylContact C-O 3.58Å; D186-S213 WeakPolarHBondContact CA-O 3.48Å; I187-S213 PolarHBondContact N-O 2.6Å; I187-S213 PolarHBondContact O-N 2.85Å; S213-E226 CarbonylContact C-O 3.57Å; S213-E226 WeakPolarHBondContact CA-O 3.37Å; S213-S227 WeakPolarHBondContact OG-CB 3.41Å
214	L	93.9	Very high	89.7	Confident	61 Å²	61	61.2 Å²	61.2	32%	0.319	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.4	174.3	-175.6	66.4	0	0	0	109.6	D186 R216 G225 E226	D186-L214 HydrophobicContact CB-CD1 4Å; L214-R216 VanDerWaalsContact CD1-CZ 3.45Å; L214-G225 CarbonylContact O-C 3.52Å; L214-G225 WeakPolarHBondContact O-CA 3.48Å; L214-E226 PolarHBondContact N-O 2.96Å; L214-E226 PolarHBondContact O-N 3.1Å
215	A	91.2	Very high	89.4	Confident	25 Å²	25	60.5 Å²	60.5	21%	0.207	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.8	173	0	0	0	0	0	110.9	N184 L185 V224	N184-A215 CarbonylContact C-O 3.41Å; N184-A215 WeakPolarHBondContact CA-O 2.99Å; L185-A215 PolarHBondContact N-O 2.86Å; L185-A215 PolarHBondContact O-N 2.84Å; A215-V224 CarbonylContact C-O 3.54Å; A215-V224 WeakPolarHBondContact CA-O 3.36Å
216	R	88.1	Confident	89.3	Confident	99 Å²	99	64.2 Å²	64.2	37%	0.374	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.4	175.8	-66	-65.6	-177.8	-105	5.9	110.8	S183 N184 L214 E218 P223 V224	S183-R216 CarbonylContact O-C 3.43Å; S183-R216 WeakPolarHBondContact O-CA 3.3Å; N184-R216 WeakPolarHBondContact OD1-CA 3.19Å; L214-R216 VanDerWaalsContact CD1-CZ 3.45Å; R216-E218 PolarHBondContact O-N 3.33Å; R216-P223 CarbonylContact O-C 3.39Å; R216-P223 WeakPolarHBondContact O-CA 3.18Å; R216-V224 PolarHBondContact N-O 3.29Å; R216-V224 PolarHBondContact O-N 3.48Å
217	L	84.2	Confident	89.2	Confident	54 Å²	54	65.3 Å²	65.3	28%	0.283	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	113.3	175.1	-171	60.8	0	0	0	110.2	S183 N184 K220	S183-L217 PolarHBondContact O-N 2.83Å; N184-L217 WeakPolarHBondContact OD1-CB 3.47Å; N184-L217 PolarHBondContact OD1-N 3.27Å; L217-K220 HydrophobicContact CD2-CB 4.48Å
218	E	78.4	Confident	89.2	Confident	68 Å²	68	63.2 Å²	63.2	32%	0.318	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.3	175.6	-158.8	-179.7	163.4	0	0	110.9	R216 K220 K221 F222 V224 R257	R216-E218 PolarHBondContact O-N 3.33Å; E218-K220 PolarHBondContact O-N 3.04Å; E218-K221 PolarHBondContact O-N 3.42Å; E218-F222 PolarHBondContact N-O 2.93Å; E218-V224 HydrophobicContact CB-CG1 4.43Å; E218-V224 HydrophobicContact CB-CG2 3.92Å; E218-R257 VanDerWaalsContact CD-CD 3.48Å; E218-R257 WeakPolarHBondContact OE1-CD 3.4Å; E218-R257 IonicContact OE1-NH1 3.78Å; E218-R257 PolarHBondContact OE1-NH1 2.7Å; E218-R257 WeakPolarHBondContact OE2-CB 3.49Å
219	E	74.1	Confident	89.2	Confident	112 Å²	112	64 Å²	64	52%	0.523	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	22.6	-179.5	-69.2	-170	179.7	0	0	116.1	K221 R257	E219-K221 HydrophobicContact CB-CG 4.48Å; E219-K221 PolarHBondContact O-N 2.97Å; E219-R257 VanDerWaalsContact CD-CZ 3.44Å; E219-R257 IonicContact OE1-CZ 2.71Å; E219-R257 VanDerWaalsContact OE1-CZ 3.29Å; E219-R257 IonicContact OE1-NH1 3.23Å; E219-R257 PolarHBondContact OE1-NH1 3.31Å; E219-R257 IonicContact OE1-NH2 2.93Å; E219-R257 PolarHBondContact OE1-NH2 2.8Å; E219-R257 IonicContact OE2-CZ 2.7Å; E219-R257 IonicContact OE2-NH1 3.54Å; E219-R257 PolarHBondContact OE2-NH1 2.86Å; E219-R257 IonicContact OE2-NH2 2.64Å; E219-R257 PolarHBondContact OE2-NH2 2.88Å
220	K	68.5	Low	89.2	Confident	192 Å²	192	64.7 Å²	64.7	84%	0.835	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	20.5	-173.5	-52	179.6	178.7	179.2	0	114.3	L217 E218	L217-K220 HydrophobicContact CD2-CB 4.48Å; E218-K220 PolarHBondContact O-N 3.04Å
221	K	73.7	Confident	89.2	Confident	94 Å²	94	66 Å²	66	41%	0.409	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-59.8	-178.6	-62.4	-174.1	-175.9	175.2	0	112.3	E218 E219 D262	E218-K221 PolarHBondContact O-N 3.42Å; E219-K221 HydrophobicContact CB-CG 4.48Å; E219-K221 PolarHBondContact O-N 2.97Å; K221-D262 IonicContact NZ-OD1 2.66Å; K221-D262 PolarHBondContact NZ-OD1 2.86Å; K221-D262 IonicContact NZ-OD2 2.79Å; K221-D262 PolarHBondContact NZ-OD2 3.38Å
222	F	76.1	Confident	89.2	Confident	63 Å²	63	65.7 Å²	65.7	28%	0.276	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	146.5	-173.6	-50.9	-76.6	0	0	0	111.5	E218 P296	E218-F222 PolarHBondContact N-O 2.93Å; F222-P296 HydrophobicContact CD1-CB 3.87Å; F222-P296 HydrophobicContact CD1-CG 4.09Å; F222-P296 HydrophobicContact CD2-CB 4.15Å; F222-P296 HydrophobicContact CD2-CG 3.47Å; F222-P296 VanDerWaalsContact CD2-CG 3.47Å; F222-P296 HydrophobicContact CE1-CB 3.89Å; F222-P296 HydrophobicContact CE1-CG 3.97Å; F222-P296 HydrophobicContact CE2-CB 4.17Å; F222-P296 HydrophobicContact CE2-CG 3.34Å; F222-P296 HydrophobicContact CG-CB 4.01Å; F222-P296 HydrophobicContact CG-CG 3.86Å; F222-P296 HydrophobicContact CZ-CB 4.06Å; F222-P296 HydrophobicContact CZ-CG 3.63Å
223	P	81.7	Confident	89.2	Confident	64 Å²	64	66.4 Å²	66.4	42%	0.416	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	134.1	171.3	30.1	-32.7	0	0	0	110.5	R216	R216-P223 CarbonylContact O-C 3.39Å; R216-P223 WeakPolarHBondContact O-CA 3.18Å
224	V	89.9	Confident	89.3	Confident	24 Å²	24	66.3 Å²	66.3	15%	0.145	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	161.8	170.7	-62.9	0	0	0	0	108.5	A215 R216 E218 L255	A215-V224 CarbonylContact C-O 3.54Å; A215-V224 WeakPolarHBondContact CA-O 3.36Å; R216-V224 PolarHBondContact N-O 3.29Å; R216-V224 PolarHBondContact O-N 3.48Å; E218-V224 HydrophobicContact CB-CG1 4.43Å; E218-V224 HydrophobicContact CB-CG2 3.92Å; V224-L255 WeakPolarHBondContact CB-O 3.47Å
225	G	93.2	Very high	89.5	Confident	27 Å²	27	65.1 Å²	65.1	28%	0.278	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	152.8	-167.2	-176	0	0	0	0	0	114.6	L214 R254 L255	L214-G225 CarbonylContact O-C 3.52Å; L214-G225 WeakPolarHBondContact O-CA 3.48Å; G225-R254 CarbonylContact O-C 3.54Å; G225-R254 WeakPolarHBondContact O-CA 3.47Å; G225-L255 PolarHBondContact N-O 2.77Å; G225-L255 PolarHBondContact O-N 2.82Å
226	E	96.4	Very high	89.9	Confident	103 Å²	103	67.1 Å²	67.1	48%	0.481	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.4	-179.1	62.9	-168.1	-177.2	0	0	111.3	S213 L214 T253	S213-E226 CarbonylContact C-O 3.57Å; S213-E226 WeakPolarHBondContact CA-O 3.37Å; L214-E226 PolarHBondContact N-O 2.96Å; L214-E226 PolarHBondContact O-N 3.1Å; E226-T253 CarbonylContact C-O 3.59Å; E226-T253 VanDerWaalsContact CA-O 3.25Å; E226-T253 WeakPolarHBondContact CA-O 3.43Å
227	S	96.7	Very high	90.3	Very high	31 Å²	31	63.3 Å²	63.3	22%	0.217	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.4	172.3	-179.8	0	0	0	0	109.8	D212 S213 K252 T253	D212-S227 CarbonylContact O-C 3.47Å; D212-S227 WeakPolarHBondContact O-CA 3.31Å; D212-S227 PolarHBondContact O-OG 3.35Å; S213-S227 WeakPolarHBondContact OG-CB 3.41Å; S227-K252 CarbonylContact O-C 3.53Å; S227-K252 VanDerWaalsContact O-CA 3.25Å; S227-K252 WeakPolarHBondContact O-CA 3.39Å; S227-T253 PolarHBondContact N-O 3.49Å; S227-T253 PolarHBondContact O-N 2.8Å
228	E	98.5	Very high	90.9	Very high	75 Å²	75	63.3 Å²	63.3	35%	0.35	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.7	170.9	-176.9	175.7	119.1	0	0	108.9	I211 D212 V250 K252	I211-E228 CarbonylContact C-O 3.59Å; I211-E228 WeakPolarHBondContact CA-O 3.09Å; D212-E228 PolarHBondContact N-O 2.89Å; D212-E228 PolarHBondContact O-N 3.05Å; D212-E228 VanDerWaalsContact O-O 3.13Å; E228-V250 HydrophobicContact CG-CG1 3.47Å; E228-V250 VanDerWaalsContact CG-CG1 3.47Å; E228-K252 HydrophobicContact CB-CG 4.36Å; E228-K252 HydrophobicContact CG-CG 4.06Å; E228-K252 WeakPolarHBondContact OE2-CE 3.43Å
229	S	98.5	Very high	91.6	Very high	31 Å²	31	65.7 Å²	65.7	22%	0.217	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.9	168.2	62.1	0	0	0	0	109.2	T210 V250 A251	T210-S229 CarbonylContact O-C 3.48Å; T210-S229 VanDerWaalsContact O-CA 3.31Å; T210-S229 WeakPolarHBondContact O-CA 3.34Å; S229-V250 CarbonylContact O-C 3.45Å; S229-V250 WeakPolarHBondContact O-CA 3.34Å; S229-A251 PolarHBondContact N-O 2.99Å; S229-A251 PolarHBondContact O-N 3.16Å; S229-A251 PolarHBondContact OG-O 2.97Å
230	K	98.7	Very high	92.5	Very high	53 Å²	53	63.7 Å²	63.7	23%	0.23	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	122.9	-169.3	179.6	176	-165.4	-171.5	0	111.7	F209 T210 N232 A248 F249 V250	F209-K230 CarbonylContact C-O 3.44Å; F209-K230 VanDerWaalsContact CA-O 3.28Å; F209-K230 WeakPolarHBondContact CA-O 3.4Å; T210-K230 PolarHBondContact N-O 3.03Å; T210-K230 PolarHBondContact O-N 2.93Å; K230-N232 WeakPolarHBondContact CE-OD1 3.27Å; K230-N232 PolarHBondContact NZ-OD1 2.87Å; K230-A248 VanDerWaalsContact CE-CB 3.41Å; K230-A248 HydrophobicContact CG-CB 4.38Å; K230-F249 CarbonylContact C-O 3.55Å; K230-F249 WeakPolarHBondContact CA-O 3.46Å; K230-V250 HydrophobicContact CB-CG1 4.38Å; K230-V250 HydrophobicContact CD-CG2 4.17Å; K230-V250 HydrophobicContact CG-CG2 4.02Å
231	F	98.8	Very high	93.7	Very high	70 Å²	70	61.4 Å²	61.4	31%	0.307	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128.4	163.5	-73.3	-86.9	0	0	0	109.2	I194 A206 S208 F209 I234 A248 F249	I194-F231 HydrophobicContact CD1-CD1 4.23Å; I194-F231 HydrophobicContact CD1-CE1 3.88Å; A206-F231 HydrophobicContact CB-CD1 4Å; S208-F231 CarbonylContact O-C 3.47Å; S208-F231 WeakPolarHBondContact O-CA 3.31Å; F209-F231 HydrophobicContact CB-CD1 4.02Å; F209-F231 HydrophobicContact CB-CE1 3.85Å; F209-F231 HydrophobicContact CB-CZ 4.41Å; F209-F231 HydrophobicContact CD2-CD1 4.02Å; F209-F231 AromaticContact CD2-CD2 3.83Å; F209-F231 HydrophobicContact CD2-CD2 3.83Å; F209-F231 AromaticContact CD2-CE1 3.71Å; F209-F231 HydrophobicContact CD2-CE1 3.71Å; F209-F231 AromaticContact CD2-CE2 3.5Å; F209-F231 HydrophobicContact CD2-CE2 3.5Å; F209-F231 HydrophobicContact CD2-CG 4.07Å; F209-F231 AromaticContact CD2-CZ 3.44Å; F209-F231 HydrophobicContact CD2-CZ 3.44Å; F209-F231 VanDerWaalsContact CD2-CZ 3.44Å; F209-F231 HydrophobicContact CE2-CD2 4.3Å; F209-F231 AromaticContact CE2-CE2 3.78Å; F209-F231 HydrophobicContact CE2-CE2 3.78Å; F209-F231 AromaticContact CE2-CZ 3.98Å; F209-F231 HydrophobicContact CE2-CZ 3.98Å; F209-F231 HydrophobicContact CG-CD1 4.49Å; F209-F231 HydrophobicContact CG-CE1 4.11Å; F209-F231 HydrophobicContact CG-CZ 4.17Å; F231-I234 HydrophobicContact CB-CD1 3.64Å; F231-I234 HydrophobicContact CB-CG1 3.89Å; F231-A248 CarbonylContact O-C 3.46Å; F231-A248 WeakPolarHBondContact O-CA 3.34Å; F231-F249 HydrophobicContact CB-CB 4.46Å; F231-F249 HydrophobicContact CD2-CD1 4.32Å; F231-F249 PolarHBondContact N-O 2.65Å; F231-F249 PolarHBondContact O-N 3.44Å
232	N	98.5	Very high	94.6	Very high	36 Å²	36	61.5 Å²	61.5	19%	0.193	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142.8	179.3	-64	-86.5	0	0	0	111.1	K207 S208 K230	K207-N232 PolarHBondContact N-O 3.42Å; S208-N232 PolarHBondContact O-N 2.82Å; S208-N232 PolarHBondContact OG-ND2 2.78Å; K230-N232 WeakPolarHBondContact CE-OD1 3.27Å; K230-N232 PolarHBondContact NZ-OD1 2.87Å
233	Q	98.4	Very high	95.6	Very high	91 Å²	91	61.1 Å²	61.1	43%	0.425	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.8	67.4	175.5	-61.2	-175.7	-24.9	0	0	112.1	A206 K207 D247	A206-Q233 WeakPolarHBondContact CA-O 3.47Å; K207-Q233 HydrophobicContact CB-CB 3.93Å; K207-Q233 PolarHBondContact N-O 2.86Å; Q233-D247 PolarHBondContact N-O 2.94Å
234	I	98.7	Very high	96.3	Very high	20 Å²	20	58.7 Å²	58.7	10%	0.103	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124	-179.2	-51.3	161.3	0	0	0	108.4	V204 T205 A206 F231 Q245 I246 F249	V204-I234 HydrophobicContact CG1-CG2 3.71Å; T205-I234 CarbonylContact O-C 3.49Å; T205-I234 WeakPolarHBondContact O-CA 3.39Å; A206-I234 HydrophobicContact CB-CG1 4.09Å; F231-I234 HydrophobicContact CB-CD1 3.64Å; F231-I234 HydrophobicContact CB-CG1 3.89Å; I234-Q245 CarbonylContact O-C 3.35Å; I234-Q245 VanDerWaalsContact O-CA 3.31Å; I234-Q245 WeakPolarHBondContact O-CA 3.34Å; I234-I246 HydrophobicContact CB-CB 4.16Å; I234-I246 HydrophobicContact CD1-CB 4.34Å; I234-I246 HydrophobicContact CD1-CG2 4.22Å; I234-I246 PolarHBondContact N-O 2.89Å; I234-I246 PolarHBondContact O-N 3.16Å; I234-F249 HydrophobicContact CD1-CB 3.58Å
235	N	98.4	Very high	96.7	Very high	35 Å²	35	61 Å²	61	19%	0.187	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.5	173.7	-59.9	-33.7	0	0	0	110	V204 T205 I237 Q245	V204-N235 CarbonylContact C-O 3.55Å; V204-N235 WeakPolarHBondContact CA-O 3.49Å; T205-N235 PolarHBondContact N-O 3.02Å; T205-N235 PolarHBondContact O-N 2.88Å; N235-I237 HydrophobicContact CB-CD1 4.32Å; N235-I237 HydrophobicContact CB-CG1 4.26Å; N235-Q245 WeakPolarHBondContact OD1-CG 3.32Å
236	I	97.9	Very high	97	Very high	68 Å²	68	60.6 Å²	60.6	35%	0.349	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.9	169.7	-55.8	179.4	0	0	0	106.4	V243 A244	I236-V243 HydrophobicContact CB-CG2 4.26Å; I236-V243 HydrophobicContact CG2-CG2 3.88Å; I236-V243 WeakPolarHBondContact O-CG2 3.17Å; I236-V243 PolarHBondContact O-N 2.91Å; I236-A244 HydrophobicContact CB-CB 4.29Å; I236-A244 HydrophobicContact CD1-CB 4.25Å; I236-A244 PolarHBondContact N-O 2.8Å; I236-A244 PolarHBondContact O-N 3.26Å
237	I	97.7	Very high	97.1	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.092	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.8	-172.8	-65.6	160.9	0	0	0	109.4	N202 K203 T205 N235 E241 D242	N202-I237 WeakPolarHBondContact CA-O 3.36Å; K203-I237 HydrophobicContact CD-CD1 4.33Å; K203-I237 HydrophobicContact CG-CB 3.78Å; K203-I237 HydrophobicContact CG-CD1 4.09Å; K203-I237 HydrophobicContact CG-CG1 4.49Å; K203-I237 HydrophobicContact CG-CG2 4.12Å; K203-I237 PolarHBondContact N-O 2.79Å; K203-I237 PolarHBondContact O-N 3.22Å; T205-I237 HydrophobicContact CG2-CD1 4Å; N235-I237 HydrophobicContact CB-CD1 4.32Å; N235-I237 HydrophobicContact CB-CG1 4.26Å; I237-E241 VanDerWaalsContact CA-O 3.31Å; I237-E241 WeakPolarHBondContact CA-O 3.06Å; I237-D242 WeakPolarHBondContact CG1-OD1 3.27Å
238	N	96.2	Very high	97.2	Very high	54 Å²	54	57.1 Å²	57.1	29%	0.289	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127	177.8	-178.5	-82.1	0	0	0	108.8	M201 N202 G240 E241 V243	M201-N238 CarbonylContact O-C 3.53Å; M201-N238 WeakPolarHBondContact O-CA 3.21Å; N202-N238 PolarHBondContact OD1-ND2 3.31Å; N238-G240 PolarHBondContact O-N 3.09Å; N238-E241 PolarHBondContact N-O 2.74Å; N238-E241 PolarHBondContact O-N 2.85Å; N238-V243 HydrophobicContact CB-CB 4.49Å; N238-V243 HydrophobicContact CB-CG1 3.69Å; N238-V243 HydrophobicContact CB-CG2 3.94Å
239	H	94.2	Very high	97.2	Very high	119 Å²	119	56.7 Å²	56.7	55%	0.551	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	27.3	-175.4	-63.9	76.7	0	0	0	114.8	M201 E241	M201-H239 HydrophobicContact CE-CB 4.05Å; M201-H239 WeakPolarHBondContact CE-CD2 3.45Å; M201-H239 PolarHBondContact O-N 2.99Å; H239-E241 VanDerWaalsContact C-N 3.3Å
240	G	92.2	Very high	97.2	Very high	69 Å²	69	55.4 Å²	55.4	71%	0.711	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	-2.2	-178.6	0	0	0	0	0	114.6	N238	N238-G240 PolarHBondContact O-N 3.09Å
241	E	93.4	Very high	97.2	Very high	145 Å²	145	53.4 Å²	53.4	68%	0.678	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.2	176	-61.4	-176.3	169.1	0	0	110.8	I237 N238 H239 V243	I237-E241 VanDerWaalsContact CA-O 3.31Å; I237-E241 WeakPolarHBondContact CA-O 3.06Å; N238-E241 PolarHBondContact N-O 2.74Å; N238-E241 PolarHBondContact O-N 2.85Å; H239-E241 VanDerWaalsContact C-N 3.3Å; E241-V243 PolarHBondContact O-N 2.93Å; E241-V243 VanDerWaalsContact O-N 3.14Å
242	D	93.5	Very high	97.2	Very high	95 Å²	95	53.3 Å²	53.3	51%	0.508	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	103.4	170.9	-69.1	-41.3	0	0	0	109.1	I237	I237-D242 WeakPolarHBondContact CG1-OD1 3.27Å
243	V	95.5	Very high	97.1	Very high	55 Å²	55	54.2 Å²	54.2	33%	0.333	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-28	179.1	-69.5	0	0	0	0	112.3	I236 N238 E241 K277 G278	I236-V243 HydrophobicContact CB-CG2 4.26Å; I236-V243 HydrophobicContact CG2-CG2 3.88Å; I236-V243 WeakPolarHBondContact O-CG2 3.17Å; I236-V243 PolarHBondContact O-N 2.91Å; N238-V243 HydrophobicContact CB-CB 4.49Å; N238-V243 HydrophobicContact CB-CG1 3.69Å; N238-V243 HydrophobicContact CB-CG2 3.94Å; E241-V243 PolarHBondContact O-N 2.93Å; E241-V243 VanDerWaalsContact O-N 3.14Å; V243-K277 WeakPolarHBondContact O-CG 3.23Å; V243-G278 PolarHBondContact O-N 2.77Å; V243-G278 VanDerWaalsContact O-N 3.09Å
244	A	97.5	Very high	97	Very high	14 Å²	14	55.5 Å²	55.5	12%	0.116	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	149.6	173.2	0	0	0	0	0	111.7	I236 T276	I236-A244 HydrophobicContact CB-CB 4.29Å; I236-A244 HydrophobicContact CD1-CB 4.25Å; I236-A244 PolarHBondContact N-O 2.8Å; I236-A244 PolarHBondContact O-N 3.26Å; A244-T276 CarbonylContact C-O 3.52Å; A244-T276 WeakPolarHBondContact CA-O 3.41Å; A244-T276 WeakPolarHBondContact CB-O 3.28Å
245	Q	98.1	Very high	96.8	Very high	71 Å²	71	57.1 Å²	57.1	33%	0.332	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.5	176.2	175.4	179.4	-14.4	0	0	109.6	I234 N235 D247 T276	I234-Q245 CarbonylContact O-C 3.35Å; I234-Q245 VanDerWaalsContact O-CA 3.31Å; I234-Q245 WeakPolarHBondContact O-CA 3.34Å; N235-Q245 WeakPolarHBondContact OD1-CG 3.32Å; Q245-D247 PolarHBondContact NE2-OD1 3.14Å; Q245-D247 VanDerWaalsContact NE2-OD1 3.07Å; Q245-T276 PolarHBondContact N-O 3.3Å; Q245-T276 PolarHBondContact O-N 2.78Å
246	I	98.5	Very high	96.6	Very high	20 Å²	20	58.2 Å²	58.2	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.1	171.5	-60.6	161.1	0	0	0	106.5	I234 A248 L272 D273 L275	I234-I246 HydrophobicContact CB-CB 4.16Å; I234-I246 HydrophobicContact CD1-CB 4.34Å; I234-I246 HydrophobicContact CD1-CG2 4.22Å; I234-I246 PolarHBondContact N-O 2.89Å; I234-I246 PolarHBondContact O-N 3.16Å; I246-A248 VanDerWaalsContact C-N 3.33Å; I246-A248 VanDerWaalsContact CG2-O 3.24Å; I246-A248 WeakPolarHBondContact CG2-O 3.3Å; I246-A248 PolarHBondContact O-N 3.48Å; I246-L272 HydrophobicContact CD1-CD1 4.17Å; I246-L272 HydrophobicContact CG1-CD2 4.38Å; I246-L272 HydrophobicContact CG2-CD2 3.99Å; I246-L272 HydrophobicContact CG2-CG 3.87Å; I246-D273 WeakPolarHBondContact CG2-O 3.39Å; I246-L275 HydrophobicContact CD1-CD1 4.38Å; I246-L275 HydrophobicContact CG1-CD1 3.62Å
247	D	98.5	Very high	96.2	Very high	59 Å²	59	58 Å²	58	32%	0.316	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	-39.4	-176.7	-80.1	-4.2	0	0	0	111.9	Q233 Q245 D273 K274	Q233-D247 PolarHBondContact N-O 2.94Å; Q245-D247 PolarHBondContact NE2-OD1 3.14Å; Q245-D247 VanDerWaalsContact NE2-OD1 3.07Å; D247-D273 HydrophobicContact CB-CB 4.35Å; D247-K274 HydrophobicContact CB-CB 4.19Å; D247-K274 PolarHBondContact N-O 2.78Å; D247-K274 WeakPolarHBondContact OD2-CD 3.48Å
248	A	98.7	Very high	95.8	Very high	2 Å²	2	58.2 Å²	58.2	2%	0.017	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	151	167.7	0	0	0	0	0	112.4	K230 F231 I246 V250 D273	K230-A248 VanDerWaalsContact CE-CB 3.41Å; K230-A248 HydrophobicContact CG-CB 4.38Å; F231-A248 CarbonylContact O-C 3.46Å; F231-A248 WeakPolarHBondContact O-CA 3.34Å; I246-A248 VanDerWaalsContact C-N 3.33Å; I246-A248 VanDerWaalsContact CG2-O 3.24Å; I246-A248 WeakPolarHBondContact CG2-O 3.3Å; I246-A248 PolarHBondContact O-N 3.48Å; A248-V250 HydrophobicContact CB-CG2 4.43Å; A248-D273 HydrophobicContact CB-CB 3.94Å; A248-D273 WeakPolarHBondContact O-CB 3.41Å; A248-D273 PolarHBondContact O-N 2.94Å
