A0A2K5LXX9_CERAT Loading...

Protein phosphatase, Mg2+/Mn2+ dependent 1H

AlphaFold DB , UniProt , Accession A0A2K5LXX9, Species CERAT (Cercocebus atys, Sooty mangabey), Gene PPM1H, Length 514 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	38.9	Very low	43.7	Very low	176 Å²	176	83.5 Å²	83.5	87%	0.867	45%	0.445	S	S	*	.				0	-51.2	0	-85.7	173.3	179.7	0	0	112.5	T3 R4	M1-T3 PolarHBondContact O-N 2.75Å; M1-R4 PolarHBondContact O-N 3.12Å
2	L	41.6	Very low	43.6	Very low	102 Å²	102	83.8 Å²	83.8	53%	0.534	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-12.1	174.2	-80.5	158.8	0	0	0	116.6	K6	L2-K6 WeakPolarHBondContact O-CD 3.48Å; L2-K6 WeakPolarHBondContact O-CG 3.45Å
3	T	40.8	Very low	43.2	Very low	105 Å²	105	88.9 Å²	88.9	64%	0.644	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-21.8	176.1	40.3	0	0	0	0	113.8	M1	M1-T3 PolarHBondContact O-N 2.75Å
4	R	47.7	Very low	42.6	Very low	160 Å²	160	86 Å²	86	60%	0.604	47%	0.465	S	S	*	.	H	α-helix	trans	-80.8	-49.7	-171.6	-66.4	-176	176.2	177.3	-3.9	112.7	M1 K6 S7	M1-R4 PolarHBondContact O-N 3.12Å; R4-K6 PolarHBondContact O-N 3.05Å; R4-S7 WeakPolarHBondContact O-CB 3.38Å; R4-S7 PolarHBondContact O-N 2.74Å
5	V	47.9	Very low	41.9	Very low	14 Å²	14	85.4 Å²	85.4	9%	0.085	49%	0.487	C	S	.	.	H	α-helix	trans	-63.5	-27.6	173.9	-172	0	0	0	0	112.2	S7 V9 E329 F370	V5-S7 VanDerWaalsContact C-N 3.25Å; V5-S7 PolarHBondContact O-N 2.97Å; V5-V9 HydrophobicContact CG1-CG2 4.35Å; V5-V9 VanDerWaalsContact O-CG2 3.32Å; V5-V9 WeakPolarHBondContact O-CG2 3.23Å; V5-V9 PolarHBondContact O-N 3.12Å; V5-V9 VanDerWaalsContact O-N 3.14Å; V5-E329 WeakPolarHBondContact CG2-OE2 3.06Å; V5-F370 HydrophobicContact CB-CD2 4.2Å; V5-F370 HydrophobicContact CB-CE1 4.39Å; V5-F370 HydrophobicContact CB-CE2 3.53Å; V5-F370 HydrophobicContact CB-CZ 3.61Å; V5-F370 HydrophobicContact CG1-CD1 3.95Å; V5-F370 HydrophobicContact CG1-CD2 3.68Å; V5-F370 HydrophobicContact CG1-CE1 3.67Å; V5-F370 HydrophobicContact CG1-CE2 3.4Å; V5-F370 VanDerWaalsContact CG1-CE2 3.4Å; V5-F370 HydrophobicContact CG1-CG 3.93Å; V5-F370 HydrophobicContact CG1-CZ 3.37Å; V5-F370 HydrophobicContact CG2-CE2 4.18Å
6	K	47.8	Very low	41.1	Very low	111 Å²	111	88.3 Å²	88.3	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-30.1	173.3	-77.7	-177.6	-179.1	-175	0	112.9	L2 R4 A10	L2-K6 WeakPolarHBondContact O-CD 3.48Å; L2-K6 WeakPolarHBondContact O-CG 3.45Å; R4-K6 PolarHBondContact O-N 3.05Å; K6-A10 WeakPolarHBondContact O-CB 3.27Å; K6-A10 PolarHBondContact O-N 3.25Å
7	S	42	Very low	40.5	Very low	59 Å²	59	93.6 Å²	93.6	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-72.3	-46	-179.8	-165.4	0	0	0	0	111.7	R4 V5 V9 A10 N11	R4-S7 WeakPolarHBondContact O-CB 3.38Å; R4-S7 PolarHBondContact O-N 2.74Å; V5-S7 VanDerWaalsContact C-N 3.25Å; V5-S7 PolarHBondContact O-N 2.97Å; S7-V9 VanDerWaalsContact C-N 3.31Å; S7-V9 PolarHBondContact O-N 2.94Å; S7-A10 PolarHBondContact O-N 2.95Å; S7-N11 PolarHBondContact O-N 2.61Å
8	A	44.5	Very low	39.7	Very low	26 Å²	26	93.1 Å²	93.1	22%	0.215	53%	0.531	C	S	.	.	H	α-helix	trans	-60.5	-41.4	174.3	0	0	0	0	0	111.8	F12 H400	A8-F12 PolarHBondContact O-N 3.34Å; A8-H400 HydrophobicContact CB-CB 4.12Å
9	V	49.3	Very low	39.1	Very low	10 Å²	10	91.6 Å²	91.6	6%	0.061	54%	0.538	C	S	.	.	H	α-helix	trans	-71.7	-35.1	177.1	173.8	0	0	0	0	112.7	V5 S7 F12 M13 F370 Y374	V5-V9 HydrophobicContact CG1-CG2 4.35Å; V5-V9 VanDerWaalsContact O-CG2 3.32Å; V5-V9 WeakPolarHBondContact O-CG2 3.23Å; V5-V9 PolarHBondContact O-N 3.12Å; V5-V9 VanDerWaalsContact O-N 3.14Å; S7-V9 VanDerWaalsContact C-N 3.31Å; S7-V9 PolarHBondContact O-N 2.94Å; V9-F12 PolarHBondContact O-N 3.02Å; V9-M13 PolarHBondContact O-N 3.39Å; V9-F370 HydrophobicContact CG2-CD1 4.39Å; V9-F370 HydrophobicContact CG2-CE1 4.01Å; V9-Y374 HydrophobicContact CG1-CE1 4.39Å; V9-Y374 HydrophobicContact CG1-CE2 4.14Å; V9-Y374 VanDerWaalsContact CG1-OH 3.22Å; V9-Y374 WeakPolarHBondContact CG1-OH 3.28Å
10	A	41.8	Very low	38.4	Very low	54 Å²	54	93.1 Å²	93.1	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-70.4	-38.5	178.2	0	0	0	0	0	112.5	K6 S7 F12 M13 G14	K6-A10 WeakPolarHBondContact O-CB 3.27Å; K6-A10 PolarHBondContact O-N 3.25Å; S7-A10 PolarHBondContact O-N 2.95Å; A10-F12 PolarHBondContact O-N 2.8Å; A10-M13 PolarHBondContact O-N 2.87Å; A10-G14 PolarHBondContact O-N 3.17Å
11	N	38.3	Very low	37.9	Very low	102 Å²	102	93.8 Å²	93.8	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-61.7	-32.2	174.6	-75	-7.8	0	0	0	111.9	S7	S7-N11 PolarHBondContact O-N 2.61Å
12	F	42.5	Very low	37.4	Very low	87 Å²	87	88.4 Å²	88.4	38%	0.382	55%	0.553	S	S	.	*	H	α-helix	trans	-73.7	-35.7	175.8	-168.7	-103.8	0	0	0	113.7	A8 V9 A10 G14 Y374 K379	A8-F12 PolarHBondContact O-N 3.34Å; V9-F12 PolarHBondContact O-N 3.02Å; A10-F12 PolarHBondContact O-N 2.8Å; F12-G14 VanDerWaalsContact C-N 3.26Å; F12-G14 PolarHBondContact O-N 3.07Å; F12-Y374 AromaticContact CD1-CE1 3.93Å; F12-Y374 HydrophobicContact CD1-CE1 3.93Å; F12-Y374 HydrophobicContact CE1-CE1 4.28Å; F12-K379 HydrophobicContact CE1-CB 4.3Å; F12-K379 HydrophobicContact CZ-CB 3.72Å; F12-K379 HydrophobicContact CZ-CD 4.2Å; F12-K379 HydrophobicContact CZ-CG 3.94Å; F12-K379 WeakPolarHBondContact CZ-O 3.39Å
13	M	38.9	Very low	36.7	Very low	150 Å²	150	88.5 Å²	88.5	74%	0.739	56%	0.562	S	S	*	*	H	α-helix	trans	-73.8	-16.5	177.2	-68.2	-176.1	71.1	0	0	113.2	V9 A10	V9-M13 PolarHBondContact O-N 3.39Å; A10-M13 PolarHBondContact O-N 2.87Å
14	G	34.7	Very low	36.4	Very low	48 Å²	48	92.5 Å²	92.5	50%	0.495	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-4.3	-175.8	0	0	0	0	0	116.4	A10 F12 I16	A10-G14 PolarHBondContact O-N 3.17Å; F12-G14 VanDerWaalsContact C-N 3.26Å; F12-G14 PolarHBondContact O-N 3.07Å; G14-I16 PolarHBondContact O-N 2.82Å
15	G	32.2	Very low	35.6	Very low	77 Å²	77	93.2 Å²	93.2	79%	0.794	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	58	16.6	175.1	0	0	0	0	0	115.4
16	I	27.9	Very low	35	Very low	131 Å²	131	96.9 Å²	96.9	67%	0.672	62%	0.624	S	S	*	*			trans	-129.2	106.6	176.8	-63.1	168.9	0	0	0	105.1	G14 A18	G14-I16 PolarHBondContact O-N 2.82Å; I16-A18 VanDerWaalsContact C-N 3.26Å; I16-A18 PolarHBondContact O-N 3.01Å
17	M	31.5	Very low	34	Very low	179 Å²	179	95.1 Å²	95.1	88%	0.882	64%	0.638	S	S	*	*			trans	-56.8	101.8	155.9	-73.8	-101.3	-150.3	0	0	105.3	G19	M17-G19 PolarHBondContact O-N 2.84Å
18	A	26.4	Very low	33.5	Very low	85 Å²	85	96.6 Å²	96.6	70%	0.702	66%	0.662	S	S	*	*			trans	-65	97	163.8	0	0	0	0	0	105.1	I16 S20	I16-A18 VanDerWaalsContact C-N 3.26Å; I16-A18 PolarHBondContact O-N 3.01Å; A18-S20 PolarHBondContact O-N 2.92Å; A18-S20 VanDerWaalsContact O-N 3.13Å
19	G	27.7	Very low	32.9	Very low	64 Å²	64	98.9 Å²	98.9	66%	0.66	69%	0.688	S	S	*	*			trans	-49.2	122.4	162.5	0	0	0	0	0	106.6	M17 S21	M17-G19 PolarHBondContact O-N 2.84Å; G19-S21 PolarHBondContact O-N 3.3Å
20	S	26.2	Very low	32.3	Very low	121 Å²	121	105.1 Å²	105.1	85%	0.846	73%	0.731	S	S	*	*			trans	-59.3	99.3	159.5	-172	0	0	0	0	105.1	A18 G22	A18-S20 PolarHBondContact O-N 2.92Å; A18-S20 VanDerWaalsContact O-N 3.13Å; S20-G22 PolarHBondContact O-N 3.32Å
21	S	26.6	Very low	31.8	Very low	108 Å²	108	106.5 Å²	106.5	76%	0.755	75%	0.75	S	S	*	*			trans	-68.5	82.2	170.9	54.2	0	0	0	0	107	G19 S23	G19-S21 PolarHBondContact O-N 3.3Å; S21-S23 PolarHBondContact O-N 3.32Å
22	G	28.1	Very low	32.1	Very low	64 Å²	64	105 Å²	105	66%	0.66	76%	0.758	S	S	*	*			trans	-68.9	86	160.6	0	0	0	0	0	107.4	S20 E24	S20-G22 PolarHBondContact O-N 3.32Å; G22-E24 VanDerWaalsContact C-N 3.32Å; G22-E24 PolarHBondContact O-N 2.91Å
23	S	27.7	Very low	32.6	Very low	103 Å²	103	104.2 Å²	104.2	72%	0.72	76%	0.764	S	S	*	*			trans	-63.5	99	160.4	51.4	0	0	0	0	107.3	S21 H25	S21-S23 PolarHBondContact O-N 3.32Å; S23-H25 VanDerWaalsContact C-N 3.25Å; S23-H25 PolarHBondContact O-N 3.04Å
24	E	34.2	Very low	34.3	Very low	190 Å²	190	105.4 Å²	105.4	89%	0.888	77%	0.773	S	S	*	*			trans	-65.9	93.4	161.9	-74.3	-168.6	154	0	0	107.7	G22	G22-E24 VanDerWaalsContact C-N 3.32Å; G22-E24 PolarHBondContact O-N 2.91Å
25	H	30.8	Very low	36.9	Very low	174 Å²	174	106.1 Å²	106.1	81%	0.806	77%	0.765	S	S	*	*			trans	-113.8	122.4	157.8	-95.7	30.3	0	0	0	107.5	S23 G27	S23-H25 VanDerWaalsContact C-N 3.25Å; S23-H25 PolarHBondContact O-N 3.04Å; H25-G27 PolarHBondContact O-N 3.41Å
26	G	36	Very low	39.8	Very low	92 Å²	92	106.1 Å²	106.1	95%	0.948	75%	0.751	S	S	*	*			trans	-51.8	125.4	-179.7	0	0	0	0	0	112.1
27	G	26.8	Very low	42.9	Very low	74 Å²	74	104.6 Å²	104.6	76%	0.763	74%	0.744	S	S	*	*			trans	171.8	103.2	175.7	0	0	0	0	0	108.9	H25	H25-G27 PolarHBondContact O-N 3.41Å
28	G	31.8	Very low	46	Very low	90 Å²	90	100.1 Å²	100.1	93%	0.928	72%	0.717	S	S	*	*			trans	-62.8	148.7	-171.5	0	0	0	0	0	115.1
29	G	30.6	Very low	49.3	Very low	73 Å²	73	98.1 Å²	98.1	75%	0.753	69%	0.693	S	S	*	*			trans	147.6	89.2	160.4	0	0	0	0	0	117
30	C	36.7	Very low	52.5	Low	142 Å²	142	99 Å²	99	96%	0.959	69%	0.687	S	S	*	*			trans	75.2	111.6	145.7	-63.5	0	0	0	0	121.7
31	G	33.1	Very low	55.8	Low	83 Å²	83	95.2 Å²	95.2	86%	0.856	65%	0.654	S	S	*	*			trans	161	-12.9	149.9	0	0	0	0	0	119.3
32	G	43.3	Very low	59	Low	69 Å²	69	90.8 Å²	90.8	71%	0.711	63%	0.626	S	S	*	*	S	Bend	trans	-82.5	136.9	172.8	0	0	0	0	0	110.7	D34	G32-D34 PolarHBondContact O-N 2.74Å
33	S	53.3	Low	62.3	Low	72 Å²	72	88.4 Å²	88.4	50%	0.503	60%	0.597	S	S	.	*			trans	-62.9	119.1	172.5	44	0	0	0	0	109.5	L35	S33-L35 PolarHBondContact O-N 3.43Å
34	D	75.6	Confident	65.7	Low	174 Å²	174	83.6 Å²	83.6	93%	0.93	56%	0.563	S	S	*	*			trans	-65.5	22.8	173.7	-78.6	-31.5	0	0	0	113.2	G32	G32-D34 PolarHBondContact O-N 2.74Å
35	L	87.9	Confident	68.6	Low	63 Å²	63	82.2 Å²	82.2	33%	0.33	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-75.3	137.9	-179.7	-66.5	178.1	0	0	0	110	S33 N264	S33-L35 PolarHBondContact O-N 3.43Å; L35-N264 HydrophobicContact CB-CB 4.24Å
36	P	93.9	Very high	71.7	Confident	77 Å²	77	75.1 Å²	75.1	50%	0.5	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-65.8	155.3	175.3	29.1	-34.6	0	0	0	110.9	Y263 N264	P36-Y263 HydrophobicContact CG-CD1 4.12Å; P36-Y263 HydrophobicContact CG-CE1 4.45Å; P36-Y263 CarbonylContact O-C 3.57Å; P36-Y263 WeakPolarHBondContact O-CA 3.16Å; P36-N264 PolarHBondContact O-N 3.27Å
37	L	93.4	Very high	74.5	Confident	99 Å²	99	70.8 Å²	70.8	52%	0.518	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-69	142.1	166.8	-63.5	173.9	0	0	0	109.8	N264	L37-N264 HydrophobicContact CD2-CB 4.31Å
38	R	95.2	Very high	77.7	Confident	85 Å²	85	68.2 Å²	68.2	32%	0.321	45%	0.452	S	S	.	.	S	Bend	trans	-66	-43.4	173.2	-178.8	54.3	164.4	144.5	6.1	111.3	V161 E259 Y263	R38-V161 HydrophobicContact CB-CG2 4.13Å; R38-V161 HydrophobicContact CG-CG2 4.29Å; R38-E259 WeakPolarHBondContact CD-OE2 3.37Å; R38-E259 IonicContact CZ-OE2 3.19Å; R38-E259 IonicContact NE-OE1 2.68Å; R38-E259 IonicContact NE-OE2 2.78Å; R38-E259 PolarHBondContact NE-OE2 2.99Å; R38-E259 IonicContact NH2-OE1 3.35Å; R38-E259 IonicContact NH2-OE2 2.9Å; R38-Y263 HydrophobicContact CB-CD1 3.99Å; R38-Y263 HydrophobicContact CB-CD2 4.23Å; R38-Y263 HydrophobicContact CB-CG 3.77Å; R38-Y263 VanDerWaalsContact CD-CE2 3.5Å; R38-Y263 HydrophobicContact CG-CD2 4.38Å; R38-Y263 HydrophobicContact CG-CG 4.37Å; R38-Y263 PolarHBondContact NH1-OH 2.64Å
39	F	96.4	Very high	80.7	Confident	44 Å²	44	66 Å²	66	19%	0.193	42%	0.419	C	S	.	.	S	Bend	trans	-138.2	142.4	173.3	-58.1	-66.6	0	0	0	108.1	V160 V161 R164 L165	F39-V160 HydrophobicContact CB-CG1 3.82Å; F39-V161 HydrophobicContact CD2-CG2 4.08Å; F39-V161 HydrophobicContact CE2-CG2 4.48Å; F39-R164 VanDerWaalsContact CD1-NH1 3.25Å; F39-R164 HydrophobicContact CD2-CB 4.41Å; F39-R164 HydrophobicContact CE2-CB 4.03Å; F39-R164 VanDerWaalsContact CG-CD 3.41Å; F39-R164 HydrophobicContact CZ-CB 4.27Å; F39-L165 HydrophobicContact CE2-CD1 3.96Å; F39-L165 HydrophobicContact CE2-CG 4.06Å; F39-L165 HydrophobicContact CZ-CD1 4.25Å; F39-L165 HydrophobicContact CZ-CD2 4.16Å; F39-L165 HydrophobicContact CZ-CG 4.22Å
40	P	94.6	Very high	83.8	Confident	83 Å²	83	65.3 Å²	65.3	54%	0.539	40%	0.402	S	S	.	.			trans	-64.6	151.1	174.7	29.2	-34.6	0	0	0	110.5
41	Y	95.5	Very high	86.4	Confident	40 Å²	40	63.8 Å²	63.8	16%	0.157	38%	0.381	C	S	.	.			trans	-60.9	143.2	169.7	176.1	-101.8	0	0	0	110.7	V54 H91 N92 S156 V160	Y41-V54 HydrophobicContact CD1-CG1 4.24Å; Y41-V54 HydrophobicContact CE1-CG1 3.85Å; Y41-H91 HydrophobicContact CE1-CB 3.92Å; Y41-H91 AromaticContact CE1-CG 3.79Å; Y41-H91 AromaticContact CE1-ND1 3.91Å; Y41-H91 HydrophobicContact CE2-CB 3.99Å; Y41-H91 AromaticContact CZ-CG 3.99Å; Y41-N92 VanDerWaalsContact CE2-O 3.27Å; Y41-N92 WeakPolarHBondContact CE2-O 3.43Å; Y41-N92 PolarHBondContact OH-N 2.94Å; Y41-N92 PolarHBondContact OH-O 3.42Å; Y41-S156 WeakPolarHBondContact CD2-OG 3.25Å; Y41-V160 HydrophobicContact CD2-CG2 4.39Å
42	G	95	Very high	89.4	Confident	15 Å²	15	65.3 Å²	65.3	16%	0.155	37%	0.369	C	S	.	.			trans	-167.2	167.6	170.4	0	0	0	0	0	109.4	Q95	G42-Q95 PolarHBondContact O-NE2 3.28Å
43	R	97	Very high	91.9	Very high	15 Å²	15	65.6 Å²	65.6	6%	0.057	35%	0.352	C	S	.	.	S	Bend	trans	-72.9	168.2	167.1	-56.6	-58.5	-66.3	-138.3	16.6	109.8	E45 L47 L49 V54 L66 E82 N92	R43-E45 PolarHBondContact O-N 3.2Å; R43-L47 HydrophobicContact CB-CD1 4.01Å; R43-L49 HydrophobicContact CB-CD1 3.96Å; R43-L49 HydrophobicContact CG-CD1 3.75Å; R43-V54 HydrophobicContact CG-CG1 4.48Å; R43-V54 HydrophobicContact CG-CG2 4.3Å; R43-L66 HydrophobicContact CG-CD1 4.29Å; R43-E82 IonicContact CZ-OE1 3.95Å; R43-E82 IonicContact NE-OE1 3.8Å; R43-E82 PolarHBondContact NE-OE1 2.89Å; R43-E82 VanDerWaalsContact NH2-CG 3.35Å; R43-E82 IonicContact NH2-OE1 2.88Å; R43-E82 PolarHBondContact NH2-OE1 2.82Å; R43-E82 IonicContact NH2-OE2 2.93Å; R43-E82 PolarHBondContact NH2-OE2 3Å; R43-N92 VanDerWaalsContact CZ-CG 3.4Å; R43-N92 PolarHBondContact NH2-ND2 3.39Å; R43-N92 PolarHBondContact NH2-OD1 3.2Å
44	P	97.7	Very high	93.8	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.013	33%	0.331	C	S	.	.			trans	-45.1	127	174.7	-32.3	37	0	0	0	112.9	F46 L47 Y80 E82 A96	P44-F46 HydrophobicContact CB-CD1 4.17Å; P44-F46 HydrophobicContact CB-CD2 4.38Å; P44-F46 HydrophobicContact CB-CE1 3.66Å; P44-F46 HydrophobicContact CB-CE2 3.89Å; P44-F46 HydrophobicContact CB-CZ 3.51Å; P44-F46 HydrophobicContact CG-CZ 4.3Å; P44-F46 PolarHBondContact O-N 3.27Å; P44-L47 HydrophobicContact CB-CD1 4.22Å; P44-L47 HydrophobicContact CB-CG 4.4Å; P44-L47 HydrophobicContact CG-CD1 4.31Å; P44-L47 WeakPolarHBondContact O-CB 3.27Å; P44-L47 PolarHBondContact O-N 3.16Å; P44-Y80 HydrophobicContact CG-CE1 4.48Å; P44-E82 WeakPolarHBondContact CD-OE1 3.29Å; P44-E82 WeakPolarHBondContact CD-OE2 3.28Å; P44-E82 WeakPolarHBondContact CG-OE2 3.4Å; P44-A96 HydrophobicContact CB-CB 4.17Å; P44-A96 HydrophobicContact CG-CB 3.82Å
45	E	95	Very high	94.7	Very high	160 Å²	160	60.2 Å²	60.2	75%	0.748	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-56.4	-33.3	-167.9	-177.3	176.7	176.4	0	0	113	R43 L47 G48 R72	R43-E45 PolarHBondContact O-N 3.2Å; E45-L47 PolarHBondContact O-N 2.9Å; E45-G48 PolarHBondContact O-N 2.77Å; E45-R72 PolarHBondContact O-NH1 3.45Å; E45-R72 VanDerWaalsContact O-NH1 3.13Å
46	F	95.9	Very high	95	Very high	26 Å²	26	61.6 Å²	61.6	11%	0.114	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-65.2	-21.4	-180	57.5	-112.3	0	0	0	113.5	P44 G48 L68 R72 L74 Y80 A96 C98 Y503	P44-F46 HydrophobicContact CB-CD1 4.17Å; P44-F46 HydrophobicContact CB-CD2 4.38Å; P44-F46 HydrophobicContact CB-CE1 3.66Å; P44-F46 HydrophobicContact CB-CE2 3.89Å; P44-F46 HydrophobicContact CB-CZ 3.51Å; P44-F46 HydrophobicContact CG-CZ 4.3Å; P44-F46 PolarHBondContact O-N 3.27Å; F46-G48 PolarHBondContact O-N 2.84Å; F46-L68 HydrophobicContact CD2-CD2 3.57Å; F46-L68 HydrophobicContact CE2-CD2 4.07Å; F46-R72 WeakPolarHBondContact O-CD 3.25Å; F46-R72 PolarHBondContact O-NH1 3.04Å; F46-L74 HydrophobicContact CB-CD2 3.62Å; F46-L74 HydrophobicContact CD1-CD2 4.04Å; F46-L74 HydrophobicContact CD2-CD1 4.41Å; F46-L74 HydrophobicContact CD2-CD2 3.93Å; F46-L74 HydrophobicContact CE2-CD1 4.36Å; F46-L74 HydrophobicContact CG-CD2 3.61Å; F46-Y80 AromaticContact CE2-CD1 3.47Å; F46-Y80 HydrophobicContact CE2-CD1 3.47Å; F46-Y80 VanDerWaalsContact CE2-CD1 3.47Å; F46-Y80 HydrophobicContact CE2-CD2 4.39Å; F46-Y80 AromaticContact CE2-CE1 3.8Å; F46-Y80 HydrophobicContact CE2-CE1 3.8Å; F46-Y80 AromaticContact CE2-CG 3.77Å; F46-Y80 HydrophobicContact CE2-CG 3.77Å; F46-Y80 AromaticContact CZ-CD1 3.82Å; F46-Y80 HydrophobicContact CZ-CD1 3.82Å; F46-Y80 HydrophobicContact CZ-CD2 4.01Å; F46-Y80 AromaticContact CZ-CE1 3.88Å; F46-Y80 HydrophobicContact CZ-CE1 3.88Å; F46-Y80 HydrophobicContact CZ-CE2 4.06Å; F46-Y80 AromaticContact CZ-CG 3.86Å; F46-Y80 HydrophobicContact CZ-CG 3.86Å; F46-Y80 AromaticContact CZ-CZ 3.99Å; F46-A96 HydrophobicContact CE1-CB 4.05Å; F46-A96 HydrophobicContact CZ-CB 3.98Å; F46-C98 HydrophobicContact CD1-CB 4.43Å; F46-C98 HydrophobicContact CE1-CB 4.41Å; F46-Y503 VanDerWaalsContact CE1-OH 3.25Å; F46-Y503 WeakPolarHBondContact CE1-OH 3.26Å; F46-Y503 HydrophobicContact CZ-CE1 4.42Å; F46-Y503 WeakPolarHBondContact CZ-OH 3.24Å
47	L	96.6	Very high	95	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-67.1	-24.5	173.2	-65.6	171.3	0	0	0	112	R43 P44 E45 L49 L68 Y80 E82	R43-L47 HydrophobicContact CB-CD1 4.01Å; P44-L47 HydrophobicContact CB-CD1 4.22Å; P44-L47 HydrophobicContact CB-CG 4.4Å; P44-L47 HydrophobicContact CG-CD1 4.31Å; P44-L47 WeakPolarHBondContact O-CB 3.27Å; P44-L47 PolarHBondContact O-N 3.16Å; E45-L47 PolarHBondContact O-N 2.9Å; L47-L49 VanDerWaalsContact C-N 3.32Å; L47-L49 HydrophobicContact CB-CD2 4.48Å; L47-L49 HydrophobicContact CB-CG 4.04Å; L47-L49 PolarHBondContact O-N 2.88Å; L47-L68 HydrophobicContact CD2-CD2 4.39Å; L47-Y80 HydrophobicContact CD1-CE1 4.35Å; L47-Y80 HydrophobicContact CD2-CD1 4.13Å; L47-Y80 HydrophobicContact CD2-CE1 4.38Å; L47-E82 VanDerWaalsContact CD1-CD 3.49Å; L47-E82 HydrophobicContact CD1-CG 4.19Å; L47-E82 WeakPolarHBondContact CD1-OE1 3.38Å
48	G	93.4	Very high	95	Very high	19 Å²	19	54.5 Å²	54.5	20%	0.196	29%	0.29	C	S	.	.			trans	63.1	36.3	172.4	0	0	0	0	0	113.8	E45 F46 K69 R72	E45-G48 PolarHBondContact O-N 2.77Å; F46-G48 PolarHBondContact O-N 2.84Å; G48-K69 WeakPolarHBondContact O-CE 3.38Å; G48-K69 PolarHBondContact O-NZ 2.87Å; G48-R72 VanDerWaalsContact CA-CZ 3.49Å
49	L	94.8	Very high	95	Very high	45 Å²	45	53.8 Å²	53.8	24%	0.236	29%	0.293	C	S	.	.			trans	-76.2	140.2	177.3	-55	-176.8	0	0	0	110.5	R43 L47 E53 V54 L66	R43-L49 HydrophobicContact CB-CD1 3.96Å; R43-L49 HydrophobicContact CG-CD1 3.75Å; L47-L49 VanDerWaalsContact C-N 3.32Å; L47-L49 HydrophobicContact CB-CD2 4.48Å; L47-L49 HydrophobicContact CB-CG 4.04Å; L47-L49 PolarHBondContact O-N 2.88Å; L49-E53 WeakPolarHBondContact CA-OE2 3.47Å; L49-E53 HydrophobicContact CB-CB 3.94Å; L49-E53 HydrophobicContact CD2-CB 4.26Å; L49-V54 HydrophobicContact CB-CG2 3.85Å; L49-V54 HydrophobicContact CD1-CG2 4.39Å; L49-L66 HydrophobicContact CD1-CD1 3.96Å
50	S	94.6	Very high	94.9	Very high	57 Å²	57	54 Å²	54	40%	0.399	29%	0.294	S	S	.	.			trans	-71.3	166	163.8	59.3	0	0	0	0	110.9	D52 E53 V54	S50-D52 VanDerWaalsContact C-N 3.3Å; S50-D52 PolarHBondContact O-N 3.05Å; S50-E53 WeakPolarHBondContact CB-OE2 3.19Å; S50-E53 PolarHBondContact N-OE2 3.21Å; S50-E53 PolarHBondContact O-N 3.33Å; S50-E53 VanDerWaalsContact O-N 3.16Å; S50-E53 VanDerWaalsContact OG-CG 3.28Å; S50-E53 WeakPolarHBondContact OG-CG 3.33Å; S50-E53 PolarHBondContact OG-N 3.21Å; S50-E53 PolarHBondContact OG-OE2 3.16Å; S50-V54 WeakPolarHBondContact O-CG2 3.3Å; S50-V54 PolarHBondContact O-N 2.93Å
51	Q	92.9	Very high	94.7	Very high	110 Å²	110	56.5 Å²	56.5	51%	0.514	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-44	178.5	-172.1	60.6	31.4	0	0	111.9	E53 V54 E55	Q51-E53 VanDerWaalsContact C-N 3.34Å; Q51-E53 PolarHBondContact O-N 2.92Å; Q51-V54 WeakPolarHBondContact O-CB 3.27Å; Q51-V54 PolarHBondContact O-N 2.77Å; Q51-V54 VanDerWaalsContact O-N 3.14Å; Q51-E55 PolarHBondContact O-N 3.23Å
52	D	94.7	Very high	94.6	Very high	116 Å²	116	57 Å²	57	62%	0.62	31%	0.314	S	S	*	.	H	α-helix	trans	-61.8	-40	177.1	-58.5	-2.2	0	0	0	111.9	S50 E55 C56	S50-D52 VanDerWaalsContact C-N 3.3Å; S50-D52 PolarHBondContact O-N 3.05Å; D52-E55 PolarHBondContact O-N 3.34Å; D52-C56 WeakPolarHBondContact O-CB 3.29Å; D52-C56 PolarHBondContact O-N 3.19Å; D52-C56 PolarHBondContact O-SG 2.94Å
53	E	95.4	Very high	94.6	Very high	74 Å²	74	56.3 Å²	56.3	35%	0.346	31%	0.307	S	S	.	.	H	α-helix	trans	-66.7	-36.5	174.9	-74.6	169.8	127	0	0	111.8	L49 S50 Q51 C56 S57 K69	L49-E53 WeakPolarHBondContact CA-OE2 3.47Å; L49-E53 HydrophobicContact CB-CB 3.94Å; L49-E53 HydrophobicContact CD2-CB 4.26Å; S50-E53 WeakPolarHBondContact CB-OE2 3.19Å; S50-E53 PolarHBondContact N-OE2 3.21Å; S50-E53 PolarHBondContact O-N 3.33Å; S50-E53 VanDerWaalsContact O-N 3.16Å; S50-E53 VanDerWaalsContact OG-CG 3.28Å; S50-E53 WeakPolarHBondContact OG-CG 3.33Å; S50-E53 PolarHBondContact OG-N 3.21Å; S50-E53 PolarHBondContact OG-OE2 3.16Å; Q51-E53 VanDerWaalsContact C-N 3.34Å; Q51-E53 PolarHBondContact O-N 2.92Å; E53-C56 PolarHBondContact O-N 3.45Å; E53-S57 WeakPolarHBondContact O-CB 3.38Å; E53-S57 PolarHBondContact O-N 3.31Å; E53-K69 IonicContact OE1-NZ 3.34Å; E53-K69 PolarHBondContact OE1-NZ 3.33Å; E53-K69 IonicContact OE2-NZ 2.89Å; E53-K69 PolarHBondContact OE2-NZ 3.04Å