249	F	98.8	Very high	95.1	Very high	65 Å²	65	64.4 Å²	64.4	29%	0.285	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.7	164.7	175.8	-100.5	0	0	0	108	K230 F231 I234 Y270 E271	K230-F249 CarbonylContact C-O 3.55Å; K230-F249 WeakPolarHBondContact CA-O 3.46Å; F231-F249 HydrophobicContact CB-CB 4.46Å; F231-F249 HydrophobicContact CD2-CD1 4.32Å; F231-F249 PolarHBondContact N-O 2.65Å; F231-F249 PolarHBondContact O-N 3.44Å; I234-F249 HydrophobicContact CD1-CB 3.58Å; F249-Y270 HydrophobicContact CE1-CD1 4.37Å; F249-Y270 HydrophobicContact CE2-CD1 4.41Å; F249-Y270 AromaticContact CZ-CD1 3.67Å; F249-Y270 HydrophobicContact CZ-CD1 3.67Å; F249-Y270 HydrophobicContact CZ-CE1 4.39Å; F249-Y270 HydrophobicContact CZ-CG 4.42Å; F249-E271 CarbonylContact C-O 3.52Å; F249-E271 WeakPolarHBondContact CA-O 3.1Å
250	V	98.7	Very high	94.3	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.024	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.9	-175.7	-163.1	0	0	0	0	109.1	E228 S229 K230 A248 K252 Y270 E271	E228-V250 HydrophobicContact CG-CG1 3.47Å; E228-V250 VanDerWaalsContact CG-CG1 3.47Å; S229-V250 CarbonylContact O-C 3.45Å; S229-V250 WeakPolarHBondContact O-CA 3.34Å; K230-V250 HydrophobicContact CB-CG1 4.38Å; K230-V250 HydrophobicContact CD-CG2 4.17Å; K230-V250 HydrophobicContact CG-CG2 4.02Å; A248-V250 HydrophobicContact CB-CG2 4.43Å; V250-K252 HydrophobicContact CG1-CG 4.02Å; V250-Y270 CarbonylContact O-C 3.5Å; V250-Y270 WeakPolarHBondContact O-CA 3.47Å; V250-E271 HydrophobicContact CB-CB 4.12Å; V250-E271 HydrophobicContact CG2-CB 4.48Å; V250-E271 PolarHBondContact N-O 3.43Å; V250-E271 PolarHBondContact O-N 3.41Å
251	A	98.6	Very high	93.7	Very high	12 Å²	12	68.2 Å²	68.2	10%	0.099	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.6	168.7	0	0	0	0	0	108.8	S229 T269 Y270	S229-A251 PolarHBondContact N-O 2.99Å; S229-A251 PolarHBondContact O-N 3.16Å; S229-A251 PolarHBondContact OG-O 2.97Å; A251-T269 CarbonylContact C-O 3.52Å; A251-T269 WeakPolarHBondContact CA-O 3.33Å; A251-Y270 HydrophobicContact CB-CD1 3.62Å; A251-Y270 HydrophobicContact CB-CE1 3.65Å
252	K	98.5	Very high	93.4	Very high	68 Å²	68	65.5 Å²	65.5	30%	0.296	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.9	179.4	-63	173.6	-174.3	161.1	0	109.5	S227 E228 V250 L268 T269 E271	S227-K252 CarbonylContact O-C 3.53Å; S227-K252 VanDerWaalsContact O-CA 3.25Å; S227-K252 WeakPolarHBondContact O-CA 3.39Å; E228-K252 HydrophobicContact CB-CG 4.36Å; E228-K252 HydrophobicContact CG-CG 4.06Å; E228-K252 WeakPolarHBondContact OE2-CE 3.43Å; V250-K252 HydrophobicContact CG1-CG 4.02Å; K252-L268 CarbonylContact O-C 3.41Å; K252-L268 WeakPolarHBondContact O-CA 3.22Å; K252-T269 PolarHBondContact N-O 3.1Å; K252-T269 PolarHBondContact O-N 2.85Å; K252-E271 WeakPolarHBondContact CE-OE1 3.38Å; K252-E271 IonicContact NZ-OE1 2.63Å; K252-E271 PolarHBondContact NZ-OE1 3.04Å; K252-E271 IonicContact NZ-OE2 3.04Å; K252-E271 PolarHBondContact NZ-OE2 3.32Å
253	T	97.5	Very high	93.4	Very high	55 Å²	55	63.9 Å²	63.9	34%	0.337	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.4	169.9	-59.5	0	0	0	0	108.4	E226 S227 N267	E226-T253 CarbonylContact C-O 3.59Å; E226-T253 VanDerWaalsContact CA-O 3.25Å; E226-T253 WeakPolarHBondContact CA-O 3.43Å; S227-T253 PolarHBondContact N-O 3.49Å; S227-T253 PolarHBondContact O-N 2.8Å; T253-N267 CarbonylContact C-O 3.57Å; T253-N267 VanDerWaalsContact CA-O 3.28Å; T253-N267 WeakPolarHBondContact CA-O 3.2Å
254	R	97	Very high	93.2	Very high	118 Å²	118	62.4 Å²	62.4	45%	0.445	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.3	174.6	-178.5	175.1	170.5	142.5	9.8	110.1	G225 D256 V266 N267	G225-R254 CarbonylContact O-C 3.54Å; G225-R254 WeakPolarHBondContact O-CA 3.47Å; R254-D256 WeakPolarHBondContact CD-OD2 2.91Å; R254-D256 WeakPolarHBondContact CG-OD2 3.39Å; R254-D256 IonicContact CZ-OD1 2.73Å; R254-D256 IonicContact CZ-OD2 3.79Å; R254-D256 VanDerWaalsContact NE-CG 3.27Å; R254-D256 IonicContact NE-OD1 2.82Å; R254-D256 PolarHBondContact NE-OD1 3.47Å; R254-D256 IonicContact NE-OD2 3.29Å; R254-D256 PolarHBondContact NE-OD2 2.81Å; R254-D256 IonicContact NH2-OD1 3.69Å; R254-D256 PolarHBondContact NH2-OD1 3.34Å; R254-D256 IonicContact NH2-OD2 3.45Å; R254-V266 CarbonylContact O-C 3.59Å; R254-V266 WeakPolarHBondContact O-CA 3.45Å; R254-N267 HydrophobicContact CB-CB 4.32Å; R254-N267 PolarHBondContact N-O 2.93Å; R254-N267 PolarHBondContact O-N 2.85Å
255	L	94.4	Very high	93.2	Very high	53 Å²	53	63.9 Å²	63.9	28%	0.277	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.6	175.5	-62.8	175.9	0	0	0	107.5	V224 G225 I264 N265 V266	V224-L255 WeakPolarHBondContact CB-O 3.47Å; G225-L255 PolarHBondContact N-O 2.77Å; G225-L255 PolarHBondContact O-N 2.82Å; L255-I264 HydrophobicContact CD2-CD1 4.38Å; L255-N265 WeakPolarHBondContact CA-O 3.43Å; L255-V266 HydrophobicContact CD2-CB 4.02Å; L255-V266 HydrophobicContact CD2-CG1 3.83Å; L255-V266 HydrophobicContact CD2-CG2 3.63Å
256	D	92.9	Very high	93.1	Very high	58 Å²	58	62.4 Å²	62.4	31%	0.31	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.5	175.1	-59.9	-76.3	0	0	0	109.8	R254 I264 N265	R254-D256 WeakPolarHBondContact CD-OD2 2.91Å; R254-D256 WeakPolarHBondContact CG-OD2 3.39Å; R254-D256 IonicContact CZ-OD1 2.73Å; R254-D256 IonicContact CZ-OD2 3.79Å; R254-D256 VanDerWaalsContact NE-CG 3.27Å; R254-D256 IonicContact NE-OD1 2.82Å; R254-D256 PolarHBondContact NE-OD1 3.47Å; R254-D256 IonicContact NE-OD2 3.29Å; R254-D256 PolarHBondContact NE-OD2 2.81Å; R254-D256 IonicContact NH2-OD1 3.69Å; R254-D256 PolarHBondContact NH2-OD1 3.34Å; R254-D256 IonicContact NH2-OD2 3.45Å; D256-I264 CarbonylContact O-C 3.27Å; D256-I264 VanDerWaalsContact O-CA 3.23Å; D256-I264 WeakPolarHBondContact O-CA 3.33Å; D256-N265 PolarHBondContact N-O 3.19Å; D256-N265 PolarHBondContact O-N 3.4Å
257	R	90.6	Very high	93	Very high	63 Å²	63	63.8 Å²	63.8	24%	0.238	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	141.1	168.7	-174	-172.7	176.8	-173.2	9.2	111.6	E218 E219 K259 K261 D262	E218-R257 VanDerWaalsContact CD-CD 3.48Å; E218-R257 WeakPolarHBondContact OE1-CD 3.4Å; E218-R257 IonicContact OE1-NH1 3.78Å; E218-R257 PolarHBondContact OE1-NH1 2.7Å; E218-R257 WeakPolarHBondContact OE2-CB 3.49Å; E219-R257 VanDerWaalsContact CD-CZ 3.44Å; E219-R257 IonicContact OE1-CZ 2.71Å; E219-R257 VanDerWaalsContact OE1-CZ 3.29Å; E219-R257 IonicContact OE1-NH1 3.23Å; E219-R257 PolarHBondContact OE1-NH1 3.31Å; E219-R257 IonicContact OE1-NH2 2.93Å; E219-R257 PolarHBondContact OE1-NH2 2.8Å; E219-R257 IonicContact OE2-CZ 2.7Å; E219-R257 IonicContact OE2-NH1 3.54Å; E219-R257 PolarHBondContact OE2-NH1 2.86Å; E219-R257 IonicContact OE2-NH2 2.64Å; E219-R257 PolarHBondContact OE2-NH2 2.88Å; R257-K259 PolarHBondContact O-N 2.84Å; R257-K261 PolarHBondContact NE-O 2.89Å; R257-D262 IonicContact NH2-OD1 3.3Å
258	V	88.1	Confident	93	Very high	23 Å²	23	63 Å²	63	14%	0.139	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-73.4	123.1	167	-176.4	0	0	0	0	109.1	D260 K261 Y263 N265	V258-D260 PolarHBondContact O-N 2.82Å; V258-K261 HydrophobicContact CB-CB 4.22Å; V258-K261 HydrophobicContact CG1-CB 4.17Å; V258-K261 HydrophobicContact CG1-CD 3.94Å; V258-K261 HydrophobicContact CG1-CG 4.26Å; V258-K261 PolarHBondContact O-N 2.96Å; V258-K261 VanDerWaalsContact O-N 3.15Å; V258-Y263 PolarHBondContact N-O 2.64Å; V258-N265 WeakPolarHBondContact CG2-OD1 3.41Å
259	K	81.7	Confident	93	Very high	184 Å²	184	63.6 Å²	63.6	80%	0.8	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	135.2	178.2	-68.7	-174	178.5	-177.8	0	111.8	R257 K261	R257-K259 PolarHBondContact O-N 2.84Å; K259-K261 PolarHBondContact O-N 2.81Å
260	D	78	Confident	93	Very high	165 Å²	165	64.9 Å²	64.9	88%	0.882	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	18.3	176.5	-50.7	-48.1	0	0	0	115.1	V258	V258-D260 PolarHBondContact O-N 2.82Å
261	K	79.7	Confident	93	Very high	104 Å²	104	66.3 Å²	66.3	45%	0.452	32%	0.318	S	S	.	.	S	Bend	trans	-129.7	157.3	174.5	-62.6	-172.5	-175.1	178.4	0	110.4	R257 V258 K259 Y263	R257-K261 PolarHBondContact NE-O 2.89Å; V258-K261 HydrophobicContact CB-CB 4.22Å; V258-K261 HydrophobicContact CG1-CB 4.17Å; V258-K261 HydrophobicContact CG1-CD 3.94Å; V258-K261 HydrophobicContact CG1-CG 4.26Å; V258-K261 PolarHBondContact O-N 2.96Å; V258-K261 VanDerWaalsContact O-N 3.15Å; K259-K261 PolarHBondContact O-N 2.81Å; K261-Y263 HydrophobicContact CB-CD2 4.22Å; K261-Y263 HydrophobicContact CB-CG 4.34Å; K261-Y263 HydrophobicContact CD-CD2 3.89Å; K261-Y263 HydrophobicContact CD-CE2 4.27Å; K261-Y263 PolarHBondContact O-N 2.71Å
262	D	87	Confident	93	Very high	87 Å²	87	66.9 Å²	66.9	47%	0.465	32%	0.319	S	S	.	.	S	Bend	trans	-85.2	28.6	171.6	-80.5	-11.7	0	0	0	112	K221 R257 P296	K221-D262 IonicContact NZ-OD1 2.66Å; K221-D262 PolarHBondContact NZ-OD1 2.86Å; K221-D262 IonicContact NZ-OD2 2.79Å; K221-D262 PolarHBondContact NZ-OD2 3.38Å; R257-D262 IonicContact NH2-OD1 3.3Å; D262-P296 WeakPolarHBondContact O-CD 3.48Å
263	Y	92	Very high	92.9	Very high	61 Å²	61	66.7 Å²	66.7	24%	0.239	32%	0.322	C	S	.	.			trans	-112.6	158.4	-177.9	-58.6	-23.6	0	0	0	111.3	V258 K261 I294 D295	V258-Y263 PolarHBondContact N-O 2.64Å; K261-Y263 HydrophobicContact CB-CD2 4.22Å; K261-Y263 HydrophobicContact CB-CG 4.34Å; K261-Y263 HydrophobicContact CD-CD2 3.89Å; K261-Y263 HydrophobicContact CD-CE2 4.27Å; K261-Y263 PolarHBondContact O-N 2.71Å; Y263-I294 CarbonylContact C-O 3.53Å; Y263-I294 VanDerWaalsContact CA-O 3.27Å; Y263-I294 WeakPolarHBondContact CA-O 3.36Å; Y263-I294 WeakPolarHBondContact CB-O 3.4Å; Y263-D295 HydrophobicContact CD1-CB 3.86Å; Y263-D295 HydrophobicContact CE1-CB 3.76Å
264	I	93.1	Very high	92.9	Very high	24 Å²	24	68 Å²	68	12%	0.123	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	154.9	175.3	64.8	176.3	0	0	0	110.9	L255 D256 V266 S293 I294 P296	L255-I264 HydrophobicContact CD2-CD1 4.38Å; D256-I264 CarbonylContact O-C 3.27Å; D256-I264 VanDerWaalsContact O-CA 3.23Å; D256-I264 WeakPolarHBondContact O-CA 3.33Å; I264-V266 HydrophobicContact CD1-CG2 4.24Å; I264-V266 HydrophobicContact CG1-CG2 4.39Å; I264-S293 PolarHBondContact O-N 2.78Å; I264-I294 HydrophobicContact CG1-CB 4.05Å; I264-I294 HydrophobicContact CG1-CG2 4.37Å; I264-I294 PolarHBondContact N-O 3.15Å; I264-I294 PolarHBondContact O-N 3.16Å; I264-P296 HydrophobicContact CD1-CB 4.29Å
265	N	95.6	Very high	93	Very high	46 Å²	46	63.8 Å²	63.8	25%	0.246	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.5	163.8	-65.8	-24.9	0	0	0	108.1	L255 D256 V258 A291 E292 S293	L255-N265 WeakPolarHBondContact CA-O 3.43Å; D256-N265 PolarHBondContact N-O 3.19Å; D256-N265 PolarHBondContact O-N 3.4Å; V258-N265 WeakPolarHBondContact CG2-OD1 3.41Å; N265-A291 CarbonylContact C-O 3.42Å; N265-A291 WeakPolarHBondContact CA-O 3.21Å; N265-E292 VanDerWaalsContact OD1-CA 3.22Å; N265-E292 WeakPolarHBondContact OD1-CA 3.36Å; N265-S293 PolarHBondContact OD1-N 2.81Å
266	V	96.2	Very high	93.2	Very high	39 Å²	39	62.3 Å²	62.3	24%	0.236	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.2	176.7	-174.2	0	0	0	0	107.8	R254 L255 I264 I290 A291 I294	R254-V266 CarbonylContact O-C 3.59Å; R254-V266 WeakPolarHBondContact O-CA 3.45Å; L255-V266 HydrophobicContact CD2-CB 4.02Å; L255-V266 HydrophobicContact CD2-CG1 3.83Å; L255-V266 HydrophobicContact CD2-CG2 3.63Å; I264-V266 HydrophobicContact CD1-CG2 4.24Å; I264-V266 HydrophobicContact CG1-CG2 4.39Å; V266-I290 CarbonylContact O-C 3.48Å; V266-I290 VanDerWaalsContact O-CA 3.27Å; V266-I290 WeakPolarHBondContact O-CA 3.29Å; V266-A291 HydrophobicContact CB-CB 4.25Å; V266-A291 PolarHBondContact N-O 3.45Å; V266-A291 PolarHBondContact O-N 2.89Å; V266-I294 HydrophobicContact CG2-CG1 4.44Å
267	N	98	Very high	93.3	Very high	50 Å²	50	62 Å²	62	27%	0.267	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	116.2	171.8	-173.7	-10.2	0	0	0	108.9	T253 R254 T269 I290	T253-N267 CarbonylContact C-O 3.57Å; T253-N267 VanDerWaalsContact CA-O 3.28Å; T253-N267 WeakPolarHBondContact CA-O 3.2Å; R254-N267 HydrophobicContact CB-CB 4.32Å; R254-N267 PolarHBondContact N-O 2.93Å; R254-N267 PolarHBondContact O-N 2.85Å; N267-T269 PolarHBondContact OD1-OG1 2.92Å; N267-T269 VanDerWaalsContact OD1-OG1 3.07Å; N267-I290 HydrophobicContact CB-CG1 4.46Å
268	L	98.4	Very high	93.3	Very high	43 Å²	43	61.1 Å²	61.1	23%	0.225	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.6	173.7	172.9	64.5	0	0	0	108.1	K252 Y270 S288 L289	K252-L268 CarbonylContact O-C 3.41Å; K252-L268 WeakPolarHBondContact O-CA 3.22Å; L268-Y270 HydrophobicContact CD1-CE1 4.43Å; L268-Y270 HydrophobicContact CD1-CE2 4.1Å; L268-Y270 HydrophobicContact CD2-CE2 3.76Å; L268-Y270 HydrophobicContact CG-CD2 4.46Å; L268-Y270 HydrophobicContact CG-CE2 3.75Å; L268-S288 CarbonylContact O-C 3.49Å; L268-S288 WeakPolarHBondContact O-CA 3.07Å; L268-L289 HydrophobicContact CB-CB 4.41Å; L268-L289 PolarHBondContact N-O 3.42Å; L268-L289 PolarHBondContact O-N 2.97Å
269	T	98.7	Very high	93.3	Very high	13 Å²	13	67.5 Å²	67.5	8%	0.08	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.4	-179.8	-62	0	0	0	0	110.2	A251 K252 N267 E271 E286 W287 S288	A251-T269 CarbonylContact C-O 3.52Å; A251-T269 WeakPolarHBondContact CA-O 3.33Å; K252-T269 PolarHBondContact N-O 3.1Å; K252-T269 PolarHBondContact O-N 2.85Å; N267-T269 PolarHBondContact OD1-OG1 2.92Å; N267-T269 VanDerWaalsContact OD1-OG1 3.07Å; T269-E271 HydrophobicContact CG2-CG 3.91Å; T269-E286 HydrophobicContact CG2-CG 3.69Å; T269-W287 CarbonylContact C-O 3.57Å; T269-W287 WeakPolarHBondContact CA-O 3.29Å; T269-S288 WeakPolarHBondContact CG2-OG 3.4Å; T269-S288 WeakPolarHBondContact OG1-CB 3.3Å; T269-S288 PolarHBondContact OG1-OG 3.29Å
270	Y	98.6	Very high	94	Very high	93 Å²	93	61 Å²	61	37%	0.365	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.4	168.5	-62.6	-75.2	0	0	0	109.2	F249 V250 A251 L268 E286 W287	F249-Y270 HydrophobicContact CE1-CD1 4.37Å; F249-Y270 HydrophobicContact CE2-CD1 4.41Å; F249-Y270 AromaticContact CZ-CD1 3.67Å; F249-Y270 HydrophobicContact CZ-CD1 3.67Å; F249-Y270 HydrophobicContact CZ-CE1 4.39Å; F249-Y270 HydrophobicContact CZ-CG 4.42Å; V250-Y270 CarbonylContact O-C 3.5Å; V250-Y270 WeakPolarHBondContact O-CA 3.47Å; A251-Y270 HydrophobicContact CB-CD1 3.62Å; A251-Y270 HydrophobicContact CB-CE1 3.65Å; L268-Y270 HydrophobicContact CD1-CE1 4.43Å; L268-Y270 HydrophobicContact CD1-CE2 4.1Å; L268-Y270 HydrophobicContact CD2-CE2 3.76Å; L268-Y270 HydrophobicContact CG-CD2 4.46Å; L268-Y270 HydrophobicContact CG-CE2 3.75Å; Y270-E286 CarbonylContact O-C 3.49Å; Y270-E286 WeakPolarHBondContact O-CA 3.21Å; Y270-W287 PolarHBondContact N-O 2.74Å; Y270-W287 PolarHBondContact O-N 2.81Å
271	E	98.7	Very high	94.8	Very high	33 Å²	33	58 Å²	58	15%	0.154	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.3	177.4	-62.4	165.9	-162.8	0	0	108.9	F249 V250 K252 T269 G285 E286	F249-E271 CarbonylContact C-O 3.52Å; F249-E271 WeakPolarHBondContact CA-O 3.1Å; V250-E271 HydrophobicContact CB-CB 4.12Å; V250-E271 HydrophobicContact CG2-CB 4.48Å; V250-E271 PolarHBondContact N-O 3.43Å; V250-E271 PolarHBondContact O-N 3.41Å; K252-E271 WeakPolarHBondContact CE-OE1 3.38Å; K252-E271 IonicContact NZ-OE1 2.63Å; K252-E271 PolarHBondContact NZ-OE1 3.04Å; K252-E271 IonicContact NZ-OE2 3.04Å; K252-E271 PolarHBondContact NZ-OE2 3.32Å; T269-E271 HydrophobicContact CG2-CG 3.91Å; E271-G285 CarbonylContact C-O 3.49Å; E271-G285 WeakPolarHBondContact CA-O 3.35Å; E271-E286 HydrophobicContact CG-CB 4.5Å; E271-E286 HydrophobicContact CG-CG 4.06Å
272	L	98.4	Very high	95.6	Very high	24 Å²	24	53.9 Å²	53.9	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	102.9	170	-169.5	157.3	0	0	0	107.1	I246 L275 S284 G285 W287	I246-L272 HydrophobicContact CD1-CD1 4.17Å; I246-L272 HydrophobicContact CG1-CD2 4.38Å; I246-L272 HydrophobicContact CG2-CD2 3.99Å; I246-L272 HydrophobicContact CG2-CG 3.87Å; L272-L275 HydrophobicContact CD2-CB 3.64Å; L272-S284 CarbonylContact O-C 3.46Å; L272-S284 WeakPolarHBondContact O-CA 3.4Å; L272-S284 VanDerWaalsContact O-CB 3.24Å; L272-S284 WeakPolarHBondContact O-CB 3.25Å; L272-G285 PolarHBondContact N-O 2.79Å; L272-G285 PolarHBondContact O-N 2.78Å; L272-W287 HydrophobicContact CB-CH2 4.16Å; L272-W287 HydrophobicContact CB-CZ3 3.79Å
273	D	97.3	Very high	96.1	Very high	65 Å²	65	49.9 Å²	49.9	35%	0.348	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	148.3	171.9	-78.9	-12.1	0	0	0	110	I246 D247 A248 L275	I246-D273 WeakPolarHBondContact CG2-O 3.39Å; D247-D273 HydrophobicContact CB-CB 4.35Å; A248-D273 HydrophobicContact CB-CB 3.94Å; A248-D273 WeakPolarHBondContact O-CB 3.41Å; A248-D273 PolarHBondContact O-N 2.94Å; D273-L275 PolarHBondContact O-N 2.82Å
274	K	97.5	Very high	96.4	Very high	81 Å²	81	48.8 Å²	48.8	35%	0.352	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	3.4	96.9	-178.5	-172.2	179	167.5	-177.8	0	115.4	D247 Q281 G283	D247-K274 HydrophobicContact CB-CB 4.19Å; D247-K274 PolarHBondContact N-O 2.78Å; D247-K274 WeakPolarHBondContact OD2-CD 3.48Å; K274-Q281 HydrophobicContact CD-CG 4.33Å; K274-Q281 VanDerWaalsContact CE-CD 3.4Å; K274-Q281 VanDerWaalsContact CE-OE1 3.26Å; K274-Q281 HydrophobicContact CG-CG 3.98Å; K274-G283 CarbonylContact C-O 3.5Å; K274-G283 VanDerWaalsContact CA-O 3.3Å; K274-G283 WeakPolarHBondContact CA-O 3.25Å
275	L	98.3	Very high	96.7	Very high	31 Å²	31	48 Å²	48	16%	0.162	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.7	165	-177	59.7	0	0	0	110.2	I246 L272 D273 L282 G283 W355	I246-L275 HydrophobicContact CD1-CD1 4.38Å; I246-L275 HydrophobicContact CG1-CD1 3.62Å; L272-L275 HydrophobicContact CD2-CB 3.64Å; D273-L275 PolarHBondContact O-N 2.82Å; L275-L282 HydrophobicContact CB-CB 4.34Å; L275-L282 HydrophobicContact CD2-CB 4.16Å; L275-L282 HydrophobicContact CD2-CD1 3.77Å; L275-L282 HydrophobicContact CD2-CG 4.49Å; L275-L282 HydrophobicContact CG-CB 4.2Å; L275-L282 HydrophobicContact CG-CD1 4.09Å; L275-L282 HydrophobicContact CG-CG 4.46Å; L275-L282 PolarHBondContact O-N 2.82Å; L275-G283 PolarHBondContact N-O 2.79Å; L275-W355 HydrophobicContact CB-CH2 4.25Å; L275-W355 HydrophobicContact CD2-CH2 3.84Å; L275-W355 HydrophobicContact CD2-CZ2 4.45Å
276	T	97.8	Very high	96.8	Very high	22 Å²	22	49 Å²	49	14%	0.135	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.3	172.5	-51.3	0	0	0	0	108.7	A244 Q245 G278 Q280	A244-T276 CarbonylContact C-O 3.52Å; A244-T276 WeakPolarHBondContact CA-O 3.41Å; A244-T276 WeakPolarHBondContact CB-O 3.28Å; Q245-T276 PolarHBondContact N-O 3.3Å; Q245-T276 PolarHBondContact O-N 2.78Å; T276-G278 WeakPolarHBondContact CG2-O 3.45Å; T276-Q280 CarbonylContact C-O 3.56Å; T276-Q280 VanDerWaalsContact CA-O 3.31Å; T276-Q280 WeakPolarHBondContact CA-O 3.48Å; T276-Q280 WeakPolarHBondContact CG2-O 3.2Å
277	K	96.2	Very high	96.9	Very high	52 Å²	52	51.5 Å²	51.5	23%	0.226	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.7	173.7	-175.1	-178.8	166.7	-164.3	0	109.1	V243 N279 Q280 L282 L405 S408 E409	V243-K277 WeakPolarHBondContact O-CG 3.23Å; K277-N279 PolarHBondContact O-N 2.94Å; K277-Q280 PolarHBondContact N-O 2.61Å; K277-Q280 PolarHBondContact O-N 3.44Å; K277-L282 HydrophobicContact CB-CD1 3.9Å; K277-L282 HydrophobicContact CB-CG 4.29Å; K277-L405 HydrophobicContact CD-CD1 4.27Å; K277-S408 WeakPolarHBondContact CD-OG 3.2Å; K277-S408 WeakPolarHBondContact CE-OG 3.48Å; K277-S408 PolarHBondContact NZ-OG 2.94Å; K277-E409 IonicContact NZ-OE1 3Å; K277-E409 PolarHBondContact NZ-OE1 3.04Å
278	G	89.2	Confident	96.9	Very high	43 Å²	43	49.8 Å²	49.8	44%	0.443	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	-121.9	-163.1	0	0	0	0	0	110.6	V243 T276	V243-G278 PolarHBondContact O-N 2.77Å; V243-G278 VanDerWaalsContact O-N 3.09Å; T276-G278 WeakPolarHBondContact CG2-O 3.45Å
279	N	89.1	Confident	96.9	Very high	157 Å²	157	51.1 Å²	51.1	84%	0.84	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	4.8	176.4	-66.4	-22.1	0	0	0	114.2	K277	K277-N279 PolarHBondContact O-N 2.94Å
280	Q	95.5	Very high	96.9	Very high	48 Å²	48	52.1 Å²	52.1	22%	0.224	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.8	-172.1	-54.9	-50.8	-33.2	0	0	111.7	T276 K277 L282 L407	T276-Q280 CarbonylContact C-O 3.56Å; T276-Q280 VanDerWaalsContact CA-O 3.31Å; T276-Q280 WeakPolarHBondContact CA-O 3.48Å; T276-Q280 WeakPolarHBondContact CG2-O 3.2Å; K277-Q280 PolarHBondContact N-O 2.61Å; K277-Q280 PolarHBondContact O-N 3.44Å; Q280-L282 PolarHBondContact O-N 2.76Å; Q280-L407 HydrophobicContact CG-CB 3.7Å
281	Q	95.7	Very high	96.9	Very high	102 Å²	102	48.3 Å²	48.3	48%	0.477	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	110.2	174.5	-179.9	172.4	-13.3	0	0	109.5	K274	K274-Q281 HydrophobicContact CD-CG 4.33Å; K274-Q281 VanDerWaalsContact CE-CD 3.4Å; K274-Q281 VanDerWaalsContact CE-OE1 3.26Å; K274-Q281 HydrophobicContact CG-CG 3.98Å
282	L	96.6	Very high	96.8	Very high	17 Å²	17	49.6 Å²	49.6	9%	0.089	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-30.1	-178	-59.4	-172.9	0	0	0	112.7	L275 K277 Q280 W355 Q404	L275-L282 HydrophobicContact CB-CB 4.34Å; L275-L282 HydrophobicContact CD2-CB 4.16Å; L275-L282 HydrophobicContact CD2-CD1 3.77Å; L275-L282 HydrophobicContact CD2-CG 4.49Å; L275-L282 HydrophobicContact CG-CB 4.2Å; L275-L282 HydrophobicContact CG-CD1 4.09Å; L275-L282 HydrophobicContact CG-CG 4.46Å; L275-L282 PolarHBondContact O-N 2.82Å; K277-L282 HydrophobicContact CB-CD1 3.9Å; K277-L282 HydrophobicContact CB-CG 4.29Å; Q280-L282 PolarHBondContact O-N 2.76Å; L282-W355 HydrophobicContact CB-CZ2 4.24Å; L282-W355 PolarHBondContact O-NE1 2.74Å; L282-Q404 HydrophobicContact CD2-CB 3.73Å
283	G	97.6	Very high	96.6	Very high	3 Å²	3	49.7 Å²	49.7	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.9	-160.8	179.1	0	0	0	0	0	114.2	K274 L275 K356	K274-G283 CarbonylContact C-O 3.5Å; K274-G283 VanDerWaalsContact CA-O 3.3Å; K274-G283 WeakPolarHBondContact CA-O 3.25Å; L275-G283 PolarHBondContact N-O 2.79Å; G283-K356 CarbonylContact C-O 3.5Å; G283-K356 WeakPolarHBondContact CA-O 3.25Å
284	S	98.4	Very high	96.5	Very high	38 Å²	38	47.8 Å²	47.8	27%	0.266	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.2	172.2	61.7	0	0	0	0	109.7	L272 W355 K356	L272-S284 CarbonylContact O-C 3.46Å; L272-S284 WeakPolarHBondContact O-CA 3.4Å; L272-S284 VanDerWaalsContact O-CB 3.24Å; L272-S284 WeakPolarHBondContact O-CB 3.25Å; S284-W355 CarbonylContact O-C 3.46Å; S284-W355 WeakPolarHBondContact O-CA 3.46Å; S284-K356 PolarHBondContact N-O 2.79Å; S284-K356 PolarHBondContact O-N 2.81Å
285	G	98.2	Very high	96.3	Very high	8 Å²	8	46 Å²	46	8%	0.082	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152.3	-176.2	0	0	0	0	0	112.8	E271 L272 R354	E271-G285 CarbonylContact C-O 3.49Å; E271-G285 WeakPolarHBondContact CA-O 3.35Å; L272-G285 PolarHBondContact N-O 2.79Å; L272-G285 PolarHBondContact O-N 2.78Å; G285-R354 CarbonylContact C-O 3.5Å; G285-R354 WeakPolarHBondContact CA-O 3.33Å
286	E	98.5	Very high	95.8	Very high	66 Å²	66	45.2 Å²	45.2	31%	0.308	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	131.5	172.6	-176.1	-177.8	101.6	0	0	108.7	T269 Y270 E271 V353 R354	T269-E286 HydrophobicContact CG2-CG 3.69Å; Y270-E286 CarbonylContact O-C 3.49Å; Y270-E286 WeakPolarHBondContact O-CA 3.21Å; E271-E286 HydrophobicContact CG-CB 4.5Å; E271-E286 HydrophobicContact CG-CG 4.06Å; E286-V353 CarbonylContact O-C 3.52Å; E286-V353 WeakPolarHBondContact O-CA 3.32Å; E286-R354 HydrophobicContact CB-CB 4.45Å; E286-R354 PolarHBondContact N-O 2.88Å; E286-R354 PolarHBondContact O-N 2.75Å
287	W	98.2	Very high	95.5	Very high	93 Å²	93	46.9 Å²	46.9	35%	0.352	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	121.8	175.2	-56.3	-99.6	0	0	0	108.3	T269 Y270 L272 V353 W355	T269-W287 CarbonylContact C-O 3.57Å; T269-W287 WeakPolarHBondContact CA-O 3.29Å; Y270-W287 PolarHBondContact N-O 2.74Å; Y270-W287 PolarHBondContact O-N 2.81Å; L272-W287 HydrophobicContact CB-CH2 4.16Å; L272-W287 HydrophobicContact CB-CZ3 3.79Å; W287-V353 HydrophobicContact CG-CG1 4.29Å; W287-V353 HydrophobicContact CG-CG2 4.47Å; W287-W355 HydrophobicContact CH2-CE3 4.23Å; W287-W355 HydrophobicContact CH2-CZ3 4.02Å; W287-W355 HydrophobicContact CZ2-CE3 4.24Å; W287-W355 HydrophobicContact CZ2-CZ3 4.34Å
288	S	98.5	Very high	95.3	Very high	13 Å²	13	44.8 Å²	44.8	9%	0.091	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.3	174.4	-46.9	0	0	0	0	112.2	L268 T269 Q351 P352	L268-S288 CarbonylContact O-C 3.49Å; L268-S288 WeakPolarHBondContact O-CA 3.07Å; T269-S288 WeakPolarHBondContact CG2-OG 3.4Å; T269-S288 WeakPolarHBondContact OG1-CB 3.3Å; T269-S288 PolarHBondContact OG1-OG 3.29Å; S288-Q351 VanDerWaalsContact O-CA 3.29Å; S288-Q351 WeakPolarHBondContact O-CA 3.28Å; S288-P352 PolarHBondContact N-O 2.63Å; S288-P352 WeakPolarHBondContact O-CD 3.28Å
289	L	98.5	Very high	95.4	Very high	71 Å²	71	45.1 Å²	45.1	37%	0.372	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	111.9	163.2	173.9	64.3	0	0	0	107.3	L268 I349 Q351	L268-L289 HydrophobicContact CB-CB 4.41Å; L268-L289 PolarHBondContact N-O 3.42Å; L268-L289 PolarHBondContact O-N 2.97Å; L289-I349 HydrophobicContact CD1-CG2 3.72Å; L289-Q351 HydrophobicContact CD1-CG 3.75Å
290	I	98.5	Very high	95.4	Very high	34 Å²	34	45.3 Å²	45.3	17%	0.174	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.4	-179	-54.4	168	0	0	0	107.8	V266 N267 E292 I349 K350 P352	V266-I290 CarbonylContact O-C 3.48Å; V266-I290 VanDerWaalsContact O-CA 3.27Å; V266-I290 WeakPolarHBondContact O-CA 3.29Å; N267-I290 HydrophobicContact CB-CG1 4.46Å; I290-E292 HydrophobicContact CG2-CG 4.11Å; I290-I349 CarbonylContact O-C 3.6Å; I290-I349 WeakPolarHBondContact O-CA 3.49Å; I290-K350 HydrophobicContact CB-CB 4.12Å; I290-K350 PolarHBondContact N-O 3Å; I290-K350 PolarHBondContact O-N 2.86Å; I290-P352 HydrophobicContact CD1-CG 4.11Å
291	A	97.5	Very high	95.2	Very high	14 Å²	14	47.9 Å²	47.9	12%	0.116	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	113.1	176.1	0	0	0	0	0	109	N265 V266 I294 I349	N265-A291 CarbonylContact C-O 3.42Å; N265-A291 WeakPolarHBondContact CA-O 3.21Å; V266-A291 HydrophobicContact CB-CB 4.25Å; V266-A291 PolarHBondContact N-O 3.45Å; V266-A291 PolarHBondContact O-N 2.89Å; A291-I294 HydrophobicContact CB-CD1 3.84Å; A291-I294 HydrophobicContact CB-CG1 3.78Å; A291-I349 HydrophobicContact CB-CD1 3.55Å
292	E	96.9	Very high	95	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	146.4	-176.7	-64.8	176.8	166.6	0	0	111.5	N265 I290 P347 T348 K350	N265-E292 VanDerWaalsContact OD1-CA 3.22Å; N265-E292 WeakPolarHBondContact OD1-CA 3.36Å; I290-E292 HydrophobicContact CG2-CG 4.11Å; E292-P347 WeakPolarHBondContact O-CA 3.45Å; E292-P347 WeakPolarHBondContact O-CB 3.17Å; E292-T348 PolarHBondContact N-O 2.94Å; E292-T348 PolarHBondContact O-N 2.79Å; E292-T348 VanDerWaalsContact O-N 3.13Å; E292-K350 IonicContact OE1-NZ 2.85Å; E292-K350 PolarHBondContact OE1-NZ 2.82Å; E292-K350 VanDerWaalsContact OE2-CE 3.27Å; E292-K350 WeakPolarHBondContact OE2-CE 3.29Å; E292-K350 IonicContact OE2-NZ 3.44Å; E292-K350 PolarHBondContact OE2-NZ 2.79Å
293	S	94.8	Very high	94.6	Very high	26 Å²	26	47.4 Å²	47.4	18%	0.182	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	57.9	47.1	178.3	-58.8	0	0	0	0	113.9	I264 N265 S345	I264-S293 PolarHBondContact O-N 2.78Å; N265-S293 PolarHBondContact OD1-N 2.81Å; S293-S345 VanDerWaalsContact O-CB 3.24Å; S293-S345 WeakPolarHBondContact O-CB 3.39Å; S293-S345 PolarHBondContact O-OG 2.87Å
294	I	94.5	Very high	94.1	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.128	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128.1	175.5	-58.7	-66.3	0	0	0	109.6	Y263 I264 V266 A291 P296 V299 P347	Y263-I294 CarbonylContact C-O 3.53Å; Y263-I294 VanDerWaalsContact CA-O 3.27Å; Y263-I294 WeakPolarHBondContact CA-O 3.36Å; Y263-I294 WeakPolarHBondContact CB-O 3.4Å; I264-I294 HydrophobicContact CG1-CB 4.05Å; I264-I294 HydrophobicContact CG1-CG2 4.37Å; I264-I294 PolarHBondContact N-O 3.15Å; I264-I294 PolarHBondContact O-N 3.16Å; V266-I294 HydrophobicContact CG2-CG1 4.44Å; A291-I294 HydrophobicContact CB-CD1 3.84Å; A291-I294 HydrophobicContact CB-CG1 3.78Å; I294-P296 WeakPolarHBondContact O-CD 3.42Å; I294-V299 HydrophobicContact CG2-CG2 3.48Å; I294-V299 VanDerWaalsContact CG2-CG2 3.48Å; I294-P347 HydrophobicContact CD1-CB 3.59Å; I294-P347 HydrophobicContact CD1-CG 4.29Å
295	D	93.1	Very high	93.7	Very high	42 Å²	42	52.2 Å²	52.2	23%	0.225	26%	0.262	C	S	.	.			trans	-82.5	108.4	170.1	-179.1	-21.3	0	0	0	109.8	Y263 S297 A298 V299	Y263-D295 HydrophobicContact CD1-CB 3.86Å; Y263-D295 HydrophobicContact CE1-CB 3.76Å; D295-S297 PolarHBondContact O-N 2.87Å; D295-S297 WeakPolarHBondContact OD1-CA 3.37Å; D295-S297 VanDerWaalsContact OD1-CB 3.25Å; D295-S297 WeakPolarHBondContact OD1-CB 3.43Å; D295-S297 PolarHBondContact OD1-N 2.75Å; D295-A298 HydrophobicContact CB-CB 3.73Å; D295-A298 WeakPolarHBondContact O-CB 3.42Å; D295-A298 PolarHBondContact O-N 3Å; D295-A298 VanDerWaalsContact O-N 3.16Å; D295-A298 PolarHBondContact OD1-N 2.82Å; D295-A298 VanDerWaalsContact OD1-N 3.07Å; D295-V299 WeakPolarHBondContact O-CG2 3.41Å; D295-V299 PolarHBondContact O-N 2.79Å
296	P	89.3	Confident	93.2	Very high	16 Å²	16	53.8 Å²	53.8	10%	0.104	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-28.8	-178.8	26.6	-35.3	0	0	0	113	F222 D262 I264 I294 R300	F222-P296 HydrophobicContact CD1-CB 3.87Å; F222-P296 HydrophobicContact CD1-CG 4.09Å; F222-P296 HydrophobicContact CD2-CB 4.15Å; F222-P296 HydrophobicContact CD2-CG 3.47Å; F222-P296 VanDerWaalsContact CD2-CG 3.47Å; F222-P296 HydrophobicContact CE1-CB 3.89Å; F222-P296 HydrophobicContact CE1-CG 3.97Å; F222-P296 HydrophobicContact CE2-CB 4.17Å; F222-P296 HydrophobicContact CE2-CG 3.34Å; F222-P296 HydrophobicContact CG-CB 4.01Å; F222-P296 HydrophobicContact CG-CG 3.86Å; F222-P296 HydrophobicContact CZ-CB 4.06Å; F222-P296 HydrophobicContact CZ-CG 3.63Å; D262-P296 WeakPolarHBondContact O-CD 3.48Å; I264-P296 HydrophobicContact CD1-CB 4.29Å; I294-P296 WeakPolarHBondContact O-CD 3.42Å; P296-R300 WeakPolarHBondContact O-CB 3.36Å; P296-R300 PolarHBondContact O-N 3.07Å
297	S	89.6	Confident	92.6	Very high	57 Å²	57	54.6 Å²	54.6	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-70	-40.9	175.6	-56.8	0	0	0	0	110.7	D295 R300 Q301	D295-S297 PolarHBondContact O-N 2.87Å; D295-S297 WeakPolarHBondContact OD1-CA 3.37Å; D295-S297 VanDerWaalsContact OD1-CB 3.25Å; D295-S297 WeakPolarHBondContact OD1-CB 3.43Å; D295-S297 PolarHBondContact OD1-N 2.75Å; S297-R300 PolarHBondContact O-N 2.89Å; S297-Q301 WeakPolarHBondContact O-CG 3.07Å; S297-Q301 PolarHBondContact O-N 2.87Å
298	A	93.1	Very high	92.1	Very high	8 Å²	8	55 Å²	55	7%	0.066	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.9	0	0	0	0	0	111.8	D295 Q301 F302 L341	D295-A298 HydrophobicContact CB-CB 3.73Å; D295-A298 WeakPolarHBondContact O-CB 3.42Å; D295-A298 PolarHBondContact O-N 3Å; D295-A298 VanDerWaalsContact O-N 3.16Å; D295-A298 PolarHBondContact OD1-N 2.82Å; D295-A298 VanDerWaalsContact OD1-N 3.07Å; A298-Q301 PolarHBondContact O-N 3.48Å; A298-F302 WeakPolarHBondContact O-CB 3.29Å; A298-F302 PolarHBondContact O-N 3.35Å; A298-L341 WeakPolarHBondContact CB-O 3.41Å
299	V	91.5	Very high	91.7	Very high	49 Å²	49	55 Å²	55	30%	0.297	28%	0.281	S	S	.	.	H	α-helix	trans	-60	-46.5	174.2	173.8	0	0	0	0	111.2	I294 D295 Q301 F302 I303 L342	I294-V299 HydrophobicContact CG2-CG2 3.48Å; I294-V299 VanDerWaalsContact CG2-CG2 3.48Å; D295-V299 WeakPolarHBondContact O-CG2 3.41Å; D295-V299 PolarHBondContact O-N 2.79Å; V299-Q301 VanDerWaalsContact C-N 3.34Å; V299-Q301 PolarHBondContact O-N 2.77Å; V299-F302 WeakPolarHBondContact O-CB 3.19Å; V299-F302 PolarHBondContact O-N 3.2Å; V299-I303 HydrophobicContact CG1-CD1 3.89Å; V299-I303 WeakPolarHBondContact O-CG1 3.29Å; V299-I303 PolarHBondContact O-N 2.76Å; V299-L342 HydrophobicContact CB-CD2 4.4Å; V299-L342 HydrophobicContact CG2-CD2 3.86Å
300	R	87.9	Confident	91.2	Very high	162 Å²	162	52.6 Å²	52.6	61%	0.611	27%	0.268	S	S	*	.	H	α-helix	trans	-59.3	-45.3	176.4	-177	176	-177.3	-97	-1.1	111.6	P296 S297 I303 I304	P296-R300 WeakPolarHBondContact O-CB 3.36Å; P296-R300 PolarHBondContact O-N 3.07Å; S297-R300 PolarHBondContact O-N 2.89Å; R300-I303 PolarHBondContact O-N 3.17Å; R300-I304 HydrophobicContact CG-CD1 3.85Å; R300-I304 VanDerWaalsContact O-CG1 3.28Å; R300-I304 WeakPolarHBondContact O-CG1 3.36Å; R300-I304 PolarHBondContact O-N 2.83Å; R300-I304 VanDerWaalsContact O-N 3.09Å
301	Q	91.4	Very high	90.7	Very high	101 Å²	101	57.3 Å²	57.3	47%	0.472	29%	0.289	S	S	.	.	H	α-helix	trans	-63.5	-43.5	177.3	-75.8	-176	-16.7	0	0	112.1	S297 A298 V299 I304 Q305	S297-Q301 WeakPolarHBondContact O-CG 3.07Å; S297-Q301 PolarHBondContact O-N 2.87Å; A298-Q301 PolarHBondContact O-N 3.48Å; V299-Q301 VanDerWaalsContact C-N 3.34Å; V299-Q301 PolarHBondContact O-N 2.77Å; Q301-I304 PolarHBondContact O-N 2.77Å; Q301-Q305 WeakPolarHBondContact O-CB 3.24Å; Q301-Q305 WeakPolarHBondContact O-CG 3.21Å; Q301-Q305 PolarHBondContact O-N 2.87Å
302	F	93.2	Very high	90.3	Very high	26 Å²	26	64.2 Å²	64.2	11%	0.114	32%	0.317	C	S	.	.	H	α-helix	trans	-56	-52	176	174.2	-89.8	0	0	0	111.1	A298 V299 I304 Q305 Y306 F335 L342	A298-F302 WeakPolarHBondContact O-CB 3.29Å; A298-F302 PolarHBondContact O-N 3.35Å; V299-F302 WeakPolarHBondContact O-CB 3.19Å; V299-F302 PolarHBondContact O-N 3.2Å; F302-I304 PolarHBondContact O-N 2.79Å; F302-Q305 PolarHBondContact O-N 2.92Å; F302-Y306 HydrophobicContact CZ-CD2 4.33Å; F302-Y306 WeakPolarHBondContact O-CB 3.49Å; F302-Y306 PolarHBondContact O-N 2.75Å; F302-F335 HydrophobicContact CE2-CD2 4.34Å; F302-F335 AromaticContact CZ-CD2 3.72Å; F302-F335 HydrophobicContact CZ-CD2 3.72Å; F302-F335 AromaticContact CZ-CE2 3.91Å; F302-F335 HydrophobicContact CZ-CE2 3.91Å; F302-L342 HydrophobicContact CB-CD2 3.72Å; F302-L342 HydrophobicContact CB-CG 4.15Å; F302-L342 HydrophobicContact CD1-CD1 4.18Å; F302-L342 HydrophobicContact CD2-CD1 3.86Å; F302-L342 HydrophobicContact CD2-CD2 4.38Å; F302-L342 HydrophobicContact CD2-CG 3.87Å; F302-L342 HydrophobicContact CE1-CD1 4.38Å; F302-L342 HydrophobicContact CE2-CD1 4.06Å; F302-L342 HydrophobicContact CE2-CG 4.49Å; F302-L342 HydrophobicContact CG-CD1 3.94Å; F302-L342 HydrophobicContact CG-CD2 3.99Å; F302-L342 HydrophobicContact CG-CG 3.97Å; F302-L342 HydrophobicContact CZ-CD1 4.33Å
303	I	88.1	Confident	90.1	Very high	84 Å²	84	64.7 Å²	64.7	43%	0.431	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-46.5	-179.6	-66.4	168.1	0	0	0	111.2	V299 R300 N307	V299-I303 HydrophobicContact CG1-CD1 3.89Å; V299-I303 WeakPolarHBondContact O-CG1 3.29Å; V299-I303 PolarHBondContact O-N 2.76Å; R300-I303 PolarHBondContact O-N 3.17Å; I303-N307 WeakPolarHBondContact O-CB 3.29Å; I303-N307 PolarHBondContact O-N 2.71Å; I303-N307 PolarHBondContact O-ND2 2.8Å
304	I	86.7	Confident	89.7	Confident	69 Å²	69	66.4 Å²	66.4	35%	0.354	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-50.6	-179.2	-69.5	169.7	0	0	0	110.8	R300 Q301 F302 N307 I308	R300-I304 HydrophobicContact CG-CD1 3.85Å; R300-I304 VanDerWaalsContact O-CG1 3.28Å; R300-I304 WeakPolarHBondContact O-CG1 3.36Å; R300-I304 PolarHBondContact O-N 2.83Å; R300-I304 VanDerWaalsContact O-N 3.09Å; Q301-I304 PolarHBondContact O-N 2.77Å; F302-I304 PolarHBondContact O-N 2.79Å; I304-N307 PolarHBondContact O-N 3.13Å; I304-I308 HydrophobicContact CG2-CD1 3.74Å; I304-I308 VanDerWaalsContact O-CG1 3.29Å; I304-I308 WeakPolarHBondContact O-CG1 3.14Å; I304-I308 PolarHBondContact O-N 3Å
305	Q	89	Confident	89.4	Confident	73 Å²	73	69 Å²	69	34%	0.341	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-42.4	-177	-69.1	-178.7	24.1	0	0	111.7	Q301 F302 N307 I308 A309 Y338	Q301-Q305 WeakPolarHBondContact O-CB 3.24Å; Q301-Q305 WeakPolarHBondContact O-CG 3.21Å; Q301-Q305 PolarHBondContact O-N 2.87Å; F302-Q305 PolarHBondContact O-N 2.92Å; Q305-N307 PolarHBondContact O-N 2.91Å; Q305-I308 PolarHBondContact O-N 2.78Å; Q305-A309 WeakPolarHBondContact O-CB 3.41Å; Q305-A309 PolarHBondContact O-N 2.86Å; Q305-Y338 HydrophobicContact CB-CD1 4.05Å; Q305-Y338 HydrophobicContact CB-CE1 3.81Å; Q305-Y338 HydrophobicContact CB-CE2 4.5Å; Q305-Y338 VanDerWaalsContact OE1-CE1 3.26Å
306	Y	88.8	Confident	89.4	Confident	41 Å²	41	70.1 Å²	70.1	16%	0.161	37%	0.366	C	S	.	.	H	α-helix	trans	-57.5	-48.5	175.3	-175.4	-86.9	0	0	0	111.6	F302 A309 M310 N331 L334 F335 Y338	F302-Y306 HydrophobicContact CZ-CD2 4.33Å; F302-Y306 WeakPolarHBondContact O-CB 3.49Å; F302-Y306 PolarHBondContact O-N 2.75Å; Y306-A309 PolarHBondContact O-N 2.77Å; Y306-M310 HydrophobicContact CE1-CE 4.06Å; Y306-M310 WeakPolarHBondContact O-CB 3.29Å; Y306-M310 PolarHBondContact O-N 3.02Å; Y306-N331 WeakPolarHBondContact OH-CB 3.33Å; Y306-N331 PolarHBondContact OH-OD1 2.76Å; Y306-L334 HydrophobicContact CD2-CB 4.05Å; Y306-L334 HydrophobicContact CE2-CB 3.8Å; Y306-F335 HydrophobicContact CE2-CB 4.43Å; Y306-Y338 HydrophobicContact CD2-CD2 4.49Å
307	N	85.9	Confident	89.5	Confident	82 Å²	82	73.3 Å²	73.3	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-42.8	-179.3	-73.1	-15.9	0	0	0	112.1	I303 I304 Q305 A309 M310 Q311	I303-N307 WeakPolarHBondContact O-CB 3.29Å; I303-N307 PolarHBondContact O-N 2.71Å; I303-N307 PolarHBondContact O-ND2 2.8Å; I304-N307 PolarHBondContact O-N 3.13Å; Q305-N307 PolarHBondContact O-N 2.91Å; N307-A309 VanDerWaalsContact C-N 3.34Å; N307-A309 PolarHBondContact O-N 2.8Å; N307-M310 PolarHBondContact O-N 3.32Å; N307-Q311 WeakPolarHBondContact O-CB 3.48Å; N307-Q311 VanDerWaalsContact O-CG 3.29Å; N307-Q311 WeakPolarHBondContact O-CG 3.38Å; N307-Q311 PolarHBondContact O-N 2.81Å
308	I	87.2	Confident	89.5	Confident	102 Å²	102	74.7 Å²	74.7	52%	0.523	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-44.9	175.5	-70.1	169	0	0	0	110.6	I304 Q305 Q311 K312	I304-I308 HydrophobicContact CG2-CD1 3.74Å; I304-I308 VanDerWaalsContact O-CG1 3.29Å; I304-I308 WeakPolarHBondContact O-CG1 3.14Å; I304-I308 PolarHBondContact O-N 3Å; Q305-I308 PolarHBondContact O-N 2.78Å; I308-Q311 PolarHBondContact O-N 3.42Å; I308-K312 WeakPolarHBondContact O-CB 3.44Å; I308-K312 PolarHBondContact O-N 2.73Å
309	A	91	Very high	89.4	Confident	14 Å²	14	79.6 Å²	79.6	12%	0.116	41%	0.409	C	S	.	.	H	α-helix	trans	-65.3	-43.6	179.3	0	0	0	0	0	111.7	Q305 Y306 N307 K312 Q313 L334 Y338	Q305-A309 WeakPolarHBondContact O-CB 3.41Å; Q305-A309 PolarHBondContact O-N 2.86Å; Y306-A309 PolarHBondContact O-N 2.77Å; N307-A309 VanDerWaalsContact C-N 3.34Å; N307-A309 PolarHBondContact O-N 2.8Å; A309-K312 WeakPolarHBondContact O-CB 3.34Å; A309-K312 PolarHBondContact O-N 3.14Å; A309-Q313 WeakPolarHBondContact O-CG 3.27Å; A309-Q313 PolarHBondContact O-N 3.47Å; A309-L334 HydrophobicContact CB-CD1 4.07Å; A309-L334 HydrophobicContact CB-CD2 3.71Å; A309-Y338 HydrophobicContact CB-CE2 3.82Å
310	M	87.7	Confident	89.3	Confident	19 Å²	19	78 Å²	78	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-61.3	-45.2	176	-173.8	57.6	64.8	0	0	112	Y306 N307 K312 Q313 L314 L327 V330 N331 L334	Y306-M310 HydrophobicContact CE1-CE 4.06Å; Y306-M310 WeakPolarHBondContact O-CB 3.29Å; Y306-M310 PolarHBondContact O-N 3.02Å; N307-M310 PolarHBondContact O-N 3.32Å; M310-K312 VanDerWaalsContact C-N 3.3Å; M310-K312 PolarHBondContact O-N 3.29Å; M310-Q313 PolarHBondContact O-N 2.83Å; M310-L314 HydrophobicContact CG-CD1 4.14Å; M310-L314 PolarHBondContact O-N 3.35Å; M310-L327 HydrophobicContact SD-CD1 4.12Å; M310-V330 HydrophobicContact CE-CG1 4.22Å; M310-V330 HydrophobicContact SD-CG1 4.22Å; M310-N331 HydrophobicContact CE-CB 4.47Å; M310-N331 WeakPolarHBondContact CE-OD1 3.47Å; M310-L334 HydrophobicContact CB-CD1 4.37Å; M310-L334 HydrophobicContact CE-CD1 3.7Å; M310-L334 HydrophobicContact SD-CD1 4.47Å