54	V	95.1	Very high	94.6	Very high	11 Å²	11	57.7 Å²	57.7	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-44.3	173.7	172.5	0	0	0	0	110.2	Y41 R43 L49 S50 Q51 S57 A58	Y41-V54 HydrophobicContact CD1-CG1 4.24Å; Y41-V54 HydrophobicContact CE1-CG1 3.85Å; R43-V54 HydrophobicContact CG-CG1 4.48Å; R43-V54 HydrophobicContact CG-CG2 4.3Å; L49-V54 HydrophobicContact CB-CG2 3.85Å; L49-V54 HydrophobicContact CD1-CG2 4.39Å; S50-V54 WeakPolarHBondContact O-CG2 3.3Å; S50-V54 PolarHBondContact O-N 2.93Å; Q51-V54 WeakPolarHBondContact O-CB 3.27Å; Q51-V54 PolarHBondContact O-N 2.77Å; Q51-V54 VanDerWaalsContact O-N 3.14Å; V54-S57 PolarHBondContact O-N 2.88Å; V54-S57 PolarHBondContact O-OG 3.14Å; V54-A58 PolarHBondContact O-N 3.27Å
55	E	93.8	Very high	94.6	Very high	122 Å²	122	59.1 Å²	59.1	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-62.9	-44.3	176.1	-71.1	174.6	-165.2	0	0	111.8	Q51 D52 S57 A58	Q51-E55 PolarHBondContact O-N 3.23Å; D52-E55 PolarHBondContact O-N 3.34Å; E55-S57 VanDerWaalsContact C-N 3.26Å; E55-S57 PolarHBondContact O-N 3.48Å; E55-A58 WeakPolarHBondContact O-CB 3.37Å; E55-A58 PolarHBondContact O-N 3.32Å; E55-A58 VanDerWaalsContact O-N 3.13Å
56	C	93.6	Very high	94.7	Very high	92 Å²	92	52.7 Å²	52.7	62%	0.622	30%	0.296	S	S	*	.	H	α-helix	trans	-64	-31.9	176.2	-67.1	0	0	0	0	112.5	D52 E53 A58 D59	D52-C56 WeakPolarHBondContact O-CB 3.29Å; D52-C56 PolarHBondContact O-N 3.19Å; D52-C56 PolarHBondContact O-SG 2.94Å; E53-C56 PolarHBondContact O-N 3.45Å; C56-A58 PolarHBondContact O-N 3.41Å; C56-D59 PolarHBondContact O-N 2.8Å
57	S	94.6	Very high	94.8	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.028	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-14	177.1	80.9	0	0	0	0	114	E53 V54 E55 D59	E53-S57 WeakPolarHBondContact O-CB 3.38Å; E53-S57 PolarHBondContact O-N 3.31Å; V54-S57 PolarHBondContact O-N 2.88Å; V54-S57 PolarHBondContact O-OG 3.14Å; E55-S57 VanDerWaalsContact C-N 3.26Å; E55-S57 PolarHBondContact O-N 3.48Å; S57-D59 VanDerWaalsContact C-N 3.26Å; S57-D59 PolarHBondContact O-N 3.09Å
58	A	94.1	Very high	94.6	Very high	23 Å²	23	54.5 Å²	54.5	19%	0.19	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	11	177.2	0	0	0	0	0	113.7	V54 E55 C56 H60 I84	V54-A58 PolarHBondContact O-N 3.27Å; E55-A58 WeakPolarHBondContact O-CB 3.37Å; E55-A58 PolarHBondContact O-N 3.32Å; E55-A58 VanDerWaalsContact O-N 3.13Å; C56-A58 PolarHBondContact O-N 3.41Å; A58-H60 PolarHBondContact O-CE1 2.81Å; A58-H60 PolarHBondContact O-N 3.5Å; A58-H60 PolarHBondContact O-ND1 2.88Å; A58-I84 HydrophobicContact CB-CD1 4.23Å
59	D	94.6	Very high	94.5	Very high	71 Å²	71	56.9 Å²	56.9	38%	0.38	31%	0.311	S	S	.	.			trans	-72.2	106.7	174.9	-173.5	-20.5	0	0	0	111.3	C56 S57 I61 A62 R63	C56-D59 PolarHBondContact O-N 2.8Å; S57-D59 VanDerWaalsContact C-N 3.26Å; S57-D59 PolarHBondContact O-N 3.09Å; D59-I61 VanDerWaalsContact C-N 3.32Å; D59-I61 PolarHBondContact O-N 3.11Å; D59-I61 WeakPolarHBondContact OD1-CA 3.27Å; D59-I61 WeakPolarHBondContact OD1-CB 3.43Å; D59-I61 PolarHBondContact OD1-N 3.03Å; D59-A62 HydrophobicContact CB-CB 4.24Å; D59-A62 PolarHBondContact OD1-N 2.75Å; D59-A62 WeakPolarHBondContact OD2-CB 3.44Å; D59-R63 VanDerWaalsContact O-CA 3.25Å; D59-R63 WeakPolarHBondContact O-CA 3.37Å; D59-R63 PolarHBondContact O-N 3.31Å
60	H	94.1	Very high	93.9	Very high	49 Å²	49	62.6 Å²	62.6	23%	0.227	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.1	179.1	-66.3	89.6	0	0	0	114.4	A58 R63 I84 N85 G87 S89	A58-H60 PolarHBondContact O-CE1 2.81Å; A58-H60 PolarHBondContact O-N 3.5Å; A58-H60 PolarHBondContact O-ND1 2.88Å; H60-R63 WeakPolarHBondContact O-CG 3.44Å; H60-I84 VanDerWaalsContact NE2-CD1 3.31Å; H60-I84 WeakPolarHBondContact NE2-CD1 3.44Å; H60-N85 PolarHBondContact CD2-O 3.1Å; H60-N85 VanDerWaalsContact CD2-O 3.32Å; H60-N85 PolarHBondContact NE2-OD1 3.29Å; H60-G87 VanDerWaalsContact CD2-CA 3.4Å; H60-G87 WeakPolarHBondContact CD2-CA 3.24Å; H60-G87 PolarHBondContact CD2-N 2.93Å; H60-S89 PolarHBondContact CE1-O 2.72Å; H60-S89 PolarHBondContact NE2-O 3.38Å
61	I	90.4	Very high	93.4	Very high	135 Å²	135	66.2 Å²	66.2	69%	0.692	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-50	175.7	-58.6	176.5	0	0	0	108.9	D59 W487	D59-I61 VanDerWaalsContact C-N 3.32Å; D59-I61 PolarHBondContact O-N 3.11Å; D59-I61 WeakPolarHBondContact OD1-CA 3.27Å; D59-I61 WeakPolarHBondContact OD1-CB 3.43Å; D59-I61 PolarHBondContact OD1-N 3.03Å; I61-W487 WeakPolarHBondContact O-CZ2 3.46Å
62	A	92.7	Very high	93.1	Very high	51 Å²	51	65.9 Å²	65.9	42%	0.421	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-34.3	179.8	0	0	0	0	0	112.5	D59 R479	D59-A62 HydrophobicContact CB-CB 4.24Å; D59-A62 PolarHBondContact OD1-N 2.75Å; D59-A62 WeakPolarHBondContact OD2-CB 3.44Å; A62-R479 PolarHBondContact O-NH1 3.32Å
63	R	95.8	Very high	92.9	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.34	C	S	.	.			trans	42.3	62.2	-172.2	-64.9	-177.6	69.4	-168.2	5	111.1	D59 H60 I65 V83 I84 N85 R479 W487 S496 D498	D59-R63 VanDerWaalsContact O-CA 3.25Å; D59-R63 WeakPolarHBondContact O-CA 3.37Å; D59-R63 PolarHBondContact O-N 3.31Å; H60-R63 WeakPolarHBondContact O-CG 3.44Å; R63-I65 PolarHBondContact O-N 3.44Å; R63-V83 HydrophobicContact CB-CG2 3.75Å; R63-V83 WeakPolarHBondContact O-CG2 3.22Å; R63-I84 HydrophobicContact CB-CG2 4.49Å; R63-I84 HydrophobicContact CG-CG2 4.29Å; R63-I84 VanDerWaalsContact CZ-O 3.25Å; R63-I84 PolarHBondContact NE-O 2.93Å; R63-I84 PolarHBondContact NH2-O 2.85Å; R63-N85 PolarHBondContact NE-O 3.22Å; R63-R479 PolarHBondContact O-NH1 2.64Å; R63-W487 HydrophobicContact CB-CH2 4.07Å; R63-W487 HydrophobicContact CB-CZ2 3.89Å; R63-W487 VanDerWaalsContact CD-CE2 3.48Å; R63-W487 HydrophobicContact CG-CH2 4.48Å; R63-W487 HydrophobicContact CG-CZ2 3.8Å; R63-S496 PolarHBondContact NH1-O 2.97Å; R63-S496 PolarHBondContact NH2-O 3.46Å; R63-D498 PolarHBondContact NH2-O 3.44Å
64	P	96.6	Very high	92.9	Very high	44 Å²	44	62.5 Å²	62.5	29%	0.286	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-61.5	132.9	-174.5	27.1	-34.1	0	0	0	110.2	L66	P64-L66 HydrophobicContact CB-CD2 4.47Å; P64-L66 PolarHBondContact O-N 3.07Å
65	I	97.9	Very high	92.9	Very high	32 Å²	32	63.7 Å²	63.7	16%	0.164	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-80.8	120.8	174.1	-59	175.1	0	0	0	107.7	R63 I67 A81 E82 V83 Q472 V475 M476	R63-I65 PolarHBondContact O-N 3.44Å; I65-I67 HydrophobicContact CG2-CG2 4.49Å; I65-A81 HydrophobicContact CG2-CB 4.39Å; I65-E82 CarbonylContact C-O 3.48Å; I65-E82 WeakPolarHBondContact CA-O 3.43Å; I65-V83 HydrophobicContact CG1-CB 4.25Å; I65-V83 HydrophobicContact CG1-CG2 4.34Å; I65-Q472 HydrophobicContact CG2-CG 3.97Å; I65-V475 HydrophobicContact CD1-CG1 4Å; I65-V475 HydrophobicContact CG1-CG1 3.97Å; I65-V475 HydrophobicContact CG2-CB 4.32Å; I65-V475 HydrophobicContact CG2-CG1 3.87Å; I65-M476 HydrophobicContact CD1-CB 4.17Å; I65-M476 HydrophobicContact CD1-CG 3.21Å; I65-M476 HydrophobicContact CD1-SD 4.47Å
66	L	98.1	Very high	93	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.131	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135	179.4	-49.2	179	0	0	0	109	R43 L49 P64 A81 E82	R43-L66 HydrophobicContact CG-CD1 4.29Å; L49-L66 HydrophobicContact CD1-CD1 3.96Å; P64-L66 HydrophobicContact CB-CD2 4.47Å; P64-L66 PolarHBondContact O-N 3.07Å; L66-A81 CarbonylContact O-C 3.54Å; L66-A81 VanDerWaalsContact O-CA 3.27Å; L66-A81 WeakPolarHBondContact O-CA 3.23Å; L66-E82 HydrophobicContact CB-CG 3.92Å; L66-E82 HydrophobicContact CD1-CG 4.3Å; L66-E82 HydrophobicContact CG-CG 4.48Å; L66-E82 PolarHBondContact N-O 2.95Å; L66-E82 PolarHBondContact O-N 3.02Å
67	I	97.1	Very high	93	Very high	59 Å²	59	57.7 Å²	57.7	30%	0.303	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	171.3	174.5	60	171	0	0	0	109.1	I65 K69 A81 T468 Q472	I65-I67 HydrophobicContact CG2-CG2 4.49Å; I67-K69 PolarHBondContact O-N 2.9Å; I67-A81 HydrophobicContact CG2-CB 3.89Å; I67-T468 HydrophobicContact CB-CG2 3.82Å; I67-T468 HydrophobicContact CD1-CG2 4.48Å; I67-T468 HydrophobicContact CG2-CG2 4.15Å; I67-Q472 HydrophobicContact CG2-CB 4.04Å; I67-Q472 HydrophobicContact CG2-CG 4Å
68	L	93.4	Very high	93.1	Very high	6 Å²	6	57.6 Å²	57.6	3%	0.031	30%	0.303	C	S	.	.			trans	-57.2	135	173	-60	172	0	0	0	110.9	F46 L47 L74	F46-L68 HydrophobicContact CD2-CD2 3.57Å; F46-L68 HydrophobicContact CE2-CD2 4.07Å; L47-L68 HydrophobicContact CD2-CD2 4.39Å; L68-L74 HydrophobicContact CD1-CB 4.46Å; L68-L74 HydrophobicContact CD1-CD1 4.03Å; L68-L74 HydrophobicContact CD1-CG 3.75Å; L68-L74 HydrophobicContact CD2-CD1 4.09Å; L68-L74 HydrophobicContact CD2-CD2 4.19Å; L68-L74 HydrophobicContact CD2-CG 3.86Å; L68-L74 HydrophobicContact CG-CG 4.45Å
69	K	89.4	Confident	93.3	Very high	68 Å²	68	56.5 Å²	56.5	30%	0.296	29%	0.294	S	S	.	.			trans	-57.2	144.3	169.3	-68.9	-174.6	174.6	-176.3	0	109.6	G48 E53 I67 T71 R72	G48-K69 WeakPolarHBondContact O-CE 3.38Å; G48-K69 PolarHBondContact O-NZ 2.87Å; E53-K69 IonicContact OE1-NZ 3.34Å; E53-K69 PolarHBondContact OE1-NZ 3.33Å; E53-K69 IonicContact OE2-NZ 2.89Å; E53-K69 PolarHBondContact OE2-NZ 3.04Å; I67-K69 PolarHBondContact O-N 2.9Å; K69-T71 PolarHBondContact O-N 3.05Å; K69-R72 HydrophobicContact CB-CG 4.5Å; K69-R72 PolarHBondContact O-N 2.86Å
70	E	82.7	Confident	93.5	Very high	165 Å²	165	53.1 Å²	53.1	77%	0.771	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.6	-176.2	-70	-178.7	177.7	0	0	113.9	R72 R73	E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.1Å; E70-R73 PolarHBondContact O-NH1 3.46Å
71	T	84	Confident	93.8	Very high	133 Å²	133	50.8 Å²	50.8	82%	0.816	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-6.6	179.3	55.3	0	0	0	0	114.4	K69	K69-T71 PolarHBondContact O-N 3.05Å
72	R	87.3	Confident	94.2	Very high	103 Å²	103	44.4 Å²	44.4	39%	0.389	23%	0.232	S	C	.	.			trans	-112.3	149	-176.4	-66.5	-168.1	171.9	-151.1	-2.1	111.2	E45 F46 G48 K69 E70	E45-R72 PolarHBondContact O-NH1 3.45Å; E45-R72 VanDerWaalsContact O-NH1 3.13Å; F46-R72 WeakPolarHBondContact O-CD 3.25Å; F46-R72 PolarHBondContact O-NH1 3.04Å; G48-R72 VanDerWaalsContact CA-CZ 3.49Å; K69-R72 HydrophobicContact CB-CG 4.5Å; K69-R72 PolarHBondContact O-N 2.86Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.1Å
73	R	90.8	Very high	94.4	Very high	107 Å²	107	42 Å²	42	40%	0.404	21%	0.212	S	C	.	.			trans	-139.4	142	172.1	-68.1	-62.4	-176.3	-73.2	-9	108.8	E70 P464 H465	E70-R73 PolarHBondContact O-NH1 3.46Å; R73-P464 PolarHBondContact NE-O 3.4Å; R73-H465 PolarHBondContact NH1-CE1 2.92Å; R73-H465 PolarHBondContact NH2-CD2 3.43Å; R73-H465 PolarHBondContact NH2-CE1 3Å; R73-H465 PolarHBondContact NH2-NE2 3.42Å
74	L	95.7	Very high	94.5	Very high	13 Å²	13	42 Å²	42	7%	0.068	21%	0.212	C	C	.	.			trans	-83.7	154.6	170.5	-67.9	-179.2	0	0	0	110.3	F46 L68 T78 C98 Y503	F46-L74 HydrophobicContact CB-CD2 3.62Å; F46-L74 HydrophobicContact CD1-CD2 4.04Å; F46-L74 HydrophobicContact CD2-CD1 4.41Å; F46-L74 HydrophobicContact CD2-CD2 3.93Å; F46-L74 HydrophobicContact CE2-CD1 4.36Å; F46-L74 HydrophobicContact CG-CD2 3.61Å; L68-L74 HydrophobicContact CD1-CB 4.46Å; L68-L74 HydrophobicContact CD1-CD1 4.03Å; L68-L74 HydrophobicContact CD1-CG 3.75Å; L68-L74 HydrophobicContact CD2-CD1 4.09Å; L68-L74 HydrophobicContact CD2-CD2 4.19Å; L68-L74 HydrophobicContact CD2-CG 3.86Å; L68-L74 HydrophobicContact CG-CG 4.45Å; L74-T78 HydrophobicContact CB-CG2 4.48Å; L74-T78 HydrophobicContact CD1-CG2 4Å; L74-C98 HydrophobicContact CD1-CB 4.25Å; L74-C98 HydrophobicContact CD2-CB 4.01Å; L74-Y503 HydrophobicContact CD1-CE1 3.97Å
75	P	94.8	Very high	94.5	Very high	35 Å²	35	39.9 Å²	39.9	23%	0.227	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-48.3	153.6	168.6	-27.2	34.1	0	0	0	112.5	A77 T78 V100	P75-A77 PolarHBondContact O-N 3.19Å; P75-A77 VanDerWaalsContact O-N 3.17Å; P75-T78 VanDerWaalsContact O-CB 3.31Å; P75-T78 WeakPolarHBondContact O-CB 3.44Å; P75-T78 PolarHBondContact O-N 3.37Å; P75-T78 VanDerWaalsContact O-N 3.11Å; P75-T78 PolarHBondContact O-OG1 2.9Å; P75-V100 HydrophobicContact CB-CG2 3.71Å; P75-V100 HydrophobicContact CG-CG2 3.85Å
76	W	94.6	Very high	94.2	Very high	40 Å²	40	40.5 Å²	40.5	15%	0.152	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	60.5	25	174.1	-149.1	-97.9	0	0	0	115	T78 H145 W147 P506 H509 L513	W76-T78 PolarHBondContact O-N 3.06Å; W76-T78 VanDerWaalsContact O-N 3.14Å; W76-H145 AromaticContact CE3-CD2 3.51Å; W76-H145 AromaticContact CE3-CE1 3.4Å; W76-H145 VanDerWaalsContact CE3-CE1 3.4Å; W76-H145 AromaticContact CE3-CG 3.73Å; W76-H145 AromaticContact CE3-ND1 3.65Å; W76-H145 AromaticContact CE3-NE2 3.32Å; W76-H145 VanDerWaalsContact CE3-NE2 3.32Å; W76-H145 AromaticContact CZ3-CE1 3.4Å; W76-H145 VanDerWaalsContact CZ3-CE1 3.4Å; W76-H145 WeakPolarHBondContact CZ3-CE1 3.46Å; W76-H145 AromaticContact CZ3-ND1 3.64Å; W76-H145 AromaticContact CZ3-NE2 3.81Å; W76-W147 HydrophobicContact CB-CH2 4.25Å; W76-W147 HydrophobicContact CB-CZ2 3.63Å; W76-W147 HydrophobicContact CD2-CH2 4.42Å; W76-W147 HydrophobicContact CG-CH2 4.08Å; W76-W147 AromaticContact CG-CZ2 3.86Å; W76-W147 HydrophobicContact CG-CZ2 3.86Å; W76-P506 VanDerWaalsContact CD1-O 3.31Å; W76-P506 PolarHBondContact NE1-O 3.03Å; W76-P506 WeakPolarHBondContact O-CG 3.42Å; W76-H509 AromaticContact CD1-CD2 3.95Å; W76-H509 HydrophobicContact CD2-CB 3.97Å; W76-H509 VanDerWaalsContact CE2-CB 3.43Å; W76-H509 HydrophobicContact CE3-CB 4.48Å; W76-H509 HydrophobicContact CG-CB 4.47Å; W76-H509 HydrophobicContact CH2-CB 4.07Å; W76-H509 VanDerWaalsContact CZ2-C 3.43Å; W76-H509 HydrophobicContact CZ2-CB 3.52Å; W76-H509 PolarHBondContact O-CD2 3.25Å; W76-L513 HydrophobicContact CH2-CD1 3.49Å; W76-L513 VanDerWaalsContact CH2-CD1 3.49Å; W76-L513 HydrophobicContact CH2-CG 3.93Å; W76-L513 HydrophobicContact CZ2-CD1 4.24Å; W76-L513 HydrophobicContact CZ3-CD1 4.34Å
77	A	94.6	Very high	93.9	Very high	48 Å²	48	41.8 Å²	41.8	40%	0.397	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	53.1	32	-173.6	0	0	0	0	0	113.3	P75 Y467 P506	P75-A77 PolarHBondContact O-N 3.19Å; P75-A77 VanDerWaalsContact O-N 3.17Å; A77-Y467 HydrophobicContact CB-CD2 4.49Å; A77-Y467 VanDerWaalsContact O-CD2 3.23Å; A77-Y467 WeakPolarHBondContact O-CD2 3.41Å; A77-P506 HydrophobicContact CB-CG 4.25Å
78	T	97.4	Very high	93.4	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.018	24%	0.236	C	C	.	.			trans	-66.3	135.1	-176.9	-59.7	0	0	0	0	111.5	L74 P75 W76 W147 Y503 I505	L74-T78 HydrophobicContact CB-CG2 4.48Å; L74-T78 HydrophobicContact CD1-CG2 4Å; P75-T78 VanDerWaalsContact O-CB 3.31Å; P75-T78 WeakPolarHBondContact O-CB 3.44Å; P75-T78 PolarHBondContact O-N 3.37Å; P75-T78 VanDerWaalsContact O-N 3.11Å; P75-T78 PolarHBondContact O-OG1 2.9Å; W76-T78 PolarHBondContact O-N 3.06Å; W76-T78 VanDerWaalsContact O-N 3.14Å; T78-W147 PolarHBondContact OG1-NE1 3.17Å; T78-Y503 HydrophobicContact CG2-CD1 3.46Å; T78-Y503 VanDerWaalsContact CG2-CD1 3.46Å; T78-Y503 HydrophobicContact CG2-CE1 3.96Å; T78-Y503 HydrophobicContact CG2-CG 4.5Å; T78-I505 HydrophobicContact CG2-CG1 3.88Å
79	G	98.3	Very high	93.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.6	167.7	0	0	0	0	0	112.6	Y467 Y503 V504	G79-Y467 VanDerWaalsContact CA-C 3.49Å; G79-Y503 WeakPolarHBondContact O-CA 3.49Å; G79-V504 PolarHBondContact N-O 3.19Å; G79-V504 PolarHBondContact O-N 2.97Å
80	Y	98.8	Very high	93.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.6	174.3	-175.3	-94.3	0	0	0	111.9	P44 F46 L47 E82 A96 L149 V502 Y503	P44-Y80 HydrophobicContact CG-CE1 4.48Å; F46-Y80 AromaticContact CE2-CD1 3.47Å; F46-Y80 HydrophobicContact CE2-CD1 3.47Å; F46-Y80 VanDerWaalsContact CE2-CD1 3.47Å; F46-Y80 HydrophobicContact CE2-CD2 4.39Å; F46-Y80 AromaticContact CE2-CE1 3.8Å; F46-Y80 HydrophobicContact CE2-CE1 3.8Å; F46-Y80 AromaticContact CE2-CG 3.77Å; F46-Y80 HydrophobicContact CE2-CG 3.77Å; F46-Y80 AromaticContact CZ-CD1 3.82Å; F46-Y80 HydrophobicContact CZ-CD1 3.82Å; F46-Y80 HydrophobicContact CZ-CD2 4.01Å; F46-Y80 AromaticContact CZ-CE1 3.88Å; F46-Y80 HydrophobicContact CZ-CE1 3.88Å; F46-Y80 HydrophobicContact CZ-CE2 4.06Å; F46-Y80 AromaticContact CZ-CG 3.86Å; F46-Y80 HydrophobicContact CZ-CG 3.86Å; F46-Y80 AromaticContact CZ-CZ 3.99Å; L47-Y80 HydrophobicContact CD1-CE1 4.35Å; L47-Y80 HydrophobicContact CD2-CD1 4.13Å; L47-Y80 HydrophobicContact CD2-CE1 4.38Å; Y80-E82 HydrophobicContact CE1-CB 3.87Å; Y80-E82 HydrophobicContact CE1-CG 3.76Å; Y80-E82 VanDerWaalsContact CE1-OE2 3.31Å; Y80-E82 WeakPolarHBondContact CE1-OE2 3.39Å; Y80-E82 PolarHBondContact OH-OE2 3.37Å; Y80-A96 HydrophobicContact CE2-CB 3.79Å; Y80-L149 HydrophobicContact CE2-CD1 4.32Å; Y80-V502 WeakPolarHBondContact CA-O 3.48Å; Y80-V502 WeakPolarHBondContact CD2-O 3.23Å; Y80-Y503 AromaticContact CD2-CD1 3.53Å; Y80-Y503 HydrophobicContact CD2-CD1 3.53Å; Y80-Y503 AromaticContact CD2-CD2 3.99Å; Y80-Y503 HydrophobicContact CD2-CD2 3.99Å; Y80-Y503 AromaticContact CD2-CE1 3.37Å; Y80-Y503 HydrophobicContact CD2-CE1 3.37Å; Y80-Y503 AromaticContact CD2-CE2 3.84Å; Y80-Y503 HydrophobicContact CD2-CE2 3.84Å; Y80-Y503 AromaticContact CD2-CG 3.85Å; Y80-Y503 HydrophobicContact CD2-CG 3.85Å; Y80-Y503 AromaticContact CD2-CZ 3.55Å; Y80-Y503 HydrophobicContact CE2-CD1 4.44Å; Y80-Y503 HydrophobicContact CE2-CD2 4.15Å; Y80-Y503 HydrophobicContact CE2-CE1 4.13Å; Y80-Y503 AromaticContact CE2-CE2 3.81Å; Y80-Y503 HydrophobicContact CE2-CE2 3.81Å; Y80-Y503 HydrophobicContact CE2-CG 4.47Å; Y80-Y503 AromaticContact CE2-CZ 3.82Å; Y80-Y503 HydrophobicContact CG-CD1 4.29Å; Y80-Y503 HydrophobicContact CG-CE1 4.07Å
81	A	98.8	Very high	94	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.4	169.2	0	0	0	0	0	110.6	I65 L66 I67 A471 Q472 V475 V502	I65-A81 HydrophobicContact CG2-CB 4.39Å; L66-A81 CarbonylContact O-C 3.54Å; L66-A81 VanDerWaalsContact O-CA 3.27Å; L66-A81 WeakPolarHBondContact O-CA 3.23Å; I67-A81 HydrophobicContact CG2-CB 3.89Å; A81-A471 HydrophobicContact CB-CB 3.9Å; A81-Q472 HydrophobicContact CB-CB 4.27Å; A81-V475 HydrophobicContact CB-CB 4.45Å; A81-V475 HydrophobicContact CB-CG2 3.83Å; A81-V502 PolarHBondContact N-O 2.89Å; A81-V502 VanDerWaalsContact N-O 3.08Å; A81-V502 PolarHBondContact O-N 3.16Å
82	E	98.8	Very high	94.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	159.7	176.1	62.8	-178.8	-153.9	0	0	113.1	R43 P44 L47 I65 L66 Y80 I500	R43-E82 IonicContact CZ-OE1 3.95Å; R43-E82 IonicContact NE-OE1 3.8Å; R43-E82 PolarHBondContact NE-OE1 2.89Å; R43-E82 VanDerWaalsContact NH2-CG 3.35Å; R43-E82 IonicContact NH2-OE1 2.88Å; R43-E82 PolarHBondContact NH2-OE1 2.82Å; R43-E82 IonicContact NH2-OE2 2.93Å; R43-E82 PolarHBondContact NH2-OE2 3Å; P44-E82 WeakPolarHBondContact CD-OE1 3.29Å; P44-E82 WeakPolarHBondContact CD-OE2 3.28Å; P44-E82 WeakPolarHBondContact CG-OE2 3.4Å; L47-E82 VanDerWaalsContact CD1-CD 3.49Å; L47-E82 HydrophobicContact CD1-CG 4.19Å; L47-E82 WeakPolarHBondContact CD1-OE1 3.38Å; I65-E82 CarbonylContact C-O 3.48Å; I65-E82 WeakPolarHBondContact CA-O 3.43Å; L66-E82 HydrophobicContact CB-CG 3.92Å; L66-E82 HydrophobicContact CD1-CG 4.3Å; L66-E82 HydrophobicContact CG-CG 4.48Å; L66-E82 PolarHBondContact N-O 2.95Å; L66-E82 PolarHBondContact O-N 3.02Å; Y80-E82 HydrophobicContact CE1-CB 3.87Å; Y80-E82 HydrophobicContact CE1-CG 3.76Å; Y80-E82 VanDerWaalsContact CE1-OE2 3.31Å; Y80-E82 WeakPolarHBondContact CE1-OE2 3.39Å; Y80-E82 PolarHBondContact OH-OE2 3.37Å; E82-I500 CarbonylContact C-O 3.6Å; E82-I500 WeakPolarHBondContact CA-O 3.48Å; E82-I500 WeakPolarHBondContact CB-O 3.45Å
83	V	98.3	Very high	95.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	145.2	171.3	67.2	0	0	0	0	111	R63 I65 N92 V475 R479 I500	R63-V83 HydrophobicContact CB-CG2 3.75Å; R63-V83 WeakPolarHBondContact O-CG2 3.22Å; I65-V83 HydrophobicContact CG1-CB 4.25Å; I65-V83 HydrophobicContact CG1-CG2 4.34Å; V83-N92 PolarHBondContact O-ND2 3.43Å; V83-V475 HydrophobicContact CB-CG1 3.89Å; V83-V475 HydrophobicContact CG1-CG1 3.48Å; V83-V475 VanDerWaalsContact CG1-CG1 3.48Å; V83-R479 HydrophobicContact CG1-CB 4.28Å; V83-R479 HydrophobicContact CG1-CG 4.26Å; V83-R479 HydrophobicContact CG2-CG 4.49Å; V83-I500 HydrophobicContact CG1-CB 3.86Å; V83-I500 HydrophobicContact CG1-CD1 3.75Å; V83-I500 HydrophobicContact CG1-CG1 3.84Å; V83-I500 PolarHBondContact N-O 3.15Å; V83-I500 PolarHBondContact O-N 3.34Å
84	I	97.6	Very high	95.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.167	C	C	.	.			trans	-65.5	154.9	174.4	-166.6	163.3	0	0	0	112.2	A58 H60 R63 N92 D499	A58-I84 HydrophobicContact CB-CD1 4.23Å; H60-I84 VanDerWaalsContact NE2-CD1 3.31Å; H60-I84 WeakPolarHBondContact NE2-CD1 3.44Å; R63-I84 HydrophobicContact CB-CG2 4.49Å; R63-I84 HydrophobicContact CG-CG2 4.29Å; R63-I84 VanDerWaalsContact CZ-O 3.25Å; R63-I84 PolarHBondContact NE-O 2.93Å; R63-I84 PolarHBondContact NH2-O 2.85Å; I84-N92 HydrophobicContact CB-CB 4.2Å; I84-N92 HydrophobicContact CD1-CB 4.29Å; I84-N92 HydrophobicContact CG1-CB 3.94Å; I84-D499 WeakPolarHBondContact CA-OD1 3.44Å
85	N	95.6	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.166	C	C	.	.			trans	-57.9	177.2	172.8	66.7	76.8	0	0	0	113.7	H60 R63 G87 K88 S89 G497 D498 D499	H60-N85 PolarHBondContact CD2-O 3.1Å; H60-N85 VanDerWaalsContact CD2-O 3.32Å; H60-N85 PolarHBondContact NE2-OD1 3.29Å; R63-N85 PolarHBondContact NE-O 3.22Å; N85-G87 PolarHBondContact O-N 3.39Å; N85-G87 PolarHBondContact OD1-N 3.11Å; N85-K88 HydrophobicContact CB-CB 4.29Å; N85-K88 PolarHBondContact OD1-N 3.33Å; N85-S89 PolarHBondContact ND2-OG 2.95Å; N85-S89 PolarHBondContact OD1-N 3.02Å; N85-G497 WeakPolarHBondContact CB-O 3.44Å; N85-D498 VanDerWaalsContact CA-C 3.47Å; N85-D498 WeakPolarHBondContact CA-O 3.44Å; N85-D498 VanDerWaalsContact CB-C 3.43Å; N85-D499 PolarHBondContact N-OD1 2.85Å; N85-D499 PolarHBondContact ND2-OD1 2.72Å; N85-D499 VanDerWaalsContact ND2-OD1 3.13Å; N85-D499 PolarHBondContact ND2-OD2 3.38Å