311	Q	86.9	Confident	89.1	Confident	134 Å²	134	73.5 Å²	73.5	63%	0.626	40%	0.395	S	S	*	.	H	α-helix	trans	-60.7	-40.4	176	-76.8	178.7	-15.8	0	0	111.7	N307 I308 Q313 L314 A315	N307-Q311 WeakPolarHBondContact O-CB 3.48Å; N307-Q311 VanDerWaalsContact O-CG 3.29Å; N307-Q311 WeakPolarHBondContact O-CG 3.38Å; N307-Q311 PolarHBondContact O-N 2.81Å; I308-Q311 PolarHBondContact O-N 3.42Å; Q311-Q313 VanDerWaalsContact C-N 3.33Å; Q311-Q313 PolarHBondContact O-N 3.22Å; Q311-L314 PolarHBondContact O-N 2.99Å; Q311-A315 VanDerWaalsContact O-CB 3.29Å; Q311-A315 WeakPolarHBondContact O-CB 3.17Å; Q311-A315 PolarHBondContact O-N 3.17Å
312	K	90.1	Very high	88.9	Confident	158 Å²	158	76 Å²	76	69%	0.687	41%	0.412	S	S	*	.	H	α-helix	trans	-63.3	-39.4	175.7	-171.4	-179.8	177.9	-175.5	0	112	I308 A309 M310 A316	I308-K312 WeakPolarHBondContact O-CB 3.44Å; I308-K312 PolarHBondContact O-N 2.73Å; A309-K312 WeakPolarHBondContact O-CB 3.34Å; A309-K312 PolarHBondContact O-N 3.14Å; M310-K312 VanDerWaalsContact C-N 3.3Å; M310-K312 PolarHBondContact O-N 3.29Å; K312-A316 WeakPolarHBondContact O-CB 3.27Å; K312-A316 PolarHBondContact O-N 3.49Å
313	Q	91.5	Very high	88.9	Confident	70 Å²	70	78.4 Å²	78.4	33%	0.327	43%	0.426	S	S	.	.	H	α-helix	trans	-64.7	-49.2	175.4	-69.8	-64.2	-16.4	0	0	111.6	A309 M310 Q311 A315 A316 H317 L320 V330 L334	A309-Q313 WeakPolarHBondContact O-CG 3.27Å; A309-Q313 PolarHBondContact O-N 3.47Å; M310-Q313 PolarHBondContact O-N 2.83Å; Q311-Q313 VanDerWaalsContact C-N 3.33Å; Q311-Q313 PolarHBondContact O-N 3.22Å; Q313-A315 VanDerWaalsContact C-N 3.29Å; Q313-A315 PolarHBondContact O-N 3.05Å; Q313-A316 PolarHBondContact O-N 2.98Å; Q313-H317 WeakPolarHBondContact O-CB 3.48Å; Q313-H317 PolarHBondContact O-N 3.33Å; Q313-L320 HydrophobicContact CB-CD1 4.23Å; Q313-V330 HydrophobicContact CB-CG1 4.07Å; Q313-V330 HydrophobicContact CG-CG1 3.86Å; Q313-L334 HydrophobicContact CG-CD1 4.4Å
314	L	87.6	Confident	89	Confident	62 Å²	62	82.6 Å²	82.6	33%	0.325	44%	0.444	S	S	.	.	H	α-helix	trans	-63.7	-32.9	178.1	-71	168.8	0	0	0	113	M310 Q311 H317 P318 L320 A321 L327	M310-L314 HydrophobicContact CG-CD1 4.14Å; M310-L314 PolarHBondContact O-N 3.35Å; Q311-L314 PolarHBondContact O-N 2.99Å; L314-H317 CarbonylContact O-C 3.51Å; L314-P318 WeakPolarHBondContact O-CA 3.41Å; L314-L320 HydrophobicContact CD2-CB 3.97Å; L314-A321 HydrophobicContact CD2-CB 4.45Å; L314-L327 HydrophobicContact CD2-CD1 4.26Å
315	A	88	Confident	89.4	Confident	80 Å²	80	83.7 Å²	83.7	66%	0.661	45%	0.454	S	S	*	.	H	α-helix	trans	-72.4	-36.2	175.9	0	0	0	0	0	112.7	Q311 Q313	Q311-A315 VanDerWaalsContact O-CB 3.29Å; Q311-A315 WeakPolarHBondContact O-CB 3.17Å; Q311-A315 PolarHBondContact O-N 3.17Å; Q313-A315 VanDerWaalsContact C-N 3.29Å; Q313-A315 PolarHBondContact O-N 3.05Å
316	A	92.8	Very high	89.6	Confident	65 Å²	65	81.3 Å²	81.3	54%	0.537	45%	0.446	S	S	.	.	H	α-helix	trans	-77.3	-31.2	176.9	0	0	0	0	0	112.6	K312 Q313	K312-A316 WeakPolarHBondContact O-CB 3.27Å; K312-A316 PolarHBondContact O-N 3.49Å; Q313-A316 PolarHBondContact O-N 2.98Å
317	H	91.8	Very high	89.7	Confident	84 Å²	84	81.6 Å²	81.6	39%	0.389	45%	0.451	S	S	.	.			trans	-133.2	74.6	-175.5	-63.7	-72	0	0	0	111.1	Q313 L314 E319 L320	Q313-H317 WeakPolarHBondContact O-CB 3.48Å; Q313-H317 PolarHBondContact O-N 3.33Å; L314-H317 CarbonylContact O-C 3.51Å; H317-E319 WeakPolarHBondContact CA-OE2 3.04Å; H317-E319 WeakPolarHBondContact CB-OE1 3.19Å; H317-E319 IonicContact CG-OE1 2.73Å; H317-E319 IonicContact ND1-OE1 3.65Å; H317-E319 PolarHBondContact ND1-OE1 3.31Å; H317-E319 PolarHBondContact O-N 3.46Å; H317-E319 VanDerWaalsContact O-N 3.1Å; H317-L320 HydrophobicContact CB-CD1 3.66Å; H317-L320 HydrophobicContact CB-CG 3.73Å; H317-L320 WeakPolarHBondContact O-CB 3.33Å; H317-L320 WeakPolarHBondContact O-CG 3.24Å; H317-L320 PolarHBondContact O-N 3.5Å
318	P	89.1	Confident	90.1	Very high	85 Å²	85	84.3 Å²	84.3	55%	0.552	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-58	-24	179.9	-24.2	35	0	0	0	113.8	L314 L320 A321	L314-P318 WeakPolarHBondContact O-CA 3.41Å; P318-L320 PolarHBondContact O-N 3Å; P318-A321 WeakPolarHBondContact O-CB 3.45Å; P318-A321 PolarHBondContact O-N 3.47Å
319	E	91.2	Very high	90.4	Very high	112 Å²	112	85.9 Å²	85.9	52%	0.523	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-59.5	-29.5	174.8	63.5	-83.6	-166.5	0	0	113.5	H317 A321 N322 D323	H317-E319 WeakPolarHBondContact CA-OE2 3.04Å; H317-E319 WeakPolarHBondContact CB-OE1 3.19Å; H317-E319 IonicContact CG-OE1 2.73Å; H317-E319 IonicContact ND1-OE1 3.65Å; H317-E319 PolarHBondContact ND1-OE1 3.31Å; H317-E319 PolarHBondContact O-N 3.46Å; H317-E319 VanDerWaalsContact O-N 3.1Å; E319-A321 PolarHBondContact O-N 2.93Å; E319-A321 VanDerWaalsContact O-N 3.14Å; E319-N322 PolarHBondContact O-N 3.17Å; E319-D323 PolarHBondContact O-N 2.92Å
320	L	88.9	Confident	90.6	Very high	15 Å²	15	86.5 Å²	86.5	8%	0.079	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-58.6	-28.3	178.1	-70.4	175.4	0	0	0	112.5	Q313 L314 H317 P318 N322 D323 A326 V330	Q313-L320 HydrophobicContact CB-CD1 4.23Å; L314-L320 HydrophobicContact CD2-CB 3.97Å; H317-L320 HydrophobicContact CB-CD1 3.66Å; H317-L320 HydrophobicContact CB-CG 3.73Å; H317-L320 WeakPolarHBondContact O-CB 3.33Å; H317-L320 WeakPolarHBondContact O-CG 3.24Å; H317-L320 PolarHBondContact O-N 3.5Å; P318-L320 PolarHBondContact O-N 3Å; L320-N322 PolarHBondContact O-N 3.18Å; L320-D323 PolarHBondContact O-N 3.01Å; L320-A326 HydrophobicContact CD2-CB 3.6Å; L320-V330 HydrophobicContact CD1-CG2 4.13Å; L320-V330 HydrophobicContact CD2-CG2 4.19Å
321	A	83.4	Confident	90.8	Very high	67 Å²	67	88 Å²	88	55%	0.554	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-63.4	-21.6	179	0	0	0	0	0	113	L314 P318 E319	L314-A321 HydrophobicContact CD2-CB 4.45Å; P318-A321 WeakPolarHBondContact O-CB 3.45Å; P318-A321 PolarHBondContact O-N 3.47Å; E319-A321 PolarHBondContact O-N 2.93Å; E319-A321 VanDerWaalsContact O-N 3.14Å
322	N	88.6	Confident	91.2	Very high	153 Å²	153	84.5 Å²	84.5	82%	0.818	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-112.6	1.2	-179	-60	-48.2	0	0	0	113.3	E319 L320	E319-N322 PolarHBondContact O-N 3.17Å; L320-N322 PolarHBondContact O-N 3.18Å
323	D	92.3	Very high	91.5	Very high	77 Å²	77	79.9 Å²	79.9	41%	0.412	46%	0.461	S	S	.	.			trans	-117.6	95.6	179	-171.1	-26.7	0	0	0	109.7	E319 L320 V325 A326 L327	E319-D323 PolarHBondContact O-N 2.92Å; L320-D323 PolarHBondContact O-N 3.01Å; D323-V325 VanDerWaalsContact C-N 3.26Å; D323-V325 PolarHBondContact O-N 2.91Å; D323-V325 PolarHBondContact OD1-N 3.43Å; D323-V325 VanDerWaalsContact OD1-N 3.15Å; D323-A326 HydrophobicContact CB-CB 3.93Å; D323-A326 VanDerWaalsContact CG-CB 3.45Å; D323-A326 PolarHBondContact O-N 2.86Å; D323-A326 PolarHBondContact OD1-N 2.73Å; D323-L327 VanDerWaalsContact O-CB 3.24Å; D323-L327 WeakPolarHBondContact O-CB 3.25Å; D323-L327 PolarHBondContact O-N 2.68Å
324	E	91.5	Very high	91.6	Very high	172 Å²	172	77 Å²	77	80%	0.804	45%	0.448	S	S	*	.	H	α-helix	trans	-61.5	-33.7	-177.2	-65.8	-174	163.7	0	0	112.8	Q328	E324-Q328 WeakPolarHBondContact O-CB 3.46Å; E324-Q328 PolarHBondContact O-N 3.4Å
325	V	93.9	Very high	92	Very high	93 Å²	93	78.9 Å²	78.9	56%	0.564	45%	0.454	S	S	*	.	H	α-helix	trans	-73.7	-50	-178.1	178.7	0	0	0	0	109.7	D323 L327 Q328 E329	D323-V325 VanDerWaalsContact C-N 3.26Å; D323-V325 PolarHBondContact O-N 2.91Å; D323-V325 PolarHBondContact OD1-N 3.43Å; D323-V325 VanDerWaalsContact OD1-N 3.15Å; V325-L327 VanDerWaalsContact C-N 3.26Å; V325-L327 PolarHBondContact O-N 3.46Å; V325-Q328 WeakPolarHBondContact O-CB 3.33Å; V325-Q328 PolarHBondContact O-N 3.41Å; V325-Q328 VanDerWaalsContact O-N 3.1Å; V325-E329 PolarHBondContact O-N 2.94Å
326	A	93.2	Very high	92.3	Very high	22 Å²	22	82.9 Å²	82.9	18%	0.182	46%	0.456	C	S	.	.	H	α-helix	trans	-60.3	-39.2	176.3	0	0	0	0	0	111.3	L320 D323 Q328 E329 V330	L320-A326 HydrophobicContact CD2-CB 3.6Å; D323-A326 HydrophobicContact CB-CB 3.93Å; D323-A326 VanDerWaalsContact CG-CB 3.45Å; D323-A326 PolarHBondContact O-N 2.86Å; D323-A326 PolarHBondContact OD1-N 2.73Å; A326-Q328 PolarHBondContact O-N 2.85Å; A326-E329 PolarHBondContact O-N 3.31Å; A326-V330 WeakPolarHBondContact O-CG2 3.12Å; A326-V330 PolarHBondContact O-N 2.82Å
327	L	91.5	Very high	92.4	Very high	48 Å²	48	85.6 Å²	85.6	25%	0.251	46%	0.458	S	S	.	.	H	α-helix	trans	-64.1	-39.6	175.4	-170.7	64.5	0	0	0	111.9	M310 L314 D323 V325 V330 N331	M310-L327 HydrophobicContact SD-CD1 4.12Å; L314-L327 HydrophobicContact CD2-CD1 4.26Å; D323-L327 VanDerWaalsContact O-CB 3.24Å; D323-L327 WeakPolarHBondContact O-CB 3.25Å; D323-L327 PolarHBondContact O-N 2.68Å; V325-L327 VanDerWaalsContact C-N 3.26Å; V325-L327 PolarHBondContact O-N 3.46Å; L327-V330 PolarHBondContact O-N 3.35Å; L327-N331 WeakPolarHBondContact O-CB 3.27Å; L327-N331 VanDerWaalsContact O-CG 3.28Å; L327-N331 PolarHBondContact O-N 3.37Å; L327-N331 PolarHBondContact O-ND2 2.92Å
328	Q	93.5	Very high	92.5	Very high	138 Å²	138	83.4 Å²	83.4	65%	0.645	45%	0.446	S	S	*	.	H	α-helix	trans	-63.1	-40.8	175.6	-174.1	176.4	5.9	0	0	112.1	E324 V325 A326 N331 A332	E324-Q328 WeakPolarHBondContact O-CB 3.46Å; E324-Q328 PolarHBondContact O-N 3.4Å; V325-Q328 WeakPolarHBondContact O-CB 3.33Å; V325-Q328 PolarHBondContact O-N 3.41Å; V325-Q328 VanDerWaalsContact O-N 3.1Å; A326-Q328 PolarHBondContact O-N 2.85Å; Q328-N331 PolarHBondContact O-N 2.83Å; Q328-A332 WeakPolarHBondContact O-CB 3.3Å; Q328-A332 PolarHBondContact O-N 2.75Å
329	E	94.5	Very high	92.8	Very high	135 Å²	135	81.7 Å²	81.7	63%	0.631	43%	0.433	S	S	*	.	H	α-helix	trans	-64.1	-44	176.3	-69	-176.4	165.6	0	0	112	V325 A326 A332 A333	V325-E329 PolarHBondContact O-N 2.94Å; A326-E329 PolarHBondContact O-N 3.31Å; E329-A332 PolarHBondContact O-N 2.82Å; E329-A333 WeakPolarHBondContact O-CB 3.46Å; E329-A333 PolarHBondContact O-N 2.86Å
330	V	94.3	Very high	93	Very high	27 Å²	27	78.9 Å²	78.9	16%	0.164	42%	0.424	C	S	.	.	H	α-helix	trans	-62.2	-45.3	175	172	0	0	0	0	111.1	M310 Q313 L320 A326 L327 A332 A333 L334	M310-V330 HydrophobicContact CE-CG1 4.22Å; M310-V330 HydrophobicContact SD-CG1 4.22Å; Q313-V330 HydrophobicContact CB-CG1 4.07Å; Q313-V330 HydrophobicContact CG-CG1 3.86Å; L320-V330 HydrophobicContact CD1-CG2 4.13Å; L320-V330 HydrophobicContact CD2-CG2 4.19Å; A326-V330 WeakPolarHBondContact O-CG2 3.12Å; A326-V330 PolarHBondContact O-N 2.82Å; L327-V330 PolarHBondContact O-N 3.35Å; V330-A332 VanDerWaalsContact C-N 3.34Å; V330-A332 PolarHBondContact O-N 3.41Å; V330-A333 PolarHBondContact O-N 2.88Å; V330-L334 HydrophobicContact CG1-CD1 3.97Å; V330-L334 HydrophobicContact CG1-CG 4.43Å; V330-L334 WeakPolarHBondContact O-CG 3.39Å; V330-L334 PolarHBondContact O-N 2.85Å
331	N	92.8	Very high	93.3	Very high	52 Å²	52	79.4 Å²	79.4	28%	0.278	43%	0.427	S	S	.	.	H	α-helix	trans	-57.2	-46.7	175	-77.2	-57.2	0	0	0	111.2	Y306 M310 L327 Q328 A333 L334 F335	Y306-N331 WeakPolarHBondContact OH-CB 3.33Å; Y306-N331 PolarHBondContact OH-OD1 2.76Å; M310-N331 HydrophobicContact CE-CB 4.47Å; M310-N331 WeakPolarHBondContact CE-OD1 3.47Å; L327-N331 WeakPolarHBondContact O-CB 3.27Å; L327-N331 VanDerWaalsContact O-CG 3.28Å; L327-N331 PolarHBondContact O-N 3.37Å; L327-N331 PolarHBondContact O-ND2 2.92Å; Q328-N331 PolarHBondContact O-N 2.83Å; N331-A333 PolarHBondContact O-N 2.9Å; N331-L334 PolarHBondContact O-N 2.78Å; N331-F335 VanDerWaalsContact O-CB 3.24Å; N331-F335 WeakPolarHBondContact O-CB 3.43Å; N331-F335 PolarHBondContact O-N 2.81Å
332	A	95	Very high	93.9	Very high	60 Å²	60	78.2 Å²	78.2	50%	0.496	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-40.9	-180	0	0	0	0	0	112.3	Q328 E329 V330 K336	Q328-A332 WeakPolarHBondContact O-CB 3.3Å; Q328-A332 PolarHBondContact O-N 2.75Å; E329-A332 PolarHBondContact O-N 2.82Å; V330-A332 VanDerWaalsContact C-N 3.34Å; V330-A332 PolarHBondContact O-N 3.41Å; A332-K336 WeakPolarHBondContact O-CB 3.48Å; A332-K336 PolarHBondContact O-N 3.42Å
333	A	95.8	Very high	94.3	Very high	60 Å²	60	71.2 Å²	71.2	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-48.1	176.9	0	0	0	0	0	112	E329 V330 N331 K336 E337	E329-A333 WeakPolarHBondContact O-CB 3.46Å; E329-A333 PolarHBondContact O-N 2.86Å; V330-A333 PolarHBondContact O-N 2.88Å; N331-A333 PolarHBondContact O-N 2.9Å; A333-K336 PolarHBondContact O-N 2.89Å; A333-E337 PolarHBondContact O-N 3.31Å
334	L	95	Very high	94.5	Very high	10 Å²	10	73.1 Å²	73.1	5%	0.052	38%	0.378	C	S	.	.	H	α-helix	trans	-67.2	-39.4	178.7	-69.5	177.4	0	0	0	112.2	Y306 A309 M310 Q313 V330 N331 K336 E337 Y338	Y306-L334 HydrophobicContact CD2-CB 4.05Å; Y306-L334 HydrophobicContact CE2-CB 3.8Å; A309-L334 HydrophobicContact CB-CD1 4.07Å; A309-L334 HydrophobicContact CB-CD2 3.71Å; M310-L334 HydrophobicContact CB-CD1 4.37Å; M310-L334 HydrophobicContact CE-CD1 3.7Å; M310-L334 HydrophobicContact SD-CD1 4.47Å; Q313-L334 HydrophobicContact CG-CD1 4.4Å; V330-L334 HydrophobicContact CG1-CD1 3.97Å; V330-L334 HydrophobicContact CG1-CG 4.43Å; V330-L334 WeakPolarHBondContact O-CG 3.39Å; V330-L334 PolarHBondContact O-N 2.85Å; N331-L334 PolarHBondContact O-N 2.78Å; L334-K336 VanDerWaalsContact C-N 3.33Å; L334-K336 PolarHBondContact O-N 2.96Å; L334-E337 PolarHBondContact O-N 2.84Å; L334-Y338 HydrophobicContact CD2-CE2 4.2Å; L334-Y338 VanDerWaalsContact O-CD2 3.23Å; L334-Y338 WeakPolarHBondContact O-CD2 3.19Å; L334-Y338 PolarHBondContact O-N 2.78Å
335	F	94.8	Very high	94.6	Very high	102 Å²	102	65.4 Å²	65.4	45%	0.447	34%	0.343	S	S	.	.	H	α-helix	trans	-58.4	-48.5	173.6	-177.4	-94.2	0	0	0	110.3	F302 Y306 N331 E337 Y338 L339	F302-F335 HydrophobicContact CE2-CD2 4.34Å; F302-F335 AromaticContact CZ-CD2 3.72Å; F302-F335 HydrophobicContact CZ-CD2 3.72Å; F302-F335 AromaticContact CZ-CE2 3.91Å; F302-F335 HydrophobicContact CZ-CE2 3.91Å; Y306-F335 HydrophobicContact CE2-CB 4.43Å; N331-F335 VanDerWaalsContact O-CB 3.24Å; N331-F335 WeakPolarHBondContact O-CB 3.43Å; N331-F335 PolarHBondContact O-N 2.81Å; F335-E337 VanDerWaalsContact C-N 3.34Å; F335-E337 PolarHBondContact O-N 2.82Å; F335-Y338 PolarHBondContact O-N 2.69Å; F335-L339 HydrophobicContact CE1-CD1 3.96Å; F335-L339 HydrophobicContact CE1-CD2 4.16Å; F335-L339 HydrophobicContact CE1-CG 4.44Å; F335-L339 HydrophobicContact CZ-CD1 3.9Å; F335-L339 WeakPolarHBondContact O-CA 3.47Å; F335-L339 WeakPolarHBondContact O-CB 3.34Å; F335-L339 PolarHBondContact O-N 2.84Å
336	K	93.7	Very high	94.7	Very high	164 Å²	164	63.6 Å²	63.6	71%	0.713	33%	0.328	S	S	*	.	H	α-helix	trans	-61.9	-38.4	177.3	-174.8	176.9	-179.2	177.9	0	112.8	A332 A333 L334	A332-K336 WeakPolarHBondContact O-CB 3.48Å; A332-K336 PolarHBondContact O-N 3.42Å; A333-K336 PolarHBondContact O-N 2.89Å; L334-K336 VanDerWaalsContact C-N 3.33Å; L334-K336 PolarHBondContact O-N 2.96Å
337	E	95.4	Very high	94.9	Very high	122 Å²	122	63 Å²	63	57%	0.57	32%	0.322	S	S	*	.	H	α-helix	trans	-62.5	-44.3	177.4	-176.6	-178.9	161.5	0	0	112.1	A333 L334 F335 P340	A333-E337 PolarHBondContact O-N 3.31Å; L334-E337 PolarHBondContact O-N 2.84Å; F335-E337 VanDerWaalsContact C-N 3.34Å; F335-E337 PolarHBondContact O-N 2.82Å; E337-P340 WeakPolarHBondContact O-CD 3.12Å
338	Y	94.8	Very high	95.2	Very high	37 Å²	37	62 Å²	62	15%	0.145	32%	0.318	C	S	.	.	H	α-helix	trans	-95.4	-11.7	-175.1	-64.1	-61.2	0	0	0	114.6	Q305 Y306 A309 L334 F335 P340 L341	Q305-Y338 HydrophobicContact CB-CD1 4.05Å; Q305-Y338 HydrophobicContact CB-CE1 3.81Å; Q305-Y338 HydrophobicContact CB-CE2 4.5Å; Q305-Y338 VanDerWaalsContact OE1-CE1 3.26Å; Y306-Y338 HydrophobicContact CD2-CD2 4.49Å; A309-Y338 HydrophobicContact CB-CE2 3.82Å; L334-Y338 HydrophobicContact CD2-CE2 4.2Å; L334-Y338 VanDerWaalsContact O-CD2 3.23Å; L334-Y338 WeakPolarHBondContact O-CD2 3.19Å; L334-Y338 PolarHBondContact O-N 2.78Å; F335-Y338 PolarHBondContact O-N 2.69Å; Y338-P340 VanDerWaalsContact C-N 3.28Å; Y338-L341 HydrophobicContact CD1-CD1 4.1Å; Y338-L341 VanDerWaalsContact O-CB 3.28Å; Y338-L341 WeakPolarHBondContact O-CB 3.3Å; Y338-L341 WeakPolarHBondContact O-CG 3.25Å; Y338-L341 PolarHBondContact O-N 2.92Å
339	L	94.6	Very high	95.4	Very high	50 Å²	50	57.5 Å²	57.5	26%	0.262	30%	0.298	S	S	.	.	H	α-helix	trans	-49.2	-40.8	176.9	-179.9	62.6	0	0	0	113.5	F335 L341 L342 Q343	F335-L339 HydrophobicContact CE1-CD1 3.96Å; F335-L339 HydrophobicContact CE1-CD2 4.16Å; F335-L339 HydrophobicContact CE1-CG 4.44Å; F335-L339 HydrophobicContact CZ-CD1 3.9Å; F335-L339 WeakPolarHBondContact O-CA 3.47Å; F335-L339 WeakPolarHBondContact O-CB 3.34Å; F335-L339 PolarHBondContact O-N 2.84Å; L339-L341 PolarHBondContact O-N 3.07Å; L339-L342 PolarHBondContact O-N 3.38Å; L339-Q343 HydrophobicContact CD1-CG 4.31Å; L339-Q343 HydrophobicContact CG-CG 4.02Å; L339-Q343 WeakPolarHBondContact O-CG 3.45Å; L339-Q343 PolarHBondContact O-N 2.8Å; L339-Q343 VanDerWaalsContact O-N 3.11Å
340	P	95.9	Very high	95.6	Very high	52 Å²	52	53.7 Å²	53.7	34%	0.338	28%	0.28	S	S	.	.	H	α-helix	trans	-56.9	-24.4	177.2	-28.6	37.4	0	0	0	114.9	E337 Y338 L342 Q343 K344 P373	E337-P340 WeakPolarHBondContact O-CD 3.12Å; Y338-P340 VanDerWaalsContact C-N 3.28Å; P340-L342 VanDerWaalsContact C-N 3.33Å; P340-Q343 PolarHBondContact O-N 2.98Å; P340-K344 WeakPolarHBondContact O-CG 3.24Å; P340-K344 PolarHBondContact O-N 2.86Å; P340-P373 HydrophobicContact CB-CG 4.48Å
341	L	95.8	Very high	95.8	Very high	27 Å²	27	56.6 Å²	56.6	14%	0.141	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-44.5	173.5	-65.3	175.1	0	0	0	111.1	A298 Y338 L339	A298-L341 WeakPolarHBondContact CB-O 3.41Å; Y338-L341 HydrophobicContact CD1-CD1 4.1Å; Y338-L341 VanDerWaalsContact O-CB 3.28Å; Y338-L341 WeakPolarHBondContact O-CB 3.3Å; Y338-L341 WeakPolarHBondContact O-CG 3.25Å; Y338-L341 PolarHBondContact O-N 2.92Å; L339-L341 PolarHBondContact O-N 3.07Å
342	L	96	Very high	96.1	Very high	41 Å²	41	55.6 Å²	55.6	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-74.6	-32.6	179.4	-56.9	-177.8	0	0	0	111.7	V299 F302 L339 P340 K344 S345	V299-L342 HydrophobicContact CB-CD2 4.4Å; V299-L342 HydrophobicContact CG2-CD2 3.86Å; F302-L342 HydrophobicContact CB-CD2 3.72Å; F302-L342 HydrophobicContact CB-CG 4.15Å; F302-L342 HydrophobicContact CD1-CD1 4.18Å; F302-L342 HydrophobicContact CD2-CD1 3.86Å; F302-L342 HydrophobicContact CD2-CD2 4.38Å; F302-L342 HydrophobicContact CD2-CG 3.87Å; F302-L342 HydrophobicContact CE1-CD1 4.38Å; F302-L342 HydrophobicContact CE2-CD1 4.06Å; F302-L342 HydrophobicContact CE2-CG 4.49Å; F302-L342 HydrophobicContact CG-CD1 3.94Å; F302-L342 HydrophobicContact CG-CD2 3.99Å; F302-L342 HydrophobicContact CG-CG 3.97Å; F302-L342 HydrophobicContact CZ-CD1 4.33Å; L339-L342 PolarHBondContact O-N 3.38Å; P340-L342 VanDerWaalsContact C-N 3.33Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.04Å; L342-S345 PolarHBondContact O-OG 3.29Å
343	Q	96.5	Very high	96.2	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.028	28%	0.277	C	S	.	.	H	α-helix	trans	-69.8	-21.7	-179.4	-66.7	178.5	-68.9	0	0	113.6	L339 P340 S345 E346 I370 D383	L339-Q343 HydrophobicContact CD1-CG 4.31Å; L339-Q343 HydrophobicContact CG-CG 4.02Å; L339-Q343 WeakPolarHBondContact O-CG 3.45Å; L339-Q343 PolarHBondContact O-N 2.8Å; L339-Q343 VanDerWaalsContact O-N 3.11Å; P340-Q343 PolarHBondContact O-N 2.98Å; Q343-S345 PolarHBondContact O-N 2.78Å; Q343-E346 WeakPolarHBondContact O-CA 3.47Å; Q343-E346 PolarHBondContact O-N 2.87Å; Q343-I370 HydrophobicContact CB-CG2 4.16Å; Q343-I370 HydrophobicContact CG-CG2 3.63Å; Q343-D383 PolarHBondContact NE2-OD1 3.11Å