86	A	92.9	Very high	95.9	Very high	45 Å²	45	25.6 Å²	25.6	37%	0.372	16%	0.157	S	C	.	.	S	Bend	trans	-96.1	33	-176.7	0	0	0	0	0	113.7	G497	A86-G497 PolarHBondContact N-O 3.3Å
87	G	90.2	Very high	96	Very high	52 Å²	52	24.1 Å²	24.1	54%	0.536	15%	0.153	S	C	.	.	S	Bend	trans	100.9	21.5	176.6	0	0	0	0	0	114.1	H60 N85	H60-G87 VanDerWaalsContact CD2-CA 3.4Å; H60-G87 WeakPolarHBondContact CD2-CA 3.24Å; H60-G87 PolarHBondContact CD2-N 2.93Å; N85-G87 PolarHBondContact O-N 3.39Å; N85-G87 PolarHBondContact OD1-N 3.11Å
88	K	88.4	Confident	96.2	Very high	108 Å²	108	22.5 Å²	22.5	47%	0.47	14%	0.138	S	C	.	.	S	Bend	trans	-73.8	-38.4	176.1	178.5	-175.8	164.1	-162.8	0	111.3	N85 D498	N85-K88 HydrophobicContact CB-CB 4.29Å; N85-K88 PolarHBondContact OD1-N 3.33Å; K88-D498 IonicContact NZ-OD1 3.87Å; K88-D498 PolarHBondContact NZ-OD1 2.61Å; K88-D498 IonicContact NZ-OD2 2.58Å; K88-D498 PolarHBondContact NZ-OD2 3.14Å
89	S	92	Very high	96.1	Very high	23 Å²	23	25.7 Å²	25.7	16%	0.161	15%	0.153	C	C	.	.	S	Bend	trans	-138.5	167.7	179.4	50.9	0	0	0	0	110.3	H60 N85 H91 E93	H60-S89 PolarHBondContact CE1-O 2.72Å; H60-S89 PolarHBondContact NE2-O 3.38Å; N85-S89 PolarHBondContact ND2-OG 2.95Å; N85-S89 PolarHBondContact OD1-N 3.02Å; S89-H91 VanDerWaalsContact C-N 3.33Å; S89-H91 PolarHBondContact OG-O 2.87Å; S89-E93 WeakPolarHBondContact CB-OE2 3.32Å; S89-E93 PolarHBondContact OG-OE2 2.89Å
90	T	91.8	Very high	96.1	Very high	107 Å²	107	29 Å²	29	66%	0.656	17%	0.173	S	C	*	.	S	Bend	trans	-75.3	-27.1	-177.6	52.9	0	0	0	0	113
91	H	93.7	Very high	95.9	Very high	81 Å²	81	29.7 Å²	29.7	38%	0.375	18%	0.176	S	C	.	.	S	Bend	trans	-131.9	156.1	-175.3	-66.4	-45	0	0	0	108	Y41 S89 E93	Y41-H91 HydrophobicContact CE1-CB 3.92Å; Y41-H91 AromaticContact CE1-CG 3.79Å; Y41-H91 AromaticContact CE1-ND1 3.91Å; Y41-H91 HydrophobicContact CE2-CB 3.99Å; Y41-H91 AromaticContact CZ-CG 3.99Å; S89-H91 VanDerWaalsContact C-N 3.33Å; S89-H91 PolarHBondContact OG-O 2.87Å; H91-E93 PolarHBondContact O-N 2.73Å
92	N	97.6	Very high	95.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.2	C	C	.	.			trans	-69	124.5	166.8	176.7	-68.8	0	0	0	108.5	Y41 R43 V83 I84 D94 D499	Y41-N92 VanDerWaalsContact CE2-O 3.27Å; Y41-N92 WeakPolarHBondContact CE2-O 3.43Å; Y41-N92 PolarHBondContact OH-N 2.94Å; Y41-N92 PolarHBondContact OH-O 3.42Å; R43-N92 VanDerWaalsContact CZ-CG 3.4Å; R43-N92 PolarHBondContact NH2-ND2 3.39Å; R43-N92 PolarHBondContact NH2-OD1 3.2Å; V83-N92 PolarHBondContact O-ND2 3.43Å; I84-N92 HydrophobicContact CB-CB 4.2Å; I84-N92 HydrophobicContact CD1-CB 4.29Å; I84-N92 HydrophobicContact CG1-CB 3.94Å; N92-D94 WeakPolarHBondContact OD1-CA 3.26Å; N92-D94 VanDerWaalsContact OD1-CB 3.22Å; N92-D94 WeakPolarHBondContact OD1-CB 3.48Å; N92-D94 PolarHBondContact OD1-N 2.9Å; N92-D94 PolarHBondContact OD1-O 2.86Å; N92-D499 WeakPolarHBondContact CA-OD1 3.4Å; N92-D499 WeakPolarHBondContact CA-OD2 3.35Å; N92-D499 WeakPolarHBondContact CB-OD1 3.09Å; N92-D499 WeakPolarHBondContact ND2-CB 3.35Å; N92-D499 PolarHBondContact ND2-OD1 2.65Å
93	E	97.9	Very high	95.5	Very high	18 Å²	18	33.7 Å²	33.7	8%	0.084	20%	0.201	C	C	.	.			trans	-89.1	-12.6	-175.4	-65.3	172.2	109.3	0	0	111.9	S89 H91 G152 A154 G155 A159 D499	S89-E93 WeakPolarHBondContact CB-OE2 3.32Å; S89-E93 PolarHBondContact OG-OE2 2.89Å; H91-E93 PolarHBondContact O-N 2.73Å; E93-G152 WeakPolarHBondContact CB-O 3.35Å; E93-G152 WeakPolarHBondContact O-CA 3.2Å; E93-G152 PolarHBondContact O-N 3.02Å; E93-A154 PolarHBondContact OE1-N 3.36Å; E93-G155 VanDerWaalsContact OE1-CA 3.27Å; E93-G155 WeakPolarHBondContact OE1-CA 3.26Å; E93-G155 PolarHBondContact OE1-N 3.05Å; E93-A159 WeakPolarHBondContact O-CB 3.32Å; E93-D499 PolarHBondContact N-OD2 3.14Å
94	D	98.6	Very high	95.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.225	C	C	.	.			trans	-64.4	148.6	173.2	-64.3	-7.6	0	0	0	111.9	N92 F150 D151 T436 S501	N92-D94 WeakPolarHBondContact OD1-CA 3.26Å; N92-D94 VanDerWaalsContact OD1-CB 3.22Å; N92-D94 WeakPolarHBondContact OD1-CB 3.48Å; N92-D94 PolarHBondContact OD1-N 2.9Å; N92-D94 PolarHBondContact OD1-O 2.86Å; D94-F150 CarbonylContact C-O 3.59Å; D94-F150 WeakPolarHBondContact CA-O 3.47Å; D94-D151 WeakPolarHBondContact OD1-CA 3.4Å; D94-T436 HydrophobicContact CB-CG2 4.48Å; D94-T436 VanDerWaalsContact OD2-CG2 3.3Å; D94-T436 WeakPolarHBondContact OD2-CG2 3.41Å; D94-T436 PolarHBondContact OD2-OG1 2.86Å; D94-S501 VanDerWaalsContact CB-OG 3.26Å; D94-S501 WeakPolarHBondContact CB-OG 3.37Å; D94-S501 WeakPolarHBondContact OD2-CB 3.31Å; D94-S501 PolarHBondContact OD2-OG 3.41Å
95	Q	98.7	Very high	94.6	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158.3	170.4	-69.4	-66.7	-50.6	0	0	111	G42 F150 A159 V160	G42-Q95 PolarHBondContact O-NE2 3.28Å; Q95-F150 HydrophobicContact CB-CB 4.35Å; Q95-F150 HydrophobicContact CB-CD2 4.26Å; Q95-F150 PolarHBondContact N-O 2.92Å; Q95-F150 PolarHBondContact O-N 3.42Å; Q95-A159 HydrophobicContact CB-CB 4.11Å; Q95-A159 HydrophobicContact CG-CB 3.81Å; Q95-V160 HydrophobicContact CG-CG2 3.91Å
96	A	98.6	Very high	93.8	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.033	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	151.3	179.5	0	0	0	0	0	110.9	P44 F46 Y80 S148 L149 Y503	P44-A96 HydrophobicContact CB-CB 4.17Å; P44-A96 HydrophobicContact CG-CB 3.82Å; F46-A96 HydrophobicContact CE1-CB 4.05Å; F46-A96 HydrophobicContact CZ-CB 3.98Å; Y80-A96 HydrophobicContact CE2-CB 3.79Å; A96-S148 VanDerWaalsContact CA-O 3.23Å; A96-S148 WeakPolarHBondContact CA-O 3.46Å; A96-S148 WeakPolarHBondContact CB-O 3.47Å; A96-L149 HydrophobicContact CB-CD1 4.02Å; A96-Y503 HydrophobicContact CB-CE2 3.98Å; A96-Y503 WeakPolarHBondContact CB-OH 2.95Å
97	S	98.1	Very high	92.5	Very high	10 Å²	10	53.7 Å²	53.7	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	151.7	166.5	68.1	0	0	0	0	111.4	Y146 W147 S148 S163 Y503	S97-Y146 WeakPolarHBondContact OG-CE1 3.14Å; S97-W147 CarbonylContact O-C 3.41Å; S97-W147 WeakPolarHBondContact O-CA 3.44Å; S97-S148 PolarHBondContact N-O 3.12Å; S97-S148 PolarHBondContact N-OG 3.33Å; S97-S148 VanDerWaalsContact N-OG 3.11Å; S97-S148 PolarHBondContact O-N 2.82Å; S97-S148 PolarHBondContact O-OG 3.35Å; S97-S148 PolarHBondContact OG-OG 2.91Å; S97-S163 PolarHBondContact OG-O 3.48Å; S97-Y503 PolarHBondContact O-OH 3.15Å
98	C	97.9	Very high	90.8	Very high	13 Å²	13	54.3 Å²	54.3	9%	0.088	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	113.6	-178.3	-179.1	0	0	0	0	109.4	F46 L74 Y146 W147 Y503	F46-C98 HydrophobicContact CD1-CB 4.43Å; F46-C98 HydrophobicContact CE1-CB 4.41Å; L74-C98 HydrophobicContact CD1-CB 4.25Å; L74-C98 HydrophobicContact CD2-CB 4.01Å; C98-Y146 CarbonylContact C-O 3.52Å; C98-Y146 VanDerWaalsContact CA-O 3.29Å; C98-Y146 WeakPolarHBondContact CA-O 3.32Å; C98-W147 PolarHBondContact SG-NE1 2.84Å; C98-Y503 HydrophobicContact CB-CE1 4.27Å
99	E	96.4	Very high	88.5	Confident	71 Å²	71	53.6 Å²	53.6	33%	0.332	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	159.4	-167.7	-64	-179.8	-154.6	0	0	112	L101 Y146 Q167	E99-L101 HydrophobicContact CB-CD2 4.14Å; E99-Y146 PolarHBondContact N-O 3.32Å; E99-Y146 PolarHBondContact O-N 2.95Å; E99-Q167 PolarHBondContact OE1-NE2 3.44Å
100	V	96.9	Very high	85.8	Confident	70 Å²	70	60.9 Å²	60.9	42%	0.424	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	111.1	165.7	-176.5	0	0	0	0	107.9	P75 S143 C144	P75-V100 HydrophobicContact CB-CG2 3.71Å; P75-V100 HydrophobicContact CG-CG2 3.85Å; V100-S143 WeakPolarHBondContact CG1-OG 3.44Å; V100-C144 CarbonylContact C-O 3.53Å
101	L	95.6	Very high	82.9	Confident	13 Å²	13	61.9 Å²	61.9	7%	0.068	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.1	179.5	-49.9	176.4	0	0	0	109.8	E99 S143 C144 Y146 Q167	E99-L101 HydrophobicContact CB-CD2 4.14Å; L101-S143 CarbonylContact O-C 3.49Å; L101-S143 VanDerWaalsContact O-CA 3.3Å; L101-S143 WeakPolarHBondContact O-CA 3.47Å; L101-S143 PolarHBondContact O-OG 3.28Å; L101-C144 PolarHBondContact N-O 2.84Å; L101-C144 PolarHBondContact O-N 2.86Å; L101-Y146 HydrophobicContact CD1-CD2 3.98Å; L101-Y146 HydrophobicContact CD1-CG 3.97Å; L101-Q167 HydrophobicContact CD1-CB 4.24Å; L101-Q167 HydrophobicContact CD2-CB 4.19Å; L101-Q167 HydrophobicContact CD2-CG 4.23Å
102	T	94.9	Very high	79.9	Confident	82 Å²	82	63.1 Å²	63.1	50%	0.503	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	109.8	172.2	-60.2	0	0	0	0	109.1	K104	T102-K104 HydrophobicContact CG2-CG 4.18Å
103	V	93.9	Very high	76.8	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.018	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120	179.7	-172.1	0	0	0	0	109.3	G141 V142 T171 L174 Q175 V178	V103-G141 CarbonylContact O-C 3.58Å; V103-G141 WeakPolarHBondContact O-CA 3.27Å; V103-V142 PolarHBondContact N-O 2.99Å; V103-V142 PolarHBondContact O-N 2.83Å; V103-T171 HydrophobicContact CG2-CG2 4.45Å; V103-L174 HydrophobicContact CG1-CB 3.76Å; V103-L174 HydrophobicContact CG2-CB 4.05Å; V103-L174 HydrophobicContact CG2-CD1 4.09Å; V103-Q175 HydrophobicContact CG1-CB 4.44Å; V103-Q175 HydrophobicContact CG1-CG 3.94Å; V103-V178 HydrophobicContact CB-CG2 4.19Å; V103-V178 HydrophobicContact CG1-CB 3.85Å; V103-V178 HydrophobicContact CG1-CG1 4.4Å; V103-V178 HydrophobicContact CG1-CG2 3.86Å
104	K	91.6	Very high	73.7	Confident	114 Å²	114	74 Å²	74	50%	0.496	45%	0.445	S	S	.	.			trans	-120.9	149.3	176	-64.2	-177.2	-178.2	-175.9	0	109.5	T102 K106 Q175	T102-K104 HydrophobicContact CG2-CG 4.18Å; K104-K106 PolarHBondContact O-N 2.67Å; K104-Q175 WeakPolarHBondContact O-CG 3.3Å
105	K	85.8	Confident	70.3	Confident	127 Å²	127	81.7 Å²	81.7	55%	0.552	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-53.8	134.7	172.8	-169.5	-163.1	-167.5	133.7	0	109	A107 V178 D179	K105-A107 PolarHBondContact O-N 3.41Å; K105-A107 VanDerWaalsContact O-N 3.11Å; K105-V178 HydrophobicContact CB-CG1 4.29Å; K105-D179 WeakPolarHBondContact CD-OD2 3.31Å; K105-D179 WeakPolarHBondContact CE-OD2 3.21Å; K105-D179 WeakPolarHBondContact CG-OD2 3.33Å; K105-D179 IonicContact NZ-OD2 3.99Å; K105-D179 PolarHBondContact NZ-OD2 3.45Å
106	K	78.1	Confident	67.3	Low	134 Å²	134	91.4 Å²	91.4	58%	0.583	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-59	117.8	171.2	-164.6	168.9	-172	166	0	108.2	K104 G108	K104-K106 PolarHBondContact O-N 2.67Å; K106-G108 PolarHBondContact O-N 3Å; K106-G108 VanDerWaalsContact O-N 3.11Å
107	A	65.7	Low	64	Low	89 Å²	89	97.9 Å²	97.9	74%	0.736	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-56.1	122.3	170.7	0	0	0	0	0	106.6	K105 A109	K105-A107 PolarHBondContact O-N 3.41Å; K105-A107 VanDerWaalsContact O-N 3.11Å; A107-A109 PolarHBondContact O-N 3.02Å
108	G	55.6	Low	60.8	Low	66 Å²	66	102.4 Å²	102.4	68%	0.68	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-46.6	132.2	-176.1	0	0	0	0	0	109.5	K106 M110	K106-G108 PolarHBondContact O-N 3Å; K106-G108 VanDerWaalsContact O-N 3.11Å; G108-M110 PolarHBondContact O-N 3.08Å
109	A	39.8	Very low	57.6	Low	92 Å²	92	107 Å²	107	76%	0.76	62%	0.62	S	S	*	*			trans	-58.2	93.7	176.5	0	0	0	0	0	108	A107 T111	A107-A109 PolarHBondContact O-N 3.02Å; A109-T111 VanDerWaalsContact C-N 3.3Å; A109-T111 PolarHBondContact O-N 2.79Å
110	M	34.5	Very low	54.7	Low	177 Å²	177	113.3 Å²	113.3	87%	0.872	65%	0.647	S	S	*	*			trans	-62.7	105	163.7	-69	-162.8	84.6	0	0	104.5	G108 S112	G108-M110 PolarHBondContact O-N 3.08Å; M110-S112 PolarHBondContact O-N 2.79Å
111	T	30.7	Very low	51.5	Low	127 Å²	127	122.2 Å²	122.2	78%	0.779	67%	0.673	S	S	*	*			trans	-59.6	86	162.7	46.7	0	0	0	0	107	A109 T113	A109-T111 VanDerWaalsContact C-N 3.3Å; A109-T111 PolarHBondContact O-N 2.79Å; T111-T113 PolarHBondContact O-N 3.29Å
112	S	31.7	Very low	48.5	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	71%	0.713	S	S	*	*			trans	-71	88.9	167.9	56.5	0	0	0	0	106.8	M110	M110-S112 PolarHBondContact O-N 2.79Å
113	T	30.9	Very low	45.4	Very low	118 Å²	118	134.9 Å²	134.9	72%	0.724	73%	0.728	S	S	*	*			trans	-58.4	128.2	162.3	38.2	0	0	0	0	108.1	T111 N115	T111-T113 PolarHBondContact O-N 3.29Å; T113-N115 PolarHBondContact O-N 3.17Å
114	P	33.4	Very low	42.5	Very low	130 Å²	130	140 Å²	140	84%	0.844	76%	0.764	S	S	*	*			trans	-76.8	92.6	179.5	29.3	-30.1	0	0	0	108.2	R116	P114-R116 PolarHBondContact O-N 2.82Å
115	N	28.2	Very low	39.6	Very low	160 Å²	160	142.5 Å²	142.5	86%	0.856	78%	0.782	S	S	*	*			trans	-82.5	113.8	173.9	-146.1	7.5	0	0	0	109.8	T113	T113-N115 PolarHBondContact O-N 3.17Å
116	R	34.4	Very low	38	Very low	212 Å²	212	141.4 Å²	141.4	80%	0.8	79%	0.787	S	S	*	*			trans	-93.4	137.8	-177.9	-179.9	179.3	154.2	-170.8	-5	108.8	P114	P114-R116 PolarHBondContact O-N 2.82Å
117	N	29.8	Very low	35.8	Very low	141 Å²	141	142.9 Å²	142.9	75%	0.754	80%	0.802	S	S	*	*			trans	92.2	133.4	176.7	-54.4	-22.8	0	0	0	113.9
118	S	31.2	Very low	34.1	Very low	105 Å²	105	142.3 Å²	142.3	73%	0.734	81%	0.805	S	S	*	*			cis	-168.9	152.7	13.8	41.2	0	0	0	0	112.3
119	S	31.1	Very low	33.1	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	82%	0.818	S	S	*	*			trans	68.1	109.2	144.4	59.1	0	0	0	0	122.9
120	K	34.9	Very low	32.8	Very low	205 Å²	205	147.8 Å²	147.8	89%	0.891	82%	0.816	S	S	*	*			trans	11.6	128.8	138	-71.6	178.1	176.2	174.4	0	119
121	R	29.8	Very low	32.8	Very low	257 Å²	257	147.3 Å²	147.3	97%	0.97	82%	0.815	S	S	*	*				-160	142.7	124.1	-104.3	174.6	-168.3	-154.2	3.4	111.9
122	R	32.4	Very low	32.9	Very low	245 Å²	245	150 Å²	150	93%	0.925	82%	0.819	S	S	*	*			trans	-87.4	168.2	-178.3	-90.4	-178.7	172.3	180	-3.4	112.7
123	S	30	Very low	33	Very low	115 Å²	115	152.5 Å²	152.5	80%	0.804	82%	0.824	S	S	*	*			trans	106.7	145.7	159.4	74.5	0	0	0	0	112.6
124	S	33.2	Very low	33.1	Very low	111 Å²	111	155.9 Å²	155.9	78%	0.776	83%	0.828	S	S	*	*			cis	-175.9	147	-13.3	40.4	0	0	0	0	105.8
125	L	31	Very low	33	Very low	167 Å²	167	158.4 Å²	158.4	87%	0.874	83%	0.829	S	S	*	*			trans	-51.7	-176.2	179.2	-68.5	156.8	0	0	0	116.2
126	P	51.3	Low	33.2	Very low	103 Å²	103	156.4 Å²	156.4	67%	0.669	82%	0.818	S	S	*	*			cis	-135.9	-172.9	-46.9	37.3	-18.8	0	0	0	113.6
127	N	31.8	Very low	33.4	Very low	165 Å²	165	151.8 Å²	151.8	88%	0.882	82%	0.818	S	S	*	*			trans	98.4	128	164.1	-70.5	3.3	0	0	0	119.4
128	G	30.9	Very low	34.2	Very low	78 Å²	78	152.8 Å²	152.8	80%	0.804	82%	0.818	S	S	*	*			trans	166.4	97.4	165.4	0	0	0	0	0	111.6
129	E	33.8	Very low	35.3	Very low	204 Å²	204	152 Å²	152	95%	0.953	81%	0.813	S	S	*	*			trans	-57.8	151.7	172.4	-66.9	177.3	133.2	0	0	112.7
130	G	33	Very low	37.1	Very low	69 Å²	69	154.5 Å²	154.5	71%	0.711	81%	0.813	S	S	*	*			trans	98.5	95.3	153.5	0	0	0	0	0	115.5
131	L	35.1	Very low	39.4	Very low	166 Å²	166	145.8 Å²	145.8	87%	0.869	78%	0.781	S	S	*	*			trans	-166.2	112.2	135.8	-101.9	144.1	0	0	0	108.5	L133	L131-L133 PolarHBondContact O-N 2.86Å
132	Q	33.3	Very low	42.3	Very low	183 Å²	183	134.4 Å²	134.4	86%	0.855	74%	0.74	S	S	*	*			trans	-51.3	108	161.9	-73.6	171	-3.3	0	0	107.7	K134	Q132-K134 VanDerWaalsContact C-N 3.27Å; Q132-K134 PolarHBondContact O-N 2.98Å
133	L	33.6	Very low	45.2	Very low	161 Å²	161	125.7 Å²	125.7	84%	0.843	72%	0.717	S	S	*	*			trans	-65.5	97.6	159.6	-80.1	158.4	0	0	0	105.7	L131 E135	L131-L133 PolarHBondContact O-N 2.86Å; L133-E135 PolarHBondContact O-N 2.86Å
134	K	32.5	Very low	48.3	Very low	189 Å²	189	120.2 Å²	120.2	82%	0.822	68%	0.679	S	S	*	*			trans	-54.9	100.9	148.5	-87.6	-178	170.5	-178.1	0	105.3	Q132 N136	Q132-K134 VanDerWaalsContact C-N 3.27Å; Q132-K134 PolarHBondContact O-N 2.98Å; K134-N136 PolarHBondContact O-N 3.14Å
135	E	32.5	Very low	51.3	Low	183 Å²	183	116.6 Å²	116.6	86%	0.855	65%	0.649	S	S	*	*			trans	-53.5	114.9	163	-75.4	-178.6	150	0	0	106.6	L133 S137	L133-E135 PolarHBondContact O-N 2.86Å; E135-S137 PolarHBondContact O-N 2.72Å
136	N	32.3	Very low	54.5	Low	117 Å²	117	108.7 Å²	108.7	63%	0.626	61%	0.608	S	S	*	*			trans	-54.1	112.5	173.4	-97.9	5	0	0	0	108.2	K134 E138	K134-N136 PolarHBondContact O-N 3.14Å; N136-E138 PolarHBondContact O-N 3.11Å
137	S	38	Very low	56.8	Low	116 Å²	116	103.8 Å²	103.8	81%	0.811	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	23	171.7	57	0	0	0	0	113.4	E135	E135-S137 PolarHBondContact O-N 2.72Å
138	E	46.9	Very low	60	Low	161 Å²	161	95.9 Å²	95.9	75%	0.752	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	1.4	-177.3	-71.5	-174.5	151.9	0	0	113.2	N136	N136-E138 PolarHBondContact O-N 3.11Å
139	S	52.9	Low	63.2	Low	89 Å²	89	92.2 Å²	92.2	62%	0.622	50%	0.495	S	S	*	.			trans	-108.2	16.9	-173.6	-53.6	0	0	0	0	114.8	G141	S139-G141 PolarHBondContact O-N 3.01Å
140	E	70.8	Confident	66.3	Low	161 Å²	161	82.5 Å²	82.5	75%	0.752	45%	0.45	S	S	*	.			trans	-77.6	108.5	-178	-128.2	174.2	-177.6	0	0	109.8	K182	E140-K182 VanDerWaalsContact O-CE 3.31Å; E140-K182 WeakPolarHBondContact O-CE 3.32Å; E140-K182 PolarHBondContact O-NZ 2.85Å
141	G	82.8	Confident	69.4	Low	22 Å²	22	79.6 Å²	79.6	23%	0.227	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-67.6	170	173.5	0	0	0	0	0	111.9	V103 S139	V103-G141 CarbonylContact O-C 3.58Å; V103-G141 WeakPolarHBondContact O-CA 3.27Å; S139-G141 PolarHBondContact O-N 3.01Å
142	V	90.8	Very high	72.5	Confident	17 Å²	17	71.7 Å²	71.7	10%	0.103	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.6	167.4	-177	0	0	0	0	108.2	V103 V178 K182 L277 L278	V103-V142 PolarHBondContact N-O 2.99Å; V103-V142 PolarHBondContact O-N 2.83Å; V142-V178 HydrophobicContact CB-CG2 3.96Å; V142-V178 HydrophobicContact CG2-CG2 3.57Å; V142-K182 HydrophobicContact CG2-CD 4.19Å; V142-K182 HydrophobicContact CG2-CG 3.58Å; V142-L277 HydrophobicContact CG1-CD1 3.46Å; V142-L277 VanDerWaalsContact CG1-CD1 3.46Å; V142-L278 HydrophobicContact CG1-CD2 3.98Å; V142-L278 HydrophobicContact CG1-CG 4.41Å
143	S	92.8	Very high	75.5	Confident	63 Å²	63	65 Å²	65	44%	0.441	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.9	172.6	-176.4	0	0	0	0	110.3	V100 L101	V100-S143 WeakPolarHBondContact CG1-OG 3.44Å; L101-S143 CarbonylContact O-C 3.49Å; L101-S143 VanDerWaalsContact O-CA 3.3Å; L101-S143 WeakPolarHBondContact O-CA 3.47Å; L101-S143 PolarHBondContact O-OG 3.28Å
144	C	94.1	Very high	78.4	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.7	170.3	55.4	0	0	0	0	111.2	V100 L101 I275 C276 L277	V100-C144 CarbonylContact C-O 3.53Å; L101-C144 PolarHBondContact N-O 2.84Å; L101-C144 PolarHBondContact O-N 2.86Å; C144-I275 HydrophobicContact CB-CG2 3.94Å; C144-C276 VanDerWaalsContact CA-O 3.24Å; C144-C276 WeakPolarHBondContact CA-O 3.47Å; C144-C276 WeakPolarHBondContact CB-O 3.49Å; C144-L277 HydrophobicContact CB-CB 4.18Å; C144-L277 HydrophobicContact CB-CD1 4Å
145	H	97.6	Very high	81.3	Confident	35 Å²	35	52.9 Å²	52.9	16%	0.162	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	136.6	173	-63.8	68.7	0	0	0	108.7	W76 W147 I275 C276	W76-H145 AromaticContact CE3-CD2 3.51Å; W76-H145 AromaticContact CE3-CE1 3.4Å; W76-H145 VanDerWaalsContact CE3-CE1 3.4Å; W76-H145 AromaticContact CE3-CG 3.73Å; W76-H145 AromaticContact CE3-ND1 3.65Å; W76-H145 AromaticContact CE3-NE2 3.32Å; W76-H145 VanDerWaalsContact CE3-NE2 3.32Å; W76-H145 AromaticContact CZ3-CE1 3.4Å; W76-H145 VanDerWaalsContact CZ3-CE1 3.4Å; W76-H145 WeakPolarHBondContact CZ3-CE1 3.46Å; W76-H145 AromaticContact CZ3-ND1 3.64Å; W76-H145 AromaticContact CZ3-NE2 3.81Å; H145-W147 HydrophobicContact CB-CE3 4.35Å; H145-W147 HydrophobicContact CB-CH2 3.28Å; H145-W147 HydrophobicContact CB-CZ2 3.98Å; H145-W147 HydrophobicContact CB-CZ3 3.49Å; H145-W147 VanDerWaalsContact CB-CZ3 3.49Å; H145-I275 CarbonylContact O-C 3.48Å; H145-I275 VanDerWaalsContact O-CA 3.31Å; H145-I275 WeakPolarHBondContact O-CA 3.29Å; H145-C276 HydrophobicContact CB-CB 4.1Å; H145-C276 PolarHBondContact N-O 3.46Å; H145-C276 VanDerWaalsContact N-O 3.15Å; H145-C276 PolarHBondContact O-N 3.18Å
146	Y	98.6	Very high	84.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.5	-174.8	178.2	-89.6	0	0	0	109.7	S97 C98 E99 L101 S148 Q167 V170 I273 V274 I275	S97-Y146 WeakPolarHBondContact OG-CE1 3.14Å; C98-Y146 CarbonylContact C-O 3.52Å; C98-Y146 VanDerWaalsContact CA-O 3.29Å; C98-Y146 WeakPolarHBondContact CA-O 3.32Å; E99-Y146 PolarHBondContact N-O 3.32Å; E99-Y146 PolarHBondContact O-N 2.95Å; L101-Y146 HydrophobicContact CD1-CD2 3.98Å; L101-Y146 HydrophobicContact CD1-CG 3.97Å; Y146-S148 WeakPolarHBondContact OH-CB 3.38Å; Y146-Q167 HydrophobicContact CD1-CB 3.96Å; Y146-Q167 HydrophobicContact CD2-CB 4.33Å; Y146-Q167 HydrophobicContact CE1-CB 3.69Å; Y146-Q167 HydrophobicContact CE2-CB 4.1Å; Y146-Q167 HydrophobicContact CG-CB 4.26Å; Y146-V170 HydrophobicContact CE2-CG2 4.29Å; Y146-I273 HydrophobicContact CE2-CB 4.18Å; Y146-I273 HydrophobicContact CE2-CD1 3.85Å; Y146-I273 HydrophobicContact CE2-CG2 4.37Å; Y146-I273 WeakPolarHBondContact OH-CG2 3.39Å; Y146-V274 WeakPolarHBondContact CA-O 3.18Å; Y146-I275 HydrophobicContact CD2-CD1 4.3Å; Y146-I275 HydrophobicContact CD2-CG1 3.97Å
147	W	98.8	Very high	87.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.2	169.3	-58.5	-100.1	0	0	0	108.7	W76 T78 S97 C98 H145 I273 V274 C276 L434 I505	W76-W147 HydrophobicContact CB-CH2 4.25Å; W76-W147 HydrophobicContact CB-CZ2 3.63Å; W76-W147 HydrophobicContact CD2-CH2 4.42Å; W76-W147 HydrophobicContact CG-CH2 4.08Å; W76-W147 AromaticContact CG-CZ2 3.86Å; W76-W147 HydrophobicContact CG-CZ2 3.86Å; T78-W147 PolarHBondContact OG1-NE1 3.17Å; S97-W147 CarbonylContact O-C 3.41Å; S97-W147 WeakPolarHBondContact O-CA 3.44Å; C98-W147 PolarHBondContact SG-NE1 2.84Å; H145-W147 HydrophobicContact CB-CE3 4.35Å; H145-W147 HydrophobicContact CB-CH2 3.28Å; H145-W147 HydrophobicContact CB-CZ2 3.98Å; H145-W147 HydrophobicContact CB-CZ3 3.49Å; H145-W147 VanDerWaalsContact CB-CZ3 3.49Å; W147-I273 CarbonylContact O-C 3.58Å; W147-I273 VanDerWaalsContact O-CA 3.23Å; W147-I273 WeakPolarHBondContact O-CA 3.03Å; W147-I273 WeakPolarHBondContact O-CB 3.5Å; W147-V274 HydrophobicContact CB-CB 4.36Å; W147-V274 HydrophobicContact CE3-CB 4.08Å; W147-V274 HydrophobicContact CE3-CG1 3.94Å; W147-V274 HydrophobicContact CZ3-CG1 4.28Å; W147-V274 PolarHBondContact N-O 3.3Å; W147-V274 PolarHBondContact O-N 2.91Å; W147-C276 HydrophobicContact CH2-CB 4.22Å; W147-C276 HydrophobicContact CZ3-CB 3.91Å; W147-L434 HydrophobicContact CB-CD2 4.45Å; W147-I505 HydrophobicContact CB-CD1 4.25Å; W147-I505 HydrophobicContact CD2-CD1 3.74Å; W147-I505 HydrophobicContact CE3-CD1 4.4Å; W147-I505 HydrophobicContact CG-CD1 3.64Å; W147-I505 HydrophobicContact CH2-CG2 4.26Å; W147-I505 HydrophobicContact CZ2-CD1 4.49Å; W147-I505 HydrophobicContact CZ2-CG2 3.77Å
148	S	98.8	Very high	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	147.6	174.8	68.1	0	0	0	0	111.8	A96 S97 Y146 F150 L272 Y503	A96-S148 VanDerWaalsContact CA-O 3.23Å; A96-S148 WeakPolarHBondContact CA-O 3.46Å; A96-S148 WeakPolarHBondContact CB-O 3.47Å; S97-S148 PolarHBondContact N-O 3.12Å; S97-S148 PolarHBondContact N-OG 3.33Å; S97-S148 VanDerWaalsContact N-OG 3.11Å; S97-S148 PolarHBondContact O-N 2.82Å; S97-S148 PolarHBondContact O-OG 3.35Å; S97-S148 PolarHBondContact OG-OG 2.91Å; Y146-S148 WeakPolarHBondContact OH-CB 3.38Å; S148-F150 VanDerWaalsContact CB-CE2 3.48Å; S148-F150 WeakPolarHBondContact OG-CE2 3.31Å; S148-L272 CarbonylContact C-O 3.49Å; S148-L272 WeakPolarHBondContact CA-O 3.38Å; S148-Y503 WeakPolarHBondContact O-CE2 2.98Å
149	L	98.8	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.7	173.8	-160.7	73.7	0	0	0	108.8	Y80 A96 L272 T436 Y503	Y80-L149 HydrophobicContact CE2-CD1 4.32Å; A96-L149 HydrophobicContact CB-CD1 4.02Å; L149-L272 HydrophobicContact CB-CB 4.47Å; L149-L272 PolarHBondContact N-O 2.83Å; L149-L272 PolarHBondContact O-N 2.89Å; L149-T436 HydrophobicContact CD1-CG2 4.39Å; L149-T436 HydrophobicContact CD2-CG2 3.49Å; L149-T436 VanDerWaalsContact CD2-CG2 3.49Å; L149-T436 HydrophobicContact CG-CG2 3.72Å; L149-Y503 HydrophobicContact CD1-CD2 4.3Å; L149-Y503 HydrophobicContact CD1-CE2 4.12Å
150	F	98.9	Very high	95	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	119	178.9	-52.2	-86.8	0	0	0	108.2	D94 Q95 S148 A159 A162 L166 C269 T270 A271 L392	D94-F150 CarbonylContact C-O 3.59Å; D94-F150 WeakPolarHBondContact CA-O 3.47Å; Q95-F150 HydrophobicContact CB-CB 4.35Å; Q95-F150 HydrophobicContact CB-CD2 4.26Å; Q95-F150 PolarHBondContact N-O 2.92Å; Q95-F150 PolarHBondContact O-N 3.42Å; S148-F150 VanDerWaalsContact CB-CE2 3.48Å; S148-F150 WeakPolarHBondContact OG-CE2 3.31Å; F150-A159 HydrophobicContact CB-CB 3.99Å; F150-A162 HydrophobicContact CD1-CB 3.7Å; F150-A162 HydrophobicContact CE1-CB 3.54Å; F150-A162 HydrophobicContact CG-CB 4.29Å; F150-A162 HydrophobicContact CZ-CB 4Å; F150-L166 HydrophobicContact CE1-CD2 3.7Å; F150-L166 HydrophobicContact CZ-CB 4.25Å; F150-L166 HydrophobicContact CZ-CD2 3.83Å; F150-C269 HydrophobicContact CB-CB 4.3Å; F150-T270 VanDerWaalsContact CA-O 3.31Å; F150-T270 WeakPolarHBondContact CA-O 3.43Å; F150-T270 WeakPolarHBondContact CD1-O 3.42Å; F150-A271 HydrophobicContact CD1-CB 3.76Å; F150-A271 HydrophobicContact CE1-CB 3.78Å; F150-L392 HydrophobicContact CE1-CD1 4.36Å
151	D	98.8	Very high	96.3	Very high	8 Å²	8	15.6 Å²	15.6	4%	0.043	11%	0.112	C	C	.	.			trans	-92.6	109.4	174.1	-169.1	-34.1	0	0	0	107.8	D94 C269 T270 T436 D437	D94-D151 WeakPolarHBondContact OD1-CA 3.4Å; D151-C269 CarbonylContact O-C 3.59Å; D151-C269 WeakPolarHBondContact O-CA 3.43Å; D151-C269 WeakPolarHBondContact O-CB 3.24Å; D151-T270 HydrophobicContact CB-CG2 3.93Å; D151-T270 WeakPolarHBondContact CB-OG1 3.23Å; D151-T270 PolarHBondContact N-OG1 2.98Å; D151-T270 PolarHBondContact O-N 2.82Å; D151-T436 HydrophobicContact CB-CG2 3.73Å; D151-T436 WeakPolarHBondContact OD2-CB 3.18Å; D151-D437 PolarHBondContact OD2-N 3.21Å; D151-D437 VanDerWaalsContact OD2-OD1 3.12Å
152	G	98.3	Very high	97.1	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	148.1	-174	0	0	0	0	0	112.7	E93	E93-G152 WeakPolarHBondContact CB-O 3.35Å; E93-G152 WeakPolarHBondContact O-CA 3.2Å; E93-G152 PolarHBondContact O-N 3.02Å
153	H	96.6	Very high	97.4	Very high	41 Å²	41	14.1 Å²	14.1	19%	0.19	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	150.5	174.3	60.7	-98.8	0	0	0	112.8	G155 G267 G268 D394	H153-G155 PolarHBondContact O-N 2.8Å; H153-G267 VanDerWaalsContact O-CA 3.25Å; H153-G267 WeakPolarHBondContact O-CA 3.47Å; H153-G268 VanDerWaalsContact CE1-C 3.49Å; H153-G268 PolarHBondContact N-O 3.01Å; H153-G268 PolarHBondContact O-N 2.83Å; H153-G268 VanDerWaalsContact O-N 3.12Å; H153-D394 IonicContact CD2-OD2 2.64Å; H153-D394 IonicContact CE1-OD2 3.05Å; H153-D394 PolarHBondContact CE1-OD2 3.38Å; H153-D394 IonicContact NE2-OD1 3.5Å; H153-D394 IonicContact NE2-OD2 2.91Å; H153-D394 PolarHBondContact NE2-OD2 3.48Å
154	A	95.1	Very high	97.7	Very high	78 Å²	78	15.4 Å²	15.4	65%	0.645	9%	0.094	S	C	*	.	S	Bend	trans	57	37.2	-175.9	0	0	0	0	0	112.6	E93 G267	E93-A154 PolarHBondContact OE1-N 3.36Å; A154-G267 WeakPolarHBondContact O-CA 3.39Å; A154-G267 PolarHBondContact O-N 2.81Å
155	G	94.4	Very high	97.9	Very high	19 Å²	19	16.7 Å²	16.7	20%	0.196	10%	0.101	C	C	.	.	S	Bend	trans	113.9	151.8	-173	0	0	0	0	0	112	E93 H153 G157	E93-G155 VanDerWaalsContact OE1-CA 3.27Å; E93-G155 WeakPolarHBondContact OE1-CA 3.26Å; E93-G155 PolarHBondContact OE1-N 3.05Å; H153-G155 PolarHBondContact O-N 2.8Å; G155-G157 VanDerWaalsContact C-N 3.32Å; G155-G157 PolarHBondContact O-N 3.32Å
156	S	96.1	Very high	97.9	Very high	22 Å²	22	15 Å²	15	15%	0.154	9%	0.093	C	C	.	.	S	Bend	trans	-85.8	-0.2	179	67	0	0	0	0	113.8	Y41 A158 A159 V160	Y41-S156 WeakPolarHBondContact CD2-OG 3.25Å; S156-A158 PolarHBondContact O-N 2.87Å; S156-A159 PolarHBondContact O-N 2.94Å; S156-V160 WeakPolarHBondContact O-CB 3.33Å; S156-V160 VanDerWaalsContact O-CG2 3.28Å; S156-V160 WeakPolarHBondContact O-CG2 3.5Å; S156-V160 PolarHBondContact O-N 3.13Å
157	G	97.3	Very high	97.9	Very high	12 Å²	12	15.3 Å²	15.3	12%	0.124	9%	0.094	C	C	.	.	H	α-helix	trans	-59.3	-50.4	-167.2	0	0	0	0	0	113	G155 V160 V161 S266	G155-G157 VanDerWaalsContact C-N 3.32Å; G155-G157 PolarHBondContact O-N 3.32Å; G157-V160 PolarHBondContact O-N 3.36Å; G157-V161 VanDerWaalsContact O-CG2 3.31Å; G157-V161 WeakPolarHBondContact O-CG2 3.16Å; G157-V161 PolarHBondContact O-N 3.13Å; G157-V161 VanDerWaalsContact O-N 3.08Å; G157-S266 WeakPolarHBondContact CA-O 3.26Å; G157-S266 PolarHBondContact N-O 3.11Å; G157-S266 PolarHBondContact N-OG 3.42Å
158	A	98.3	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.7	-45.9	177.1	0	0	0	0	0	112.2	S156 V160 V161 A162 S266	S156-A158 PolarHBondContact O-N 2.87Å; A158-V160 PolarHBondContact O-N 2.64Å; A158-V161 PolarHBondContact O-N 3.39Å; A158-A162 VanDerWaalsContact O-CB 3.29Å; A158-A162 WeakPolarHBondContact O-CB 3.09Å; A158-A162 PolarHBondContact O-N 2.82Å; A158-S266 PolarHBondContact N-O 3.44Å
159	A	98.7	Very high	97.9	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.4	-43.9	178.8	0	0	0	0	0	112.3	E93 Q95 F150 S156 V161 A162 S163 C269	E93-A159 WeakPolarHBondContact O-CB 3.32Å; Q95-A159 HydrophobicContact CB-CB 4.11Å; Q95-A159 HydrophobicContact CG-CB 3.81Å; F150-A159 HydrophobicContact CB-CB 3.99Å; S156-A159 PolarHBondContact O-N 2.94Å; A159-V161 PolarHBondContact O-N 2.94Å; A159-A162 PolarHBondContact O-N 3.23Å; A159-S163 WeakPolarHBondContact O-CB 3.46Å; A159-S163 PolarHBondContact O-N 2.98Å; A159-S163 PolarHBondContact O-OG 3Å; A159-C269 HydrophobicContact CB-CB 3.87Å
160	V	98.5	Very high	97.8	Very high	6 Å²	6	21 Å²	21	4%	0.036	12%	0.121	C	C	.	.	H	α-helix	trans	-65	-39.5	178.6	168.7	0	0	0	0	111.8	F39 Y41 Q95 S156 G157 A158 S163 R164	F39-V160 HydrophobicContact CB-CG1 3.82Å; Y41-V160 HydrophobicContact CD2-CG2 4.39Å; Q95-V160 HydrophobicContact CG-CG2 3.91Å; S156-V160 WeakPolarHBondContact O-CB 3.33Å; S156-V160 VanDerWaalsContact O-CG2 3.28Å; S156-V160 WeakPolarHBondContact O-CG2 3.5Å; S156-V160 PolarHBondContact O-N 3.13Å; G157-V160 PolarHBondContact O-N 3.36Å; A158-V160 PolarHBondContact O-N 2.64Å; V160-S163 PolarHBondContact O-OG 2.89Å; V160-R164 WeakPolarHBondContact O-CG 3.06Å
161	V	98.5	Very high	97.8	Very high	4 Å²	4	22 Å²	22	2%	0.024	13%	0.127	C	C	.	.	H	α-helix	trans	-69.9	-44.4	177.2	172.9	0	0	0	0	110.4	R38 F39 G157 A158 A159 R164 L165 M252 I256 I265	R38-V161 HydrophobicContact CB-CG2 4.13Å; R38-V161 HydrophobicContact CG-CG2 4.29Å; F39-V161 HydrophobicContact CD2-CG2 4.08Å; F39-V161 HydrophobicContact CE2-CG2 4.48Å; G157-V161 VanDerWaalsContact O-CG2 3.31Å; G157-V161 WeakPolarHBondContact O-CG2 3.16Å; G157-V161 PolarHBondContact O-N 3.13Å; G157-V161 VanDerWaalsContact O-N 3.08Å; A158-V161 PolarHBondContact O-N 3.39Å; A159-V161 PolarHBondContact O-N 2.94Å; V161-R164 PolarHBondContact O-N 3.17Å; V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 WeakPolarHBondContact O-CB 3.35Å; V161-L165 PolarHBondContact O-N 3.32Å; V161-L165 VanDerWaalsContact O-N 3.16Å; V161-M252 HydrophobicContact CG1-CE 3.66Å; V161-I256 HydrophobicContact CG1-CG1 4.08Å; V161-I265 HydrophobicContact CG2-CD1 4.07Å; V161-I265 HydrophobicContact CG2-CG1 4.16Å; V161-I265 HydrophobicContact CG2-CG2 4.16Å
162	A	98.7	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-41.8	180	0	0	0	0	0	112.4	F150 A158 A159 R164 L165 L166 L392	F150-A162 HydrophobicContact CD1-CB 3.7Å; F150-A162 HydrophobicContact CE1-CB 3.54Å; F150-A162 HydrophobicContact CG-CB 4.29Å; F150-A162 HydrophobicContact CZ-CB 4Å; A158-A162 VanDerWaalsContact O-CB 3.29Å; A158-A162 WeakPolarHBondContact O-CB 3.09Å; A158-A162 PolarHBondContact O-N 2.82Å; A159-A162 PolarHBondContact O-N 3.23Å; A162-R164 PolarHBondContact O-N 3.02Å; A162-L165 PolarHBondContact O-N 3.02Å; A162-L166 VanDerWaalsContact O-CB 3.27Å; A162-L166 WeakPolarHBondContact O-CB 3.41Å; A162-L166 PolarHBondContact O-N 3.25Å; A162-L392 HydrophobicContact CB-CD1 3.78Å
163	S	98.6	Very high	97.6	Very high	8 Å²	8	28.7 Å²	28.7	6%	0.056	16%	0.158	C	C	.	.	H	α-helix	trans	-64.1	-23.5	-179.8	70.9	0	0	0	0	114.4	S97 A159 V160 Q167	S97-S163 PolarHBondContact OG-O 3.48Å; A159-S163 WeakPolarHBondContact O-CB 3.46Å; A159-S163 PolarHBondContact O-N 2.98Å; A159-S163 PolarHBondContact O-OG 3Å; V160-S163 PolarHBondContact O-OG 2.89Å; S163-Q167 PolarHBondContact O-NE2 3.11Å
164	R	98	Very high	97.6	Very high	89 Å²	89	26.9 Å²	26.9	34%	0.336	15%	0.149	S	C	.	.	H	α-helix	trans	-95.3	-23	178.8	-67.3	-176.9	-178.1	-146.7	3.8	114.3	F39 V160 V161 A162 Q167 H168	F39-R164 VanDerWaalsContact CD1-NH1 3.25Å; F39-R164 HydrophobicContact CD2-CB 4.41Å; F39-R164 HydrophobicContact CE2-CB 4.03Å; F39-R164 VanDerWaalsContact CG-CD 3.41Å; F39-R164 HydrophobicContact CZ-CB 4.27Å; V160-R164 WeakPolarHBondContact O-CG 3.06Å; V161-R164 PolarHBondContact O-N 3.17Å; A162-R164 PolarHBondContact O-N 3.02Å; R164-Q167 PolarHBondContact O-NE2 2.86Å; R164-Q167 PolarHBondContact O-OE1 3.31Å; R164-Q167 VanDerWaalsContact O-OE1 3.09Å; R164-H168 PolarHBondContact O-CE1 2.88Å; R164-H168 PolarHBondContact O-ND1 2.86Å; R164-H168 VanDerWaalsContact O-ND1 3.07Å
165	L	98.5	Very high	97.6	Very high	27 Å²	27	25.4 Å²	25.4	14%	0.141	13%	0.129	C	C	.	.	H	α-helix	trans	-121.4	-23.3	-168.2	-62	-178.5	0	0	0	114.7	F39 V161 A162 Q167 H168 H169 M252	F39-L165 HydrophobicContact CE2-CD1 3.96Å; F39-L165 HydrophobicContact CE2-CG 4.06Å; F39-L165 HydrophobicContact CZ-CD1 4.25Å; F39-L165 HydrophobicContact CZ-CD2 4.16Å; F39-L165 HydrophobicContact CZ-CG 4.22Å; V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 WeakPolarHBondContact O-CB 3.35Å; V161-L165 PolarHBondContact O-N 3.32Å; V161-L165 VanDerWaalsContact O-N 3.16Å; A162-L165 PolarHBondContact O-N 3.02Å; L165-Q167 VanDerWaalsContact C-N 3.32Å; L165-Q167 VanDerWaalsContact C-OE1 3.23Å; L165-Q167 VanDerWaalsContact N-OE1 3.12Å; L165-Q167 PolarHBondContact O-N 2.58Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 2.85Å; L165-H169 PolarHBondContact O-CD2 3.15Å; L165-H169 PolarHBondContact O-N 2.83Å; L165-M252 HydrophobicContact CB-CE 4.03Å; L165-M252 HydrophobicContact CB-SD 3.74Å; L165-M252 HydrophobicContact CD1-CE 4.4Å
166	L	98.8	Very high	97.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-36.6	-176.1	-179.3	58.3	0	0	0	112.6	F150 A162 H168 H169 V170 A248 F249 M252 I273	F150-L166 HydrophobicContact CE1-CD2 3.7Å; F150-L166 HydrophobicContact CZ-CB 4.25Å; F150-L166 HydrophobicContact CZ-CD2 3.83Å; A162-L166 VanDerWaalsContact O-CB 3.27Å; A162-L166 WeakPolarHBondContact O-CB 3.41Å; A162-L166 PolarHBondContact O-N 3.25Å; L166-H168 PolarHBondContact O-N 3.15Å; L166-H169 PolarHBondContact O-N 3.35Å; L166-V170 WeakPolarHBondContact O-CG2 3.12Å; L166-V170 PolarHBondContact O-N 2.82Å; L166-A248 HydrophobicContact CD1-CB 4.47Å; L166-F249 HydrophobicContact CD1-CD2 4.14Å; L166-F249 HydrophobicContact CD1-CE2 4.48Å; L166-F249 HydrophobicContact CD2-CD2 4.42Å; L166-F249 HydrophobicContact CD2-CE2 4.04Å; L166-F249 HydrophobicContact CD2-CZ 4.2Å; L166-M252 HydrophobicContact CB-CG 4.23Å; L166-M252 HydrophobicContact CB-SD 4.16Å; L166-M252 HydrophobicContact CD1-CB 3.76Å; L166-M252 HydrophobicContact CD1-CG 4.03Å; L166-I273 HydrophobicContact CD2-CG2 3.69Å
167	Q	98.1	Very high	97.3	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.028	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-28.6	174.8	75.3	-79	44.5	0	0	112.9	E99 L101 Y146 S163 R164 L165 T171	E99-Q167 PolarHBondContact OE1-NE2 3.44Å; L101-Q167 HydrophobicContact CD1-CB 4.24Å; L101-Q167 HydrophobicContact CD2-CB 4.19Å; L101-Q167 HydrophobicContact CD2-CG 4.23Å; Y146-Q167 HydrophobicContact CD1-CB 3.96Å; Y146-Q167 HydrophobicContact CD2-CB 4.33Å; Y146-Q167 HydrophobicContact CE1-CB 3.69Å; Y146-Q167 HydrophobicContact CE2-CB 4.1Å; Y146-Q167 HydrophobicContact CG-CB 4.26Å; S163-Q167 PolarHBondContact O-NE2 3.11Å; R164-Q167 PolarHBondContact O-NE2 2.86Å; R164-Q167 PolarHBondContact O-OE1 3.31Å; R164-Q167 VanDerWaalsContact O-OE1 3.09Å; L165-Q167 VanDerWaalsContact C-N 3.32Å; L165-Q167 VanDerWaalsContact C-OE1 3.23Å; L165-Q167 VanDerWaalsContact N-OE1 3.12Å; L165-Q167 PolarHBondContact O-N 2.58Å; Q167-T171 WeakPolarHBondContact O-CB 3.39Å; Q167-T171 PolarHBondContact O-N 2.86Å; Q167-T171 PolarHBondContact O-OG1 2.96Å
168	H	97.9	Very high	97	Very high	103 Å²	103	29.3 Å²	29.3	48%	0.477	14%	0.141	S	C	.	.	H	α-helix	trans	-71.9	-47.3	176	-62.8	77	0	0	0	110.4	R164 L165 L166 V170 T171 E172	R164-H168 PolarHBondContact O-CE1 2.88Å; R164-H168 PolarHBondContact O-ND1 2.86Å; R164-H168 VanDerWaalsContact O-ND1 3.07Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 2.85Å; L166-H168 PolarHBondContact O-N 3.15Å; H168-V170 VanDerWaalsContact C-N 3.33Å; H168-V170 PolarHBondContact O-N 2.94Å; H168-T171 WeakPolarHBondContact O-CB 3.46Å; H168-T171 PolarHBondContact O-N 2.74Å; H168-T171 VanDerWaalsContact O-N 3.13Å; H168-E172 WeakPolarHBondContact O-CG 3.19Å; H168-E172 PolarHBondContact O-N 3.01Å
169	H	98.5	Very high	96.6	Very high	17 Å²	17	32.4 Å²	32.4	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-45.1	173.7	-73.6	-65.6	0	0	0	111.9	L165 L166 T171 E172 Q173 A248 Q255	L165-H169 PolarHBondContact O-CD2 3.15Å; L165-H169 PolarHBondContact O-N 2.83Å; L166-H169 PolarHBondContact O-N 3.35Å; H169-T171 VanDerWaalsContact C-N 3.31Å; H169-T171 PolarHBondContact O-N 2.89Å; H169-E172 PolarHBondContact O-N 2.95Å; H169-Q173 VanDerWaalsContact O-CG 3.27Å; H169-Q173 WeakPolarHBondContact O-CG 3.14Å; H169-Q173 PolarHBondContact O-N 2.83Å; H169-A248 HydrophobicContact CB-CB 3.89Å; H169-Q255 PolarHBondContact CE1-OE1 2.82Å; H169-Q255 PolarHBondContact NE2-OE1 2.83Å
170	V	98.4	Very high	96.2	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-56.1	-48.8	174.4	162.9	0	0	0	0	110.6	Y146 L166 H168 E172 Q173 L174 L245 A248 I273 I275	Y146-V170 HydrophobicContact CE2-CG2 4.29Å; L166-V170 WeakPolarHBondContact O-CG2 3.12Å; L166-V170 PolarHBondContact O-N 2.82Å; H168-V170 VanDerWaalsContact C-N 3.33Å; H168-V170 PolarHBondContact O-N 2.94Å; V170-E172 PolarHBondContact O-N 3.44Å; V170-Q173 PolarHBondContact O-N 3.08Å; V170-L174 HydrophobicContact CG1-CD1 3.94Å; V170-L174 HydrophobicContact CG1-CG 4.48Å; V170-L174 WeakPolarHBondContact O-CB 3.33Å; V170-L174 VanDerWaalsContact O-CG 3.27Å; V170-L174 WeakPolarHBondContact O-CG 3.47Å; V170-L174 PolarHBondContact O-N 2.83Å; V170-L245 HydrophobicContact CG1-CD2 4.2Å; V170-L245 HydrophobicContact CG2-CD2 3.94Å; V170-A248 HydrophobicContact CB-CB 4.42Å; V170-A248 HydrophobicContact CG2-CB 3.76Å; V170-I273 HydrophobicContact CG2-CD1 3.94Å; V170-I275 HydrophobicContact CG1-CD1 3.3Å; V170-I275 HydrophobicContact CG2-CD1 4.47Å
171	T	97.6	Very high	95.8	Very high	21 Å²	21	34.3 Å²	34.3	13%	0.129	17%	0.167	C	C	.	.	H	α-helix	trans	-58.8	-51.3	178.9	-61.4	0	0	0	0	110.2	V103 Q167 H168 H169 Q173 L174 Q175	V103-T171 HydrophobicContact CG2-CG2 4.45Å; Q167-T171 WeakPolarHBondContact O-CB 3.39Å; Q167-T171 PolarHBondContact O-N 2.86Å; Q167-T171 PolarHBondContact O-OG1 2.96Å; H168-T171 WeakPolarHBondContact O-CB 3.46Å; H168-T171 PolarHBondContact O-N 2.74Å; H168-T171 VanDerWaalsContact O-N 3.13Å; H169-T171 VanDerWaalsContact C-N 3.31Å; H169-T171 PolarHBondContact O-N 2.89Å; T171-Q173 PolarHBondContact O-N 2.89Å; T171-L174 PolarHBondContact O-N 2.96Å; T171-L174 VanDerWaalsContact O-N 3.1Å; T171-Q175 HydrophobicContact CG2-CG 4.39Å; T171-Q175 VanDerWaalsContact O-CG 3.29Å; T171-Q175 WeakPolarHBondContact O-CG 3.37Å; T171-Q175 PolarHBondContact O-N 3.01Å
172	E	96.7	Very high	95.2	Very high	103 Å²	103	38.7 Å²	38.7	48%	0.481	19%	0.186	S	C	.	.	H	α-helix	trans	-54.8	-47.3	179.3	-72.2	-174.1	153	0	0	112.6	H168 H169 V170 L174 Q175	H168-E172 WeakPolarHBondContact O-CG 3.19Å; H168-E172 PolarHBondContact O-N 3.01Å; H169-E172 PolarHBondContact O-N 2.95Å; V170-E172 PolarHBondContact O-N 3.44Å; E172-L174 VanDerWaalsContact C-N 3.32Å; E172-L174 PolarHBondContact O-N 2.99Å; E172-Q175 WeakPolarHBondContact O-CB 3.37Å; E172-Q175 PolarHBondContact O-N 3.1Å
173	Q	97.3	Very high	94.5	Very high	46 Å²	46	42.5 Å²	42.5	22%	0.215	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-35.5	178.2	-62.2	-62.4	-38.7	0	0	112.2	H169 V170 T171 A244 A248	H169-Q173 VanDerWaalsContact O-CG 3.27Å; H169-Q173 WeakPolarHBondContact O-CG 3.14Å; H169-Q173 PolarHBondContact O-N 2.83Å; V170-Q173 PolarHBondContact O-N 3.08Å; T171-Q173 PolarHBondContact O-N 2.89Å; Q173-A244 HydrophobicContact CB-CB 3.75Å; Q173-A244 WeakPolarHBondContact CB-O 3.39Å; Q173-A244 WeakPolarHBondContact CG-O 3.41Å; Q173-A248 HydrophobicContact CG-CB 4.05Å
174	L	96.3	Very high	93.5	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-71.6	-29.2	175.7	-68.3	177.6	0	0	0	112.6	V103 V170 T171 E172 D176 I177 V178 V241 A244 L277	V103-L174 HydrophobicContact CG1-CB 3.76Å; V103-L174 HydrophobicContact CG2-CB 4.05Å; V103-L174 HydrophobicContact CG2-CD1 4.09Å; V170-L174 HydrophobicContact CG1-CD1 3.94Å; V170-L174 HydrophobicContact CG1-CG 4.48Å; V170-L174 WeakPolarHBondContact O-CB 3.33Å; V170-L174 VanDerWaalsContact O-CG 3.27Å; V170-L174 WeakPolarHBondContact O-CG 3.47Å; V170-L174 PolarHBondContact O-N 2.83Å; T171-L174 PolarHBondContact O-N 2.96Å; T171-L174 VanDerWaalsContact O-N 3.1Å; E172-L174 VanDerWaalsContact C-N 3.32Å; E172-L174 PolarHBondContact O-N 2.99Å; L174-D176 PolarHBondContact O-N 2.64Å; L174-I177 HydrophobicContact CD2-CD1 4Å; L174-I177 HydrophobicContact CD2-CG1 4.41Å; L174-I177 WeakPolarHBondContact O-CG1 3.19Å; L174-I177 PolarHBondContact O-N 3.37Å; L174-I177 VanDerWaalsContact O-N 3.13Å; L174-V178 WeakPolarHBondContact O-CB 3.44Å; L174-V178 PolarHBondContact O-N 2.99Å; L174-V241 HydrophobicContact CD2-CG1 4.29Å; L174-A244 HydrophobicContact CD2-CB 3.99Å; L174-L277 HydrophobicContact CD1-CD2 4.36Å; L174-L277 HydrophobicContact CD2-CD2 4.2Å
175	Q	94.7	Very high	92.5	Very high	48 Å²	48	46.9 Å²	46.9	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-32.8	178.3	-67.9	180	-1	0	0	112.2	V103 K104 T171 E172 I177 V178	V103-Q175 HydrophobicContact CG1-CB 4.44Å; V103-Q175 HydrophobicContact CG1-CG 3.94Å; K104-Q175 WeakPolarHBondContact O-CG 3.3Å; T171-Q175 HydrophobicContact CG2-CG 4.39Å; T171-Q175 VanDerWaalsContact O-CG 3.29Å; T171-Q175 WeakPolarHBondContact O-CG 3.37Å; T171-Q175 PolarHBondContact O-N 3.01Å; E172-Q175 WeakPolarHBondContact O-CB 3.37Å; E172-Q175 PolarHBondContact O-N 3.1Å; Q175-I177 PolarHBondContact O-N 3.44Å; Q175-V178 WeakPolarHBondContact O-CG1 3.34Å
176	D	91	Very high	91.5	Very high	107 Å²	107	49.4 Å²	49.4	57%	0.572	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.5	-179.7	-70.6	-16.5	0	0	0	112.6	L174	L174-D176 PolarHBondContact O-N 2.64Å