344	K	95.5	Very high	96.3	Very high	117 Å²	117	56.3 Å²	56.3	51%	0.509	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-32.5	-178.8	-82.2	175.4	-177.2	179.7	0	114.3	P340 L342	P340-K344 WeakPolarHBondContact O-CG 3.24Å; P340-K344 PolarHBondContact O-N 2.86Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.04Å
345	S	94.7	Very high	96.5	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.07	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.3	177	72.1	0	0	0	0	113.1	S293 L342 Q343	S293-S345 VanDerWaalsContact O-CB 3.24Å; S293-S345 WeakPolarHBondContact O-CB 3.39Å; S293-S345 PolarHBondContact O-OG 2.87Å; L342-S345 PolarHBondContact O-OG 3.29Å; Q343-S345 PolarHBondContact O-N 2.78Å
346	E	96	Very high	96.6	Very high	56 Å²	56	57.4 Å²	57.4	26%	0.262	27%	0.273	S	S	.	.			trans	50	55.2	-179.7	-54.8	-170.7	116.9	0	0	112.5	Q343 I370 D372 K385	Q343-E346 WeakPolarHBondContact O-CA 3.47Å; Q343-E346 PolarHBondContact O-N 2.87Å; E346-I370 CarbonylContact C-O 3.54Å; E346-I370 WeakPolarHBondContact CA-O 3.45Å; E346-I370 WeakPolarHBondContact CB-O 3.39Å; E346-D372 HydrophobicContact CG-CB 3.7Å; E346-D372 PolarHBondContact OE1-N 3.09Å; E346-K385 WeakPolarHBondContact OE1-CE 3.21Å; E346-K385 IonicContact OE1-NZ 2.87Å; E346-K385 PolarHBondContact OE1-NZ 2.78Å; E346-K385 IonicContact OE2-NZ 3.07Å; E346-K385 PolarHBondContact OE2-NZ 2.78Å
347	P	96.7	Very high	96.8	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.052	24%	0.242	C	C	.	.			trans	-67.2	157.4	-171.7	29.6	-36.2	0	0	0	112	E292 I294 I370	E292-P347 WeakPolarHBondContact O-CA 3.45Å; E292-P347 WeakPolarHBondContact O-CB 3.17Å; I294-P347 HydrophobicContact CD1-CB 3.59Å; I294-P347 HydrophobicContact CD1-CG 4.29Å; P347-I370 HydrophobicContact CG-CB 4.09Å; P347-I370 HydrophobicContact CG-CG1 4.26Å; P347-I370 VanDerWaalsContact O-CB 3.3Å; P347-I370 WeakPolarHBondContact O-CB 3.48Å; P347-I370 WeakPolarHBondContact O-CG1 3.3Å; P347-I370 PolarHBondContact O-N 3.37Å
348	T	97.9	Very high	96.8	Very high	27 Å²	27	48.8 Å²	48.8	17%	0.166	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.7	168.2	-64.1	0	0	0	0	109.4	E292 K350 I368 S369	E292-T348 PolarHBondContact N-O 2.94Å; E292-T348 PolarHBondContact O-N 2.79Å; E292-T348 VanDerWaalsContact O-N 3.13Å; T348-K350 HydrophobicContact CG2-CG 4.04Å; T348-I368 CarbonylContact C-O 3.54Å; T348-I368 WeakPolarHBondContact CA-O 3.35Å; T348-S369 PolarHBondContact OG1-OG 2.99Å; T348-S369 VanDerWaalsContact OG1-OG 3.06Å
349	I	98.2	Very high	96.9	Very high	44 Å²	44	51.2 Å²	51.2	23%	0.226	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.7	177.1	-53.5	-51.4	0	0	0	108.6	L289 I290 A291 D367 I368	L289-I349 HydrophobicContact CD1-CG2 3.72Å; I290-I349 CarbonylContact O-C 3.6Å; I290-I349 WeakPolarHBondContact O-CA 3.49Å; A291-I349 HydrophobicContact CB-CD1 3.55Å; I349-D367 CarbonylContact O-C 3.56Å; I349-D367 WeakPolarHBondContact O-CA 3.29Å; I349-I368 PolarHBondContact N-O 3.06Å; I349-I368 PolarHBondContact O-N 3.44Å
350	K	98.6	Very high	97	Very high	56 Å²	56	50.1 Å²	50.1	24%	0.243	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.8	178.4	-43.2	-178.3	176.5	160	0	110.3	I290 E292 T348 L366 D367	I290-K350 HydrophobicContact CB-CB 4.12Å; I290-K350 PolarHBondContact N-O 3Å; I290-K350 PolarHBondContact O-N 2.86Å; E292-K350 IonicContact OE1-NZ 2.85Å; E292-K350 PolarHBondContact OE1-NZ 2.82Å; E292-K350 VanDerWaalsContact OE2-CE 3.27Å; E292-K350 WeakPolarHBondContact OE2-CE 3.29Å; E292-K350 IonicContact OE2-NZ 3.44Å; E292-K350 PolarHBondContact OE2-NZ 2.79Å; T348-K350 HydrophobicContact CG2-CG 4.04Å; K350-L366 CarbonylContact C-O 3.5Å; K350-L366 WeakPolarHBondContact CA-O 3.44Å; K350-D367 VanDerWaalsContact CB-OD1 3.22Å; K350-D367 WeakPolarHBondContact CB-OD1 3.29Å; K350-D367 WeakPolarHBondContact CD-OD1 3.12Å; K350-D367 HydrophobicContact CG-CB 4.5Å; K350-D367 WeakPolarHBondContact CG-OD1 3.33Å
351	Q	98.2	Very high	97.1	Very high	87 Å²	87	49.8 Å²	49.8	41%	0.407	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	79.9	178.4	-67.7	-177.6	-26.5	0	0	110.4	S288 L289 L366	S288-Q351 VanDerWaalsContact O-CA 3.29Å; S288-Q351 WeakPolarHBondContact O-CA 3.28Å; L289-Q351 HydrophobicContact CD1-CG 3.75Å; Q351-L366 HydrophobicContact CB-CB 4.3Å; Q351-L366 PolarHBondContact N-O 2.8Å; Q351-L366 PolarHBondContact O-N 3.39Å
352	P	98.3	Very high	97.1	Very high	31 Å²	31	50.2 Å²	50.2	20%	0.201	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	137.6	170.7	32.9	-35.1	0	0	0	110.5	S288 I290 A364 N365	S288-P352 PolarHBondContact N-O 2.63Å; S288-P352 WeakPolarHBondContact O-CD 3.28Å; I290-P352 HydrophobicContact CD1-CG 4.11Å; P352-A364 CarbonylContact C-O 3.49Å; P352-N365 WeakPolarHBondContact CA-OD1 3.49Å; P352-N365 WeakPolarHBondContact CB-OD1 3.28Å
353	V	98.2	Very high	97.2	Very high	45 Å²	45	50.6 Å²	50.6	27%	0.273	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128.9	177.3	177.6	0	0	0	0	108.3	E286 W287 N363 A364	E286-V353 CarbonylContact O-C 3.52Å; E286-V353 WeakPolarHBondContact O-CA 3.32Å; W287-V353 HydrophobicContact CG-CG1 4.29Å; W287-V353 HydrophobicContact CG-CG2 4.47Å; V353-N363 CarbonylContact O-C 3.41Å; V353-N363 WeakPolarHBondContact O-CA 3.1Å; V353-A364 HydrophobicContact CB-CB 4.41Å; V353-A364 PolarHBondContact N-O 2.96Å; V353-A364 PolarHBondContact O-N 3.37Å
354	R	98.1	Very high	97.3	Very high	91 Å²	91	51.4 Å²	51.4	34%	0.343	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.9	179.5	-178.8	170.6	-178.8	-147.4	12.7	110.2	G285 E286 E361 L362 N363	G285-R354 CarbonylContact C-O 3.5Å; G285-R354 WeakPolarHBondContact CA-O 3.33Å; E286-R354 HydrophobicContact CB-CB 4.45Å; E286-R354 PolarHBondContact N-O 2.88Å; E286-R354 PolarHBondContact O-N 2.75Å; R354-E361 VanDerWaalsContact CZ-CD 3.45Å; R354-E361 IonicContact CZ-OE1 2.69Å; R354-E361 IonicContact CZ-OE2 3.88Å; R354-E361 VanDerWaalsContact NE-CD 3.27Å; R354-E361 IonicContact NE-OE1 3.39Å; R354-E361 IonicContact NE-OE2 2.73Å; R354-E361 PolarHBondContact NE-OE2 3.37Å; R354-E361 IonicContact NH2-OE1 2.84Å; R354-E361 PolarHBondContact NH2-OE1 3.33Å; R354-E361 IonicContact NH2-OE2 2.68Å; R354-E361 PolarHBondContact NH2-OE2 2.87Å; R354-L362 WeakPolarHBondContact CA-O 3.43Å; R354-N363 WeakPolarHBondContact CD-OD1 3.33Å; R354-N363 VanDerWaalsContact CG-OD1 3.26Å; R354-N363 WeakPolarHBondContact CG-OD1 3.49Å
355	W	98	Very high	97.4	Very high	39 Å²	39	48.8 Å²	48.8	15%	0.148	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	134	168.4	-178.4	-85.9	0	0	0	109.6	L275 L282 S284 W287 E361 L362	L275-W355 HydrophobicContact CB-CH2 4.25Å; L275-W355 HydrophobicContact CD2-CH2 3.84Å; L275-W355 HydrophobicContact CD2-CZ2 4.45Å; L282-W355 HydrophobicContact CB-CZ2 4.24Å; L282-W355 PolarHBondContact O-NE1 2.74Å; S284-W355 CarbonylContact O-C 3.46Å; S284-W355 WeakPolarHBondContact O-CA 3.46Å; W287-W355 HydrophobicContact CH2-CE3 4.23Å; W287-W355 HydrophobicContact CH2-CZ3 4.02Å; W287-W355 HydrophobicContact CZ2-CE3 4.24Å; W287-W355 HydrophobicContact CZ2-CZ3 4.34Å; W355-E361 CarbonylContact O-C 3.55Å; W355-E361 VanDerWaalsContact O-CA 3.29Å; W355-E361 WeakPolarHBondContact O-CA 3.32Å; W355-L362 HydrophobicContact CB-CD1 3.58Å; W355-L362 HydrophobicContact CB-CD2 4.06Å; W355-L362 HydrophobicContact CB-CG 3.69Å; W355-L362 HydrophobicContact CG-CD2 4.38Å; W355-L362 HydrophobicContact CG-CG 4.48Å; W355-L362 PolarHBondContact N-O 2.8Å; W355-L362 PolarHBondContact O-N 2.79Å
356	K	98.2	Very high	97.6	Very high	95 Å²	95	50.1 Å²	50.1	41%	0.413	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134	-175.4	-178.2	174	-169.2	143.4	0	110.1	G283 S284 G360 E361	G283-K356 CarbonylContact C-O 3.5Å; G283-K356 WeakPolarHBondContact CA-O 3.25Å; S284-K356 PolarHBondContact N-O 2.79Å; S284-K356 PolarHBondContact O-N 2.81Å; K356-G360 WeakPolarHBondContact CA-O 3.49Å; K356-E361 HydrophobicContact CB-CG 3.77Å; K356-E361 HydrophobicContact CD-CG 4.01Å; K356-E361 VanDerWaalsContact CD-OE1 3.3Å; K356-E361 WeakPolarHBondContact CD-OE1 3.25Å; K356-E361 WeakPolarHBondContact CE-OE1 3.47Å; K356-E361 HydrophobicContact CG-CG 3.61Å; K356-E361 IonicContact NZ-OE1 2.86Å; K356-E361 PolarHBondContact NZ-OE1 3.12Å
357	N	97.3	Very high	97.7	Very high	14 Å²	14	49.7 Å²	49.7	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	-168.6	165.9	70.3	23.5	0	0	0	110.4	L359 G360 V397 T401	N357-L359 PolarHBondContact O-N 3.17Å; N357-L359 PolarHBondContact OD1-N 3.1Å; N357-G360 PolarHBondContact N-O 2.65Å; N357-G360 PolarHBondContact O-N 2.52Å; N357-G360 PolarHBondContact OD1-N 3.32Å; N357-V397 PolarHBondContact ND2-O 3.48Å; N357-T401 PolarHBondContact ND2-OG1 3.39Å
358	A	95.9	Very high	97.8	Very high	91 Å²	91	51.2 Å²	51.2	75%	0.752	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.1	-177.4	0	0	0	0	0	114.4
359	L	97.1	Very high	97.8	Very high	88 Å²	88	51.2 Å²	51.2	46%	0.461	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-3.6	-175.7	-61.4	-169	0	0	0	114.2	N357 N396 V397 E400	N357-L359 PolarHBondContact O-N 3.17Å; N357-L359 PolarHBondContact OD1-N 3.1Å; L359-N396 HydrophobicContact CD1-CB 4.36Å; L359-N396 PolarHBondContact O-ND2 3.38Å; L359-V397 HydrophobicContact CB-CG2 4.45Å; L359-E400 HydrophobicContact CD1-CB 3.65Å; L359-E400 HydrophobicContact CD1-CG 3.94Å; L359-E400 HydrophobicContact CG-CB 4.08Å; L359-E400 HydrophobicContact CG-CG 3.97Å
360	G	97	Very high	97.8	Very high	27 Å²	27	50.7 Å²	50.7	28%	0.278	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	140.3	-152.5	180	0	0	0	0	0	112.9	K356 N357	K356-G360 WeakPolarHBondContact CA-O 3.49Å; N357-G360 PolarHBondContact N-O 2.65Å; N357-G360 PolarHBondContact O-N 2.52Å; N357-G360 PolarHBondContact OD1-N 3.32Å
361	E	97	Very high	97.7	Very high	46 Å²	46	48.1 Å²	48.1	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.5	-166.4	-64.1	170.5	-179.9	0	0	111.3	R354 W355 K356 P394	R354-E361 VanDerWaalsContact CZ-CD 3.45Å; R354-E361 IonicContact CZ-OE1 2.69Å; R354-E361 IonicContact CZ-OE2 3.88Å; R354-E361 VanDerWaalsContact NE-CD 3.27Å; R354-E361 IonicContact NE-OE1 3.39Å; R354-E361 IonicContact NE-OE2 2.73Å; R354-E361 PolarHBondContact NE-OE2 3.37Å; R354-E361 IonicContact NH2-OE1 2.84Å; R354-E361 PolarHBondContact NH2-OE1 3.33Å; R354-E361 IonicContact NH2-OE2 2.68Å; R354-E361 PolarHBondContact NH2-OE2 2.87Å; W355-E361 CarbonylContact O-C 3.55Å; W355-E361 VanDerWaalsContact O-CA 3.29Å; W355-E361 WeakPolarHBondContact O-CA 3.32Å; K356-E361 HydrophobicContact CB-CG 3.77Å; K356-E361 HydrophobicContact CD-CG 4.01Å; K356-E361 VanDerWaalsContact CD-OE1 3.3Å; K356-E361 WeakPolarHBondContact CD-OE1 3.25Å; K356-E361 WeakPolarHBondContact CE-OE1 3.47Å; K356-E361 HydrophobicContact CG-CG 3.61Å; K356-E361 IonicContact NZ-OE1 2.86Å; K356-E361 PolarHBondContact NZ-OE1 3.12Å; E361-P394 WeakPolarHBondContact O-CD 3.01Å; E361-P394 WeakPolarHBondContact O-CG 3.23Å
362	L	96.2	Very high	97.6	Very high	36 Å²	36	44.6 Å²	44.6	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.9	167.3	63.3	88.1	0	0	0	109	R354 W355 L393 V397	R354-L362 WeakPolarHBondContact CA-O 3.43Å; W355-L362 HydrophobicContact CB-CD1 3.58Å; W355-L362 HydrophobicContact CB-CD2 4.06Å; W355-L362 HydrophobicContact CB-CG 3.69Å; W355-L362 HydrophobicContact CG-CD2 4.38Å; W355-L362 HydrophobicContact CG-CG 4.48Å; W355-L362 PolarHBondContact N-O 2.8Å; W355-L362 PolarHBondContact O-N 2.79Å; L362-L393 HydrophobicContact CB-CD2 3.87Å; L362-L393 HydrophobicContact CD1-CD2 4.43Å; L362-V397 HydrophobicContact CD2-CG1 4.37Å
363	N	97.1	Very high	97.4	Very high	49 Å²	49	44.8 Å²	44.8	26%	0.262	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.5	-176	-58.3	-73.6	0	0	0	110.5	V353 R354 K392	V353-N363 CarbonylContact O-C 3.41Å; V353-N363 WeakPolarHBondContact O-CA 3.1Å; R354-N363 WeakPolarHBondContact CD-OD1 3.33Å; R354-N363 VanDerWaalsContact CG-OD1 3.26Å; R354-N363 WeakPolarHBondContact CG-OD1 3.49Å; N363-K392 PolarHBondContact N-O 2.91Å; N363-K392 PolarHBondContact O-N 2.88Å
364	A	98.3	Very high	97.2	Very high	22 Å²	22	47 Å²	47	18%	0.182	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135	168.1	0	0	0	0	0	108.7	P352 V353 D390 V391	P352-A364 CarbonylContact C-O 3.49Å; V353-A364 HydrophobicContact CB-CB 4.41Å; V353-A364 PolarHBondContact N-O 2.96Å; V353-A364 PolarHBondContact O-N 3.37Å; A364-D390 CarbonylContact C-O 3.49Å; A364-D390 WeakPolarHBondContact CA-O 3.23Å; A364-V391 HydrophobicContact CB-CG1 4.4Å; A364-V391 HydrophobicContact CB-CG2 4.04Å
365	N	98.4	Very high	96.9	Very high	63 Å²	63	49.1 Å²	49.1	34%	0.337	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.3	178.8	-58.2	-63.3	0	0	0	109	P352 F389 D390	P352-N365 WeakPolarHBondContact CA-OD1 3.49Å; P352-N365 WeakPolarHBondContact CB-OD1 3.28Å; N365-F389 CarbonylContact O-C 3.52Å; N365-F389 WeakPolarHBondContact O-CA 3.49Å; N365-F389 WeakPolarHBondContact O-CD2 3.44Å; N365-D390 PolarHBondContact N-O 3.05Å; N365-D390 PolarHBondContact O-N 2.92Å
366	L	98.5	Very high	96.6	Very high	38 Å²	38	48.7 Å²	48.7	20%	0.199	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.8	170.2	171.6	64.1	0	0	0	108.6	K350 Q351 I368 L387 N388 F389	K350-L366 CarbonylContact C-O 3.5Å; K350-L366 WeakPolarHBondContact CA-O 3.44Å; Q351-L366 HydrophobicContact CB-CB 4.3Å; Q351-L366 PolarHBondContact N-O 2.8Å; Q351-L366 PolarHBondContact O-N 3.39Å; L366-I368 HydrophobicContact CD1-CD1 4.2Å; L366-I368 HydrophobicContact CD1-CG1 3.89Å; L366-I368 HydrophobicContact CD2-CD1 4.09Å; L366-I368 HydrophobicContact CD2-CG1 4.48Å; L366-I368 HydrophobicContact CG-CD1 4.2Å; L366-I368 HydrophobicContact CG-CG1 4.03Å; L366-L387 HydrophobicContact CD1-CD1 4.29Å; L366-L387 HydrophobicContact CD1-CD2 4.37Å; L366-L387 HydrophobicContact CD1-CG 4.09Å; L366-N388 CarbonylContact C-O 3.56Å; L366-N388 WeakPolarHBondContact CA-O 3.48Å; L366-F389 HydrophobicContact CB-CD2 3.98Å; L366-F389 HydrophobicContact CD1-CB 4.1Å; L366-F389 HydrophobicContact CD1-CD2 4.27Å
367	D	98.4	Very high	96	Very high	47 Å²	47	50.1 Å²	50.1	25%	0.251	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.8	173.8	-58.5	-54.1	0	0	0	109.3	I349 K350 L387 N388	I349-D367 CarbonylContact O-C 3.56Å; I349-D367 WeakPolarHBondContact O-CA 3.29Å; K350-D367 VanDerWaalsContact CB-OD1 3.22Å; K350-D367 WeakPolarHBondContact CB-OD1 3.29Å; K350-D367 WeakPolarHBondContact CD-OD1 3.12Å; K350-D367 HydrophobicContact CG-CB 4.5Å; K350-D367 WeakPolarHBondContact CG-OD1 3.33Å; D367-L387 CarbonylContact O-C 3.52Å; D367-L387 VanDerWaalsContact O-CA 3.29Å; D367-L387 WeakPolarHBondContact O-CA 2.99Å; D367-N388 HydrophobicContact CB-CB 4.33Å; D367-N388 PolarHBondContact N-O 3.42Å; D367-N388 PolarHBondContact O-N 3.17Å
368	I	98.3	Very high	95.6	Very high	39 Å²	39	50.3 Å²	50.3	20%	0.2	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.1	177.6	-50.6	177.4	0	0	0	108.4	T348 I349 L366 I370 I384 L387	T348-I368 CarbonylContact C-O 3.54Å; T348-I368 WeakPolarHBondContact CA-O 3.35Å; I349-I368 PolarHBondContact N-O 3.06Å; I349-I368 PolarHBondContact O-N 3.44Å; L366-I368 HydrophobicContact CD1-CD1 4.2Å; L366-I368 HydrophobicContact CD1-CG1 3.89Å; L366-I368 HydrophobicContact CD2-CD1 4.09Å; L366-I368 HydrophobicContact CD2-CG1 4.48Å; L366-I368 HydrophobicContact CG-CD1 4.2Å; L366-I368 HydrophobicContact CG-CG1 4.03Å; I368-I370 HydrophobicContact CG2-CD1 3.65Å; I368-I384 HydrophobicContact CG2-CG2 4.4Å; I368-L387 HydrophobicContact CD1-CD1 4.27Å; I368-L387 HydrophobicContact CG1-CD1 4.1Å; I368-L387 HydrophobicContact CG1-CG 4.21Å
369	S	98.1	Very high	95	Very high	27 Å²	27	51.6 Å²	51.6	19%	0.189	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.3	171.2	-63.4	0	0	0	0	109.5	T348 K385 S386	T348-S369 PolarHBondContact OG1-OG 2.99Å; T348-S369 VanDerWaalsContact OG1-OG 3.06Å; S369-K385 PolarHBondContact O-N 2.98Å; S369-S386 WeakPolarHBondContact CB-OG 3.25Å; S369-S386 PolarHBondContact N-O 2.81Å; S369-S386 PolarHBondContact O-N 2.83Å
370	I	97.7	Very high	94.5	Very high	34 Å²	34	51 Å²	51	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	140	-175.8	-55.5	-62.5	0	0	0	109.8	Q343 E346 P347 I368	Q343-I370 HydrophobicContact CB-CG2 4.16Å; Q343-I370 HydrophobicContact CG-CG2 3.63Å; E346-I370 CarbonylContact C-O 3.54Å; E346-I370 WeakPolarHBondContact CA-O 3.45Å; E346-I370 WeakPolarHBondContact CB-O 3.39Å; P347-I370 HydrophobicContact CG-CB 4.09Å; P347-I370 HydrophobicContact CG-CG1 4.26Å; P347-I370 VanDerWaalsContact O-CB 3.3Å; P347-I370 WeakPolarHBondContact O-CB 3.48Å; P347-I370 WeakPolarHBondContact O-CG1 3.3Å; P347-I370 PolarHBondContact O-N 3.37Å; I368-I370 HydrophobicContact CG2-CD1 3.65Å
371	A	96.8	Very high	94.1	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.017	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-97.1	147.9	176.5	0	0	0	0	0	111	P373 K382 D383 K385	A371-P373 VanDerWaalsContact O-CD 3.29Å; A371-P373 WeakPolarHBondContact O-CD 3.37Å; A371-K382 VanDerWaalsContact CB-O 3.32Å; A371-K382 WeakPolarHBondContact CB-O 3.16Å; A371-D383 PolarHBondContact N-O 2.94Å; A371-K385 HydrophobicContact CB-CG 3.61Å
372	D	96	Very high	93.9	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.07	33%	0.325	C	S	.	.			trans	-76.1	111.6	162.3	177.2	-9.5	0	0	0	107.7	E346 A374 K375 S376	E346-D372 HydrophobicContact CG-CB 3.7Å; E346-D372 PolarHBondContact OE1-N 3.09Å; D372-A374 PolarHBondContact O-N 2.72Å; D372-A374 VanDerWaalsContact O-N 3.09Å; D372-A374 WeakPolarHBondContact OD1-CB 3.21Å; D372-A374 PolarHBondContact OD1-N 3.28Å; D372-K375 HydrophobicContact CB-CB 4.2Å; D372-K375 HydrophobicContact CB-CD 4.14Å; D372-K375 HydrophobicContact CB-CG 4.27Å; D372-K375 PolarHBondContact O-N 3.43Å; D372-K375 WeakPolarHBondContact OD2-CD 3.46Å; D372-K375 WeakPolarHBondContact OD2-CE 3.32Å; D372-K375 IonicContact OD2-NZ 3.46Å; D372-K375 PolarHBondContact OD2-NZ 3.42Å; D372-S376 PolarHBondContact O-N 2.92Å
373	P	94	Very high	93.8	Very high	34 Å²	34	56.3 Å²	56.3	22%	0.221	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.6	-175.3	25	-34.5	0	0	0	113	P340 A371 K382	P340-P373 HydrophobicContact CB-CG 4.48Å; A371-P373 VanDerWaalsContact O-CD 3.29Å; A371-P373 WeakPolarHBondContact O-CD 3.37Å; P373-K382 WeakPolarHBondContact CA-O 3.48Å; P373-K382 HydrophobicContact CB-CB 4.3Å
374	A	94	Very high	93.7	Very high	92 Å²	92	55.9 Å²	55.9	76%	0.76	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.9	175.6	0	0	0	0	0	113.1	D372	D372-A374 PolarHBondContact O-N 2.72Å; D372-A374 VanDerWaalsContact O-N 3.09Å; D372-A374 WeakPolarHBondContact OD1-CB 3.21Å; D372-A374 PolarHBondContact OD1-N 3.28Å
375	K	92.9	Very high	93.6	Very high	136 Å²	136	59 Å²	59	59%	0.591	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-17	177.4	-64.2	176.4	-170.1	132.9	0	113	D372 S377	D372-K375 HydrophobicContact CB-CB 4.2Å; D372-K375 HydrophobicContact CB-CD 4.14Å; D372-K375 HydrophobicContact CB-CG 4.27Å; D372-K375 PolarHBondContact O-N 3.43Å; D372-K375 WeakPolarHBondContact OD2-CD 3.46Å; D372-K375 WeakPolarHBondContact OD2-CE 3.32Å; D372-K375 IonicContact OD2-NZ 3.46Å; D372-K375 PolarHBondContact OD2-NZ 3.42Å; K375-S377 PolarHBondContact O-N 3.23Å
376	S	91	Very high	93.5	Very high	29 Å²	29	57.3 Å²	57.3	20%	0.203	33%	0.334	C	S	.	.			trans	-66.4	122.2	-178.1	-171.2	0	0	0	0	111.7	D372 S378 K382	D372-S376 PolarHBondContact O-N 2.92Å; S376-S378 VanDerWaalsContact C-N 3.32Å; S376-S378 PolarHBondContact OG-N 3.01Å; S376-K382 WeakPolarHBondContact CB-O 3.47Å; S376-K382 WeakPolarHBondContact OG-CA 3.22Å
377	S	86.8	Confident	93.5	Very high	125 Å²	125	57.1 Å²	57.1	87%	0.874	33%	0.333	S	S	*	.			trans	-86.8	-2.7	173.8	57.3	0	0	0	0	113.3	K375	K375-S377 PolarHBondContact O-N 3.23Å
378	S	87.1	Confident	93.5	Very high	18 Å²	18	57 Å²	57	13%	0.126	33%	0.332	C	S	.	.			trans	-66.7	135.2	-177.7	172.1	0	0	0	0	111.9	S376 T380 N381 K382 P452	S376-S378 VanDerWaalsContact C-N 3.32Å; S376-S378 PolarHBondContact OG-N 3.01Å; S378-T380 PolarHBondContact OG-N 2.91Å; S378-N381 WeakPolarHBondContact CB-O 3.23Å; S378-N381 PolarHBondContact OG-N 3.46Å; S378-N381 VanDerWaalsContact OG-N 3.09Å; S378-N381 PolarHBondContact OG-O 3.49Å; S378-K382 VanDerWaalsContact O-CE 3.25Å; S378-K382 WeakPolarHBondContact O-CE 3.46Å; S378-K382 VanDerWaalsContact O-CG 3.3Å; S378-K382 WeakPolarHBondContact O-CG 3.36Å; S378-P452 WeakPolarHBondContact OG-CB 3.41Å
379	S	84.6	Confident	93.5	Very high	119 Å²	119	58.3 Å²	58.3	83%	0.832	34%	0.337	S	S	*	.	S	Bend	trans	-87.2	-24.7	174.8	53.8	0	0	0	0	113.3
380	T	85.4	Confident	93.5	Very high	75 Å²	75	58.5 Å²	58.5	46%	0.46	34%	0.336	S	S	.	.	S	Bend	trans	-93.3	-42.1	-175.8	60.4	0	0	0	0	112.4	S378 G453 E464	S378-T380 PolarHBondContact OG-N 2.91Å; T380-G453 PolarHBondContact OG1-N 2.74Å; T380-E464 WeakPolarHBondContact CB-OE1 3.16Å; T380-E464 WeakPolarHBondContact CB-OE2 3.45Å; T380-E464 PolarHBondContact OG1-OE1 2.85Å
381	N	89.7	Confident	93.5	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.203	33%	0.333	C	S	.	.			trans	-148.8	116.9	-177.2	-174.1	-30.5	0	0	0	110.9	S378 D383 I384 Y450	S378-N381 WeakPolarHBondContact CB-O 3.23Å; S378-N381 PolarHBondContact OG-N 3.46Å; S378-N381 VanDerWaalsContact OG-N 3.09Å; S378-N381 PolarHBondContact OG-O 3.49Å; N381-D383 PolarHBondContact OD1-N 3.05Å; N381-I384 PolarHBondContact OD1-N 3.06Å; N381-I384 VanDerWaalsContact OD1-N 3.17Å; N381-Y450 WeakPolarHBondContact CB-OH 3.06Å; N381-Y450 PolarHBondContact ND2-OH 3.38Å
382	K	92.4	Very high	93.5	Very high	110 Å²	110	63.2 Å²	63.2	48%	0.478	36%	0.356	S	S	.	.	S	Bend	trans	-94.2	-7.3	-177.3	-68.6	-170.7	177.2	-171	0	114.5	A371 P373 S376 S378	A371-K382 VanDerWaalsContact CB-O 3.32Å; A371-K382 WeakPolarHBondContact CB-O 3.16Å; P373-K382 WeakPolarHBondContact CA-O 3.48Å; P373-K382 HydrophobicContact CB-CB 4.3Å; S376-K382 WeakPolarHBondContact CB-O 3.47Å; S376-K382 WeakPolarHBondContact OG-CA 3.22Å; S378-K382 VanDerWaalsContact O-CE 3.25Å; S378-K382 WeakPolarHBondContact O-CE 3.46Å; S378-K382 VanDerWaalsContact O-CG 3.3Å; S378-K382 WeakPolarHBondContact O-CG 3.36Å
383	D	93.7	Very high	93.5	Very high	73 Å²	73	65.3 Å²	65.3	39%	0.39	37%	0.367	S	S	.	.	S	Bend	trans	-101.2	-21.7	-170.9	-63.2	-58.3	0	0	0	113.4	Q343 A371 N381	Q343-D383 PolarHBondContact NE2-OD1 3.11Å; A371-D383 PolarHBondContact N-O 2.94Å; N381-D383 PolarHBondContact OD1-N 3.05Å
384	I	95.1	Very high	93.7	Very high	39 Å²	39	65 Å²	65	20%	0.2	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.7	-175.9	-59.7	176.2	0	0	0	109.6	I368 N381 L387 Y450 P452	I368-I384 HydrophobicContact CG2-CG2 4.4Å; N381-I384 PolarHBondContact OD1-N 3.06Å; N381-I384 VanDerWaalsContact OD1-N 3.17Å; I384-L387 HydrophobicContact CG2-CB 4.46Å; I384-Y450 HydrophobicContact CB-CE1 4.1Å; I384-Y450 HydrophobicContact CG2-CD1 4Å; I384-Y450 HydrophobicContact CG2-CE1 3.75Å; I384-P452 VanDerWaalsContact O-CG 3.23Å; I384-P452 WeakPolarHBondContact O-CG 3.37Å
385	K	96.3	Very high	93.8	Very high	88 Å²	88	61.4 Å²	61.4	38%	0.383	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-44.5	169.7	-65.7	-173.2	176	-179.5	0	111.4	E346 S369 A371 P452	E346-K385 WeakPolarHBondContact OE1-CE 3.21Å; E346-K385 IonicContact OE1-NZ 2.87Å; E346-K385 PolarHBondContact OE1-NZ 2.78Å; E346-K385 IonicContact OE2-NZ 3.07Å; E346-K385 PolarHBondContact OE2-NZ 2.78Å; S369-K385 PolarHBondContact O-N 2.98Å; A371-K385 HydrophobicContact CB-CG 3.61Å; K385-P452 VanDerWaalsContact O-CD 3.25Å; K385-P452 WeakPolarHBondContact O-CD 3.29Å
386	S	97.4	Very high	93.9	Very high	27 Å²	27	58.1 Å²	58.1	19%	0.189	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	152.7	177.2	55.9	0	0	0	0	111.8	S369 Y450	S369-S386 WeakPolarHBondContact CB-OG 3.25Å; S369-S386 PolarHBondContact N-O 2.81Å; S369-S386 PolarHBondContact O-N 2.83Å; S386-Y450 CarbonylContact C-O 3.56Å; S386-Y450 WeakPolarHBondContact CA-O 3.42Å
387	L	97.8	Very high	94.2	Very high	34 Å²	34	56.8 Å²	56.8	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.4	168	174.8	156.7	0	0	0	108.5	L366 D367 I368 I384 F389 L448 R449 Y450	L366-L387 HydrophobicContact CD1-CD1 4.29Å; L366-L387 HydrophobicContact CD1-CD2 4.37Å; L366-L387 HydrophobicContact CD1-CG 4.09Å; D367-L387 CarbonylContact O-C 3.52Å; D367-L387 VanDerWaalsContact O-CA 3.29Å; D367-L387 WeakPolarHBondContact O-CA 2.99Å; I368-L387 HydrophobicContact CD1-CD1 4.27Å; I368-L387 HydrophobicContact CG1-CD1 4.1Å; I368-L387 HydrophobicContact CG1-CG 4.21Å; I384-L387 HydrophobicContact CG2-CB 4.46Å; L387-F389 HydrophobicContact CD2-CB 4.31Å; L387-L448 HydrophobicContact CD2-CD2 3.91Å; L387-L448 HydrophobicContact CD2-CG 4.14Å; L387-R449 CarbonylContact O-C 3.46Å; L387-R449 WeakPolarHBondContact O-CA 3.35Å; L387-Y450 HydrophobicContact CB-CD1 4.06Å; L387-Y450 PolarHBondContact N-O 3.03Å; L387-Y450 PolarHBondContact O-N 2.91Å
388	N	98.3	Very high	94.7	Very high	45 Å²	45	52.5 Å²	52.5	24%	0.241	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.7	170.5	-58	-58.1	0	0	0	108.6	L366 D367 L448 R449	L366-N388 CarbonylContact C-O 3.56Å; L366-N388 WeakPolarHBondContact CA-O 3.48Å; D367-N388 HydrophobicContact CB-CB 4.33Å; D367-N388 PolarHBondContact N-O 3.42Å; D367-N388 PolarHBondContact O-N 3.17Å; N388-L448 CarbonylContact C-O 3.55Å; N388-L448 WeakPolarHBondContact CA-O 3.23Å; N388-R449 WeakPolarHBondContact OD1-CG 3.26Å
389	F	98.3	Very high	95.2	Very high	67 Å²	67	52.5 Å²	52.5	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	116.7	173.5	178.6	-122.5	0	0	0	108.7	N365 L366 L387 V391 L446 Q447 L448	N365-F389 CarbonylContact O-C 3.52Å; N365-F389 WeakPolarHBondContact O-CA 3.49Å; N365-F389 WeakPolarHBondContact O-CD2 3.44Å; L366-F389 HydrophobicContact CB-CD2 3.98Å; L366-F389 HydrophobicContact CD1-CB 4.1Å; L366-F389 HydrophobicContact CD1-CD2 4.27Å; L387-F389 HydrophobicContact CD2-CB 4.31Å; F389-V391 HydrophobicContact CD1-CG2 4.32Å; F389-V391 HydrophobicContact CD2-CG2 4.45Å; F389-V391 HydrophobicContact CE1-CG2 3.59Å; F389-V391 HydrophobicContact CE2-CG2 3.74Å; F389-V391 HydrophobicContact CZ-CG2 3.25Å; F389-L446 HydrophobicContact CD1-CD2 3.47Å; F389-L446 VanDerWaalsContact CD1-CD2 3.47Å; F389-L446 HydrophobicContact CE1-CD2 3.64Å; F389-Q447 CarbonylContact O-C 3.49Å; F389-Q447 WeakPolarHBondContact O-CA 3.46Å; F389-L448 HydrophobicContact CB-CB 4.25Å; F389-L448 PolarHBondContact N-O 2.82Å; F389-L448 PolarHBondContact O-N 2.71Å
390	D	98.2	Very high	95.8	Very high	31 Å²	31	48 Å²	48	17%	0.166	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.6	-175.4	-78.3	-90.6	0	0	0	109.4	A364 N365 L446 Q447	A364-D390 CarbonylContact C-O 3.49Å; A364-D390 WeakPolarHBondContact CA-O 3.23Å; N365-D390 PolarHBondContact N-O 3.05Å; N365-D390 PolarHBondContact O-N 2.92Å; D390-L446 WeakPolarHBondContact CA-O 2.83Å; D390-Q447 WeakPolarHBondContact OD1-CG 3.4Å; D390-Q447 PolarHBondContact OD1-NE2 3.31Å
391	V	97.9	Very high	96.3	Very high	19 Å²	19	46.1 Å²	46.1	12%	0.115	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.5	177	-176.4	0	0	0	0	109	A364 F389 L393 S445 L446	A364-V391 HydrophobicContact CB-CG1 4.4Å; A364-V391 HydrophobicContact CB-CG2 4.04Å; F389-V391 HydrophobicContact CD1-CG2 4.32Å; F389-V391 HydrophobicContact CD2-CG2 4.45Å; F389-V391 HydrophobicContact CE1-CG2 3.59Å; F389-V391 HydrophobicContact CE2-CG2 3.74Å; F389-V391 HydrophobicContact CZ-CG2 3.25Å; V391-L393 HydrophobicContact CG1-CD1 4.12Å; V391-L393 HydrophobicContact CG1-CD2 3.81Å; V391-L393 HydrophobicContact CG1-CG 3.76Å; V391-S445 VanDerWaalsContact O-CA 3.23Å; V391-S445 WeakPolarHBondContact O-CA 2.55Å; V391-L446 HydrophobicContact CB-CB 4.17Å; V391-L446 HydrophobicContact CG2-CB 4.5Å; V391-L446 PolarHBondContact N-O 3.02Å; V391-L446 PolarHBondContact O-N 3.45Å
392	K	96.7	Very high	96.6	Very high	116 Å²	116	45 Å²	45	50%	0.504	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	116.6	175.4	-67.5	-176.5	-179.5	179.6	0	110.2	N363 T443	N363-K392 PolarHBondContact N-O 2.91Å; N363-K392 PolarHBondContact O-N 2.88Å; K392-T443 HydrophobicContact CB-CG2 4.47Å
393	L	96.6	Very high	96.8	Very high	56 Å²	56	42 Å²	42	29%	0.293	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	92.6	-175.3	-53.5	179.5	0	0	0	109.8	L362 V391 L395 V398 A444	L362-L393 HydrophobicContact CB-CD2 3.87Å; L362-L393 HydrophobicContact CD1-CD2 4.43Å; V391-L393 HydrophobicContact CG1-CD1 4.12Å; V391-L393 HydrophobicContact CG1-CD2 3.81Å; V391-L393 HydrophobicContact CG1-CG 3.76Å; L393-L395 PolarHBondContact O-N 3.44Å; L393-V398 HydrophobicContact CB-CG2 3.9Å; L393-A444 HydrophobicContact CB-CB 4.34Å; L393-A444 PolarHBondContact N-O 2.83Å; L393-A444 PolarHBondContact O-N 3.29Å
394	P	97.3	Very high	97	Very high	29 Å²	29	39.8 Å²	39.8	19%	0.188	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	123.4	170.3	-22.6	34.7	0	0	0	109.7	E361 N396 V397 V398	E361-P394 WeakPolarHBondContact O-CD 3.01Å; E361-P394 WeakPolarHBondContact O-CG 3.23Å; P394-N396 VanDerWaalsContact C-N 3.28Å; P394-N396 VanDerWaalsContact CB-OD1 3.29Å; P394-N396 WeakPolarHBondContact CB-OD1 3.25Å; P394-N396 PolarHBondContact O-N 3.44Å; P394-V397 HydrophobicContact CB-CB 4.28Å; P394-V397 HydrophobicContact CB-CG2 3.84Å; P394-V397 HydrophobicContact CG-CG2 4.31Å; P394-V397 WeakPolarHBondContact O-CB 3.4Å; P394-V397 PolarHBondContact O-N 3.39Å; P394-V398 PolarHBondContact O-N 3.09Å; P394-V398 VanDerWaalsContact O-N 3.15Å
395	L	96.1	Very high	97	Very high	16 Å²	16	41.7 Å²	41.7	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-34.7	-168.6	-65.9	173	0	0	0	112.3	L393 V397 V398 T399 I424 M428 I439 N442 A444	L393-L395 PolarHBondContact O-N 3.44Å; L395-V397 VanDerWaalsContact C-N 3.31Å; L395-V397 PolarHBondContact O-N 3.49Å; L395-V398 PolarHBondContact O-N 2.99Å; L395-T399 VanDerWaalsContact O-CB 3.3Å; L395-T399 WeakPolarHBondContact O-CB 3.35Å; L395-T399 PolarHBondContact O-N 2.84Å; L395-T399 PolarHBondContact O-OG1 3.13Å; L395-I424 HydrophobicContact CD2-CG2 4.18Å; L395-M428 HydrophobicContact CD1-CE 4.35Å; L395-M428 HydrophobicContact CD1-SD 3.27Å; L395-M428 WeakPolarHBondContact CD1-SD 3.5Å; L395-M428 HydrophobicContact CD2-CG 3.91Å; L395-M428 HydrophobicContact CD2-SD 3.36Å; L395-M428 WeakPolarHBondContact CD2-SD 3.22Å; L395-M428 HydrophobicContact CG-SD 3.92Å; L395-I439 HydrophobicContact CD1-CG2 4.3Å; L395-N442 WeakPolarHBondContact CB-O 3.11Å; L395-N442 WeakPolarHBondContact CD1-OD1 3.48Å; L395-N442 VanDerWaalsContact CG-O 3.3Å; L395-N442 WeakPolarHBondContact CG-O 3.34Å; L395-N442 PolarHBondContact N-O 3.32Å; L395-A444 HydrophobicContact CD2-CB 4Å
396	N	96.2	Very high	97	Very high	67 Å²	67	38.4 Å²	38.4	36%	0.358	20%	0.202	S	C	.	.	H	α-helix	trans	-59.5	-40.4	173.3	63.6	-37.3	0	0	0	112.3	L359 P394 E400	L359-N396 HydrophobicContact CD1-CB 4.36Å; L359-N396 PolarHBondContact O-ND2 3.38Å; P394-N396 VanDerWaalsContact C-N 3.28Å; P394-N396 VanDerWaalsContact CB-OD1 3.29Å; P394-N396 WeakPolarHBondContact CB-OD1 3.25Å; P394-N396 PolarHBondContact O-N 3.44Å; N396-E400 VanDerWaalsContact O-CB 3.29Å; N396-E400 WeakPolarHBondContact O-CB 3.39Å; N396-E400 PolarHBondContact O-N 2.6Å
397	V	97.3	Very high	97	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-47.6	179.1	179.5	0	0	0	0	110	N357 L359 L362 P394 L395 E400 T401	N357-V397 PolarHBondContact ND2-O 3.48Å; L359-V397 HydrophobicContact CB-CG2 4.45Å; L362-V397 HydrophobicContact CD2-CG1 4.37Å; P394-V397 HydrophobicContact CB-CB 4.28Å; P394-V397 HydrophobicContact CB-CG2 3.84Å; P394-V397 HydrophobicContact CG-CG2 4.31Å; P394-V397 WeakPolarHBondContact O-CB 3.4Å; P394-V397 PolarHBondContact O-N 3.39Å; L395-V397 VanDerWaalsContact C-N 3.31Å; L395-V397 PolarHBondContact O-N 3.49Å; V397-E400 PolarHBondContact O-N 2.69Å; V397-T401 PolarHBondContact O-N 2.73Å; V397-T401 PolarHBondContact O-OG1 3.02Å
398	V	96.5	Very high	96.8	Very high	34 Å²	34	38.1 Å²	38.1	21%	0.206	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-45.7	179.8	-174.8	0	0	0	0	111.3	L393 P394 L395 E400 T401 A402 I424	L393-V398 HydrophobicContact CB-CG2 3.9Å; P394-V398 PolarHBondContact O-N 3.09Å; P394-V398 VanDerWaalsContact O-N 3.15Å; L395-V398 PolarHBondContact O-N 2.99Å; V398-E400 VanDerWaalsContact C-N 3.32Å; V398-E400 PolarHBondContact O-N 2.87Å; V398-T401 PolarHBondContact O-N 3.06Å; V398-A402 PolarHBondContact O-N 3.43Å; V398-A402 VanDerWaalsContact O-N 3.08Å; V398-I424 HydrophobicContact CG1-CD1 3.55Å; V398-I424 HydrophobicContact CG1-CG1 4.26Å
399	T	97.1	Very high	96.5	Very high	18 Å²	18	42.1 Å²	42.1	11%	0.11	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-41.4	176.8	-63.7	0	0	0	0	111.5	L395 A402 K403 A420 D421	L395-T399 VanDerWaalsContact O-CB 3.3Å; L395-T399 WeakPolarHBondContact O-CB 3.35Å; L395-T399 PolarHBondContact O-N 2.84Å; L395-T399 PolarHBondContact O-OG1 3.13Å; T399-A402 PolarHBondContact O-N 2.85Å; T399-K403 WeakPolarHBondContact O-CB 3.28Å; T399-K403 PolarHBondContact O-N 2.73Å; T399-A420 HydrophobicContact CG2-CB 4.04Å; T399-D421 VanDerWaalsContact CG2-OD1 3.28Å; T399-D421 WeakPolarHBondContact CG2-OD1 3.38Å
400	E	97.2	Very high	96.2	Very high	24 Å²	24	42.3 Å²	42.3	11%	0.112	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-43.7	177.8	-177.3	63.8	-165.9	0	0	111.8	L359 N396 V397 V398 A402 K403 Q404	L359-E400 HydrophobicContact CD1-CB 3.65Å; L359-E400 HydrophobicContact CD1-CG 3.94Å; L359-E400 HydrophobicContact CG-CB 4.08Å; L359-E400 HydrophobicContact CG-CG 3.97Å; N396-E400 VanDerWaalsContact O-CB 3.29Å; N396-E400 WeakPolarHBondContact O-CB 3.39Å; N396-E400 PolarHBondContact O-N 2.6Å; V397-E400 PolarHBondContact O-N 2.69Å; V398-E400 VanDerWaalsContact C-N 3.32Å; V398-E400 PolarHBondContact O-N 2.87Å; E400-A402 VanDerWaalsContact C-N 3.33Å; E400-A402 PolarHBondContact O-N 2.88Å; E400-K403 PolarHBondContact O-N 3.19Å; E400-K403 WeakPolarHBondContact OE2-CD 3.2Å; E400-K403 IonicContact OE2-NZ 2.56Å; E400-Q404 HydrophobicContact CG-CG 4.22Å; E400-Q404 WeakPolarHBondContact O-CB 3.48Å; E400-Q404 VanDerWaalsContact O-CG 3.25Å; E400-Q404 WeakPolarHBondContact O-CG 3.22Å; E400-Q404 PolarHBondContact O-N 2.84Å; E400-Q404 WeakPolarHBondContact OE1-CG 3.44Å; E400-Q404 PolarHBondContact OE1-NE2 3.23Å
401	T	95.8	Very high	96.1	Very high	37 Å²	37	43.9 Å²	43.9	23%	0.227	25%	0.245	C	C	.	.	H	α-helix	trans	-59	-44.7	175.5	-60.4	0	0	0	0	111.4	N357 V397 V398 Q404 L405	N357-T401 PolarHBondContact ND2-OG1 3.39Å; V397-T401 PolarHBondContact O-N 2.73Å; V397-T401 PolarHBondContact O-OG1 3.02Å; V398-T401 PolarHBondContact O-N 3.06Å; T401-Q404 PolarHBondContact O-N 2.94Å; T401-L405 WeakPolarHBondContact O-CB 3.22Å; T401-L405 PolarHBondContact O-N 3.36Å
402	A	96.3	Very high	96	Very high	15 Å²	15	47.2 Å²	47.2	12%	0.124	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-41.6	177.4	0	0	0	0	0	112.3	V398 T399 E400 L405 N406 A420 I424	V398-A402 PolarHBondContact O-N 3.43Å; V398-A402 VanDerWaalsContact O-N 3.08Å; T399-A402 PolarHBondContact O-N 2.85Å; E400-A402 VanDerWaalsContact C-N 3.33Å; E400-A402 PolarHBondContact O-N 2.88Å; A402-L405 PolarHBondContact O-N 3.02Å; A402-N406 VanDerWaalsContact O-CG 3.28Å; A402-N406 PolarHBondContact O-N 3.25Å; A402-N406 PolarHBondContact O-ND2 2.8Å; A402-A420 HydrophobicContact CB-CB 3.89Å; A402-I424 HydrophobicContact CB-CD1 4.44Å
403	K	97.5	Very high	95.9	Very high	46 Å²	46	44.2 Å²	44.2	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-47.4	175.5	178	-157.2	-175.1	169.9	0	111.9	T399 E400 L405 N406 L407 A416 Q417 A420	T399-K403 WeakPolarHBondContact O-CB 3.28Å; T399-K403 PolarHBondContact O-N 2.73Å; E400-K403 PolarHBondContact O-N 3.19Å; E400-K403 WeakPolarHBondContact OE2-CD 3.2Å; E400-K403 IonicContact OE2-NZ 2.56Å; K403-L405 VanDerWaalsContact C-N 3.28Å; K403-L405 PolarHBondContact O-N 2.82Å; K403-N406 WeakPolarHBondContact O-CB 3.43Å; K403-N406 PolarHBondContact O-N 3.14Å; K403-N406 VanDerWaalsContact O-N 3.16Å; K403-L407 HydrophobicContact CG-CD1 4.24Å; K403-L407 WeakPolarHBondContact O-CG 3.18Å; K403-L407 PolarHBondContact O-N 2.74Å; K403-A416 HydrophobicContact CG-CB 4.36Å; K403-Q417 VanDerWaalsContact CD-OE1 3.28Å; K403-A420 HydrophobicContact CB-CB 4Å
404	Q	97.2	Very high	96	Very high	27 Å²	27	47.2 Å²	47.2	13%	0.126	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-37.8	179.1	-69.5	-62.5	-26.8	0	0	111.4	L282 E400 T401 L407 S408	L282-Q404 HydrophobicContact CD2-CB 3.73Å; E400-Q404 HydrophobicContact CG-CG 4.22Å; E400-Q404 WeakPolarHBondContact O-CB 3.48Å; E400-Q404 VanDerWaalsContact O-CG 3.25Å; E400-Q404 WeakPolarHBondContact O-CG 3.22Å; E400-Q404 PolarHBondContact O-N 2.84Å; E400-Q404 WeakPolarHBondContact OE1-CG 3.44Å; E400-Q404 PolarHBondContact OE1-NE2 3.23Å; T401-Q404 PolarHBondContact O-N 2.94Å; Q404-L407 PolarHBondContact O-N 2.93Å; Q404-S408 WeakPolarHBondContact O-CB 3.41Å; Q404-S408 PolarHBondContact O-N 2.93Å
405	L	95.4	Very high	96	Very high	78 Å²	78	52.7 Å²	52.7	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-47	172	-176.3	62.1	0	0	0	111.8	K277 T401 A402 K403 L407 S408 E409	K277-L405 HydrophobicContact CD-CD1 4.27Å; T401-L405 WeakPolarHBondContact O-CB 3.22Å; T401-L405 PolarHBondContact O-N 3.36Å; A402-L405 PolarHBondContact O-N 3.02Å; K403-L405 VanDerWaalsContact C-N 3.28Å; K403-L405 PolarHBondContact O-N 2.82Å; L405-L407 VanDerWaalsContact C-N 3.35Å; L405-L407 PolarHBondContact O-N 2.97Å; L405-S408 WeakPolarHBondContact O-CB 3.01Å; L405-S408 PolarHBondContact O-N 3.32Å; L405-S408 VanDerWaalsContact O-N 3.11Å; L405-S408 PolarHBondContact O-OG 2.78Å; L405-E409 PolarHBondContact O-N 2.81Å
406	N	96.7	Very high	96	Very high	20 Å²	20	51.9 Å²	51.9	11%	0.107	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-43	176	-72.4	-25.4	0	0	0	112.3	A402 K403 S408 E409 M411 A416	A402-N406 VanDerWaalsContact O-CG 3.28Å; A402-N406 PolarHBondContact O-N 3.25Å; A402-N406 PolarHBondContact O-ND2 2.8Å; K403-N406 WeakPolarHBondContact O-CB 3.43Å; K403-N406 PolarHBondContact O-N 3.14Å; K403-N406 VanDerWaalsContact O-N 3.16Å; N406-S408 VanDerWaalsContact C-N 3.3Å; N406-S408 PolarHBondContact O-N 2.91Å; N406-E409 PolarHBondContact O-N 3.04Å; N406-M411 HydrophobicContact CB-CG 4.49Å; N406-M411 HydrophobicContact CB-SD 3.61Å; N406-M411 VanDerWaalsContact O-CB 3.31Å; N406-M411 WeakPolarHBondContact O-CB 3.08Å; N406-M411 WeakPolarHBondContact O-CG 3.3Å; N406-M411 PolarHBondContact O-N 3.36Å; N406-A416 HydrophobicContact CB-CB 3.72Å; N406-A416 PolarHBondContact ND2-O 2.91Å
407	L	96.7	Very high	96.1	Very high	30 Å²	30	51.3 Å²	51.3	16%	0.157	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-36.8	174.8	-74.6	173.1	0	0	0	112	Q280 K403 Q404 L405 E409 G410 M411 A413 A416	Q280-L407 HydrophobicContact CG-CB 3.7Å; K403-L407 HydrophobicContact CG-CD1 4.24Å; K403-L407 WeakPolarHBondContact O-CG 3.18Å; K403-L407 PolarHBondContact O-N 2.74Å; Q404-L407 PolarHBondContact O-N 2.93Å; L405-L407 VanDerWaalsContact C-N 3.35Å; L405-L407 PolarHBondContact O-N 2.97Å; L407-E409 PolarHBondContact O-N 2.85Å; L407-G410 PolarHBondContact O-N 2.97Å; L407-M411 WeakPolarHBondContact CD2-O 3.25Å; L407-A413 HydrophobicContact CD2-CB 4.24Å; L407-A416 HydrophobicContact CD2-CB 3.9Å; L407-A416 HydrophobicContact CG-CB 3.9Å
408	S	94.2	Very high	96.1	Very high	24 Å²	24	57.3 Å²	57.3	17%	0.168	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-21.1	178	79	0	0	0	0	113.2	K277 Q404 L405 N406 G410	K277-S408 WeakPolarHBondContact CD-OG 3.2Å; K277-S408 WeakPolarHBondContact CE-OG 3.48Å; K277-S408 PolarHBondContact NZ-OG 2.94Å; Q404-S408 WeakPolarHBondContact O-CB 3.41Å; Q404-S408 PolarHBondContact O-N 2.93Å; L405-S408 WeakPolarHBondContact O-CB 3.01Å; L405-S408 PolarHBondContact O-N 3.32Å; L405-S408 VanDerWaalsContact O-N 3.11Å; L405-S408 PolarHBondContact O-OG 2.78Å; N406-S408 VanDerWaalsContact C-N 3.3Å; N406-S408 PolarHBondContact O-N 2.91Å; S408-G410 VanDerWaalsContact C-N 3.28Å