177	I	92.6	Very high	90.7	Very high	24 Å²	24	53.6 Å²	53.6	12%	0.123	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-6.5	-176.5	63	168.8	0	0	0	113.9	L174 Q175 D179 I180 L181 L240 V241 A244	L174-I177 HydrophobicContact CD2-CD1 4Å; L174-I177 HydrophobicContact CD2-CG1 4.41Å; L174-I177 WeakPolarHBondContact O-CG1 3.19Å; L174-I177 PolarHBondContact O-N 3.37Å; L174-I177 VanDerWaalsContact O-N 3.13Å; Q175-I177 PolarHBondContact O-N 3.44Å; I177-D179 VanDerWaalsContact C-N 3.3Å; I177-D179 PolarHBondContact O-N 2.77Å; I177-I180 WeakPolarHBondContact O-CB 3.49Å; I177-I180 PolarHBondContact O-N 2.95Å; I177-L181 HydrophobicContact CD1-CD1 3.85Å; I177-L181 HydrophobicContact CD1-CD2 4.49Å; I177-L181 HydrophobicContact CD1-CG 4.28Å; I177-L181 HydrophobicContact CG1-CD1 3.93Å; I177-L181 HydrophobicContact CG1-CG 4.28Å; I177-L181 WeakPolarHBondContact O-CG 3.24Å; I177-L181 PolarHBondContact O-N 3.15Å; I177-L240 HydrophobicContact CB-CB 4.47Å; I177-L240 HydrophobicContact CB-CD1 4.33Å; I177-L240 HydrophobicContact CD1-CB 3.61Å; I177-L240 HydrophobicContact CG2-CB 4.35Å; I177-L240 HydrophobicContact CG2-CD1 4.38Å; I177-V241 HydrophobicContact CD1-CG2 4.42Å; I177-A244 HydrophobicContact CD1-CB 4.09Å
178	V	91.9	Very high	90	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-37.4	-170.2	70.7	0	0	0	0	113.6	V103 K105 V142 L174 Q175 I180 L181 K182	V103-V178 HydrophobicContact CB-CG2 4.19Å; V103-V178 HydrophobicContact CG1-CB 3.85Å; V103-V178 HydrophobicContact CG1-CG1 4.4Å; V103-V178 HydrophobicContact CG1-CG2 3.86Å; K105-V178 HydrophobicContact CB-CG1 4.29Å; V142-V178 HydrophobicContact CB-CG2 3.96Å; V142-V178 HydrophobicContact CG2-CG2 3.57Å; L174-V178 WeakPolarHBondContact O-CB 3.44Å; L174-V178 PolarHBondContact O-N 2.99Å; Q175-V178 WeakPolarHBondContact O-CG1 3.34Å; V178-I180 VanDerWaalsContact C-N 3.31Å; V178-I180 PolarHBondContact O-N 3.49Å; V178-L181 PolarHBondContact O-N 3.19Å; V178-K182 WeakPolarHBondContact O-CG 3.3Å; V178-K182 PolarHBondContact O-N 3.26Å
179	D	89.2	Confident	89.3	Confident	65 Å²	65	52.4 Å²	52.4	35%	0.348	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-35	178.7	-75.1	-9.1	0	0	0	112	K105 I177	K105-D179 WeakPolarHBondContact CD-OD2 3.31Å; K105-D179 WeakPolarHBondContact CE-OD2 3.21Å; K105-D179 WeakPolarHBondContact CG-OD2 3.33Å; K105-D179 IonicContact NZ-OD2 3.99Å; K105-D179 PolarHBondContact NZ-OD2 3.45Å; I177-D179 VanDerWaalsContact C-N 3.3Å; I177-D179 PolarHBondContact O-N 2.77Å
180	I	90.1	Very high	88.6	Confident	35 Å²	35	56.1 Å²	56.1	18%	0.179	32%	0.32	C	S	.	.	H	α-helix	trans	-68.3	-46.4	175.4	-56.4	166.4	0	0	0	108.6	I177 V178 K182 N183 P188 P189 L240	I177-I180 WeakPolarHBondContact O-CB 3.49Å; I177-I180 PolarHBondContact O-N 2.95Å; V178-I180 VanDerWaalsContact C-N 3.31Å; V178-I180 PolarHBondContact O-N 3.49Å; I180-K182 VanDerWaalsContact C-N 3.27Å; I180-K182 PolarHBondContact O-N 3.13Å; I180-N183 CarbonylContact O-C 3.48Å; I180-N183 PolarHBondContact O-N 3.49Å; I180-N183 VanDerWaalsContact O-N 3.1Å; I180-P188 HydrophobicContact CG2-CB 4.21Å; I180-P188 HydrophobicContact CG2-CG 4.1Å; I180-P189 HydrophobicContact CD1-CG 4.42Å; I180-L240 HydrophobicContact CB-CD1 4.35Å; I180-L240 HydrophobicContact CD1-CD1 4.32Å; I180-L240 HydrophobicContact CG2-CD1 3.89Å
181	L	90.1	Very high	87.8	Confident	11 Å²	11	61.1 Å²	61.1	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-32.1	-178.7	-64.3	-178.4	0	0	0	113.4	I177 V178 N183 H237 V241 L277 L278	I177-L181 HydrophobicContact CD1-CD1 3.85Å; I177-L181 HydrophobicContact CD1-CD2 4.49Å; I177-L181 HydrophobicContact CD1-CG 4.28Å; I177-L181 HydrophobicContact CG1-CD1 3.93Å; I177-L181 HydrophobicContact CG1-CG 4.28Å; I177-L181 WeakPolarHBondContact O-CG 3.24Å; I177-L181 PolarHBondContact O-N 3.15Å; V178-L181 PolarHBondContact O-N 3.19Å; L181-N183 PolarHBondContact O-N 3.35Å; L181-H237 HydrophobicContact CD2-CB 4.03Å; L181-V241 HydrophobicContact CD1-CG2 3.91Å; L181-V241 HydrophobicContact CD2-CG2 3.94Å; L181-L277 HydrophobicContact CD1-CD2 4.04Å; L181-L278 HydrophobicContact CB-CD1 3.84Å; L181-L278 WeakPolarHBondContact O-CD1 3.23Å
182	K	86.2	Confident	86.8	Confident	96 Å²	96	66.7 Å²	66.7	42%	0.417	38%	0.382	S	S	.	.	H	α-helix	trans	-66	-25.1	176.9	-77	173.8	176	-178.7	0	113.5	E140 V142 V178 I180	E140-K182 VanDerWaalsContact O-CE 3.31Å; E140-K182 WeakPolarHBondContact O-CE 3.32Å; E140-K182 PolarHBondContact O-NZ 2.85Å; V142-K182 HydrophobicContact CG2-CD 4.19Å; V142-K182 HydrophobicContact CG2-CG 3.58Å; V178-K182 WeakPolarHBondContact O-CG 3.3Å; V178-K182 PolarHBondContact O-N 3.26Å; I180-K182 VanDerWaalsContact C-N 3.27Å; I180-K182 PolarHBondContact O-N 3.13Å
183	N	83.9	Confident	85.3	Confident	80 Å²	80	65.1 Å²	65.1	43%	0.428	39%	0.393	S	S	.	.			trans	-116.3	76.5	-178.7	-168.7	-7.9	0	0	0	111.1	I180 L181 A185 V186	I180-N183 CarbonylContact O-C 3.48Å; I180-N183 PolarHBondContact O-N 3.49Å; I180-N183 VanDerWaalsContact O-N 3.1Å; L181-N183 PolarHBondContact O-N 3.35Å; N183-A185 PolarHBondContact O-N 3.35Å; N183-A185 PolarHBondContact OD1-N 2.9Å; N183-V186 WeakPolarHBondContact ND2-CG2 3.47Å; N183-V186 PolarHBondContact O-N 3.24Å
184	S	77	Confident	83	Confident	99 Å²	99	72.3 Å²	72.3	69%	0.692	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-17.7	-179.3	61.7	0	0	0	0	114.6	V186 H237	S184-V186 VanDerWaalsContact C-N 3.3Å; S184-H237 PolarHBondContact O-CE1 2.99Å
185	A	77.4	Confident	80.5	Confident	90 Å²	90	80.2 Å²	80.2	74%	0.744	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-18.8	176.6	0	0	0	0	0	113.2	N183	N183-A185 PolarHBondContact O-N 3.35Å; N183-A185 PolarHBondContact OD1-N 2.9Å
186	V	79	Confident	78.1	Confident	80 Å²	80	83.3 Å²	83.3	49%	0.485	49%	0.488	S	S	.	.	S	Bend	trans	-105.1	123.6	-179.6	179.7	0	0	0	0	108.7	N183 S184 H237	N183-V186 WeakPolarHBondContact ND2-CG2 3.47Å; N183-V186 PolarHBondContact O-N 3.24Å; S184-V186 VanDerWaalsContact C-N 3.3Å; V186-H237 PolarHBondContact O-CE1 2.85Å; V186-H237 PolarHBondContact O-NE2 3.24Å
187	L	80.3	Confident	75.5	Confident	89 Å²	89	86.6 Å²	86.6	47%	0.466	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-65.6	148.4	174.2	-70.4	175.8	0	0	0	110.5	K234	L187-K234 HydrophobicContact CD1-CB 4.25Å; L187-K234 HydrophobicContact CD1-CD 4.03Å; L187-K234 HydrophobicContact CD1-CG 3.91Å
188	P	84.9	Confident	73	Confident	18 Å²	18	93.7 Å²	93.7	12%	0.117	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-49.8	128.7	172.7	-28.5	36.1	0	0	0	111.5	I180 T190 I235 L240	I180-P188 HydrophobicContact CG2-CB 4.21Å; I180-P188 HydrophobicContact CG2-CG 4.1Å; P188-T190 PolarHBondContact O-N 3.41Å; P188-I235 VanDerWaalsContact CD-O 3.25Å; P188-I235 WeakPolarHBondContact CD-O 3.05Å; P188-L240 HydrophobicContact CB-CD1 3.89Å; P188-L240 HydrophobicContact CB-CD2 4.23Å; P188-L240 HydrophobicContact CB-CG 4.35Å; P188-L240 HydrophobicContact CG-CD1 3.6Å; P188-L240 HydrophobicContact CG-CD2 4.38Å; P188-L240 HydrophobicContact CG-CG 4.01Å
189	P	82.6	Confident	70.3	Confident	66 Å²	66	99.2 Å²	99.2	43%	0.429	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-66.8	133.3	176.2	28.4	-34.4	0	0	0	109.9	I180 C191 L192	I180-P189 HydrophobicContact CD1-CG 4.42Å; P189-C191 VanDerWaalsContact C-N 3.28Å; P189-C191 PolarHBondContact O-N 2.92Å; P189-L192 HydrophobicContact CG-CD2 3.78Å
190	T	83.8	Confident	67.9	Low	95 Å²	95	102.1 Å²	102.1	58%	0.583	59%	0.594	S	S	*	*	S	Bend	trans	-64.8	-34.4	177.3	-60.5	0	0	0	0	112.4	P188 E232	P188-T190 PolarHBondContact O-N 3.41Å; T190-E232 WeakPolarHBondContact CB-OE1 3.4Å; T190-E232 PolarHBondContact OG1-OE1 3.22Å
191	C	80.9	Confident	65.6	Low	105 Å²	105	104.6 Å²	104.6	71%	0.709	62%	0.62	S	S	*	*	S	Bend	trans	-128.5	128.3	171.8	-62.1	0	0	0	0	108.3	P189	P189-C191 VanDerWaalsContact C-N 3.28Å; P189-C191 PolarHBondContact O-N 2.92Å
192	L	76.4	Confident	63	Low	139 Å²	139	111.9 Å²	111.9	73%	0.728	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-67.1	133.5	166.3	-62.2	172.9	0	0	0	108.2	P189	P189-L192 HydrophobicContact CG-CD2 3.78Å
193	G	66	Low	60.5	Low	69 Å²	69	113.3 Å²	113.3	71%	0.711	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-69.5	152.1	175.8	0	0	0	0	0	111.3	E195	G193-E195 PolarHBondContact O-N 2.93Å
194	E	49.2	Very low	58.2	Low	197 Å²	197	120.3 Å²	120.3	92%	0.921	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-64.8	127	159.6	-70.1	177.2	168.3	0	0	107.4
195	E	44.2	Very low	56.2	Low	169 Å²	169	121.9 Å²	121.9	79%	0.79	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-51.7	128	172.7	-72.3	-75.3	126.3	0	0	108.7	G193 E197	G193-E195 PolarHBondContact O-N 2.93Å; E195-E197 PolarHBondContact O-N 3.14Å
196	P	43.4	Very low	54.2	Low	113 Å²	113	125.6 Å²	125.6	73%	0.734	71%	0.714	S	S	*	*			trans	-65.3	114.1	179.9	24	-30	0	0	0	109.2	N198	P196-N198 PolarHBondContact O-N 3.16Å
197	E	37.3	Very low	52.2	Low	175 Å²	175	126.9 Å²	126.9	82%	0.818	72%	0.722	S	S	*	*			trans	-54.3	123.7	167.3	-77.3	-170.3	155.2	0	0	109	E195 T199	E195-E197 PolarHBondContact O-N 3.14Å; E197-T199 VanDerWaalsContact C-N 3.34Å; E197-T199 PolarHBondContact O-N 3.43Å; E197-T199 PolarHBondContact O-OG1 3.36Å
198	N	39.1	Very low	50.5	Low	174 Å²	174	135 Å²	135	93%	0.93	75%	0.747	S	S	*	*			trans	-52.6	94.4	172.4	-85.5	-36.3	0	0	0	110.5	P196	P196-N198 PolarHBondContact O-N 3.16Å
199	T	36	Very low	48.2	Very low	119 Å²	119	138.5 Å²	138.5	73%	0.73	78%	0.776	S	S	*	*			trans	-107.3	129.3	164	28.3	0	0	0	0	108.4	E197 A201	E197-T199 VanDerWaalsContact C-N 3.34Å; E197-T199 PolarHBondContact O-N 3.43Å; E197-T199 PolarHBondContact O-OG1 3.36Å; T199-A201 PolarHBondContact O-N 3.39Å
200	P	37.9	Very low	46	Very low	125 Å²	125	139.8 Å²	139.8	81%	0.812	79%	0.793	S	S	*	*			trans	-69.4	133.4	-176	28.2	-31.3	0	0	0	110.1	N202	P200-N202 PolarHBondContact O-N 3.37Å
201	A	41.2	Very low	44	Very low	88 Å²	88	140.5 Å²	140.5	73%	0.727	80%	0.802	S	S	*	*	S	Bend	trans	2.6	105	166.3	0	0	0	0	0	117.3	T199	T199-A201 PolarHBondContact O-N 3.39Å
202	N	36.7	Very low	42.1	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	81%	0.809	S	S	*	*				161	91.1	127.1	-85.9	-24.1	0	0	0	110.2	P200	P200-N202 PolarHBondContact O-N 3.37Å
203	S	33.9	Very low	40.3	Very low	125 Å²	125	148.5 Å²	148.5	87%	0.874	82%	0.819	S	S	*	*			trans	-172.9	153.1	140.3	-156.2	0	0	0	0	110.6
204	R	35.7	Very low	38.9	Very low	227 Å²	227	149 Å²	149	86%	0.857	82%	0.823	S	S	*	*			trans	-62.8	143.2	-167.9	-68.5	164.2	171.8	164.4	-3.7	113.2	L206	R204-L206 PolarHBondContact O-N 2.87Å
205	T	34.2	Very low	38.2	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	82%	0.819	S	S	*	*			trans	-37.1	114.7	168	-37.2	0	0	0	0	112.8
206	L	35.3	Very low	38.1	Very low	168 Å²	168	142.9 Å²	142.9	88%	0.88	83%	0.827	S	S	*	*			trans	-115.9	85.8	167.4	-91.9	160.6	0	0	0	108.7	R204 R208	R204-L206 PolarHBondContact O-N 2.87Å; L206-R208 PolarHBondContact O-N 2.76Å
207	T	36.8	Very low	37.8	Very low	108 Å²	108	141 Å²	141	66%	0.663	83%	0.828	S	S	*	*			trans	-66.4	119.8	167.6	-14.9	0	0	0	0	108	A209	T207-A209 PolarHBondContact O-N 2.91Å
208	R	44.2	Very low	37.8	Very low	260 Å²	260	137.1 Å²	137.1	98%	0.981	83%	0.826	S	S	*	*	S	Bend	trans	-72.9	64.5	174.4	-158.7	178	-173.6	176.1	1.6	110	L206	L206-R208 PolarHBondContact O-N 2.76Å
209	A	38.3	Very low	38.1	Very low	90 Å²	90	135.6 Å²	135.6	74%	0.744	83%	0.826	S	S	*	*			trans	-142.9	27.8	170.7	0	0	0	0	0	110.4	T207	T207-A209 PolarHBondContact O-N 2.91Å
210	A	35.2	Very low	38.4	Very low	93 Å²	93	133.2 Å²	133.2	77%	0.769	83%	0.825	S	S	*	*			trans	-123.5	60.3	175.6	0	0	0	0	0	110.1
211	S	42.3	Very low	38.5	Very low	111 Å²	111	132 Å²	132	78%	0.776	82%	0.82	S	S	*	*	S	Bend	trans	-134.2	123.1	150.8	-139.8	0	0	0	0	104.9
212	L	40	Very low	38.9	Very low	163 Å²	163	134.3 Å²	134.3	85%	0.853	83%	0.827	S	S	*	*			trans	94.3	58.3	-169.6	-47.9	169.9	0	0	0	115.9
213	R	39.3	Very low	39.4	Very low	249 Å²	249	131.3 Å²	131.3	94%	0.94	82%	0.819	S	S	*	*			trans	-123.4	123.1	136.2	-71.6	-167.4	-148.7	-128.2	3.3	108.4	G215	R213-G215 PolarHBondContact O-N 2.94Å
214	G	37.1	Very low	40	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.2	125.8	-177.7	0	0	0	0	0	111.7
215	G	34.6	Very low	40.7	Very low	81 Å²	81	126.2 Å²	126.2	84%	0.835	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70	121.7	156.6	0	0	0	0	0	108.3	R213 G217	R213-G215 PolarHBondContact O-N 2.94Å; G215-G217 PolarHBondContact O-N 3.2Å
216	V	41.3	Very low	41.4	Very low	157 Å²	157	125.4 Å²	125.4	95%	0.952	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.5	120.2	170.4	-164.9	0	0	0	0	107.4
217	G	37.1	Very low	42.3	Very low	74 Å²	74	122.7 Å²	122.7	76%	0.763	80%	0.798	S	S	*	*			trans	113	93.9	158.1	0	0	0	0	0	117.5	G215	G215-G217 PolarHBondContact O-N 3.2Å
218	A	38.3	Very low	43.4	Very low	94 Å²	94	127.5 Å²	127.5	78%	0.777	80%	0.803	S	S	*	*			trans	-171.1	128.3	132.2	0	0	0	0	0	109.1
219	P	44	Very low	43.9	Very low	141 Å²	141	124.1 Å²	124.1	92%	0.916	80%	0.796	S	S	*	*			trans	-80.9	122.5	177	31.5	-28.3	0	0	0	109.5
220	G	42.7	Very low	45.1	Very low	69 Å²	69	128.3 Å²	128.3	71%	0.711	80%	0.798	S	S	*	*			trans	130	78.2	168.3	0	0	0	0	0	114.2
221	S	40.2	Very low	46.9	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	80%	0.8	S	S	*	*			trans	-164.8	112.3	152.3	-82.2	0	0	0	0	109.4	S223	S221-S223 PolarHBondContact O-N 3.47Å
222	P	50.1	Low	48.6	Very low	136 Å²	136	131.7 Å²	131.7	88%	0.883	80%	0.795	S	S	*	*	S	Bend	trans	-87	76.3	177.2	33.9	-29.7	0	0	0	109.7
223	S	46.7	Very low	50.7	Low	101 Å²	101	132 Å²	132	71%	0.706	79%	0.789	S	S	*	*			trans	-175.9	41.4	169.8	48.2	0	0	0	0	114.7	S221 P225	S221-S223 PolarHBondContact O-N 3.47Å; S223-P225 VanDerWaalsContact O-CD 3.28Å; S223-P225 WeakPolarHBondContact O-CD 3.32Å
224	T	46.8	Very low	52.8	Low	133 Å²	133	128 Å²	128	82%	0.816	78%	0.778	S	S	*	*			trans	-80.7	113.2	162.2	31.1	0	0	0	0	109.3
225	P	50.8	Low	55.4	Low	111 Å²	111	127.1 Å²	127.1	72%	0.721	76%	0.755	S	S	*	*			trans	-64.9	147.7	173.9	28.2	-32.8	0	0	0	109.3	S223	S223-P225 VanDerWaalsContact O-CD 3.28Å; S223-P225 WeakPolarHBondContact O-CD 3.32Å
226	P	48.9	Very low	58.1	Low	116 Å²	116	126.1 Å²	126.1	75%	0.753	73%	0.734	S	S	*	*			trans	-60.8	142.4	-178.1	23.7	-31	0	0	0	110.5	R228	P226-R228 PolarHBondContact O-N 3.32Å
227	T	54.5	Low	60.5	Low	111 Å²	111	120 Å²	120	68%	0.681	70%	0.695	S	S	*	*			trans	-48.5	109.3	170.9	38.9	0	0	0	0	109.4	F229	T227-F229 PolarHBondContact O-N 2.72Å
228	R	58.7	Low	63.2	Low	208 Å²	208	118.8 Å²	118.8	79%	0.785	67%	0.669	S	S	*	*			trans	-63	119.7	171.2	-71.6	-174.5	-175.7	-164.5	1.9	107.3	P226 F230	P226-R228 PolarHBondContact O-N 3.32Å; R228-F230 VanDerWaalsContact C-N 3.34Å; R228-F230 HydrophobicContact CB-CD2 3.84Å; R228-F230 HydrophobicContact CB-CE2 3.64Å; R228-F230 HydrophobicContact CG-CE2 4.46Å; R228-F230 PolarHBondContact O-N 2.79Å
229	F	54.8	Low	66	Low	190 Å²	190	117.2 Å²	117.2	83%	0.833	65%	0.652	S	S	*	*			trans	-62.5	96	170.3	-66.5	-87.9	0	0	0	108.4	T227 T231	T227-F229 PolarHBondContact O-N 2.72Å; F229-T231 PolarHBondContact O-N 2.87Å
230	F	62.8	Low	68.4	Low	178 Å²	178	112.3 Å²	112.3	78%	0.781	62%	0.618	S	S	*	*			trans	-91.7	88.3	167.7	-81.8	-83.7	0	0	0	107.7	R228	R228-F230 VanDerWaalsContact C-N 3.34Å; R228-F230 HydrophobicContact CB-CD2 3.84Å; R228-F230 HydrophobicContact CB-CE2 3.64Å; R228-F230 HydrophobicContact CG-CE2 4.46Å; R228-F230 PolarHBondContact O-N 2.79Å
231	T	74.1	Confident	71	Confident	131 Å²	131	109 Å²	109	80%	0.804	58%	0.584	S	S	*	*			trans	-88.7	112.7	163.9	49.8	0	0	0	0	108.1	F229	F229-T231 PolarHBondContact O-N 2.87Å
232	E	77.4	Confident	73.8	Confident	144 Å²	144	106 Å²	106	67%	0.673	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-76.4	128.1	175.8	-169.9	167.1	-144.7	0	0	110.1	T190	T190-E232 WeakPolarHBondContact CB-OE1 3.4Å; T190-E232 PolarHBondContact OG1-OE1 3.22Å
233	K	83.8	Confident	76.1	Confident	168 Å²	168	100.7 Å²	100.7	73%	0.73	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-78	127.2	179.5	-177	179.9	176.5	-175.3	0	109.1	I235	K233-I235 HydrophobicContact CB-CD1 4.45Å; K233-I235 HydrophobicContact CD-CD1 3.93Å; K233-I235 HydrophobicContact CG-CD1 3.98Å; K233-I235 PolarHBondContact O-N 3.28Å
234	K	85	Confident	78.6	Confident	165 Å²	165	96.2 Å²	96.2	72%	0.717	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-70.1	124.4	170	-63.4	-175.6	178.8	-177.1	0	109.5	L187	L187-K234 HydrophobicContact CD1-CB 4.25Å; L187-K234 HydrophobicContact CD1-CD 4.03Å; L187-K234 HydrophobicContact CD1-CG 3.91Å
235	I	89.9	Confident	81	Confident	60 Å²	60	90 Å²	90	31%	0.308	46%	0.46	S	S	.	.			trans	-104.5	119.4	178.5	-56.3	-57.9	0	0	0	108.8	P188 K233 C239	P188-I235 VanDerWaalsContact CD-O 3.25Å; P188-I235 WeakPolarHBondContact CD-O 3.05Å; K233-I235 HydrophobicContact CB-CD1 4.45Å; K233-I235 HydrophobicContact CD-CD1 3.93Å; K233-I235 HydrophobicContact CG-CD1 3.98Å; K233-I235 PolarHBondContact O-N 3.28Å; I235-C239 HydrophobicContact CG2-CB 3.8Å
236	P	91.7	Very high	83.3	Confident	61 Å²	61	88.9 Å²	88.9	40%	0.396	45%	0.446	S	S	.	.			trans	-63.9	151.2	172.6	-19.8	31.6	0	0	0	112	E238 C239	P236-E238 WeakPolarHBondContact CB-OE2 3.37Å; P236-E238 PolarHBondContact O-N 2.9Å; P236-C239 WeakPolarHBondContact O-CB 3.33Å; P236-C239 PolarHBondContact O-N 2.66Å; P236-C239 VanDerWaalsContact O-N 3.09Å
237	H	91.8	Very high	85.7	Confident	28 Å²	28	85.6 Å²	85.6	13%	0.13	43%	0.425	C	S	.	.	H	α-helix	trans	-60.2	-34	178.2	-72.5	90.1	0	0	0	112.3	L181 S184 V186 C239 L240 V241	L181-H237 HydrophobicContact CD2-CB 4.03Å; S184-H237 PolarHBondContact O-CE1 2.99Å; V186-H237 PolarHBondContact O-CE1 2.85Å; V186-H237 PolarHBondContact O-NE2 3.24Å; H237-C239 PolarHBondContact O-N 3.38Å; H237-L240 VanDerWaalsContact O-CB 3.32Å; H237-L240 WeakPolarHBondContact O-CB 3.49Å; H237-L240 PolarHBondContact O-N 3.18Å; H237-V241 PolarHBondContact O-N 2.8Å
238	E	94.9	Very high	87.8	Confident	48 Å²	48	80.3 Å²	80.3	22%	0.224	39%	0.393	C	S	.	.	H	α-helix	trans	-59.9	-33.7	178	-60	78.8	-172.4	0	0	111.8	P236 L240 V241 I242 K280 Y282 I418	P236-E238 WeakPolarHBondContact CB-OE2 3.37Å; P236-E238 PolarHBondContact O-N 2.9Å; E238-L240 VanDerWaalsContact C-N 3.26Å; E238-L240 PolarHBondContact O-N 3.5Å; E238-V241 PolarHBondContact O-N 2.56Å; E238-I242 VanDerWaalsContact O-CG1 3.3Å; E238-I242 WeakPolarHBondContact O-CG1 3.33Å; E238-I242 PolarHBondContact O-N 2.81Å; E238-K280 HydrophobicContact CG-CD 4.1Å; E238-K280 IonicContact OE1-NZ 3.68Å; E238-K280 PolarHBondContact OE1-NZ 3.33Å; E238-Y282 HydrophobicContact CB-CE1 4.26Å; E238-I418 HydrophobicContact CB-CD1 3.62Å; E238-I418 HydrophobicContact CG-CD1 4.06Å
239	C	95.8	Very high	89.7	Confident	61 Å²	61	70.4 Å²	70.4	41%	0.412	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-29.1	176.5	-66.7	0	0	0	0	112.3	I235 P236 H237 G243	I235-C239 HydrophobicContact CG2-CB 3.8Å; P236-C239 WeakPolarHBondContact O-CB 3.33Å; P236-C239 PolarHBondContact O-N 2.66Å; P236-C239 VanDerWaalsContact O-N 3.09Å; H237-C239 PolarHBondContact O-N 3.38Å; C239-G243 PolarHBondContact O-N 3.05Å
240	L	95.8	Very high	91.8	Very high	38 Å²	38	67 Å²	67	20%	0.199	34%	0.34	C	S	.	.	H	α-helix	trans	-68.1	-43.4	173.1	-58.3	-177.7	0	0	0	110.7	I177 I180 P188 H237 E238 G243 A244	I177-L240 HydrophobicContact CB-CB 4.47Å; I177-L240 HydrophobicContact CB-CD1 4.33Å; I177-L240 HydrophobicContact CD1-CB 3.61Å; I177-L240 HydrophobicContact CG2-CB 4.35Å; I177-L240 HydrophobicContact CG2-CD1 4.38Å; I180-L240 HydrophobicContact CB-CD1 4.35Å; I180-L240 HydrophobicContact CD1-CD1 4.32Å; I180-L240 HydrophobicContact CG2-CD1 3.89Å; P188-L240 HydrophobicContact CB-CD1 3.89Å; P188-L240 HydrophobicContact CB-CD2 4.23Å; P188-L240 HydrophobicContact CB-CG 4.35Å; P188-L240 HydrophobicContact CG-CD1 3.6Å; P188-L240 HydrophobicContact CG-CD2 4.38Å; P188-L240 HydrophobicContact CG-CG 4.01Å; H237-L240 VanDerWaalsContact O-CB 3.32Å; H237-L240 WeakPolarHBondContact O-CB 3.49Å; H237-L240 PolarHBondContact O-N 3.18Å; E238-L240 VanDerWaalsContact C-N 3.26Å; E238-L240 PolarHBondContact O-N 3.5Å; L240-G243 PolarHBondContact O-N 2.83Å; L240-A244 WeakPolarHBondContact O-CB 3.28Å; L240-A244 PolarHBondContact O-N 2.98Å
241	V	97.4	Very high	93.5	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-43	177.8	-177.1	0	0	0	0	110.8	L174 I177 L181 H237 E238 G243 A244 L245 L277 Y282	L174-V241 HydrophobicContact CD2-CG1 4.29Å; I177-V241 HydrophobicContact CD1-CG2 4.42Å; L181-V241 HydrophobicContact CD1-CG2 3.91Å; L181-V241 HydrophobicContact CD2-CG2 3.94Å; H237-V241 PolarHBondContact O-N 2.8Å; E238-V241 PolarHBondContact O-N 2.56Å; V241-G243 PolarHBondContact O-N 3.42Å; V241-A244 PolarHBondContact O-N 3.13Å; V241-L245 HydrophobicContact CG1-CD1 4.24Å; V241-L245 WeakPolarHBondContact O-CG 3.5Å; V241-L245 PolarHBondContact O-N 2.66Å; V241-L277 HydrophobicContact CG1-CD2 4.2Å; V241-L277 HydrophobicContact CG2-CD2 4Å; V241-Y282 HydrophobicContact CB-CD1 4.09Å; V241-Y282 HydrophobicContact CB-CE1 3.63Å; V241-Y282 HydrophobicContact CB-CE2 4.49Å; V241-Y282 HydrophobicContact CG1-CD1 3.6Å; V241-Y282 HydrophobicContact CG1-CD2 3.95Å; V241-Y282 HydrophobicContact CG1-CE1 3.59Å; V241-Y282 HydrophobicContact CG1-CE2 3.93Å; V241-Y282 HydrophobicContact CG1-CG 3.8Å; V241-Y282 HydrophobicContact CG2-CE1 4.25Å
242	I	98.5	Very high	94.7	Very high	37 Å²	37	55.2 Å²	55.2	19%	0.19	28%	0.279	C	S	.	.	H	α-helix	trans	-56.8	-51.9	174	-68.1	163.8	0	0	0	110.3	E238 A244 L245 E246 V416 I418	E238-I242 VanDerWaalsContact O-CG1 3.3Å; E238-I242 WeakPolarHBondContact O-CG1 3.33Å; E238-I242 PolarHBondContact O-N 2.81Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.05Å; I242-L245 PolarHBondContact O-N 3.02Å; I242-L245 VanDerWaalsContact O-N 3.12Å; I242-E246 HydrophobicContact CG2-CG 4.33Å; I242-E246 WeakPolarHBondContact O-CG 3.45Å; I242-E246 PolarHBondContact O-N 3.01Å; I242-V416 HydrophobicContact CG1-CB 4.08Å; I242-V416 HydrophobicContact CG1-CG1 3.92Å; I242-V416 HydrophobicContact CG2-CB 4.11Å; I242-V416 HydrophobicContact CG2-CG2 4.09Å; I242-I418 HydrophobicContact CD1-CD1 3.78Å; I242-I418 HydrophobicContact CG1-CD1 4.29Å