409	E	91.7	Very high	96.2	Very high	129 Å²	129	58.9 Å²	58.9	60%	0.603	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	8.1	174	-61.7	-64.6	163.5	0	0	112.7	K277 L405 N406 L407	K277-E409 IonicContact NZ-OE1 3Å; K277-E409 PolarHBondContact NZ-OE1 3.04Å; L405-E409 PolarHBondContact O-N 2.81Å; N406-E409 PolarHBondContact O-N 3.04Å; L407-E409 PolarHBondContact O-N 2.85Å
410	G	92.6	Very high	96.2	Very high	71 Å²	71	58 Å²	58	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	14	178.5	0	0	0	0	0	114.8	L407 S408	L407-G410 PolarHBondContact O-N 2.97Å; S408-G410 VanDerWaalsContact C-N 3.28Å
411	M	95.4	Very high	96.2	Very high	64 Å²	64	60.4 Å²	60.4	32%	0.315	32%	0.323	S	S	.	.			trans	-68	143.2	171.8	-64.2	-177.1	66.6	0	0	111.1	N406 L407 K415 A416 Q419	N406-M411 HydrophobicContact CB-CG 4.49Å; N406-M411 HydrophobicContact CB-SD 3.61Å; N406-M411 VanDerWaalsContact O-CB 3.31Å; N406-M411 WeakPolarHBondContact O-CB 3.08Å; N406-M411 WeakPolarHBondContact O-CG 3.3Å; N406-M411 PolarHBondContact O-N 3.36Å; L407-M411 WeakPolarHBondContact CD2-O 3.25Å; M411-K415 HydrophobicContact CE-CB 4.02Å; M411-A416 HydrophobicContact CB-CB 4.12Å; M411-Q419 HydrophobicContact CE-CB 3.99Å; M411-Q419 HydrophobicContact CE-CG 4.3Å
412	D	95.7	Very high	96.3	Very high	89 Å²	89	66 Å²	66	48%	0.476	34%	0.344	S	S	.	.			trans	-59.9	150.4	166.7	159.8	75	0	0	0	111.3	E414 K415 A416	D412-E414 PolarHBondContact O-N 3.09Å; D412-E414 WeakPolarHBondContact OD2-CA 3.45Å; D412-E414 WeakPolarHBondContact OD2-CB 3.32Å; D412-E414 PolarHBondContact OD2-N 3.49Å; D412-K415 PolarHBondContact O-N 2.91Å; D412-K415 PolarHBondContact OD2-N 3Å; D412-A416 VanDerWaalsContact O-CB 3.26Å; D412-A416 WeakPolarHBondContact O-CB 3.45Å; D412-A416 PolarHBondContact O-N 3.48Å
413	A	95.5	Very high	96.2	Very high	54 Å²	54	68.9 Å²	68.9	45%	0.446	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-40.4	-175	0	0	0	0	0	114.1	L407 Q417	L407-A413 HydrophobicContact CD2-CB 4.24Å; A413-Q417 WeakPolarHBondContact O-CB 2.92Å; A413-Q417 PolarHBondContact O-N 3.32Å
414	E	97.1	Very high	96.2	Very high	119 Å²	119	67.4 Å²	67.4	56%	0.556	35%	0.349	S	S	*	.	H	α-helix	trans	-68.8	-43	178.8	-167	-170.1	162.9	0	0	110.5	D412 K418	D412-E414 PolarHBondContact O-N 3.09Å; D412-E414 WeakPolarHBondContact OD2-CA 3.45Å; D412-E414 WeakPolarHBondContact OD2-CB 3.32Å; D412-E414 PolarHBondContact OD2-N 3.49Å; E414-K418 WeakPolarHBondContact O-CG 3.38Å; E414-K418 PolarHBondContact O-N 3.31Å; E414-K418 VanDerWaalsContact OE1-CE 3.24Å; E414-K418 WeakPolarHBondContact OE1-CE 3.38Å; E414-K418 IonicContact OE1-NZ 2.62Å; E414-K418 PolarHBondContact OE1-NZ 3.25Å
415	K	97.5	Very high	96.1	Very high	143 Å²	143	68.9 Å²	68.9	62%	0.622	36%	0.362	S	S	*	.	H	α-helix	trans	-65.2	-42.6	176.2	-68.8	-177	-178.3	174.8	0	112.1	M411 D412 Q417 K418 Q419	M411-K415 HydrophobicContact CE-CB 4.02Å; D412-K415 PolarHBondContact O-N 2.91Å; D412-K415 PolarHBondContact OD2-N 3Å; K415-Q417 VanDerWaalsContact C-N 3.35Å; K415-K418 PolarHBondContact O-N 3.42Å; K415-Q419 VanDerWaalsContact O-CB 3.25Å; K415-Q419 WeakPolarHBondContact O-CB 3.28Å; K415-Q419 PolarHBondContact O-N 2.97Å
416	A	97.4	Very high	96	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-43	179.3	0	0	0	0	0	111.6	K403 N406 L407 M411 D412 A420	K403-A416 HydrophobicContact CG-CB 4.36Å; N406-A416 HydrophobicContact CB-CB 3.72Å; N406-A416 PolarHBondContact ND2-O 2.91Å; L407-A416 HydrophobicContact CD2-CB 3.9Å; L407-A416 HydrophobicContact CG-CB 3.9Å; M411-A416 HydrophobicContact CB-CB 4.12Å; D412-A416 VanDerWaalsContact O-CB 3.26Å; D412-A416 WeakPolarHBondContact O-CB 3.45Å; D412-A416 PolarHBondContact O-N 3.48Å; A416-A420 WeakPolarHBondContact O-CB 3.46Å; A416-A420 PolarHBondContact O-N 3.28Å
417	Q	97.8	Very high	95.9	Very high	55 Å²	55	72.3 Å²	72.3	26%	0.257	39%	0.386	S	S	.	.	H	α-helix	trans	-64.4	-52.7	175.9	-175.2	63.7	57.9	0	0	111.5	K403 A413 K415 Q419 A420 D421	K403-Q417 VanDerWaalsContact CD-OE1 3.28Å; A413-Q417 WeakPolarHBondContact O-CB 2.92Å; A413-Q417 PolarHBondContact O-N 3.32Å; K415-Q417 VanDerWaalsContact C-N 3.35Å; Q417-Q419 PolarHBondContact O-N 2.83Å; Q417-A420 PolarHBondContact O-N 3.19Å; Q417-A420 VanDerWaalsContact O-N 3.13Å; Q417-D421 PolarHBondContact NE2-OD1 3Å; Q417-D421 PolarHBondContact NE2-OD2 3.29Å; Q417-D421 VanDerWaalsContact O-CG 3.29Å; Q417-D421 PolarHBondContact O-N 2.86Å
418	K	97.7	Very high	95.7	Very high	126 Å²	126	72.9 Å²	72.9	55%	0.548	39%	0.389	S	S	.	.	H	α-helix	trans	-57.7	-39.1	178.9	-74.5	179.5	-175.5	170.8	0	112.4	E414 K415 K422	E414-K418 WeakPolarHBondContact O-CG 3.38Å; E414-K418 PolarHBondContact O-N 3.31Å; E414-K418 VanDerWaalsContact OE1-CE 3.24Å; E414-K418 WeakPolarHBondContact OE1-CE 3.38Å; E414-K418 IonicContact OE1-NZ 2.62Å; E414-K418 PolarHBondContact OE1-NZ 3.25Å; K415-K418 PolarHBondContact O-N 3.42Å; K418-K422 WeakPolarHBondContact O-CB 3.25Å; K418-K422 PolarHBondContact O-N 2.95Å
419	Q	97.4	Very high	95.7	Very high	68 Å²	68	75.5 Å²	75.5	32%	0.318	40%	0.404	S	S	.	.	H	α-helix	trans	-67.7	-44.5	177.7	-178.8	62.3	19.2	0	0	111.6	M411 K415 Q417 K422 Q423	M411-Q419 HydrophobicContact CE-CB 3.99Å; M411-Q419 HydrophobicContact CE-CG 4.3Å; K415-Q419 VanDerWaalsContact O-CB 3.25Å; K415-Q419 WeakPolarHBondContact O-CB 3.28Å; K415-Q419 PolarHBondContact O-N 2.97Å; Q417-Q419 PolarHBondContact O-N 2.83Å; Q419-K422 PolarHBondContact O-N 3.38Å; Q419-Q423 WeakPolarHBondContact O-CB 3.39Å; Q419-Q423 VanDerWaalsContact O-CG 3.29Å; Q419-Q423 WeakPolarHBondContact O-CG 3.24Å; Q419-Q423 PolarHBondContact O-N 2.98Å
420	A	97.6	Very high	95.7	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-60	-49.5	175.1	0	0	0	0	0	111	T399 A402 K403 A416 Q417 K422 Q423 I424	T399-A420 HydrophobicContact CG2-CB 4.04Å; A402-A420 HydrophobicContact CB-CB 3.89Å; K403-A420 HydrophobicContact CB-CB 4Å; A416-A420 WeakPolarHBondContact O-CB 3.46Å; A416-A420 PolarHBondContact O-N 3.28Å; Q417-A420 PolarHBondContact O-N 3.19Å; Q417-A420 VanDerWaalsContact O-N 3.13Å; A420-K422 VanDerWaalsContact C-N 3.32Å; A420-K422 PolarHBondContact O-N 2.99Å; A420-Q423 PolarHBondContact O-N 3.07Å; A420-I424 WeakPolarHBondContact O-CG1 3.46Å; A420-I424 PolarHBondContact O-N 3.16Å
421	D	97.7	Very high	95.7	Very high	73 Å²	73	70.9 Å²	70.9	39%	0.39	37%	0.368	S	S	.	.	H	α-helix	trans	-57.7	-44.3	178.5	-66.5	-30.9	0	0	0	111.8	T399 Q417 S425	T399-D421 VanDerWaalsContact CG2-OD1 3.28Å; T399-D421 WeakPolarHBondContact CG2-OD1 3.38Å; Q417-D421 PolarHBondContact NE2-OD1 3Å; Q417-D421 PolarHBondContact NE2-OD2 3.29Å; Q417-D421 VanDerWaalsContact O-CG 3.29Å; Q417-D421 PolarHBondContact O-N 2.86Å; D421-S425 WeakPolarHBondContact O-CB 3.48Å; D421-S425 PolarHBondContact O-N 2.66Å
422	K	97.2	Very high	95.6	Very high	154 Å²	154	72.6 Å²	72.6	67%	0.67	38%	0.375	S	S	*	.	H	α-helix	trans	-63.3	-44	177.4	-176.3	-178.9	177.5	-176.1	0	112.1	K418 Q419 A420 G426	K418-K422 WeakPolarHBondContact O-CB 3.25Å; K418-K422 PolarHBondContact O-N 2.95Å; Q419-K422 PolarHBondContact O-N 3.38Å; A420-K422 VanDerWaalsContact C-N 3.32Å; A420-K422 PolarHBondContact O-N 2.99Å; K422-G426 PolarHBondContact O-N 2.76Å
423	Q	95.3	Very high	95.3	Very high	76 Å²	76	73.9 Å²	73.9	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-49.9	178.7	-75.9	169.6	-18.3	0	0	111.1	Q419 A420 G426 M427	Q419-Q423 WeakPolarHBondContact O-CB 3.39Å; Q419-Q423 VanDerWaalsContact O-CG 3.29Å; Q419-Q423 WeakPolarHBondContact O-CG 3.24Å; Q419-Q423 PolarHBondContact O-N 2.98Å; A420-Q423 PolarHBondContact O-N 3.07Å; Q423-G426 PolarHBondContact O-N 3.17Å; Q423-M427 WeakPolarHBondContact O-CG 3.27Å; Q423-M427 PolarHBondContact O-N 3.46Å
424	I	96.1	Very high	95	Very high	15 Å²	15	75.8 Å²	75.8	8%	0.077	38%	0.378	C	S	.	.	H	α-helix	trans	-67.4	-41.7	-178.8	-59	-41.2	0	0	0	110.6	L395 V398 A402 A420 G426 M427 M428	L395-I424 HydrophobicContact CD2-CG2 4.18Å; V398-I424 HydrophobicContact CG1-CD1 3.55Å; V398-I424 HydrophobicContact CG1-CG1 4.26Å; A402-I424 HydrophobicContact CB-CD1 4.44Å; A420-I424 WeakPolarHBondContact O-CG1 3.46Å; A420-I424 PolarHBondContact O-N 3.16Å; I424-G426 PolarHBondContact O-N 3.32Å; I424-M427 HydrophobicContact CD1-SD 4.5Å; I424-M427 PolarHBondContact O-N 3.06Å; I424-M428 HydrophobicContact CG2-CE 4.32Å; I424-M428 HydrophobicContact CG2-CG 4.37Å; I424-M428 HydrophobicContact CG2-SD 4.49Å; I424-M428 VanDerWaalsContact O-CG 3.3Å; I424-M428 WeakPolarHBondContact O-CG 3.3Å; I424-M428 PolarHBondContact O-N 3.36Å
425	S	94.8	Very high	94.7	Very high	58 Å²	58	75.1 Å²	75.1	41%	0.406	38%	0.375	S	S	.	.	H	α-helix	trans	-59.3	-44.5	174.6	-179.3	0	0	0	0	112.4	D421 M427 M428 T429	D421-S425 WeakPolarHBondContact O-CB 3.48Å; D421-S425 PolarHBondContact O-N 2.66Å; S425-M427 PolarHBondContact O-N 3.41Å; S425-M428 PolarHBondContact O-N 2.82Å; S425-T429 PolarHBondContact O-N 3.29Å; S425-T429 PolarHBondContact O-OG1 2.86Å; S425-T429 VanDerWaalsContact O-OG1 3.08Å
426	G	94.4	Very high	94.3	Very high	33 Å²	33	70.9 Å²	70.9	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-45.4	175.5	0	0	0	0	0	112.9	K422 Q423 I424 T429 L430	K422-G426 PolarHBondContact O-N 2.76Å; Q423-G426 PolarHBondContact O-N 3.17Å; I424-G426 PolarHBondContact O-N 3.32Å; G426-T429 PolarHBondContact O-N 3.11Å; G426-L430 WeakPolarHBondContact O-CG 3.27Å; G426-L430 PolarHBondContact O-N 2.86Å
427	M	93.5	Very high	94.2	Very high	137 Å²	137	72.5 Å²	72.5	68%	0.675	37%	0.367	S	S	*	.	H	α-helix	trans	-62.7	-41.9	176.2	-73	-179.6	165.1	0	0	112.3	Q423 I424 S425 L430 G431	Q423-M427 WeakPolarHBondContact O-CG 3.27Å; Q423-M427 PolarHBondContact O-N 3.46Å; I424-M427 HydrophobicContact CD1-SD 4.5Å; I424-M427 PolarHBondContact O-N 3.06Å; S425-M427 PolarHBondContact O-N 3.41Å; M427-L430 PolarHBondContact O-N 3.24Å; M427-G431 PolarHBondContact O-N 3.22Å
428	M	93.9	Very high	94.1	Very high	42 Å²	42	72.8 Å²	72.8	21%	0.207	37%	0.373	C	S	.	.	H	α-helix	trans	-61.7	-47.6	175.9	-73.9	-170	-64.2	0	0	111.9	L395 I424 S425 L430 G431 Q432 I439	L395-M428 HydrophobicContact CD1-CE 4.35Å; L395-M428 HydrophobicContact CD1-SD 3.27Å; L395-M428 WeakPolarHBondContact CD1-SD 3.5Å; L395-M428 HydrophobicContact CD2-CG 3.91Å; L395-M428 HydrophobicContact CD2-SD 3.36Å; L395-M428 WeakPolarHBondContact CD2-SD 3.22Å; L395-M428 HydrophobicContact CG-SD 3.92Å; I424-M428 HydrophobicContact CG2-CE 4.32Å; I424-M428 HydrophobicContact CG2-CG 4.37Å; I424-M428 HydrophobicContact CG2-SD 4.49Å; I424-M428 VanDerWaalsContact O-CG 3.3Å; I424-M428 WeakPolarHBondContact O-CG 3.3Å; I424-M428 PolarHBondContact O-N 3.36Å; S425-M428 PolarHBondContact O-N 2.82Å; M428-L430 PolarHBondContact O-N 2.9Å; M428-G431 PolarHBondContact O-N 2.94Å; M428-Q432 WeakPolarHBondContact O-CB 3.24Å; M428-Q432 WeakPolarHBondContact O-CG 3.1Å; M428-Q432 PolarHBondContact O-N 3Å; M428-I439 HydrophobicContact CB-CD1 4.02Å; M428-I439 HydrophobicContact CG-CD1 4.01Å; M428-I439 HydrophobicContact SD-CD1 3.8Å
429	T	93.4	Very high	93.9	Very high	80 Å²	80	69.5 Å²	69.5	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-60	-46.4	179	-60.5	0	0	0	0	111.2	S425 G426 Q432 M433	S425-T429 PolarHBondContact O-N 3.29Å; S425-T429 PolarHBondContact O-OG1 2.86Å; S425-T429 VanDerWaalsContact O-OG1 3.08Å; G426-T429 PolarHBondContact O-N 3.11Å; T429-Q432 PolarHBondContact O-N 3.36Å; T429-M433 WeakPolarHBondContact O-CB 3.42Å; T429-M433 PolarHBondContact O-N 3.48Å
430	L	92.1	Very high	93.7	Very high	93 Å²	93	72.2 Å²	72.2	49%	0.487	38%	0.377	S	S	.	.	H	α-helix	trans	-62.9	-46	176.2	-68.3	175.9	0	0	0	111.3	G426 M427 M428 Q432 M433 F434	G426-L430 WeakPolarHBondContact O-CG 3.27Å; G426-L430 PolarHBondContact O-N 2.86Å; M427-L430 PolarHBondContact O-N 3.24Å; M428-L430 PolarHBondContact O-N 2.9Å; L430-Q432 PolarHBondContact O-N 3.17Å; L430-M433 HydrophobicContact CD2-CE 3.65Å; L430-M433 PolarHBondContact O-N 2.79Å; L430-F434 HydrophobicContact CB-CD2 4.42Å; L430-F434 HydrophobicContact CB-CE2 4.48Å; L430-F434 HydrophobicContact CD2-CE2 4.16Å; L430-F434 WeakPolarHBondContact O-CB 3.42Å; L430-F434 WeakPolarHBondContact O-CD2 3.09Å; L430-F434 PolarHBondContact O-N 3.44Å
431	G	92.6	Very high	93.4	Very high	9 Å²	9	79.1 Å²	79.1	9%	0.093	41%	0.414	C	S	.	.	H	α-helix	trans	-58.8	-42.5	178.2	0	0	0	0	0	113	M427 M428 Q435 L436 I437	M427-G431 PolarHBondContact O-N 3.22Å; M428-G431 PolarHBondContact O-N 2.94Å; G431-Q435 CarbonylContact O-C 3.59Å; G431-Q435 WeakPolarHBondContact O-CA 3.32Å; G431-Q435 PolarHBondContact O-N 3.41Å; G431-L436 PolarHBondContact O-N 3.32Å; G431-I437 PolarHBondContact O-N 3.38Å
432	Q	92.2	Very high	93.1	Very high	101 Å²	101	80.2 Å²	80.2	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-72.3	-41.6	176.1	-72.1	-176.8	-52.6	0	0	112.5	M428 T429 L430 F434 Q435 I437 I439	M428-Q432 WeakPolarHBondContact O-CB 3.24Å; M428-Q432 WeakPolarHBondContact O-CG 3.1Å; M428-Q432 PolarHBondContact O-N 3Å; T429-Q432 PolarHBondContact O-N 3.36Å; L430-Q432 PolarHBondContact O-N 3.17Å; Q432-F434 VanDerWaalsContact C-N 3.3Å; Q432-F434 PolarHBondContact O-N 3.37Å; Q432-Q435 WeakPolarHBondContact O-CA 3.48Å; Q432-Q435 PolarHBondContact O-N 3.35Å; Q432-I437 HydrophobicContact CG-CG1 4.39Å; Q432-I439 HydrophobicContact CG-CD1 3.93Å; Q432-I439 HydrophobicContact CG-CG1 4.21Å
433	M	90.4	Very high	93.1	Very high	115 Å²	115	74.6 Å²	74.6	57%	0.567	40%	0.399	S	S	*	.	H	α-helix	trans	-59.5	-41.9	178	-178.8	-179.5	72.3	0	0	111.4	T429 L430	T429-M433 WeakPolarHBondContact O-CB 3.42Å; T429-M433 PolarHBondContact O-N 3.48Å; L430-M433 HydrophobicContact CD2-CE 3.65Å; L430-M433 PolarHBondContact O-N 2.79Å
434	F	88.9	Confident	93.1	Very high	94 Å²	94	71.3 Å²	71.3	41%	0.412	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.4	173.5	-65.7	-57.9	0	0	0	113.5	L430 Q432 L436 F474	L430-F434 HydrophobicContact CB-CD2 4.42Å; L430-F434 HydrophobicContact CB-CE2 4.48Å; L430-F434 HydrophobicContact CD2-CE2 4.16Å; L430-F434 WeakPolarHBondContact O-CB 3.42Å; L430-F434 WeakPolarHBondContact O-CD2 3.09Å; L430-F434 PolarHBondContact O-N 3.44Å; Q432-F434 VanDerWaalsContact C-N 3.3Å; Q432-F434 PolarHBondContact O-N 3.37Å; F434-L436 HydrophobicContact CB-CD1 4.01Å; F434-L436 HydrophobicContact CB-CG 3.82Å; F434-L436 PolarHBondContact O-N 3.26Å; F434-L436 VanDerWaalsContact O-N 3.12Å; F434-F474 HydrophobicContact CB-CE1 3.73Å; F434-F474 HydrophobicContact CB-CZ 4.15Å; F434-F474 AromaticContact CD1-CE1 3.76Å; F434-F474 HydrophobicContact CD1-CE1 3.76Å; F434-F474 AromaticContact CG-CE1 3.84Å; F434-F474 HydrophobicContact CG-CE1 3.84Å
435	Q	90	Very high	93.2	Very high	105 Å²	105	71.5 Å²	71.5	49%	0.491	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.6	-179.4	-61.1	173	-4.5	0	0	113	G431 Q432 F457 N458 R470	G431-Q435 CarbonylContact O-C 3.59Å; G431-Q435 WeakPolarHBondContact O-CA 3.32Å; G431-Q435 PolarHBondContact O-N 3.41Å; Q432-Q435 WeakPolarHBondContact O-CA 3.48Å; Q432-Q435 PolarHBondContact O-N 3.35Å; Q435-F457 WeakPolarHBondContact O-CE1 3.16Å; Q435-N458 PolarHBondContact O-ND2 2.9Å; Q435-R470 PolarHBondContact O-NH2 2.66Å
436	L	90.7	Very high	93.3	Very high	54 Å²	54	70.4 Å²	70.4	28%	0.283	38%	0.377	S	S	.	.			trans	-75	-29.5	178.5	-66.1	175.7	0	0	0	112	G431 F434 L446 F457 N458 F474	G431-L436 PolarHBondContact O-N 3.32Å; F434-L436 HydrophobicContact CB-CD1 4.01Å; F434-L436 HydrophobicContact CB-CG 3.82Å; F434-L436 PolarHBondContact O-N 3.26Å; F434-L436 VanDerWaalsContact O-N 3.12Å; L436-L446 WeakPolarHBondContact O-CD1 2.88Å; L436-L446 WeakPolarHBondContact O-CG 3.3Å; L436-F457 HydrophobicContact CD2-CZ 4.42Å; L436-N458 PolarHBondContact O-ND2 2.74Å; L436-F474 HydrophobicContact CD2-CD2 4.25Å; L436-F474 HydrophobicContact CD2-CE1 4.27Å; L436-F474 HydrophobicContact CD2-CE2 3.69Å; L436-F474 HydrophobicContact CD2-CZ 3.7Å; L436-F474 HydrophobicContact CG-CZ 4.31Å
437	I	94.7	Very high	93.4	Very high	35 Å²	35	72.1 Å²	72.1	18%	0.179	38%	0.376	C	S	.	.			trans	-127.2	154.9	179.9	62.8	174.8	0	0	0	110.9	G431 Q432 I439 A444 S445 L446	G431-I437 PolarHBondContact O-N 3.38Å; Q432-I437 HydrophobicContact CG-CG1 4.39Å; I437-I439 HydrophobicContact CD1-CD1 4.42Å; I437-I439 HydrophobicContact CD1-CG1 4.31Å; I437-A444 HydrophobicContact CD1-CB 4.03Å; I437-S445 CarbonylContact C-O 3.41Å; I437-S445 WeakPolarHBondContact CA-O 3.32Å; I437-S445 WeakPolarHBondContact CB-O 3.43Å; I437-L446 HydrophobicContact CG2-CB 4.4Å
438	T	95.7	Very high	93.6	Very high	61 Å²	61	66.8 Å²	66.8	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	152.8	160.5	57.8	0	0	0	0	109	A444 S445 N458	T438-A444 CarbonylContact O-C 3.55Å; T438-A444 WeakPolarHBondContact O-CA 3.2Å; T438-S445 PolarHBondContact N-O 2.94Å; T438-S445 PolarHBondContact O-N 2.94Å; T438-N458 HydrophobicContact CG2-CB 3.91Å
439	I	93.8	Very high	93.8	Very high	56 Å²	56	71.2 Å²	71.2	29%	0.287	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.3	174.2	-57	-176.3	0	0	0	107.2	L395 M428 Q432 I437 T443 A444	L395-I439 HydrophobicContact CD1-CG2 4.3Å; M428-I439 HydrophobicContact CB-CD1 4.02Å; M428-I439 HydrophobicContact CG-CD1 4.01Å; M428-I439 HydrophobicContact SD-CD1 3.8Å; Q432-I439 HydrophobicContact CG-CD1 3.93Å; Q432-I439 HydrophobicContact CG-CG1 4.21Å; I437-I439 HydrophobicContact CD1-CD1 4.42Å; I437-I439 HydrophobicContact CD1-CG1 4.31Å; I439-T443 WeakPolarHBondContact CA-O 3.38Å; I439-A444 HydrophobicContact CG1-CB 4.48Å
440	D	92.8	Very high	94	Very high	125 Å²	125	68.5 Å²	68.5	67%	0.668	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	138.7	172.6	179.6	41	0	0	0	109.2	N442 T443	D440-N442 VanDerWaalsContact C-N 3.28Å; D440-N442 PolarHBondContact O-N 3.05Å; D440-N442 VanDerWaalsContact O-N 3.1Å; D440-T443 PolarHBondContact N-O 2.98Å; D440-T443 VanDerWaalsContact N-O 3.11Å; D440-T443 WeakPolarHBondContact O-CA 3.21Å; D440-T443 WeakPolarHBondContact O-CB 3.22Å; D440-T443 PolarHBondContact O-N 3.34Å
441	N	90.8	Very high	94.1	Very high	146 Å²	146	67 Å²	67	78%	0.781	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.7	50.6	177.9	-161.3	26.2	0	0	0	114.4	T443	N441-T443 PolarHBondContact O-N 2.76Å
442	N	91.5	Very high	94.2	Very high	95 Å²	95	68.6 Å²	68.6	51%	0.508	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	24.7	-178.7	-156.1	51.6	0	0	0	115.3	L395 D440	L395-N442 WeakPolarHBondContact CB-O 3.11Å; L395-N442 WeakPolarHBondContact CD1-OD1 3.48Å; L395-N442 VanDerWaalsContact CG-O 3.3Å; L395-N442 WeakPolarHBondContact CG-O 3.34Å; L395-N442 PolarHBondContact N-O 3.32Å; D440-N442 VanDerWaalsContact C-N 3.28Å; D440-N442 PolarHBondContact O-N 3.05Å; D440-N442 VanDerWaalsContact O-N 3.1Å
443	T	96.6	Very high	94.1	Very high	37 Å²	37	66.1 Å²	66.1	23%	0.227	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120	176.5	-57.8	0	0	0	0	109.7	K392 I439 D440 N441	K392-T443 HydrophobicContact CB-CG2 4.47Å; I439-T443 WeakPolarHBondContact CA-O 3.38Å; D440-T443 PolarHBondContact N-O 2.98Å; D440-T443 VanDerWaalsContact N-O 3.11Å; D440-T443 WeakPolarHBondContact O-CA 3.21Å; D440-T443 WeakPolarHBondContact O-CB 3.22Å; D440-T443 PolarHBondContact O-N 3.34Å; N441-T443 PolarHBondContact O-N 2.76Å
444	A	96.6	Very high	94.3	Very high	6 Å²	6	64.3 Å²	64.3	5%	0.05	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	130.8	168.5	0	0	0	0	0	109.4	L393 L395 I437 T438 I439	L393-A444 HydrophobicContact CB-CB 4.34Å; L393-A444 PolarHBondContact N-O 2.83Å; L393-A444 PolarHBondContact O-N 3.29Å; L395-A444 HydrophobicContact CD2-CB 4Å; I437-A444 HydrophobicContact CD1-CB 4.03Å; T438-A444 CarbonylContact O-C 3.55Å; T438-A444 WeakPolarHBondContact O-CA 3.2Å; I439-A444 HydrophobicContact CG1-CB 4.48Å