243	G	98.3	Very high	95.7	Very high	24 Å²	24	48.9 Å²	48.9	25%	0.247	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-34.8	-179.9	0	0	0	0	0	113.4	C239 L240 V241 S247	C239-G243 PolarHBondContact O-N 3.05Å; L240-G243 PolarHBondContact O-N 2.83Å; V241-G243 PolarHBondContact O-N 3.42Å; G243-S247 VanDerWaalsContact O-CB 3.3Å; G243-S247 WeakPolarHBondContact O-CB 3.48Å; G243-S247 PolarHBondContact O-N 3.2Å; G243-S247 PolarHBondContact O-OG 2.76Å
244	A	98.4	Very high	96.4	Very high	8 Å²	8	43.5 Å²	43.5	7%	0.066	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-42.9	173.3	0	0	0	0	0	111.7	Q173 L174 I177 L240 V241 I242 S247 A248	Q173-A244 HydrophobicContact CB-CB 3.75Å; Q173-A244 WeakPolarHBondContact CB-O 3.39Å; Q173-A244 WeakPolarHBondContact CG-O 3.41Å; L174-A244 HydrophobicContact CD2-CB 3.99Å; I177-A244 HydrophobicContact CD1-CB 4.09Å; L240-A244 WeakPolarHBondContact O-CB 3.28Å; L240-A244 PolarHBondContact O-N 2.98Å; V241-A244 PolarHBondContact O-N 3.13Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.05Å; A244-S247 PolarHBondContact O-N 2.82Å; A244-A248 WeakPolarHBondContact O-CB 3.39Å; A244-A248 PolarHBondContact O-N 2.72Å
245	L	98.8	Very high	97.1	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-45.4	177.5	-68.5	172.1	0	0	0	112.3	V170 V241 I242 S247 A248 F249 I273 I275 Y282 A284 V416	V170-L245 HydrophobicContact CG1-CD2 4.2Å; V170-L245 HydrophobicContact CG2-CD2 3.94Å; V241-L245 HydrophobicContact CG1-CD1 4.24Å; V241-L245 WeakPolarHBondContact O-CG 3.5Å; V241-L245 PolarHBondContact O-N 2.66Å; I242-L245 PolarHBondContact O-N 3.02Å; I242-L245 VanDerWaalsContact O-N 3.12Å; L245-S247 VanDerWaalsContact C-N 3.27Å; L245-S247 PolarHBondContact O-N 2.93Å; L245-A248 PolarHBondContact O-N 2.82Å; L245-F249 VanDerWaalsContact O-CD2 3.3Å; L245-F249 WeakPolarHBondContact O-CD2 3.46Å; L245-F249 PolarHBondContact O-N 2.87Å; L245-I273 HydrophobicContact CD2-CD1 3.78Å; L245-I275 HydrophobicContact CD2-CD1 3.29Å; L245-I275 HydrophobicContact CD2-CG1 4.33Å; L245-I275 HydrophobicContact CG-CD1 4.42Å; L245-Y282 HydrophobicContact CD1-CG 4.46Å; L245-A284 HydrophobicContact CD1-CB 4.38Å; L245-V416 HydrophobicContact CB-CG2 4.33Å; L245-V416 HydrophobicContact CD1-CG1 3.98Å; L245-V416 HydrophobicContact CD1-CG2 4.48Å
246	E	98.8	Very high	97.5	Very high	89 Å²	89	34.5 Å²	34.5	42%	0.416	19%	0.187	S	C	.	.	H	α-helix	trans	-58.9	-41.5	175.5	-69.8	172.2	163	0	0	111.4	I242 K250 P414 V416	I242-E246 HydrophobicContact CG2-CG 4.33Å; I242-E246 WeakPolarHBondContact O-CG 3.45Å; I242-E246 PolarHBondContact O-N 3.01Å; E246-K250 PolarHBondContact O-N 2.94Å; E246-P414 HydrophobicContact CG-CG 4.26Å; E246-V416 HydrophobicContact CG-CG2 4.48Å
247	S	98.8	Very high	97.8	Very high	47 Å²	47	35.2 Å²	35.2	33%	0.329	19%	0.185	S	C	.	.	H	α-helix	trans	-67.2	-40.2	176.6	-58.8	0	0	0	0	111.9	G243 A244 L245 F249 K250 E251	G243-S247 VanDerWaalsContact O-CB 3.3Å; G243-S247 WeakPolarHBondContact O-CB 3.48Å; G243-S247 PolarHBondContact O-N 3.2Å; G243-S247 PolarHBondContact O-OG 2.76Å; A244-S247 PolarHBondContact O-N 2.82Å; L245-S247 VanDerWaalsContact C-N 3.27Å; L245-S247 PolarHBondContact O-N 2.93Å; S247-F249 PolarHBondContact O-N 3.28Å; S247-K250 WeakPolarHBondContact O-CB 3.36Å; S247-K250 PolarHBondContact O-N 2.98Å; S247-E251 WeakPolarHBondContact O-CG 3.2Å; S247-E251 PolarHBondContact O-N 3.2Å
248	A	98.8	Very high	98	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-42	178.1	0	0	0	0	0	112.6	L166 H169 V170 Q173 A244 L245 K250 E251 M252	L166-A248 HydrophobicContact CD1-CB 4.47Å; H169-A248 HydrophobicContact CB-CB 3.89Å; V170-A248 HydrophobicContact CB-CB 4.42Å; V170-A248 HydrophobicContact CG2-CB 3.76Å; Q173-A248 HydrophobicContact CG-CB 4.05Å; A244-A248 WeakPolarHBondContact O-CB 3.39Å; A244-A248 PolarHBondContact O-N 2.72Å; L245-A248 PolarHBondContact O-N 2.82Å; A248-K250 VanDerWaalsContact C-N 3.33Å; A248-K250 PolarHBondContact O-N 3.4Å; A248-E251 PolarHBondContact O-N 3.45Å; A248-M252 WeakPolarHBondContact O-CB 3.36Å; A248-M252 PolarHBondContact O-N 3.11Å
249	F	98.9	Very high	98.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-42	175.1	-87.8	-120.7	0	0	0	111.7	L166 L245 S247 M252 D253 A271 I273 A284 A286 L392 S412 P414	L166-F249 HydrophobicContact CD1-CD2 4.14Å; L166-F249 HydrophobicContact CD1-CE2 4.48Å; L166-F249 HydrophobicContact CD2-CD2 4.42Å; L166-F249 HydrophobicContact CD2-CE2 4.04Å; L166-F249 HydrophobicContact CD2-CZ 4.2Å; L245-F249 VanDerWaalsContact O-CD2 3.3Å; L245-F249 WeakPolarHBondContact O-CD2 3.46Å; L245-F249 PolarHBondContact O-N 2.87Å; S247-F249 PolarHBondContact O-N 3.28Å; F249-M252 PolarHBondContact O-N 3.01Å; F249-D253 PolarHBondContact O-N 2.89Å; F249-A271 HydrophobicContact CD1-CB 4.36Å; F249-A271 HydrophobicContact CE1-CB 3.56Å; F249-A271 HydrophobicContact CZ-CB 4.13Å; F249-I273 HydrophobicContact CE2-CD1 3.67Å; F249-I273 HydrophobicContact CE2-CG1 3.8Å; F249-I273 HydrophobicContact CE2-CG2 4.43Å; F249-I273 HydrophobicContact CZ-CD1 4.34Å; F249-I273 HydrophobicContact CZ-CG1 3.98Å; F249-I273 HydrophobicContact CZ-CG2 4.18Å; F249-A284 HydrophobicContact CE2-CB 4.1Å; F249-A284 HydrophobicContact CZ-CB 4.16Å; F249-A286 HydrophobicContact CD1-CB 4.06Å; F249-A286 HydrophobicContact CE1-CB 3.85Å; F249-L392 HydrophobicContact CD1-CD2 4.49Å; F249-S412 WeakPolarHBondContact CB-O 3.44Å; F249-S412 WeakPolarHBondContact CD1-O 3.43Å; F249-P414 HydrophobicContact CB-CG 4.15Å; F249-P414 HydrophobicContact CD1-CB 3.89Å; F249-P414 HydrophobicContact CD1-CG 3.89Å; F249-P414 HydrophobicContact CD2-CB 4.46Å; F249-P414 HydrophobicContact CD2-CG 3.88Å; F249-P414 HydrophobicContact CE1-CB 3.8Å; F249-P414 HydrophobicContact CE1-CG 4.2Å; F249-P414 HydrophobicContact CE2-CB 4.37Å; F249-P414 HydrophobicContact CE2-CG 4.19Å; F249-P414 HydrophobicContact CG-CB 4.23Å; F249-P414 HydrophobicContact CG-CG 3.71Å; F249-P414 HydrophobicContact CZ-CB 4.05Å; F249-P414 HydrophobicContact CZ-CG 4.35Å
250	K	98.8	Very high	98	Very high	119 Å²	119	40.4 Å²	40.4	52%	0.517	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-47.7	176.2	-177.5	-175.2	174.7	-170.2	0	111.6	E246 S247 A248 M252 D253 L254	E246-K250 PolarHBondContact O-N 2.94Å; S247-K250 WeakPolarHBondContact O-CB 3.36Å; S247-K250 PolarHBondContact O-N 2.98Å; A248-K250 VanDerWaalsContact C-N 3.33Å; A248-K250 PolarHBondContact O-N 3.4Å; K250-M252 VanDerWaalsContact C-N 3.33Å; K250-M252 PolarHBondContact O-N 3.41Å; K250-D253 PolarHBondContact O-N 2.92Å; K250-L254 HydrophobicContact CG-CD1 4.13Å; K250-L254 WeakPolarHBondContact O-CB 3.4Å; K250-L254 VanDerWaalsContact O-CG 3.31Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 2.86Å
251	E	98.8	Very high	97.7	Very high	61 Å²	61	42.8 Å²	42.8	29%	0.285	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-36.5	179.3	-71.3	-54.3	131.5	0	0	112.4	S247 A248 L254 Q255 R258	S247-E251 WeakPolarHBondContact O-CG 3.2Å; S247-E251 PolarHBondContact O-N 3.2Å; A248-E251 PolarHBondContact O-N 3.45Å; E251-L254 PolarHBondContact O-N 2.88Å; E251-Q255 WeakPolarHBondContact O-CB 3.31Å; E251-Q255 PolarHBondContact O-N 2.75Å; E251-R258 IonicContact OE2-NH2 3.18Å
252	M	98.8	Very high	97.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-48	172.6	-173.7	67.8	-113.2	0	0	111.7	V161 L165 L166 A248 F249 K250 L254 Q255 I256 L392	V161-M252 HydrophobicContact CG1-CE 3.66Å; L165-M252 HydrophobicContact CB-CE 4.03Å; L165-M252 HydrophobicContact CB-SD 3.74Å; L165-M252 HydrophobicContact CD1-CE 4.4Å; L166-M252 HydrophobicContact CB-CG 4.23Å; L166-M252 HydrophobicContact CB-SD 4.16Å; L166-M252 HydrophobicContact CD1-CB 3.76Å; L166-M252 HydrophobicContact CD1-CG 4.03Å; A248-M252 WeakPolarHBondContact O-CB 3.36Å; A248-M252 PolarHBondContact O-N 3.11Å; F249-M252 PolarHBondContact O-N 3.01Å; K250-M252 VanDerWaalsContact C-N 3.33Å; K250-M252 PolarHBondContact O-N 3.41Å; M252-L254 VanDerWaalsContact C-N 3.35Å; M252-L254 PolarHBondContact O-N 2.83Å; M252-Q255 HydrophobicContact CE-CB 4.46Å; M252-Q255 PolarHBondContact O-N 2.82Å; M252-Q255 VanDerWaalsContact O-N 3.17Å; M252-I256 HydrophobicContact CE-CD1 3.9Å; M252-I256 HydrophobicContact CE-CG1 3.65Å; M252-I256 HydrophobicContact CG-CD1 4.47Å; M252-I256 WeakPolarHBondContact O-CG1 3.47Å; M252-I256 PolarHBondContact O-N 3.2Å; M252-L392 HydrophobicContact CG-CD1 3.92Å
253	D	98.9	Very high	97.4	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-40.5	178.2	-168.9	51.5	0	0	0	112	F249 K250 Q255 I256 E257 L392 G393 H395 K407 S412	F249-D253 PolarHBondContact O-N 2.89Å; K250-D253 PolarHBondContact O-N 2.92Å; D253-Q255 VanDerWaalsContact C-N 3.34Å; D253-I256 PolarHBondContact O-N 2.65Å; D253-E257 PolarHBondContact O-N 2.78Å; D253-L392 HydrophobicContact CB-CD2 3.86Å; D253-G393 PolarHBondContact OD1-N 2.94Å; D253-H395 PolarHBondContact O-NE2 2.88Å; D253-H395 IonicContact OD1-CE1 3.56Å; D253-H395 IonicContact OD1-NE2 3.93Å; D253-H395 PolarHBondContact OD1-NE2 3.22Å; D253-H395 IonicContact OD2-CE1 3.56Å; D253-H395 PolarHBondContact OD2-CE1 2.75Å; D253-H395 IonicContact OD2-NE2 3.05Å; D253-K407 VanDerWaalsContact CG-NZ 3.31Å; D253-K407 IonicContact OD1-NZ 3.14Å; D253-K407 PolarHBondContact OD1-NZ 3.44Å; D253-K407 VanDerWaalsContact OD1-NZ 3.09Å; D253-K407 IonicContact OD2-NZ 2.7Å; D253-K407 PolarHBondContact OD2-NZ 3.34Å; D253-S412 PolarHBondContact OD2-OG 2.89Å
254	L	98.6	Very high	97.2	Very high	55 Å²	55	49.3 Å²	49.3	29%	0.288	25%	0.245	S	C	.	.	H	α-helix	trans	-66.7	-33.9	174	-71.4	174.6	0	0	0	112.4	K250 E251 M252 E257 R258	K250-L254 HydrophobicContact CG-CD1 4.13Å; K250-L254 WeakPolarHBondContact O-CB 3.4Å; K250-L254 VanDerWaalsContact O-CG 3.31Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 2.86Å; E251-L254 PolarHBondContact O-N 2.88Å; M252-L254 VanDerWaalsContact C-N 3.35Å; M252-L254 PolarHBondContact O-N 2.83Å; L254-E257 PolarHBondContact O-N 2.89Å; L254-R258 WeakPolarHBondContact O-CB 3.4Å; L254-R258 VanDerWaalsContact O-CG 3.3Å; L254-R258 WeakPolarHBondContact O-CG 3.39Å; L254-R258 PolarHBondContact O-N 3.39Å; L254-R258 PolarHBondContact O-NE 2.91Å
255	Q	98.6	Very high	97.1	Very high	31 Å²	31	49.9 Å²	49.9	15%	0.145	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-45	173.2	-175.2	174	5.7	0	0	110.9	H169 E251 M252 D253 E257 R258 E259	H169-Q255 PolarHBondContact CE1-OE1 2.82Å; H169-Q255 PolarHBondContact NE2-OE1 2.83Å; E251-Q255 WeakPolarHBondContact O-CB 3.31Å; E251-Q255 PolarHBondContact O-N 2.75Å; M252-Q255 HydrophobicContact CE-CB 4.46Å; M252-Q255 PolarHBondContact O-N 2.82Å; M252-Q255 VanDerWaalsContact O-N 3.17Å; D253-Q255 VanDerWaalsContact C-N 3.34Å; Q255-E257 VanDerWaalsContact C-N 3.28Å; Q255-E257 PolarHBondContact O-N 3.2Å; Q255-R258 PolarHBondContact O-N 3.37Å; Q255-E259 HydrophobicContact CG-CG 4.12Å; Q255-E259 PolarHBondContact NE2-OE1 3.05Å; Q255-E259 WeakPolarHBondContact O-CB 2.98Å; Q255-E259 WeakPolarHBondContact O-CG 3.42Å; Q255-E259 PolarHBondContact O-N 3.01Å
256	I	98.6	Very high	96.9	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-44.7	173.7	-69.7	165.3	0	0	0	110.2	V161 M252 D253 R258 E259 R260 I265 L392	V161-I256 HydrophobicContact CG1-CG1 4.08Å; M252-I256 HydrophobicContact CE-CD1 3.9Å; M252-I256 HydrophobicContact CE-CG1 3.65Å; M252-I256 HydrophobicContact CG-CD1 4.47Å; M252-I256 WeakPolarHBondContact O-CG1 3.47Å; M252-I256 PolarHBondContact O-N 3.2Å; D253-I256 PolarHBondContact O-N 2.65Å; I256-R258 PolarHBondContact O-N 2.87Å; I256-E259 PolarHBondContact O-N 3.06Å; I256-R260 WeakPolarHBondContact O-CB 3.42Å; I256-R260 PolarHBondContact O-N 3.27Å; I256-I265 HydrophobicContact CG2-CG2 4.03Å; I256-L392 HydrophobicContact CD1-CB 3.99Å
257	E	97.8	Very high	96.7	Very high	76 Å²	76	48.6 Å²	48.6	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-59	-44.1	177.5	-166.2	178.9	-172.6	0	0	112.9	D253 L254 Q255 R260 H395	D253-E257 PolarHBondContact O-N 2.78Å; L254-E257 PolarHBondContact O-N 2.89Å; Q255-E257 VanDerWaalsContact C-N 3.28Å; Q255-E257 PolarHBondContact O-N 3.2Å; E257-R260 WeakPolarHBondContact O-CD 3.35Å; E257-R260 VanDerWaalsContact O-CG 3.28Å; E257-R260 WeakPolarHBondContact O-CG 3.16Å; E257-R260 PolarHBondContact O-NE 3.46Å; E257-R260 VanDerWaalsContact O-NE 3.14Å; E257-H395 HydrophobicContact CG-CB 4.33Å; E257-H395 IonicContact OE2-CE1 2.73Å
258	R	97.3	Very high	96.7	Very high	153 Å²	153	46.3 Å²	46.3	58%	0.577	24%	0.235	S	C	*	.	H	α-helix	trans	-70.8	-43	-179.8	-73.6	179.7	-68.8	-161.1	-1.6	111.7	E251 L254 Q255 I256	E251-R258 IonicContact OE2-NH2 3.18Å; L254-R258 WeakPolarHBondContact O-CB 3.4Å; L254-R258 VanDerWaalsContact O-CG 3.3Å; L254-R258 WeakPolarHBondContact O-CG 3.39Å; L254-R258 PolarHBondContact O-N 3.39Å; L254-R258 PolarHBondContact O-NE 2.91Å; Q255-R258 PolarHBondContact O-N 3.37Å; I256-R258 PolarHBondContact O-N 2.87Å
259	E	96.9	Very high	96.7	Very high	30 Å²	30	46.3 Å²	46.3	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-78.1	-23.9	-173.1	-73.8	-167.3	-169.6	0	0	113.3	R38 Q255 I256 S261 S262 Y263 I265	R38-E259 WeakPolarHBondContact CD-OE2 3.37Å; R38-E259 IonicContact CZ-OE2 3.19Å; R38-E259 IonicContact NE-OE1 2.68Å; R38-E259 IonicContact NE-OE2 2.78Å; R38-E259 PolarHBondContact NE-OE2 2.99Å; R38-E259 IonicContact NH2-OE1 3.35Å; R38-E259 IonicContact NH2-OE2 2.9Å; Q255-E259 HydrophobicContact CG-CG 4.12Å; Q255-E259 PolarHBondContact NE2-OE1 3.05Å; Q255-E259 WeakPolarHBondContact O-CB 2.98Å; Q255-E259 WeakPolarHBondContact O-CG 3.42Å; Q255-E259 PolarHBondContact O-N 3.01Å; I256-E259 PolarHBondContact O-N 3.06Å; E259-S261 PolarHBondContact O-N 3.28Å; E259-S261 VanDerWaalsContact O-N 3.08Å; E259-S262 PolarHBondContact O-N 3.3Å; E259-Y263 HydrophobicContact CB-CD2 4.03Å; E259-Y263 HydrophobicContact CG-CD2 4.44Å; E259-Y263 PolarHBondContact O-N 3.09Å; E259-I265 HydrophobicContact CB-CD1 3.66Å
260	R	92.6	Very high	96.7	Very high	63 Å²	63	46.4 Å²	46.4	24%	0.238	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.5	178.6	78.5	-163.9	167.4	98.8	-14.2	114.8	I256 E257 S262 Y263 I265 D396	I256-R260 WeakPolarHBondContact O-CB 3.42Å; I256-R260 PolarHBondContact O-N 3.27Å; E257-R260 WeakPolarHBondContact O-CD 3.35Å; E257-R260 VanDerWaalsContact O-CG 3.28Å; E257-R260 WeakPolarHBondContact O-CG 3.16Å; E257-R260 PolarHBondContact O-NE 3.46Å; E257-R260 VanDerWaalsContact O-NE 3.14Å; R260-S262 VanDerWaalsContact C-N 3.34Å; R260-Y263 CarbonylContact C-O 3.57Å; R260-Y263 WeakPolarHBondContact CA-O 3.47Å; R260-I265 HydrophobicContact CB-CB 4.37Å; R260-D396 IonicContact CZ-OD1 3.88Å; R260-D396 IonicContact CZ-OD2 2.64Å; R260-D396 IonicContact NH1-OD1 2.58Å; R260-D396 PolarHBondContact NH1-OD1 3.38Å; R260-D396 IonicContact NH1-OD2 3.63Å; R260-D396 PolarHBondContact NH1-OD2 3.45Å; R260-D396 IonicContact NH2-OD1 2.65Å
261	S	89	Confident	96.7	Very high	89 Å²	89	40.8 Å²	40.8	62%	0.622	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.5	175.2	-61.3	0	0	0	0	112.7	E259	E259-S261 PolarHBondContact O-N 3.28Å; E259-S261 VanDerWaalsContact O-N 3.08Å
262	S	95.4	Very high	96.7	Very high	70 Å²	70	37.9 Å²	37.9	49%	0.49	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-26.1	-178.5	-58.5	0	0	0	0	112.4	E259 R260	E259-S262 PolarHBondContact O-N 3.3Å; R260-S262 VanDerWaalsContact C-N 3.34Å
263	Y	95.6	Very high	96.7	Very high	63 Å²	63	37.9 Å²	37.9	25%	0.247	20%	0.198	C	C	.	.	S	Bend	trans	-130.9	148.5	-178	-58	-79.1	0	0	0	110.2	P36 R38 E259 R260 I265	P36-Y263 HydrophobicContact CG-CD1 4.12Å; P36-Y263 HydrophobicContact CG-CE1 4.45Å; P36-Y263 CarbonylContact O-C 3.57Å; P36-Y263 WeakPolarHBondContact O-CA 3.16Å; R38-Y263 HydrophobicContact CB-CD1 3.99Å; R38-Y263 HydrophobicContact CB-CD2 4.23Å; R38-Y263 HydrophobicContact CB-CG 3.77Å; R38-Y263 VanDerWaalsContact CD-CE2 3.5Å; R38-Y263 HydrophobicContact CG-CD2 4.38Å; R38-Y263 HydrophobicContact CG-CG 4.37Å; R38-Y263 PolarHBondContact NH1-OH 2.64Å; E259-Y263 HydrophobicContact CB-CD2 4.03Å; E259-Y263 HydrophobicContact CG-CD2 4.44Å; E259-Y263 PolarHBondContact O-N 3.09Å; R260-Y263 CarbonylContact C-O 3.57Å; R260-Y263 WeakPolarHBondContact CA-O 3.47Å; Y263-I265 VanDerWaalsContact C-N 3.28Å; Y263-I265 PolarHBondContact O-N 3.04Å
264	N	93.1	Very high	96.7	Very high	66 Å²	66	37.3 Å²	37.3	35%	0.353	20%	0.195	S	C	.	.			trans	-75.5	81.5	173.5	-172.4	15.5	0	0	0	110.6	L35 P36 L37	L35-N264 HydrophobicContact CB-CB 4.24Å; P36-N264 PolarHBondContact O-N 3.27Å; L37-N264 HydrophobicContact CD2-CB 4.31Å
265	I	96.3	Very high	96.7	Very high	20 Å²	20	34.7 Å²	34.7	10%	0.103	18%	0.181	C	C	.	.			trans	-96.5	96.5	174.4	-52.2	176.3	0	0	0	107.9	V161 I256 E259 R260 Y263	V161-I265 HydrophobicContact CG2-CD1 4.07Å; V161-I265 HydrophobicContact CG2-CG1 4.16Å; V161-I265 HydrophobicContact CG2-CG2 4.16Å; I256-I265 HydrophobicContact CG2-CG2 4.03Å; E259-I265 HydrophobicContact CB-CD1 3.66Å; R260-I265 HydrophobicContact CB-CB 4.37Å; Y263-I265 VanDerWaalsContact C-N 3.28Å; Y263-I265 PolarHBondContact O-N 3.04Å
266	S	94.7	Very high	96.7	Very high	42 Å²	42	33.4 Å²	33.4	29%	0.294	18%	0.175	S	C	.	.			trans	-81.5	152.1	-179.8	54.7	0	0	0	0	113	G157 A158	G157-S266 WeakPolarHBondContact CA-O 3.26Å; G157-S266 PolarHBondContact N-O 3.11Å; G157-S266 PolarHBondContact N-OG 3.42Å; A158-S266 PolarHBondContact N-O 3.44Å
267	G	95.8	Very high	96.5	Very high	20 Å²	20	33.4 Å²	33.4	21%	0.206	18%	0.175	C	C	.	.	S	Bend	trans	69.9	-159.2	165.4	0	0	0	0	0	115.7	H153 A154 D394	H153-G267 VanDerWaalsContact O-CA 3.25Å; H153-G267 WeakPolarHBondContact O-CA 3.47Å; A154-G267 WeakPolarHBondContact O-CA 3.39Å; A154-G267 PolarHBondContact O-N 2.81Å; G267-D394 PolarHBondContact O-N 3.23Å
268	G	98.4	Very high	96.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	177.2	172.5	0	0	0	0	0	110.2	H153 L392 D394	H153-G268 VanDerWaalsContact CE1-C 3.49Å; H153-G268 PolarHBondContact N-O 3.01Å; H153-G268 PolarHBondContact O-N 2.83Å; H153-G268 VanDerWaalsContact O-N 3.12Å; G268-L392 CarbonylContact C-O 3.51Å; G268-L392 WeakPolarHBondContact CA-O 3.4Å; G268-D394 PolarHBondContact N-OD1 3.18Å
269	C	98.8	Very high	96	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	156.2	170.7	62.4	0	0	0	0	112.3	F150 D151 A159 G391 L392	F150-C269 HydrophobicContact CB-CB 4.3Å; D151-C269 CarbonylContact O-C 3.59Å; D151-C269 WeakPolarHBondContact O-CA 3.43Å; D151-C269 WeakPolarHBondContact O-CB 3.24Å; A159-C269 HydrophobicContact CB-CB 3.87Å; C269-G391 CarbonylContact O-C 3.56Å; C269-G391 WeakPolarHBondContact O-CA 3.36Å; C269-L392 PolarHBondContact N-O 3.34Å; C269-L392 PolarHBondContact O-N 2.95Å
270	T	98.8	Very high	96	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.012	16%	0.159	C	C	.	.			trans	-69.8	164.4	158.4	76	0	0	0	0	110.1	F150 D151 A286 D288 S289 V388	F150-T270 VanDerWaalsContact CA-O 3.31Å; F150-T270 WeakPolarHBondContact CA-O 3.43Å; F150-T270 WeakPolarHBondContact CD1-O 3.42Å; D151-T270 HydrophobicContact CB-CG2 3.93Å; D151-T270 WeakPolarHBondContact CB-OG1 3.23Å; D151-T270 PolarHBondContact N-OG1 2.98Å; D151-T270 PolarHBondContact O-N 2.82Å; T270-A286 CarbonylContact C-O 3.32Å; T270-A286 WeakPolarHBondContact CA-O 3.3Å; T270-D288 VanDerWaalsContact CG2-OD1 3.28Å; T270-D288 WeakPolarHBondContact CG2-OD1 3.31Å; T270-S289 PolarHBondContact OG1-OG 3.39Å; T270-V388 HydrophobicContact CG2-CG1 4.15Å
271	A	98.8	Very high	96.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	113.7	174.4	0	0	0	0	0	110.6	F150 F249 N285 A286 L392	F150-A271 HydrophobicContact CD1-CB 3.76Å; F150-A271 HydrophobicContact CE1-CB 3.78Å; F249-A271 HydrophobicContact CD1-CB 4.36Å; F249-A271 HydrophobicContact CE1-CB 3.56Å; F249-A271 HydrophobicContact CZ-CB 4.13Å; A271-N285 CarbonylContact O-C 3.54Å; A271-A286 PolarHBondContact N-O 3.26Å; A271-A286 PolarHBondContact O-N 2.66Å; A271-L392 HydrophobicContact CB-CD1 3.97Å; A271-L392 HydrophobicContact CB-CG 4.24Å
272	L	98.9	Very high	96.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.6	172.4	173.9	62.1	0	0	0	108.6	S148 L149 V283 A284 N285 A291 L434	S148-L272 CarbonylContact C-O 3.49Å; S148-L272 WeakPolarHBondContact CA-O 3.38Å; L149-L272 HydrophobicContact CB-CB 4.47Å; L149-L272 PolarHBondContact N-O 2.83Å; L149-L272 PolarHBondContact O-N 2.89Å; L272-V283 HydrophobicContact CD1-CG1 3.8Å; L272-A284 WeakPolarHBondContact CA-O 3.25Å; L272-N285 HydrophobicContact CD1-CB 3.86Å; L272-A291 HydrophobicContact CD1-CB 4.27Å; L272-A291 HydrophobicContact CD2-CB 4.15Å; L272-L434 HydrophobicContact CD2-CB 3.93Å; L272-L434 HydrophobicContact CD2-CD2 4.28Å; L272-L434 HydrophobicContact CD2-CG 4.02Å; L272-L434 HydrophobicContact CG-CD2 4.25Å; L272-L434 HydrophobicContact CG-CG 4.44Å
273	I	98.8	Very high	96.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	151.7	176.8	75.1	163.4	0	0	0	111.7	Y146 W147 L166 V170 L245 F249 I275 V283 A284	Y146-I273 HydrophobicContact CE2-CB 4.18Å; Y146-I273 HydrophobicContact CE2-CD1 3.85Å; Y146-I273 HydrophobicContact CE2-CG2 4.37Å; Y146-I273 WeakPolarHBondContact OH-CG2 3.39Å; W147-I273 CarbonylContact O-C 3.58Å; W147-I273 VanDerWaalsContact O-CA 3.23Å; W147-I273 WeakPolarHBondContact O-CA 3.03Å; W147-I273 WeakPolarHBondContact O-CB 3.5Å; L166-I273 HydrophobicContact CD2-CG2 3.69Å; V170-I273 HydrophobicContact CG2-CD1 3.94Å; L245-I273 HydrophobicContact CD2-CD1 3.78Å; F249-I273 HydrophobicContact CE2-CD1 3.67Å; F249-I273 HydrophobicContact CE2-CG1 3.8Å; F249-I273 HydrophobicContact CE2-CG2 4.43Å; F249-I273 HydrophobicContact CZ-CD1 4.34Å; F249-I273 HydrophobicContact CZ-CG1 3.98Å; F249-I273 HydrophobicContact CZ-CG2 4.18Å; I273-I275 HydrophobicContact CD1-CD1 4.32Å; I273-I275 HydrophobicContact CD1-CG1 4.42Å; I273-V283 WeakPolarHBondContact O-CA 3.4Å; I273-A284 HydrophobicContact CD1-CB 4.44Å; I273-A284 HydrophobicContact CG1-CB 3.79Å; I273-A284 PolarHBondContact N-O 2.77Å; I273-A284 PolarHBondContact O-N 2.78Å
274	V	98.8	Very high	97	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.6	172.8	179	0	0	0	0	108.9	Y146 W147 L281 Y282 V283 L432 L434	Y146-V274 WeakPolarHBondContact CA-O 3.18Å; W147-V274 HydrophobicContact CB-CB 4.36Å; W147-V274 HydrophobicContact CE3-CB 4.08Å; W147-V274 HydrophobicContact CE3-CG1 3.94Å; W147-V274 HydrophobicContact CZ3-CG1 4.28Å; W147-V274 PolarHBondContact N-O 3.3Å; W147-V274 PolarHBondContact O-N 2.91Å; V274-L281 HydrophobicContact CG1-CD2 4.21Å; V274-Y282 CarbonylContact C-O 3.59Å; V274-Y282 VanDerWaalsContact CA-O 3.31Å; V274-Y282 WeakPolarHBondContact CA-O 3.45Å; V274-V283 HydrophobicContact CG1-CG2 4.41Å; V274-V283 HydrophobicContact CG2-CB 4.38Å; V274-V283 HydrophobicContact CG2-CG1 4.05Å; V274-V283 HydrophobicContact CG2-CG2 4Å; V274-L432 HydrophobicContact CB-CD2 4.48Å; V274-L432 HydrophobicContact CG1-CD2 3.83Å; V274-L432 HydrophobicContact CG2-CD2 4.01Å; V274-L434 HydrophobicContact CG2-CD1 4.09Å; V274-L434 HydrophobicContact CG2-CD2 3.68Å; V274-L434 HydrophobicContact CG2-CG 4.1Å
275	I	98.1	Very high	97.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.4	172.6	-58.4	-175.4	0	0	0	109.4	C144 H145 Y146 V170 L245 I273 L277 L281 Y282	C144-I275 HydrophobicContact CB-CG2 3.94Å; H145-I275 CarbonylContact O-C 3.48Å; H145-I275 VanDerWaalsContact O-CA 3.31Å; H145-I275 WeakPolarHBondContact O-CA 3.29Å; Y146-I275 HydrophobicContact CD2-CD1 4.3Å; Y146-I275 HydrophobicContact CD2-CG1 3.97Å; V170-I275 HydrophobicContact CG1-CD1 3.3Å; V170-I275 HydrophobicContact CG2-CD1 4.47Å; L245-I275 HydrophobicContact CD2-CD1 3.29Å; L245-I275 HydrophobicContact CD2-CG1 4.33Å; L245-I275 HydrophobicContact CG-CD1 4.42Å; I273-I275 HydrophobicContact CD1-CD1 4.32Å; I273-I275 HydrophobicContact CD1-CG1 4.42Å; I275-L277 HydrophobicContact CG2-CB 3.87Å; I275-L281 CarbonylContact O-C 3.6Å; I275-L281 WeakPolarHBondContact O-CA 3.49Å; I275-Y282 PolarHBondContact N-O 2.92Å; I275-Y282 PolarHBondContact O-N 3Å
276	C	97.6	Very high	97.4	Very high	3 Å²	3	10.9 Å²	10.9	2%	0.02	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	108.5	164.3	-174.3	0	0	0	0	109.4	C144 H145 W147 K280 L281 L513	C144-C276 VanDerWaalsContact CA-O 3.24Å; C144-C276 WeakPolarHBondContact CA-O 3.47Å; C144-C276 WeakPolarHBondContact CB-O 3.49Å; H145-C276 HydrophobicContact CB-CB 4.1Å; H145-C276 PolarHBondContact N-O 3.46Å; H145-C276 VanDerWaalsContact N-O 3.15Å; H145-C276 PolarHBondContact O-N 3.18Å; W147-C276 HydrophobicContact CH2-CB 4.22Å; W147-C276 HydrophobicContact CZ3-CB 3.91Å; C276-K280 CarbonylContact C-O 3.5Å; C276-K280 WeakPolarHBondContact CA-O 3.45Å; C276-L281 HydrophobicContact CB-CD2 3.66Å; C276-L513 VanDerWaalsContact SG-CD1 3.56Å
277	L	95	Very high	97.6	Very high	4 Å²	4	8.9 Å²	8.9	2%	0.021	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124	-177.7	176.2	66.1	0	0	0	109.7	V142 C144 L174 L181 V241 I275 G279 K280 Y282	V142-L277 HydrophobicContact CG1-CD1 3.46Å; V142-L277 VanDerWaalsContact CG1-CD1 3.46Å; C144-L277 HydrophobicContact CB-CB 4.18Å; C144-L277 HydrophobicContact CB-CD1 4Å; L174-L277 HydrophobicContact CD1-CD2 4.36Å; L174-L277 HydrophobicContact CD2-CD2 4.2Å; L181-L277 HydrophobicContact CD1-CD2 4.04Å; V241-L277 HydrophobicContact CG1-CD2 4.2Å; V241-L277 HydrophobicContact CG2-CD2 4Å; I275-L277 HydrophobicContact CG2-CB 3.87Å; L277-G279 PolarHBondContact O-N 2.87Å; L277-K280 PolarHBondContact N-O 3.34Å; L277-K280 PolarHBondContact O-N 3.24Å; L277-K280 VanDerWaalsContact O-N 3.12Å; L277-Y282 HydrophobicContact CB-CD2 4.42Å; L277-Y282 HydrophobicContact CB-CE2 4.17Å
278	L	92.1	Very high	97.7	Very high	93 Å²	93	9 Å²	9	49%	0.487	5%	0.047	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	49.7	176.4	-57.2	175.5	0	0	0	113.3	V142 L181 K280	V142-L278 HydrophobicContact CG1-CD2 3.98Å; V142-L278 HydrophobicContact CG1-CG 4.41Å; L181-L278 HydrophobicContact CB-CD1 3.84Å; L181-L278 WeakPolarHBondContact O-CD1 3.23Å; L278-K280 VanDerWaalsContact C-N 3.26Å; L278-K280 PolarHBondContact O-N 3.13Å
279	G	92.6	Very high	97.7	Very high	7 Å²	7	9 Å²	9	7%	0.072	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	10.9	177.9	0	0	0	0	0	114.9	L277 L421	L277-G279 PolarHBondContact O-N 2.87Å; G279-L421 VanDerWaalsContact O-CB 3.26Å; G279-L421 WeakPolarHBondContact O-CB 2.81Å; G279-L421 PolarHBondContact O-N 3.42Å
280	K	96	Very high	97.7	Very high	42 Å²	42	11.2 Å²	11.2	18%	0.183	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.7	179.9	-65.8	177.5	-179.1	134.2	0	111.4	E238 C276 L277 L278 Y282 I418 Y419 D420	E238-K280 HydrophobicContact CG-CD 4.1Å; E238-K280 IonicContact OE1-NZ 3.68Å; E238-K280 PolarHBondContact OE1-NZ 3.33Å; C276-K280 CarbonylContact C-O 3.5Å; C276-K280 WeakPolarHBondContact CA-O 3.45Å; L277-K280 PolarHBondContact N-O 3.34Å; L277-K280 PolarHBondContact O-N 3.24Å; L277-K280 VanDerWaalsContact O-N 3.12Å; L278-K280 VanDerWaalsContact C-N 3.26Å; L278-K280 PolarHBondContact O-N 3.13Å; K280-Y282 HydrophobicContact CB-CD2 4.34Å; K280-Y282 HydrophobicContact CB-CE2 3.67Å; K280-I418 HydrophobicContact CB-CG2 4.25Å; K280-I418 HydrophobicContact CD-CG2 4.19Å; K280-I418 HydrophobicContact CG-CG2 4.47Å; K280-Y419 WeakPolarHBondContact CA-O 3.47Å; K280-D420 WeakPolarHBondContact CE-OD2 3.41Å; K280-D420 HydrophobicContact CG-CB 4.38Å
281	L	98.4	Very high	97.7	Very high	6 Å²	6	11.1 Å²	11.1	3%	0.031	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.5	166.6	-58.9	176.5	0	0	0	109	V274 I275 C276 I418 Y419 L421 L432 L507	V274-L281 HydrophobicContact CG1-CD2 4.21Å; I275-L281 CarbonylContact O-C 3.6Å; I275-L281 WeakPolarHBondContact O-CA 3.49Å; C276-L281 HydrophobicContact CB-CD2 3.66Å; L281-I418 CarbonylContact O-C 3.46Å; L281-I418 WeakPolarHBondContact O-CA 3.31Å; L281-Y419 HydrophobicContact CD1-CD1 4.21Å; L281-Y419 PolarHBondContact N-O 2.87Å; L281-Y419 PolarHBondContact O-N 3.33Å; L281-L421 HydrophobicContact CD1-CD2 3.91Å; L281-L421 HydrophobicContact CD1-CG 4.42Å; L281-L421 HydrophobicContact CD2-CD1 4.08Å; L281-L421 HydrophobicContact CG-CD1 3.98Å; L281-L421 HydrophobicContact CG-CD2 4.08Å; L281-L421 HydrophobicContact CG-CG 4.04Å; L281-L432 HydrophobicContact CD1-CD2 4.16Å; L281-L507 HydrophobicContact CD1-CD2 3.7Å
282	Y	98.8	Very high	97.7	Very high	8 Å²	8	11.2 Å²	11.2	3%	0.031	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.6	170.5	-61.3	-97.8	0	0	0	107.7	E238 V241 L245 V274 I275 L277 K280 V416 R417 I418	E238-Y282 HydrophobicContact CB-CE1 4.26Å; V241-Y282 HydrophobicContact CB-CD1 4.09Å; V241-Y282 HydrophobicContact CB-CE1 3.63Å; V241-Y282 HydrophobicContact CB-CE2 4.49Å; V241-Y282 HydrophobicContact CG1-CD1 3.6Å; V241-Y282 HydrophobicContact CG1-CD2 3.95Å; V241-Y282 HydrophobicContact CG1-CE1 3.59Å; V241-Y282 HydrophobicContact CG1-CE2 3.93Å; V241-Y282 HydrophobicContact CG1-CG 3.8Å; V241-Y282 HydrophobicContact CG2-CE1 4.25Å; L245-Y282 HydrophobicContact CD1-CG 4.46Å; V274-Y282 CarbonylContact C-O 3.59Å; V274-Y282 VanDerWaalsContact CA-O 3.31Å; V274-Y282 WeakPolarHBondContact CA-O 3.45Å; I275-Y282 PolarHBondContact N-O 2.92Å; I275-Y282 PolarHBondContact O-N 3Å; L277-Y282 HydrophobicContact CB-CD2 4.42Å; L277-Y282 HydrophobicContact CB-CE2 4.17Å; K280-Y282 HydrophobicContact CB-CD2 4.34Å; K280-Y282 HydrophobicContact CB-CE2 3.67Å; Y282-V416 HydrophobicContact CD1-CG1 4.44Å; Y282-R417 WeakPolarHBondContact CA-O 3.45Å; Y282-I418 HydrophobicContact CD1-CD1 4.24Å; Y282-I418 HydrophobicContact CD1-CG1 3.73Å; Y282-I418 HydrophobicContact CE1-CD1 3.92Å; Y282-I418 HydrophobicContact CE1-CG1 3.84Å; Y282-I418 HydrophobicContact CE1-CG2 4.43Å
283	V	98.9	Very high	97.7	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.006	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	108.2	-178.7	-174	0	0	0	0	107.9	L272 I273 V274 A291 M302 V416 R417	L272-V283 HydrophobicContact CD1-CG1 3.8Å; I273-V283 WeakPolarHBondContact O-CA 3.4Å; V274-V283 HydrophobicContact CG1-CG2 4.41Å; V274-V283 HydrophobicContact CG2-CB 4.38Å; V274-V283 HydrophobicContact CG2-CG1 4.05Å; V274-V283 HydrophobicContact CG2-CG2 4Å; V283-A291 HydrophobicContact CG1-CB 3.9Å; V283-M302 HydrophobicContact CB-CB 4.44Å; V283-M302 HydrophobicContact CB-CE 4.32Å; V283-M302 HydrophobicContact CG1-CB 4.32Å; V283-M302 VanDerWaalsContact CG1-O 3.3Å; V283-M302 WeakPolarHBondContact CG1-O 3.25Å; V283-M302 HydrophobicContact CG2-CB 4.12Å; V283-M302 HydrophobicContact CG2-CE 3.68Å; V283-V416 CarbonylContact O-C 3.51Å; V283-V416 WeakPolarHBondContact O-CA 3.31Å; V283-R417 PolarHBondContact N-O 2.76Å; V283-R417 PolarHBondContact O-N 2.68Å
284	A	98.9	Very high	97.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.7	-178.2	0	0	0	0	0	110	L245 F249 L272 I273 P414 E415 V416	L245-A284 HydrophobicContact CD1-CB 4.38Å; F249-A284 HydrophobicContact CE2-CB 4.1Å; F249-A284 HydrophobicContact CZ-CB 4.16Å; L272-A284 WeakPolarHBondContact CA-O 3.25Å; I273-A284 HydrophobicContact CD1-CB 4.44Å; I273-A284 HydrophobicContact CG1-CB 3.79Å; I273-A284 PolarHBondContact N-O 2.77Å; I273-A284 PolarHBondContact O-N 2.78Å; A284-P414 HydrophobicContact CB-CB 4.03Å; A284-P414 HydrophobicContact CB-CG 4.38Å; A284-E415 CarbonylContact C-O 3.58Å; A284-E415 VanDerWaalsContact CA-O 3.31Å; A284-E415 WeakPolarHBondContact CA-O 3.22Å; A284-V416 HydrophobicContact CB-CG2 3.89Å
285	N	98.9	Very high	97.5	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132.1	-176	-167.8	35.7	0	0	0	113	A271 L272 G287 S289 S304 F306 P414 E415	A271-N285 CarbonylContact O-C 3.54Å; L272-N285 HydrophobicContact CD1-CB 3.86Å; N285-G287 PolarHBondContact ND2-O 2.91Å; N285-S289 PolarHBondContact ND2-O 2.78Å; N285-S289 PolarHBondContact OD1-O 3.23Å; N285-S304 PolarHBondContact ND2-O 2.94Å; N285-F306 HydrophobicContact CB-CE2 4.39Å; N285-F306 WeakPolarHBondContact O-CE2 3.42Å; N285-P414 CarbonylContact O-C 3.57Å; N285-P414 WeakPolarHBondContact O-CA 3.07Å; N285-E415 PolarHBondContact N-O 2.81Å; N285-E415 PolarHBondContact O-N 2.98Å
286	A	98.8	Very high	97	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	94.2	168.9	0	0	0	0	0	109.5	F249 T270 A271 R390 P414	F249-A286 HydrophobicContact CD1-CB 4.06Å; F249-A286 HydrophobicContact CE1-CB 3.85Å; T270-A286 CarbonylContact C-O 3.32Å; T270-A286 WeakPolarHBondContact CA-O 3.3Å; A271-A286 PolarHBondContact N-O 3.26Å; A271-A286 PolarHBondContact O-N 2.66Å; A286-R390 HydrophobicContact CB-CB 4.06Å; A286-P414 HydrophobicContact CB-CB 4.44Å
287	G	98.3	Very high	96.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	140.4	-156.2	-178.6	0	0	0	0	0	111.8	N285 F306 R390	N285-G287 PolarHBondContact ND2-O 2.91Å; G287-F306 WeakPolarHBondContact O-CD2 3.44Å; G287-F306 PolarHBondContact O-N 3.09Å; G287-R390 WeakPolarHBondContact CA-O 3.33Å
288	D	97.9	Very high	96.3	Very high	21 Å²	21	25.9 Å²	25.9	11%	0.112	14%	0.141	C	C	.	.	S	Bend	trans	-112.1	4.9	179.9	50.5	2.3	0	0	0	114.1	T270 E305 T307 V388	T270-D288 VanDerWaalsContact CG2-OD1 3.28Å; T270-D288 WeakPolarHBondContact CG2-OD1 3.31Å; D288-E305 HydrophobicContact CB-CB 4.3Å; D288-E305 HydrophobicContact CB-CG 4.36Å; D288-T307 HydrophobicContact CB-CG2 4.43Å; D288-V388 HydrophobicContact CB-CG1 4.29Å; D288-V388 VanDerWaalsContact OD1-CG1 3.3Å; D288-V388 WeakPolarHBondContact OD1-CG1 3.39Å; D288-V388 WeakPolarHBondContact OD2-CG1 3.47Å
289	S	98.4	Very high	96.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.			trans	-56.6	147.6	156.1	-74.7	0	0	0	0	110.6	T270 N285	T270-S289 PolarHBondContact OG1-OG 3.39Å; N285-S289 PolarHBondContact ND2-O 2.78Å; N285-S289 PolarHBondContact OD1-O 3.23Å
290	R	98.4	Very high	96.8	Very high	48 Å²	48	25.4 Å²	25.4	18%	0.181	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.8	-172	-166.8	-166.3	-62.8	-174.7	-0.7	112.9	S303 E305 A435 W440 N445	R290-S303 WeakPolarHBondContact CA-OG 3.11Å; R290-E305 IonicContact CZ-OE1 2.88Å; R290-E305 IonicContact CZ-OE2 3.31Å; R290-E305 IonicContact NE-OE1 3.41Å; R290-E305 PolarHBondContact NE-OE1 3.41Å; R290-E305 IonicContact NE-OE2 2.72Å; R290-E305 IonicContact NH2-OE1 3.31Å; R290-E305 PolarHBondContact NH2-OE1 2.82Å; R290-E305 IonicContact NH2-OE2 2.81Å; R290-E305 PolarHBondContact NH2-OE2 3.16Å; R290-A435 PolarHBondContact N-O 2.65Å; R290-A435 PolarHBondContact O-N 2.83Å; R290-W440 HydrophobicContact CB-CD2 3.97Å; R290-W440 HydrophobicContact CB-CG 3.92Å; R290-W440 HydrophobicContact CB-CZ2 4.31Å; R290-W440 HydrophobicContact CG-CD2 4.48Å; R290-W440 WeakPolarHBondContact O-CZ2 3.23Å; R290-W440 PolarHBondContact O-NE1 3.45Å; R290-N445 PolarHBondContact NH1-OD1 3.35Å
291	A	98.8	Very high	97	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.3	174	0	0	0	0	0	111.8	L272 V283 M302 S303 L432 I433 L434	L272-A291 HydrophobicContact CD1-CB 4.27Å; L272-A291 HydrophobicContact CD2-CB 4.15Å; V283-A291 HydrophobicContact CG1-CB 3.9Å; A291-M302 HydrophobicContact CB-CB 3.99Å; A291-M302 WeakPolarHBondContact O-CA 3.31Å; A291-M302 PolarHBondContact O-N 2.85Å; A291-S303 PolarHBondContact N-OG 3.36Å; A291-S303 PolarHBondContact O-N 2.88Å; A291-L432 HydrophobicContact CB-CD1 4.32Å; A291-I433 CarbonylContact C-O 3.46Å; A291-I433 WeakPolarHBondContact CA-O 3.37Å; A291-L434 HydrophobicContact CB-CG 4.38Å
292	I	98.8	Very high	97	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.3	172.3	67.5	177.6	0	0	0	110.1	V294 I299 I300 I433 W440 N445 V448	I292-V294 HydrophobicContact CD1-CG2 4.25Å; I292-V294 HydrophobicContact CG1-CG2 4.46Å; I292-I299 HydrophobicContact CB-CG2 4.32Å; I292-I299 HydrophobicContact CD1-CG2 4.25Å; I292-I299 HydrophobicContact CG2-CG2 4.5Å; I292-I300 WeakPolarHBondContact CA-O 3.3Å; I292-I433 HydrophobicContact CD1-CD1 4.4Å; I292-I433 HydrophobicContact CG1-CB 4.17Å; I292-I433 HydrophobicContact CG1-CD1 4.26Å; I292-I433 PolarHBondContact N-O 3.47Å; I292-I433 PolarHBondContact O-N 2.91Å; I292-W440 HydrophobicContact CD1-CH2 3.76Å; I292-W440 HydrophobicContact CD1-CZ3 3.97Å; I292-W440 HydrophobicContact CG1-CH2 3.88Å; I292-W440 HydrophobicContact CG2-CH2 4.46Å; I292-N445 HydrophobicContact CD1-CB 4.32Å; I292-V448 HydrophobicContact CD1-CB 4.47Å; I292-V448 HydrophobicContact CD1-CG1 4.15Å
293	I	98.8	Very high	96.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.7	163.3	-72.6	168.2	0	0	0	108.2	R295 I299 I300 M302 Y419 V431 L432 L507	I293-R295 HydrophobicContact CG2-CB 3.8Å; I293-I299 WeakPolarHBondContact O-CA 3.38Å; I293-I300 HydrophobicContact CB-CB 4.11Å; I293-I300 HydrophobicContact CG2-CD1 4.16Å; I293-I300 PolarHBondContact N-O 2.75Å; I293-I300 PolarHBondContact O-N 2.91Å; I293-M302 HydrophobicContact CB-CG 4.43Å; I293-M302 HydrophobicContact CD1-CG 3.75Å; I293-M302 HydrophobicContact CD1-SD 3.96Å; I293-M302 HydrophobicContact CG1-CG 3.77Å; I293-Y419 HydrophobicContact CD1-CD1 3.82Å; I293-Y419 HydrophobicContact CD1-CD2 3.55Å; I293-Y419 HydrophobicContact CD1-CE1 4.06Å; I293-Y419 HydrophobicContact CD1-CE2 3.82Å; I293-Y419 HydrophobicContact CD1-CG 3.54Å; I293-V431 WeakPolarHBondContact CA-O 3.38Å; I293-L432 HydrophobicContact CG1-CB 4.07Å; I293-L432 HydrophobicContact CG1-CD1 3.69Å; I293-L432 HydrophobicContact CG1-CG 4.47Å; I293-L507 HydrophobicContact CD1-CD1 4.25Å; I293-L507 HydrophobicContact CG1-CD1 4.18Å; I293-L507 HydrophobicContact CG2-CD1 3.65Å
294	V	98.4	Very high	96.8	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	112.7	166.5	-178.1	0	0	0	0	106.4	I292 E298 D430 V431 I433 A449 I452	I292-V294 HydrophobicContact CD1-CG2 4.25Å; I292-V294 HydrophobicContact CG1-CG2 4.46Å; V294-E298 WeakPolarHBondContact CA-O 3.32Å; V294-D430 WeakPolarHBondContact O-CA 3.24Å; V294-V431 HydrophobicContact CB-CG2 4.4Å; V294-V431 PolarHBondContact N-O 3.09Å; V294-V431 PolarHBondContact O-N 3.17Å; V294-I433 HydrophobicContact CG2-CD1 3.74Å; V294-A449 HydrophobicContact CG1-CB 4.12Å; V294-A449 HydrophobicContact CG2-CB 3.79Å; V294-I452 HydrophobicContact CG1-CG2 4.49Å
295	R	95.3	Very high	96.6	Very high	22 Å²	22	30.8 Å²	30.8	8%	0.083	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	122.2	-176.3	-178.5	-161.7	66.3	-167.6	3.1	110.6	I293 G297 E298 Y419 Y424 D430	I293-R295 HydrophobicContact CG2-CB 3.8Å; R295-G297 PolarHBondContact O-N 3.08Å; R295-G297 VanDerWaalsContact O-N 3.16Å; R295-E298 IonicContact CZ-OE2 2.67Å; R295-E298 PolarHBondContact N-O 2.96Å; R295-E298 IonicContact NH2-OE2 3.56Å; R295-E298 PolarHBondContact NH2-OE2 3.44Å; R295-E298 WeakPolarHBondContact O-CA 3.42Å; R295-E298 WeakPolarHBondContact O-CB 3.37Å; R295-E298 PolarHBondContact O-N 3.01Å; R295-Y419 PolarHBondContact NH1-OH 3.27Å; R295-Y424 VanDerWaalsContact NH1-CD2 3.33Å; R295-Y424 VanDerWaalsContact NH1-CE1 3.29Å; R295-D430 WeakPolarHBondContact CA-OD1 3.4Å; R295-D430 HydrophobicContact CB-CB 4.35Å; R295-D430 HydrophobicContact CG-CB 4.1Å
296	N	88.1	Confident	96.6	Very high	125 Å²	125	30.9 Å²	30.9	67%	0.668	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	37.7	-178.3	-67	-38.5	0	0	0	113.6	E298 D430	N296-E298 PolarHBondContact O-N 3.09Å; N296-D430 PolarHBondContact N-OD1 3.48Å
297	G	82.8	Confident	96.5	Very high	55 Å²	55	32.1 Å²	32.1	57%	0.567	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.8	-2.2	-175.8	0	0	0	0	0	115.3	R295	R295-G297 PolarHBondContact O-N 3.08Å; R295-G297 VanDerWaalsContact O-N 3.16Å
298	E	94.8	Very high	96.5	Very high	110 Å²	110	32.2 Å²	32.2	51%	0.514	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	142.3	172.1	-59.1	-174.5	146.5	0	0	111.1	V294 R295 N296	V294-E298 WeakPolarHBondContact CA-O 3.32Å; R295-E298 IonicContact CZ-OE2 2.67Å; R295-E298 PolarHBondContact N-O 2.96Å; R295-E298 IonicContact NH2-OE2 3.56Å; R295-E298 PolarHBondContact NH2-OE2 3.44Å; R295-E298 WeakPolarHBondContact O-CA 3.42Å; R295-E298 WeakPolarHBondContact O-CB 3.37Å; R295-E298 PolarHBondContact O-N 3.01Å; N296-E298 PolarHBondContact O-N 3.09Å
299	I	98.3	Very high	96.3	Very high	50 Å²	50	35.4 Å²	35.4	26%	0.256	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121	174.5	-56	172.9	0	0	0	108.3	I292 I293 N445 E446 A449	I292-I299 HydrophobicContact CB-CG2 4.32Å; I292-I299 HydrophobicContact CD1-CG2 4.25Å; I292-I299 HydrophobicContact CG2-CG2 4.5Å; I293-I299 WeakPolarHBondContact O-CA 3.38Å; I299-N445 HydrophobicContact CD1-CB 4.28Å; I299-N445 HydrophobicContact CG2-CB 4.14Å; I299-E446 HydrophobicContact CD1-CG 4.16Å; I299-A449 HydrophobicContact CD1-CB 3.58Å; I299-A449 HydrophobicContact CG1-CB 3.62Å
300	I	98.3	Very high	96.2	Very high	41 Å²	41	39.4 Å²	39.4	21%	0.21	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	107.2	178.6	-54	168.8	0	0	0	108.1	I292 I293 M302 Y419	I292-I300 WeakPolarHBondContact CA-O 3.3Å; I293-I300 HydrophobicContact CB-CB 4.11Å; I293-I300 HydrophobicContact CG2-CD1 4.16Å; I293-I300 PolarHBondContact N-O 2.75Å; I293-I300 PolarHBondContact O-N 2.91Å; I300-M302 HydrophobicContact CG2-SD 4.12Å; I300-M302 PolarHBondContact O-N 3.07Å; I300-Y419 HydrophobicContact CD1-CE2 4.12Å
301	P	98.3	Very high	96.2	Very high	66 Å²	66	38.5 Å²	38.5	43%	0.429	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	122	177.5	-22.7	34.2	0	0	0	111.7	R417	P301-R417 PolarHBondContact O-NH1 3.22Å
302	M	98.6	Very high	96.1	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.03	22%	0.222	C	C	.	.			trans	-105.8	-0.3	-178.9	-70.2	-53.1	-57.5	0	0	113.8	V283 A291 I293 I300 R417 Y419 L432	V283-M302 HydrophobicContact CB-CB 4.44Å; V283-M302 HydrophobicContact CB-CE 4.32Å; V283-M302 HydrophobicContact CG1-CB 4.32Å; V283-M302 VanDerWaalsContact CG1-O 3.3Å; V283-M302 WeakPolarHBondContact CG1-O 3.25Å; V283-M302 HydrophobicContact CG2-CB 4.12Å; V283-M302 HydrophobicContact CG2-CE 3.68Å; A291-M302 HydrophobicContact CB-CB 3.99Å; A291-M302 WeakPolarHBondContact O-CA 3.31Å; A291-M302 PolarHBondContact O-N 2.85Å; I293-M302 HydrophobicContact CB-CG 4.43Å; I293-M302 HydrophobicContact CD1-CG 3.75Å; I293-M302 HydrophobicContact CD1-SD 3.96Å; I293-M302 HydrophobicContact CG1-CG 3.77Å; I300-M302 HydrophobicContact CG2-SD 4.12Å; I300-M302 PolarHBondContact O-N 3.07Å; M302-R417 HydrophobicContact CE-CB 3.98Å; M302-R417 WeakPolarHBondContact O-CD 3.4Å; M302-Y419 HydrophobicContact SD-CD2 4.4Å; M302-L432 HydrophobicContact CB-CD1 4.29Å; M302-L432 HydrophobicContact CG-CD1 4.17Å
303	S	98.1	Very high	96	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	24%	0.241	C	C	.	.			trans	-147.4	168.6	166.3	68.6	0	0	0	0	112.2	R290 A291	R290-S303 WeakPolarHBondContact CA-OG 3.11Å; A291-S303 PolarHBondContact N-OG 3.36Å; A291-S303 PolarHBondContact O-N 2.88Å
304	S	95.6	Very high	95.9	Very high	36 Å²	36	46.7 Å²	46.7	25%	0.252	25%	0.253	S	S	.	.			trans	-110	151.4	165.4	-49.1	0	0	0	0	109.3	N285 F306 E415 R417	N285-S304 PolarHBondContact ND2-O 2.94Å; S304-F306 WeakPolarHBondContact O-CE2 3.42Å; S304-E415 PolarHBondContact OG-OE1 3.19Å; S304-E415 PolarHBondContact OG-OE2 3.35Å; S304-R417 PolarHBondContact OG-NH2 3.45Å