445	S	97.2	Very high	94.7	Very high	20 Å²	20	60 Å²	60	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.8	-178.8	-56.1	0	0	0	0	111.6	V391 I437 T438	V391-S445 VanDerWaalsContact O-CA 3.23Å; V391-S445 WeakPolarHBondContact O-CA 2.55Å; I437-S445 CarbonylContact C-O 3.41Å; I437-S445 WeakPolarHBondContact CA-O 3.32Å; I437-S445 WeakPolarHBondContact CB-O 3.43Å; T438-S445 PolarHBondContact N-O 2.94Å; T438-S445 PolarHBondContact O-N 2.94Å
446	L	96.7	Very high	95.1	Very high	35 Å²	35	56.8 Å²	56.8	18%	0.183	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.3	168.4	-179.2	160.2	0	0	0	107.8	F389 D390 V391 L436 I437 F457 N458	F389-L446 HydrophobicContact CD1-CD2 3.47Å; F389-L446 VanDerWaalsContact CD1-CD2 3.47Å; F389-L446 HydrophobicContact CE1-CD2 3.64Å; D390-L446 WeakPolarHBondContact CA-O 2.83Å; V391-L446 HydrophobicContact CB-CB 4.17Å; V391-L446 HydrophobicContact CG2-CB 4.5Å; V391-L446 PolarHBondContact N-O 3.02Å; V391-L446 PolarHBondContact O-N 3.45Å; L436-L446 WeakPolarHBondContact O-CD1 2.88Å; L436-L446 WeakPolarHBondContact O-CG 3.3Å; I437-L446 HydrophobicContact CG2-CB 4.4Å; L446-F457 HydrophobicContact CD1-CE2 4.35Å; L446-F457 HydrophobicContact CD1-CZ 4.45Å; L446-F457 HydrophobicContact CD2-CE2 4.1Å; L446-F457 HydrophobicContact CG-CE2 3.98Å; L446-F457 HydrophobicContact CG-CZ 4.37Å; L446-N458 WeakPolarHBondContact CA-OD1 3.28Å
447	Q	97.4	Very high	95.3	Very high	68 Å²	68	54.9 Å²	54.9	32%	0.318	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.7	178.1	-61.6	-170.9	-45.3	0	0	110	F389 D390 F457 N458	F389-Q447 CarbonylContact O-C 3.49Å; F389-Q447 WeakPolarHBondContact O-CA 3.46Å; D390-Q447 WeakPolarHBondContact OD1-CG 3.4Å; D390-Q447 PolarHBondContact OD1-NE2 3.31Å; Q447-F457 CarbonylContact O-C 3.54Å; Q447-F457 WeakPolarHBondContact O-CA 3.08Å; Q447-F457 WeakPolarHBondContact O-CD2 3.29Å; Q447-N458 PolarHBondContact N-OD1 3.11Å; Q447-N458 PolarHBondContact O-N 2.95Å
448	L	97.4	Very high	95.4	Very high	26 Å²	26	54.3 Å²	54.3	14%	0.136	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.2	172.3	172.7	64.2	0	0	0	108.1	L387 N388 F389 V455 F457 F467	L387-L448 HydrophobicContact CD2-CD2 3.91Å; L387-L448 HydrophobicContact CD2-CG 4.14Å; N388-L448 CarbonylContact C-O 3.55Å; N388-L448 WeakPolarHBondContact CA-O 3.23Å; F389-L448 HydrophobicContact CB-CB 4.25Å; F389-L448 PolarHBondContact N-O 2.82Å; F389-L448 PolarHBondContact O-N 2.71Å; L448-V455 HydrophobicContact CD1-CG1 3.58Å; L448-F457 HydrophobicContact CB-CD2 4.08Å; L448-F457 HydrophobicContact CD1-CB 4.38Å; L448-F457 HydrophobicContact CD1-CD2 4.07Å; L448-F467 HydrophobicContact CD1-CD2 4.44Å; L448-F467 HydrophobicContact CD1-CE1 4.4Å; L448-F467 HydrophobicContact CD1-CE2 3.76Å; L448-F467 HydrophobicContact CD1-CZ 3.73Å; L448-F467 HydrophobicContact CD2-CZ 3.95Å
449	R	98.1	Very high	95.2	Very high	134 Å²	134	54.4 Å²	54.4	51%	0.506	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.2	169.1	-55.3	-174.7	178.7	-164.2	-3.4	108.4	L387 N388 V455 V456	L387-R449 CarbonylContact O-C 3.46Å; L387-R449 WeakPolarHBondContact O-CA 3.35Å; N388-R449 WeakPolarHBondContact OD1-CG 3.26Å; R449-V455 CarbonylContact O-C 3.54Å; R449-V455 WeakPolarHBondContact O-CA 3.41Å; R449-V456 HydrophobicContact CB-CB 4.29Å; R449-V456 PolarHBondContact N-O 3.29Å; R449-V456 PolarHBondContact O-N 3.03Å
450	Y	96.9	Very high	95.3	Very high	24 Å²	24	56.6 Å²	56.6	9%	0.094	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135	-179.2	164.4	-101	0	0	0	109.3	N381 I384 S386 L387 V455 E464	N381-Y450 WeakPolarHBondContact CB-OH 3.06Å; N381-Y450 PolarHBondContact ND2-OH 3.38Å; I384-Y450 HydrophobicContact CB-CE1 4.1Å; I384-Y450 HydrophobicContact CG2-CD1 4Å; I384-Y450 HydrophobicContact CG2-CE1 3.75Å; S386-Y450 CarbonylContact C-O 3.56Å; S386-Y450 WeakPolarHBondContact CA-O 3.42Å; L387-Y450 HydrophobicContact CB-CD1 4.06Å; L387-Y450 PolarHBondContact N-O 3.03Å; L387-Y450 PolarHBondContact O-N 2.91Å; Y450-V455 HydrophobicContact CD2-CG2 3.91Å; Y450-E464 HydrophobicContact CE2-CG 3.9Å; Y450-E464 WeakPolarHBondContact CE2-OE1 3.35Å; Y450-E464 PolarHBondContact OH-OE1 2.77Å
451	T	95.5	Very high	95.4	Very high	62 Å²	62	56.9 Å²	56.9	38%	0.38	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.7	162.4	50.6	0	0	0	0	106.3	G453 K454	T451-G453 PolarHBondContact O-N 3.41Å; T451-G453 VanDerWaalsContact O-N 3.14Å; T451-K454 PolarHBondContact N-O 2.7Å; T451-K454 CarbonylContact O-C 3.59Å; T451-K454 PolarHBondContact O-N 3.47Å
452	P	93.7	Very high	95.6	Very high	41 Å²	41	51.1 Å²	51.1	27%	0.266	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	126.6	179.8	-26.2	32.7	0	0	0	112.9	S378 I384 K385	S378-P452 WeakPolarHBondContact OG-CB 3.41Å; I384-P452 VanDerWaalsContact O-CG 3.23Å; I384-P452 WeakPolarHBondContact O-CG 3.37Å; K385-P452 VanDerWaalsContact O-CD 3.25Å; K385-P452 WeakPolarHBondContact O-CD 3.29Å
453	G	91.7	Very high	95.7	Very high	49 Å²	49	48.7 Å²	48.7	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-4.6	-176.2	0	0	0	0	0	115.6	T380 T451 E464	T380-G453 PolarHBondContact OG1-N 2.74Å; T451-G453 PolarHBondContact O-N 3.41Å; T451-G453 VanDerWaalsContact O-N 3.14Å; G453-E464 PolarHBondContact N-OE1 2.73Å
454	K	94.5	Very high	95.4	Very high	78 Å²	78	49.1 Å²	49.1	34%	0.339	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	126.7	-174.4	177.7	169.8	175.5	146.8	0	113.2	T451 E461	T451-K454 PolarHBondContact N-O 2.7Å; T451-K454 CarbonylContact O-C 3.59Å; T451-K454 PolarHBondContact O-N 3.47Å; K454-E461 WeakPolarHBondContact CE-OE1 3.2Å; K454-E461 VanDerWaalsContact CE-OE2 3.29Å; K454-E461 WeakPolarHBondContact CE-OE2 3.08Å; K454-E461 HydrophobicContact CG-CG 4.38Å; K454-E461 IonicContact NZ-OE1 2.85Å; K454-E461 PolarHBondContact NZ-OE1 2.84Å; K454-E461 IonicContact NZ-OE2 2.66Å; K454-E461 PolarHBondContact NZ-OE2 2.79Å
455	V	96.6	Very high	95	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.5	171.8	-179.6	0	0	0	0	109.4	L448 R449 Y450 F457 E461 M462 E464 F467	L448-V455 HydrophobicContact CD1-CG1 3.58Å; R449-V455 CarbonylContact O-C 3.54Å; R449-V455 WeakPolarHBondContact O-CA 3.41Å; Y450-V455 HydrophobicContact CD2-CG2 3.91Å; V455-F457 HydrophobicContact CG1-CB 4.39Å; V455-E461 CarbonylContact O-C 3.53Å; V455-E461 WeakPolarHBondContact O-CA 3.25Å; V455-M462 HydrophobicContact CB-CG 4Å; V455-M462 HydrophobicContact CG1-CG 4.21Å; V455-M462 PolarHBondContact N-O 2.94Å; V455-M462 PolarHBondContact O-N 2.88Å; V455-M462 VanDerWaalsContact O-O 3.08Å; V455-E464 HydrophobicContact CG2-CG 4.3Å; V455-F467 HydrophobicContact CB-CB 4.18Å; V455-F467 HydrophobicContact CB-CG 4.42Å; V455-F467 HydrophobicContact CG1-CB 4.04Å; V455-F467 HydrophobicContact CG1-CD1 4.42Å; V455-F467 HydrophobicContact CG1-CD2 3.67Å; V455-F467 HydrophobicContact CG1-CE2 4.23Å; V455-F467 HydrophobicContact CG1-CG 3.78Å; V455-F467 HydrophobicContact CG2-CB 3.99Å; V455-F467 HydrophobicContact CG2-CD1 4.49Å; V455-F467 HydrophobicContact CG2-CG 4.23Å
456	V	97.7	Very high	94.7	Very high	38 Å²	38	61.1 Å²	61.1	23%	0.23	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.5	166.5	-177.4	0	0	0	0	107.8	R449 Q460 E461	R449-V456 HydrophobicContact CB-CB 4.29Å; R449-V456 PolarHBondContact N-O 3.29Å; R449-V456 PolarHBondContact O-N 3.03Å; V456-Q460 CarbonylContact C-O 3.5Å; V456-Q460 WeakPolarHBondContact CA-O 3.36Å; V456-E461 HydrophobicContact CG2-CB 4.48Å
457	F	96.2	Very high	94.5	Very high	13 Å²	13	61.4 Å²	61.4	6%	0.057	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120.4	-179.9	-175.9	-115.7	0	0	0	110.1	Q435 L436 L446 Q447 L448 V455 G459 Q460 M462 F467	Q435-F457 WeakPolarHBondContact O-CE1 3.16Å; L436-F457 HydrophobicContact CD2-CZ 4.42Å; L446-F457 HydrophobicContact CD1-CE2 4.35Å; L446-F457 HydrophobicContact CD1-CZ 4.45Å; L446-F457 HydrophobicContact CD2-CE2 4.1Å; L446-F457 HydrophobicContact CG-CE2 3.98Å; L446-F457 HydrophobicContact CG-CZ 4.37Å; Q447-F457 CarbonylContact O-C 3.54Å; Q447-F457 WeakPolarHBondContact O-CA 3.08Å; Q447-F457 WeakPolarHBondContact O-CD2 3.29Å; L448-F457 HydrophobicContact CB-CD2 4.08Å; L448-F457 HydrophobicContact CD1-CB 4.38Å; L448-F457 HydrophobicContact CD1-CD2 4.07Å; V455-F457 HydrophobicContact CG1-CB 4.39Å; F457-G459 PolarHBondContact O-N 2.9Å; F457-G459 VanDerWaalsContact O-N 3.16Å; F457-Q460 PolarHBondContact N-O 3.35Å; F457-Q460 WeakPolarHBondContact O-CB 3.47Å; F457-Q460 PolarHBondContact O-N 2.85Å; F457-M462 HydrophobicContact CB-CE 3.98Å; F457-M462 HydrophobicContact CB-SD 4.46Å; F457-F467 HydrophobicContact CB-CD2 4.23Å; F457-F467 HydrophobicContact CB-CE2 4.11Å; F457-F467 HydrophobicContact CD1-CE2 4.46Å; F457-F467 AromaticContact CD2-CE2 3.95Å; F457-F467 HydrophobicContact CD2-CE2 3.95Å; F457-F467 HydrophobicContact CG-CD2 4.43Å; F457-F467 AromaticContact CG-CE2 3.92Å; F457-F467 HydrophobicContact CG-CE2 3.92Å
458	N	95	Very high	93.9	Very high	24 Å²	24	64.1 Å²	64.1	13%	0.128	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	39.9	-176.6	-69.7	-22.8	0	0	0	113.1	Q435 L436 T438 L446 Q447 Q460	Q435-N458 PolarHBondContact O-ND2 2.9Å; L436-N458 PolarHBondContact O-ND2 2.74Å; T438-N458 HydrophobicContact CG2-CB 3.91Å; L446-N458 WeakPolarHBondContact CA-OD1 3.28Å; Q447-N458 PolarHBondContact N-OD1 3.11Å; Q447-N458 PolarHBondContact O-N 2.95Å; N458-Q460 VanDerWaalsContact C-N 3.31Å; N458-Q460 PolarHBondContact O-N 3.36Å
459	G	93.3	Very high	93.4	Very high	63 Å²	63	66.6 Å²	66.6	65%	0.649	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-4.5	-179.1	0	0	0	0	0	115.5	F457	F457-G459 PolarHBondContact O-N 2.9Å; F457-G459 VanDerWaalsContact O-N 3.16Å
460	Q	94.2	Very high	92.7	Very high	101 Å²	101	62 Å²	62	47%	0.472	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.4	176.6	-63.3	179.9	-19	0	0	110.5	V456 F457 N458 M462	V456-Q460 CarbonylContact C-O 3.5Å; V456-Q460 WeakPolarHBondContact CA-O 3.36Å; F457-Q460 PolarHBondContact N-O 3.35Å; F457-Q460 WeakPolarHBondContact O-CB 3.47Å; F457-Q460 PolarHBondContact O-N 2.85Å; N458-Q460 VanDerWaalsContact C-N 3.31Å; N458-Q460 PolarHBondContact O-N 3.36Å; Q460-M462 HydrophobicContact CB-CE 3.95Å
461	E	96.6	Very high	91.8	Very high	132 Å²	132	62.1 Å²	62.1	62%	0.617	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.7	172.4	-175.2	166.9	166.8	0	0	110.5	K454 V455 V456	K454-E461 WeakPolarHBondContact CE-OE1 3.2Å; K454-E461 VanDerWaalsContact CE-OE2 3.29Å; K454-E461 WeakPolarHBondContact CE-OE2 3.08Å; K454-E461 HydrophobicContact CG-CG 4.38Å; K454-E461 IonicContact NZ-OE1 2.85Å; K454-E461 PolarHBondContact NZ-OE1 2.84Å; K454-E461 IonicContact NZ-OE2 2.66Å; K454-E461 PolarHBondContact NZ-OE2 2.79Å; V455-E461 CarbonylContact O-C 3.53Å; V455-E461 WeakPolarHBondContact O-CA 3.25Å; V456-E461 HydrophobicContact CG2-CB 4.48Å
462	M	94.6	Very high	90.6	Very high	25 Å²	25	60.7 Å²	60.7	12%	0.123	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.7	178.9	65.3	-166.9	69.4	0	0	111	V455 F457 Q460 E466 F467	V455-M462 HydrophobicContact CB-CG 4Å; V455-M462 HydrophobicContact CG1-CG 4.21Å; V455-M462 PolarHBondContact N-O 2.94Å; V455-M462 PolarHBondContact O-N 2.88Å; V455-M462 VanDerWaalsContact O-O 3.08Å; F457-M462 HydrophobicContact CB-CE 3.98Å; F457-M462 HydrophobicContact CB-SD 4.46Å; Q460-M462 HydrophobicContact CB-CE 3.95Å; M462-E466 HydrophobicContact CB-CB 4.16Å; M462-F467 HydrophobicContact CG-CB 4.11Å; M462-F467 HydrophobicContact SD-CB 3.92Å; M462-F467 HydrophobicContact SD-CD2 3.94Å; M462-F467 HydrophobicContact SD-CG 4.45Å
463	S	92.7	Very high	89.5	Confident	44 Å²	44	67.9 Å²	67.9	31%	0.308	37%	0.367	S	S	.	.			trans	-73	162.5	172.4	64.2	0	0	0	0	112.1	E465 E466 F467	S463-E465 VanDerWaalsContact C-N 3.3Å; S463-E465 PolarHBondContact O-N 3.01Å; S463-E466 PolarHBondContact N-OE2 3.29Å; S463-E466 PolarHBondContact O-N 3.04Å; S463-E466 WeakPolarHBondContact OG-CB 3.35Å; S463-E466 VanDerWaalsContact OG-CD 3.29Å; S463-E466 WeakPolarHBondContact OG-CG 3.07Å; S463-E466 PolarHBondContact OG-N 3.41Å; S463-E466 PolarHBondContact OG-OE2 2.94Å; S463-F467 PolarHBondContact O-N 2.87Å
464	E	90.3	Very high	88	Confident	46 Å²	46	69.3 Å²	69.3	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-41.9	173.3	-67	178.9	-163.5	0	0	111.8	T380 Y450 G453 V455 F467 M468	T380-E464 WeakPolarHBondContact CB-OE1 3.16Å; T380-E464 WeakPolarHBondContact CB-OE2 3.45Å; T380-E464 PolarHBondContact OG1-OE1 2.85Å; Y450-E464 HydrophobicContact CE2-CG 3.9Å; Y450-E464 WeakPolarHBondContact CE2-OE1 3.35Å; Y450-E464 PolarHBondContact OH-OE1 2.77Å; G453-E464 PolarHBondContact N-OE1 2.73Å; V455-E464 HydrophobicContact CG2-CG 4.3Å; E464-F467 PolarHBondContact O-N 3.07Å; E464-M468 WeakPolarHBondContact O-CB 3.36Å; E464-M468 VanDerWaalsContact O-CG 3.3Å; E464-M468 WeakPolarHBondContact O-CG 3.31Å; E464-M468 PolarHBondContact O-N 3.46Å
465	E	89.1	Confident	86	Confident	164 Å²	164	71.6 Å²	71.6	77%	0.766	38%	0.379	S	S	*	.	H	α-helix	trans	-63.6	-44.2	179.1	-66.4	-178.5	-179.5	0	0	111.9	S463 M468 S469	S463-E465 VanDerWaalsContact C-N 3.3Å; S463-E465 PolarHBondContact O-N 3.01Å; E465-M468 PolarHBondContact O-N 3.15Å; E465-S469 VanDerWaalsContact O-CB 3.24Å; E465-S469 WeakPolarHBondContact O-CB 3.41Å; E465-S469 PolarHBondContact O-N 2.66Å
466	E	90.6	Very high	83.3	Confident	114 Å²	114	82.3 Å²	82.3	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-62.8	-43.8	175.5	-75.3	168.6	145.1	0	0	111.5	M462 S463 S469 R470	M462-E466 HydrophobicContact CB-CB 4.16Å; S463-E466 PolarHBondContact N-OE2 3.29Å; S463-E466 PolarHBondContact O-N 3.04Å; S463-E466 WeakPolarHBondContact OG-CB 3.35Å; S463-E466 VanDerWaalsContact OG-CD 3.29Å; S463-E466 WeakPolarHBondContact OG-CG 3.07Å; S463-E466 PolarHBondContact OG-N 3.41Å; S463-E466 PolarHBondContact OG-OE2 2.94Å; E466-S469 PolarHBondContact O-N 3.3Å; E466-R470 WeakPolarHBondContact O-CB 3.31Å; E466-R470 PolarHBondContact O-N 2.76Å
467	F	91.4	Very high	82.6	Confident	41 Å²	41	84.5 Å²	84.5	18%	0.18	44%	0.439	C	S	.	.	H	α-helix	trans	-62.9	-46.1	176.8	-178.9	-102.4	0	0	0	111.8	L448 V455 F457 M462 S463 E464 R470 A471	L448-F467 HydrophobicContact CD1-CD2 4.44Å; L448-F467 HydrophobicContact CD1-CE1 4.4Å; L448-F467 HydrophobicContact CD1-CE2 3.76Å; L448-F467 HydrophobicContact CD1-CZ 3.73Å; L448-F467 HydrophobicContact CD2-CZ 3.95Å; V455-F467 HydrophobicContact CB-CB 4.18Å; V455-F467 HydrophobicContact CB-CG 4.42Å; V455-F467 HydrophobicContact CG1-CB 4.04Å; V455-F467 HydrophobicContact CG1-CD1 4.42Å; V455-F467 HydrophobicContact CG1-CD2 3.67Å; V455-F467 HydrophobicContact CG1-CE2 4.23Å; V455-F467 HydrophobicContact CG1-CG 3.78Å; V455-F467 HydrophobicContact CG2-CB 3.99Å; V455-F467 HydrophobicContact CG2-CD1 4.49Å; V455-F467 HydrophobicContact CG2-CG 4.23Å; F457-F467 HydrophobicContact CB-CD2 4.23Å; F457-F467 HydrophobicContact CB-CE2 4.11Å; F457-F467 HydrophobicContact CD1-CE2 4.46Å; F457-F467 AromaticContact CD2-CE2 3.95Å; F457-F467 HydrophobicContact CD2-CE2 3.95Å; F457-F467 HydrophobicContact CG-CD2 4.43Å; F457-F467 AromaticContact CG-CE2 3.92Å; F457-F467 HydrophobicContact CG-CE2 3.92Å; M462-F467 HydrophobicContact CG-CB 4.11Å; M462-F467 HydrophobicContact SD-CB 3.92Å; M462-F467 HydrophobicContact SD-CD2 3.94Å; M462-F467 HydrophobicContact SD-CG 4.45Å; S463-F467 PolarHBondContact O-N 2.87Å; E464-F467 PolarHBondContact O-N 3.07Å; F467-R470 CarbonylContact O-C 3.56Å; F467-R470 WeakPolarHBondContact O-CB 3.45Å; F467-R470 PolarHBondContact O-N 2.82Å; F467-A471 WeakPolarHBondContact O-CB 3.29Å; F467-A471 PolarHBondContact O-N 3.43Å
468	M	86.1	Confident	81.9	Confident	124 Å²	124	88.3 Å²	88.3	61%	0.611	46%	0.459	S	S	*	.	H	α-helix	trans	-66.7	-38.3	178.6	-71.4	-57.7	-65.4	0	0	112.5	E464 E465 R470 A471 G472	E464-M468 WeakPolarHBondContact O-CB 3.36Å; E464-M468 VanDerWaalsContact O-CG 3.3Å; E464-M468 WeakPolarHBondContact O-CG 3.31Å; E464-M468 PolarHBondContact O-N 3.46Å; E465-M468 PolarHBondContact O-N 3.15Å; M468-R470 VanDerWaalsContact C-N 3.27Å; M468-R470 PolarHBondContact O-N 2.9Å; M468-A471 PolarHBondContact O-N 2.74Å; M468-G472 PolarHBondContact O-N 3.01Å
469	S	86.4	Confident	81.1	Confident	78 Å²	78	91.8 Å²	91.8	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-60.4	-39.2	172.5	178.8	0	0	0	0	111.6	E465 E466	E465-S469 VanDerWaalsContact O-CB 3.24Å; E465-S469 WeakPolarHBondContact O-CB 3.41Å; E465-S469 PolarHBondContact O-N 2.66Å; E466-S469 PolarHBondContact O-N 3.3Å
470	R	83.6	Confident	80.4	Confident	39 Å²	39	93.5 Å²	93.5	15%	0.147	47%	0.467	C	S	.	.	H	α-helix	trans	-69.7	-44.9	173.8	-174.1	173.4	174.4	-179.6	-8.3	111.8	Q435 E466 F467 M468 R473 F474	Q435-R470 PolarHBondContact O-NH2 2.66Å; E466-R470 WeakPolarHBondContact O-CB 3.31Å; E466-R470 PolarHBondContact O-N 2.76Å; F467-R470 CarbonylContact O-C 3.56Å; F467-R470 WeakPolarHBondContact O-CB 3.45Å; F467-R470 PolarHBondContact O-N 2.82Å; M468-R470 VanDerWaalsContact C-N 3.27Å; M468-R470 PolarHBondContact O-N 2.9Å; R470-R473 WeakPolarHBondContact O-CB 2.97Å; R470-R473 PolarHBondContact O-N 3Å; R470-F474 HydrophobicContact CG-CE2 4.23Å; R470-F474 WeakPolarHBondContact O-CD2 3.34Å; R470-F474 WeakPolarHBondContact O-CE2 3.41Å
471	A	78.2	Confident	79.6	Confident	26 Å²	26	93.1 Å²	93.1	22%	0.215	47%	0.467	C	S	.	.	H	α-helix	trans	-64.3	-39	-179.9	0	0	0	0	0	112.6	F467 M468 R473 F474	F467-A471 WeakPolarHBondContact O-CB 3.29Å; F467-A471 PolarHBondContact O-N 3.43Å; M468-A471 PolarHBondContact O-N 2.74Å; A471-R473 PolarHBondContact O-N 3.12Å; A471-F474 WeakPolarHBondContact O-CB 3.21Å; A471-F474 WeakPolarHBondContact O-CD2 3.28Å; A471-F474 PolarHBondContact O-N 3.36Å
472	G	71.2	Confident	78.4	Confident	31 Å²	31	90.5 Å²	90.5	32%	0.32	46%	0.457	S	S	.	.	H	α-helix	trans	-61.5	-22	178.1	0	0	0	0	0	113.9	M468 F474 H476	M468-G472 PolarHBondContact O-N 3.01Å; G472-F474 PolarHBondContact O-N 2.72Å; G472-H476 PolarHBondContact O-CD2 2.79Å
473	R	68.6	Low	77.3	Confident	193 Å²	193	95.1 Å²	95.1	73%	0.728	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.8	172.1	-61.1	-178.9	-174.5	-173.7	0.4	113.6	R470 A471	R470-R473 WeakPolarHBondContact O-CB 2.97Å; R470-R473 PolarHBondContact O-N 3Å; A471-R473 PolarHBondContact O-N 3.12Å
474	F	61.7	Low	76.1	Confident	79 Å²	79	99.1 Å²	99.1	35%	0.346	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-13.6	-176.9	-48.9	-61.3	0	0	0	113.9	F434 L436 R470 A471 G472	F434-F474 HydrophobicContact CB-CE1 3.73Å; F434-F474 HydrophobicContact CB-CZ 4.15Å; F434-F474 AromaticContact CD1-CE1 3.76Å; F434-F474 HydrophobicContact CD1-CE1 3.76Å; F434-F474 AromaticContact CG-CE1 3.84Å; F434-F474 HydrophobicContact CG-CE1 3.84Å; L436-F474 HydrophobicContact CD2-CD2 4.25Å; L436-F474 HydrophobicContact CD2-CE1 4.27Å; L436-F474 HydrophobicContact CD2-CE2 3.69Å; L436-F474 HydrophobicContact CD2-CZ 3.7Å; L436-F474 HydrophobicContact CG-CZ 4.31Å; R470-F474 HydrophobicContact CG-CE2 4.23Å; R470-F474 WeakPolarHBondContact O-CD2 3.34Å; R470-F474 WeakPolarHBondContact O-CE2 3.41Å; A471-F474 WeakPolarHBondContact O-CB 3.21Å; A471-F474 WeakPolarHBondContact O-CD2 3.28Å; A471-F474 PolarHBondContact O-N 3.36Å; G472-F474 PolarHBondContact O-N 2.72Å
475	V	52.3	Low	74.9	Confident	125 Å²	125	103.5 Å²	103.5	76%	0.758	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-10.1	-178.6	-175.6	0	0	0	0	111.9
476	H	39.6	Very low	73.6	Confident	228 Å²	228	98 Å²	98	100%	1.056	49%	0.494	S	S	*	.			trans	-104.6	0	168.9	-64.7	-55.2	0	0	0	110	G472	G472-H476 PolarHBondContact O-CD2 2.79Å

Retrieved 476 of 476 residues in 290 ms (Link to these results)

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