305	E	95.9	Very high	95.9	Very high	52 Å²	52	46.6 Å²	46.6	24%	0.243	25%	0.252	C	S	.	.			trans	-87	137.3	170	-65.9	172.8	155.2	0	0	111.3	D288 R290 T307 T310	D288-E305 HydrophobicContact CB-CB 4.3Å; D288-E305 HydrophobicContact CB-CG 4.36Å; R290-E305 IonicContact CZ-OE1 2.88Å; R290-E305 IonicContact CZ-OE2 3.31Å; R290-E305 IonicContact NE-OE1 3.41Å; R290-E305 PolarHBondContact NE-OE1 3.41Å; R290-E305 IonicContact NE-OE2 2.72Å; R290-E305 IonicContact NH2-OE1 3.31Å; R290-E305 PolarHBondContact NH2-OE1 2.82Å; R290-E305 IonicContact NH2-OE2 2.81Å; R290-E305 PolarHBondContact NH2-OE2 3.16Å; E305-T307 HydrophobicContact CB-CG2 4.3Å; E305-T310 WeakPolarHBondContact O-CB 3.32Å; E305-T310 PolarHBondContact O-OG1 2.82Å
306	F	97.9	Very high	96.1	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.018	25%	0.249	C	C	.	.			trans	-107.5	72.2	-175.9	-65.7	-69	0	0	0	112.5	N285 G287 S304 E311 T389 R390 E415	N285-F306 HydrophobicContact CB-CE2 4.39Å; N285-F306 WeakPolarHBondContact O-CE2 3.42Å; G287-F306 WeakPolarHBondContact O-CD2 3.44Å; G287-F306 PolarHBondContact O-N 3.09Å; S304-F306 WeakPolarHBondContact O-CE2 3.42Å; F306-E311 HydrophobicContact CB-CG 4.36Å; F306-E311 HydrophobicContact CD1-CG 3.71Å; F306-T389 PolarHBondContact O-N 3.22Å; F306-T389 PolarHBondContact O-OG1 3.46Å; F306-R390 HydrophobicContact CB-CB 3.94Å; F306-R390 HydrophobicContact CB-CG 3.8Å; F306-R390 HydrophobicContact CD1-CG 4.27Å; F306-R390 VanDerWaalsContact CD1-NE 3.3Å; F306-R390 HydrophobicContact CD2-CB 4.47Å; F306-R390 HydrophobicContact CD2-CG 4.49Å; F306-R390 HydrophobicContact CG-CB 4.24Å; F306-R390 HydrophobicContact CG-CG 3.93Å; F306-E415 HydrophobicContact CE2-CB 3.93Å; F306-E415 HydrophobicContact CZ-CB 3.43Å; F306-E415 VanDerWaalsContact CZ-CB 3.43Å; F306-E415 HydrophobicContact CZ-CG 4.34Å; F306-E415 WeakPolarHBondContact CZ-OE2 3.4Å
307	T	97.2	Very high	96.6	Very high	26 Å²	26	45.4 Å²	45.4	16%	0.16	24%	0.239	C	C	.	.			trans	-96.7	167.2	179.3	76.1	0	0	0	0	111.5	D288 E305 E309 T310 E311 T389	D288-T307 HydrophobicContact CB-CG2 4.43Å; E305-T307 HydrophobicContact CB-CG2 4.3Å; T307-E309 PolarHBondContact O-N 2.84Å; T307-E309 PolarHBondContact OG1-N 2.89Å; T307-T310 PolarHBondContact N-OG1 3.19Å; T307-T310 PolarHBondContact O-N 2.86Å; T307-T310 PolarHBondContact O-OG1 3.34Å; T307-T310 PolarHBondContact OG1-N 3.46Å; T307-T310 PolarHBondContact OG1-OG1 2.96Å; T307-E311 PolarHBondContact O-N 3.33Å; T307-T389 WeakPolarHBondContact O-CG2 3.47Å
308	P	97.6	Very high	97.3	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-34.1	175.6	-29.6	34.6	0	0	0	113.6	R312 L315 I373 A380 V382 G387 T389	P308-R312 WeakPolarHBondContact O-CA 3.27Å; P308-R312 PolarHBondContact O-N 3.42Å; P308-L315 HydrophobicContact CB-CD1 4.48Å; P308-I373 HydrophobicContact CB-CG1 4.1Å; P308-I373 HydrophobicContact CB-CG2 3.74Å; P308-I373 WeakPolarHBondContact O-CD1 3.02Å; P308-A380 HydrophobicContact CB-CB 4.18Å; P308-A380 HydrophobicContact CG-CB 4.35Å; P308-V382 HydrophobicContact CB-CG2 4.18Å; P308-V382 HydrophobicContact CG-CG2 3.89Å; P308-G387 WeakPolarHBondContact CD-O 3.2Å; P308-T389 HydrophobicContact CB-CG2 4.38Å; P308-T389 HydrophobicContact CG-CG2 4.11Å
309	E	95.2	Very high	97.5	Very high	89 Å²	89	39.1 Å²	39.1	42%	0.416	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-45.5	-179.6	-65.9	-175.9	140.2	0	0	112.1	T307 E311 R312 E376 G377 A380	T307-E309 PolarHBondContact O-N 2.84Å; T307-E309 PolarHBondContact OG1-N 2.89Å; E309-E311 VanDerWaalsContact C-N 3.29Å; E309-E311 PolarHBondContact O-N 2.94Å; E309-R312 WeakPolarHBondContact O-CB 3.31Å; E309-R312 PolarHBondContact O-N 2.87Å; E309-E376 WeakPolarHBondContact OE1-CA 3.2Å; E309-G377 VanDerWaalsContact CD-N 3.25Å; E309-G377 PolarHBondContact OE1-N 3.02Å; E309-G377 VanDerWaalsContact OE2-CA 3.24Å; E309-G377 WeakPolarHBondContact OE2-CA 3.29Å; E309-G377 PolarHBondContact OE2-N 3.15Å; E309-G377 VanDerWaalsContact OE2-N 3.09Å; E309-A380 HydrophobicContact CG-CB 3.82Å
310	T	95.9	Very high	97.4	Very high	84 Å²	84	41.2 Å²	41.2	52%	0.515	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.7	-179.2	60.7	0	0	0	0	111.6	E305 T307	E305-T310 WeakPolarHBondContact O-CB 3.32Å; E305-T310 PolarHBondContact O-OG1 2.82Å; T307-T310 PolarHBondContact N-OG1 3.19Å; T307-T310 PolarHBondContact O-N 2.86Å; T307-T310 PolarHBondContact O-OG1 3.34Å; T307-T310 PolarHBondContact OG1-N 3.46Å; T307-T310 PolarHBondContact OG1-OG1 2.96Å
311	E	97.4	Very high	97.4	Very high	28 Å²	28	44.4 Å²	44.4	13%	0.131	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	14.1	-179.2	-69	-89.2	107.1	0	0	113.4	F306 T307 E309 Q313 R314 L315 T389 R390	F306-E311 HydrophobicContact CB-CG 4.36Å; F306-E311 HydrophobicContact CD1-CG 3.71Å; T307-E311 PolarHBondContact O-N 3.33Å; E309-E311 VanDerWaalsContact C-N 3.29Å; E309-E311 PolarHBondContact O-N 2.94Å; E311-Q313 VanDerWaalsContact C-N 3.3Å; E311-Q313 PolarHBondContact O-N 3.28Å; E311-Q313 VanDerWaalsContact O-N 3.14Å; E311-R314 WeakPolarHBondContact O-CB 3.22Å; E311-R314 PolarHBondContact O-N 3.3Å; E311-R314 WeakPolarHBondContact OE2-CD 3.22Å; E311-R314 IonicContact OE2-CZ 3.05Å; E311-R314 IonicContact OE2-NE 3.93Å; E311-R314 PolarHBondContact OE2-NE 2.95Å; E311-R314 IonicContact OE2-NH2 2.83Å; E311-L315 WeakPolarHBondContact O-CG 3.36Å; E311-L315 PolarHBondContact O-N 3.04Å; E311-T389 HydrophobicContact CB-CG2 4.31Å; E311-T389 WeakPolarHBondContact CG-OG1 3.4Å; E311-R390 VanDerWaalsContact CD-NH2 3.33Å; E311-R390 IonicContact OE1-NH2 3.78Å; E311-R390 PolarHBondContact OE1-NH2 2.79Å; E311-R390 VanDerWaalsContact OE1-NH2 3.14Å; E311-R390 IonicContact OE2-CZ 3.91Å; E311-R390 IonicContact OE2-NE 3.19Å; E311-R390 PolarHBondContact OE2-NE 2.9Å; E311-R390 IonicContact OE2-NH2 3.03Å; E311-R390 PolarHBondContact OE2-NH2 2.7Å
312	R	97.1	Very high	97.4	Very high	19 Å²	19	44.9 Å²	44.9	7%	0.072	22%	0.215	C	C	.	.	H	α-helix	trans	-46.1	-50.3	-176.2	177.2	-160.4	60.1	97.1	-5.9	113	P308 E309 R314 L315 Q316 E334 D352 M355 I373	P308-R312 WeakPolarHBondContact O-CA 3.27Å; P308-R312 PolarHBondContact O-N 3.42Å; E309-R312 WeakPolarHBondContact O-CB 3.31Å; E309-R312 PolarHBondContact O-N 2.87Å; R312-R314 PolarHBondContact O-N 2.91Å; R312-L315 PolarHBondContact O-N 3.04Å; R312-Q316 HydrophobicContact CG-CG 4.22Å; R312-Q316 WeakPolarHBondContact O-CB 3.4Å; R312-Q316 WeakPolarHBondContact O-CG 3.41Å; R312-Q316 PolarHBondContact O-N 3.32Å; R312-E334 WeakPolarHBondContact CD-OE2 3.49Å; R312-D352 PolarHBondContact NH1-O 3.08Å; R312-D352 VanDerWaalsContact NH1-O 3.11Å; R312-M355 PolarHBondContact NH1-O 3.35Å; R312-M355 PolarHBondContact NH2-O 3.26Å; R312-I373 HydrophobicContact CB-CD1 3.79Å; R312-I373 HydrophobicContact CG-CD1 3.61Å
313	Q	96.8	Very high	97.3	Very high	88 Å²	88	48.4 Å²	48.4	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-40.7	-176.5	-68.1	-171.5	-68.1	0	0	112.1	E311 Y317 F353	E311-Q313 VanDerWaalsContact C-N 3.3Å; E311-Q313 PolarHBondContact O-N 3.28Å; E311-Q313 VanDerWaalsContact O-N 3.14Å; Q313-Y317 WeakPolarHBondContact O-CB 3.18Å; Q313-Y317 PolarHBondContact O-N 2.74Å; Q313-F353 WeakPolarHBondContact CG-O 3.44Å; Q313-F353 PolarHBondContact NE2-O 2.67Å
314	R	97.4	Very high	97.2	Very high	67 Å²	67	54.2 Å²	54.2	25%	0.253	27%	0.265	S	S	.	.	H	α-helix	trans	-62.3	-46.7	176.2	-175.8	-173.6	65.7	81.7	-4.4	110.7	E311 R312 Y317 L318 T389 F409	E311-R314 WeakPolarHBondContact O-CB 3.22Å; E311-R314 PolarHBondContact O-N 3.3Å; E311-R314 WeakPolarHBondContact OE2-CD 3.22Å; E311-R314 IonicContact OE2-CZ 3.05Å; E311-R314 IonicContact OE2-NE 3.93Å; E311-R314 PolarHBondContact OE2-NE 2.95Å; E311-R314 IonicContact OE2-NH2 2.83Å; R312-R314 PolarHBondContact O-N 2.91Å; R314-Y317 PolarHBondContact O-N 3.14Å; R314-L318 WeakPolarHBondContact O-CB 3.42Å; R314-L318 PolarHBondContact O-N 3.35Å; R314-T389 PolarHBondContact NH2-O 3.42Å; R314-F409 PolarHBondContact NH1-O 2.9Å; R314-F409 PolarHBondContact NH2-O 3.13Å
315	L	98.4	Very high	97.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-50	179.8	-65	177.5	0	0	0	111.7	P308 E311 R312 Y317 L318 A319 L372 I373 V382 T389 F409	P308-L315 HydrophobicContact CB-CD1 4.48Å; E311-L315 WeakPolarHBondContact O-CG 3.36Å; E311-L315 PolarHBondContact O-N 3.04Å; R312-L315 PolarHBondContact O-N 3.04Å; L315-Y317 VanDerWaalsContact C-N 3.33Å; L315-Y317 PolarHBondContact O-N 2.94Å; L315-L318 PolarHBondContact O-N 2.98Å; L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 3.49Å; L315-L372 HydrophobicContact CB-CD2 3.89Å; L315-L372 WeakPolarHBondContact O-CD2 3.16Å; L315-I373 HydrophobicContact CD1-CD1 4.03Å; L315-I373 HydrophobicContact CD1-CG1 4.04Å; L315-V382 HydrophobicContact CD1-CG2 3.83Å; L315-V382 HydrophobicContact CD2-CG2 4.5Å; L315-T389 HydrophobicContact CD1-CG2 3.78Å; L315-T389 HydrophobicContact CD2-CG2 4.34Å; L315-T389 HydrophobicContact CG-CG2 4.44Å; L315-F409 HydrophobicContact CD2-CB 3.87Å; L315-F409 HydrophobicContact CD2-CD1 3.9Å; L315-F409 HydrophobicContact CD2-CG 4.36Å
316	Q	98.1	Very high	97.3	Very high	3 Å²	3	51.8 Å²	51.8	1%	0.014	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-38.5	179	-68.9	-178.2	-47.5	0	0	111.8	R312 A319 F320 H332 F353 L372	R312-Q316 HydrophobicContact CG-CG 4.22Å; R312-Q316 WeakPolarHBondContact O-CB 3.4Å; R312-Q316 WeakPolarHBondContact O-CG 3.41Å; R312-Q316 PolarHBondContact O-N 3.32Å; Q316-A319 PolarHBondContact O-N 3.4Å; Q316-F320 VanDerWaalsContact O-CB 3.3Å; Q316-F320 WeakPolarHBondContact O-CB 3.24Å; Q316-F320 PolarHBondContact O-N 3Å; Q316-H332 HydrophobicContact CB-CB 4.49Å; Q316-H332 VanDerWaalsContact CD-O 3.28Å; Q316-H332 VanDerWaalsContact CG-O 3.23Å; Q316-H332 WeakPolarHBondContact CG-O 3.42Å; Q316-H332 PolarHBondContact NE2-O 3.03Å; Q316-F353 HydrophobicContact CB-CB 3.65Å; Q316-L372 HydrophobicContact CG-CD2 4.46Å
317	Y	98.3	Very high	97.2	Very high	120 Å²	120	53.3 Å²	53.3	47%	0.471	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-45.7	176.2	177	-113.3	0	0	0	111.7	Q313 R314 L315 A319 F320 M321 F353	Q313-Y317 WeakPolarHBondContact O-CB 3.18Å; Q313-Y317 PolarHBondContact O-N 2.74Å; R314-Y317 PolarHBondContact O-N 3.14Å; L315-Y317 VanDerWaalsContact C-N 3.33Å; L315-Y317 PolarHBondContact O-N 2.94Å; Y317-A319 VanDerWaalsContact C-N 3.34Å; Y317-A319 PolarHBondContact O-N 3.5Å; Y317-F320 PolarHBondContact O-N 2.93Å; Y317-M321 HydrophobicContact CD2-CG 4.09Å; Y317-M321 HydrophobicContact CE1-CG 4.11Å; Y317-M321 HydrophobicContact CE2-CG 3.64Å; Y317-M321 HydrophobicContact CE2-SD 3.97Å; Y317-M321 WeakPolarHBondContact O-CB 3.35Å; Y317-M321 WeakPolarHBondContact O-CG 3.16Å; Y317-M321 PolarHBondContact O-N 3.12Å; Y317-F353 AromaticContact CD2-CD2 3.62Å; Y317-F353 HydrophobicContact CD2-CD2 3.62Å; Y317-F353 AromaticContact CD2-CE2 3.66Å; Y317-F353 HydrophobicContact CD2-CE2 3.66Å; Y317-F353 HydrophobicContact CD2-CG 4.25Å; Y317-F353 HydrophobicContact CD2-CZ 4.32Å; Y317-F353 HydrophobicContact CE2-CE2 4.2Å; Y317-F353 HydrophobicContact CG-CD2 4.32Å
318	L	98.4	Very high	97	Very high	32 Å²	32	57.7 Å²	57.7	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-45.8	175.4	179.2	58	0	0	0	111.4	R314 L315 F320 M321 Q322 L325 P408 F409	R314-L318 WeakPolarHBondContact O-CB 3.42Å; R314-L318 PolarHBondContact O-N 3.35Å; L315-L318 PolarHBondContact O-N 2.98Å; L318-F320 VanDerWaalsContact C-N 3.33Å; L318-F320 PolarHBondContact O-N 3.2Å; L318-M321 PolarHBondContact O-N 3.3Å; L318-Q322 WeakPolarHBondContact O-CB 3.16Å; L318-Q322 PolarHBondContact O-N 2.89Å; L318-L325 HydrophobicContact CD1-CD1 4.31Å; L318-L325 HydrophobicContact CG-CD1 4.2Å; L318-P408 HydrophobicContact CD2-CB 4.4Å; L318-P408 HydrophobicContact CD2-CG 4.14Å; L318-F409 HydrophobicContact CB-CD1 4.47Å; L318-F409 HydrophobicContact CB-CE1 4.17Å; L318-F409 HydrophobicContact CD2-CD1 3.76Å; L318-F409 HydrophobicContact CD2-CE1 4.01Å; L318-F409 HydrophobicContact CD2-CG 4.35Å; L318-F409 HydrophobicContact CG-CD1 4.27Å; L318-F409 HydrophobicContact CG-CE1 4.01Å
319	A	97.9	Very high	96.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.7	-34.1	178	0	0	0	0	0	113.3	L315 Q316 Y317 Q322 P323 L326 H332 L372 F409	L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 3.49Å; Q316-A319 PolarHBondContact O-N 3.4Å; Y317-A319 VanDerWaalsContact C-N 3.34Å; Y317-A319 PolarHBondContact O-N 3.5Å; A319-Q322 CarbonylContact O-C 3.58Å; A319-P323 VanDerWaalsContact O-CA 3.25Å; A319-P323 WeakPolarHBondContact O-CA 3.28Å; A319-L326 HydrophobicContact CB-CD1 4.08Å; A319-L326 HydrophobicContact CB-CD2 3.84Å; A319-L326 HydrophobicContact CB-CG 4.14Å; A319-H332 HydrophobicContact CB-CB 3.6Å; A319-L372 HydrophobicContact CB-CD2 3.69Å; A319-F409 HydrophobicContact CB-CE1 3.8Å; A319-F409 HydrophobicContact CB-CZ 3.91Å
320	F	97.2	Very high	96.8	Very high	95 Å²	95	56.5 Å²	56.5	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-45.6	172.8	171	-97.5	0	0	0	111.4	Q316 Y317 L318 H332 F353	Q316-F320 VanDerWaalsContact O-CB 3.3Å; Q316-F320 WeakPolarHBondContact O-CB 3.24Å; Q316-F320 PolarHBondContact O-N 3Å; Y317-F320 PolarHBondContact O-N 2.93Å; L318-F320 VanDerWaalsContact C-N 3.33Å; L318-F320 PolarHBondContact O-N 3.2Å; F320-H332 AromaticContact CD2-NE2 3.72Å; F320-F353 HydrophobicContact CB-CD1 3.82Å; F320-F353 HydrophobicContact CB-CE1 3.99Å; F320-F353 HydrophobicContact CD1-CD1 4.13Å; F320-F353 AromaticContact CD1-CE1 3.43Å; F320-F353 HydrophobicContact CD1-CE1 3.43Å; F320-F353 VanDerWaalsContact CD1-CE1 3.43Å; F320-F353 AromaticContact CD1-CZ 3.8Å; F320-F353 HydrophobicContact CD1-CZ 3.8Å; F320-F353 HydrophobicContact CD2-CD1 4.2Å; F320-F353 AromaticContact CD2-CE1 3.7Å; F320-F353 HydrophobicContact CD2-CE1 3.7Å; F320-F353 AromaticContact CE1-CE1 3.76Å; F320-F353 HydrophobicContact CE1-CE1 3.76Å; F320-F353 AromaticContact CE1-CZ 3.88Å; F320-F353 HydrophobicContact CE1-CZ 3.88Å; F320-F353 HydrophobicContact CE2-CE1 4Å; F320-F353 AromaticContact CG-CD1 3.78Å; F320-F353 HydrophobicContact CG-CD1 3.78Å; F320-F353 AromaticContact CG-CE1 3.4Å; F320-F353 HydrophobicContact CG-CE1 3.4Å; F320-F353 VanDerWaalsContact CG-CE1 3.4Å; F320-F353 HydrophobicContact CG-CZ 4.24Å; F320-F353 HydrophobicContact CZ-CE1 4.03Å; F320-F353 HydrophobicContact CZ-CZ 4.38Å
321	M	98.1	Very high	96.8	Very high	107 Å²	107	53 Å²	53	53%	0.527	26%	0.263	S	S	.	.	H	α-helix	trans	-71	-31.4	179.7	-69.8	-59.5	-61.9	0	0	112.9	Y317 L318	Y317-M321 HydrophobicContact CD2-CG 4.09Å; Y317-M321 HydrophobicContact CE1-CG 4.11Å; Y317-M321 HydrophobicContact CE2-CG 3.64Å; Y317-M321 HydrophobicContact CE2-SD 3.97Å; Y317-M321 WeakPolarHBondContact O-CB 3.35Å; Y317-M321 WeakPolarHBondContact O-CG 3.16Å; Y317-M321 PolarHBondContact O-N 3.12Å; L318-M321 PolarHBondContact O-N 3.3Å
322	Q	97.9	Very high	96.8	Very high	76 Å²	76	53.4 Å²	53.4	36%	0.355	26%	0.264	S	S	.	.			trans	-130.4	68.3	-176.5	-64.3	-170.4	-60.7	0	0	111.2	L318 A319 H324 L325	L318-Q322 WeakPolarHBondContact O-CB 3.16Å; L318-Q322 PolarHBondContact O-N 2.89Å; A319-Q322 CarbonylContact O-C 3.58Å; Q322-H324 PolarHBondContact O-N 3.13Å; Q322-H324 VanDerWaalsContact O-N 3.09Å; Q322-L325 HydrophobicContact CB-CD1 3.61Å; Q322-L325 HydrophobicContact CB-CG 3.89Å; Q322-L325 HydrophobicContact CG-CD1 4.5Å; Q322-L325 WeakPolarHBondContact O-CB 3.05Å; Q322-L325 WeakPolarHBondContact O-CG 3.31Å; Q322-L325 PolarHBondContact O-N 3.29Å
323	P	96.4	Very high	96.7	Very high	80 Å²	80	53.4 Å²	53.4	52%	0.519	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-65.1	-19.4	-173.4	25.4	-35.2	0	0	0	114	A319 L325 L326	A319-P323 VanDerWaalsContact O-CA 3.25Å; A319-P323 WeakPolarHBondContact O-CA 3.28Å; P323-L325 PolarHBondContact O-N 2.9Å; P323-L326 WeakPolarHBondContact O-CB 3.44Å; P323-L326 PolarHBondContact O-N 3.1Å; P323-L326 VanDerWaalsContact O-N 3.12Å
324	H	96.8	Very high	96.7	Very high	132 Å²	132	51 Å²	51	61%	0.611	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-62.6	-26	174.2	62.7	-86.2	0	0	0	112.6	Q322 L326 G327	Q322-H324 PolarHBondContact O-N 3.13Å; Q322-H324 VanDerWaalsContact O-N 3.09Å; H324-L326 PolarHBondContact O-N 3.42Å; H324-G327 PolarHBondContact O-N 3.33Å
325	L	97.4	Very high	96.6	Very high	29 Å²	29	48.8 Å²	48.8	15%	0.152	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-65.6	-18.4	175.4	-61.4	177.2	0	0	0	112.9	L318 Q322 P323 G327 I404 P408 F409	L318-L325 HydrophobicContact CD1-CD1 4.31Å; L318-L325 HydrophobicContact CG-CD1 4.2Å; Q322-L325 HydrophobicContact CB-CD1 3.61Å; Q322-L325 HydrophobicContact CB-CG 3.89Å; Q322-L325 HydrophobicContact CG-CD1 4.5Å; Q322-L325 WeakPolarHBondContact O-CB 3.05Å; Q322-L325 WeakPolarHBondContact O-CG 3.31Å; Q322-L325 PolarHBondContact O-N 3.29Å; P323-L325 PolarHBondContact O-N 2.9Å; L325-G327 VanDerWaalsContact C-N 3.3Å; L325-I404 VanDerWaalsContact O-CG2 3.23Å; L325-I404 WeakPolarHBondContact O-CG2 3.24Å; L325-P408 HydrophobicContact CD1-CG 3.56Å; L325-P408 HydrophobicContact CD2-CG 4.25Å; L325-F409 HydrophobicContact CB-CE2 3.82Å; L325-F409 HydrophobicContact CB-CZ 3.97Å; L325-F409 HydrophobicContact CD1-CE2 4.4Å; L325-F409 HydrophobicContact CD1-CZ 4.29Å
326	L	96.9	Very high	96.3	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.037	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-85.7	-1.9	178.3	-59.9	176	0	0	0	113.2	A319 P323 H324 N328 E329 F330 H332 L372 F409	A319-L326 HydrophobicContact CB-CD1 4.08Å; A319-L326 HydrophobicContact CB-CD2 3.84Å; A319-L326 HydrophobicContact CB-CG 4.14Å; P323-L326 WeakPolarHBondContact O-CB 3.44Å; P323-L326 PolarHBondContact O-N 3.1Å; P323-L326 VanDerWaalsContact O-N 3.12Å; H324-L326 PolarHBondContact O-N 3.42Å; L326-N328 PolarHBondContact O-N 3.38Å; L326-E329 PolarHBondContact O-N 3.11Å; L326-F330 HydrophobicContact CB-CB 4.03Å; L326-F330 WeakPolarHBondContact CD1-O 3.32Å; L326-F330 HydrophobicContact CD2-CB 3.86Å; L326-F330 HydrophobicContact CG-CB 4.46Å; L326-F330 PolarHBondContact O-N 3.36Å; L326-F330 VanDerWaalsContact O-N 3.16Å; L326-H332 HydrophobicContact CD1-CB 4.46Å; L326-L372 HydrophobicContact CD2-CD1 3.88Å; L326-F409 HydrophobicContact CD2-CZ 4.08Å
327	G	95	Very high	96	Very high	37 Å²	37	57.9 Å²	57.9	38%	0.381	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	18.1	178.9	0	0	0	0	0	115.3	H324 L325 E329	H324-G327 PolarHBondContact O-N 3.33Å; L325-G327 VanDerWaalsContact C-N 3.3Å; G327-E329 PolarHBondContact O-N 3.02Å; G327-E329 VanDerWaalsContact O-N 3.15Å
328	N	92.6	Very high	95.7	Very high	118 Å²	118	56.3 Å²	56.3	63%	0.631	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	12.8	-170.2	-160.4	42.9	0	0	0	114.8	L326 K369	L326-N328 PolarHBondContact O-N 3.38Å; N328-K369 VanDerWaalsContact O-CE 3.26Å; N328-K369 WeakPolarHBondContact O-CE 3.22Å; N328-K369 VanDerWaalsContact OD1-CE 3.26Å; N328-K369 WeakPolarHBondContact OD1-CE 3.28Å; N328-K369 PolarHBondContact OD1-NZ 3.18Å
329	E	93.6	Very high	95.5	Very high	59 Å²	59	55.1 Å²	55.1	28%	0.276	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-27.4	178.4	-62.6	-167.5	169.7	0	0	112	V5 L326 G327 K369 F370 I404	V5-E329 WeakPolarHBondContact CG2-OE2 3.06Å; L326-E329 PolarHBondContact O-N 3.11Å; G327-E329 PolarHBondContact O-N 3.02Å; G327-E329 VanDerWaalsContact O-N 3.15Å; E329-K369 WeakPolarHBondContact O-CB 3.27Å; E329-F370 PolarHBondContact O-N 3.01Å; E329-I404 HydrophobicContact CB-CD1 4.31Å; E329-I404 HydrophobicContact CG-CD1 4.42Å
330	F	96.1	Very high	95.4	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	157	-177.8	-62.7	-91.4	0	0	0	112.3	L326 F370 M383 V399 I404	L326-F330 HydrophobicContact CB-CB 4.03Å; L326-F330 WeakPolarHBondContact CD1-O 3.32Å; L326-F330 HydrophobicContact CD2-CB 3.86Å; L326-F330 HydrophobicContact CG-CB 4.46Å; L326-F330 PolarHBondContact O-N 3.36Å; L326-F330 VanDerWaalsContact O-N 3.16Å; F330-F370 CarbonylContact C-O 3.57Å; F330-F370 WeakPolarHBondContact CA-O 3.42Å; F330-F370 HydrophobicContact CD1-CB 3.56Å; F330-F370 HydrophobicContact CE1-CB 3.63Å; F330-F370 HydrophobicContact CG-CB 4.39Å; F330-F370 HydrophobicContact CZ-CB 4.5Å; F330-M383 HydrophobicContact CD1-CB 4.14Å; F330-M383 HydrophobicContact CD1-CG 3.82Å; F330-M383 HydrophobicContact CD1-SD 4.48Å; F330-M383 HydrophobicContact CD2-CG 4.2Å; F330-M383 HydrophobicContact CD2-SD 3.83Å; F330-M383 HydrophobicContact CE1-CB 3.73Å; F330-M383 HydrophobicContact CE1-CG 3.96Å; F330-M383 HydrophobicContact CE2-CB 4.27Å; F330-M383 HydrophobicContact CE2-CG 4.34Å; F330-M383 HydrophobicContact CE2-SD 4.16Å; F330-M383 HydrophobicContact CG-CG 3.96Å; F330-M383 HydrophobicContact CG-SD 4.02Å; F330-M383 HydrophobicContact CZ-CB 3.82Å; F330-M383 HydrophobicContact CZ-CG 4.23Å; F330-V399 HydrophobicContact CE2-CG1 4.06Å; F330-V399 HydrophobicContact CE2-CG2 4.48Å; F330-V399 HydrophobicContact CZ-CG1 3.8Å; F330-I404 HydrophobicContact CD2-CD1 3.92Å; F330-I404 HydrophobicContact CE2-CD1 3.81Å
331	T	95.8	Very high	95.3	Very high	11 Å²	11	63.1 Å²	63.1	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	142.5	171.5	-178	0	0	0	0	110	L333 K369 F370 L372	T331-L333 VanDerWaalsContact C-N 3.27Å; T331-L333 PolarHBondContact OG1-N 3.01Å; T331-L333 VanDerWaalsContact OG1-N 3.15Å; T331-K369 HydrophobicContact CG2-CB 4.16Å; T331-F370 PolarHBondContact N-O 3.14Å; T331-L372 WeakPolarHBondContact O-CB 3.4Å; T331-L372 PolarHBondContact O-N 3Å
332	H	96.1	Very high	95.3	Very high	35 Å²	35	64.6 Å²	64.6	16%	0.162	31%	0.312	C	S	.	.	S	Bend	trans	-75.7	-20	171.6	64.5	-80	0	0	0	111.4	Q316 A319 F320 L326 D352	Q316-H332 HydrophobicContact CB-CB 4.49Å; Q316-H332 VanDerWaalsContact CD-O 3.28Å; Q316-H332 VanDerWaalsContact CG-O 3.23Å; Q316-H332 WeakPolarHBondContact CG-O 3.42Å; Q316-H332 PolarHBondContact NE2-O 3.03Å; A319-H332 HydrophobicContact CB-CB 3.6Å; F320-H332 AromaticContact CD2-NE2 3.72Å; L326-H332 HydrophobicContact CD1-CB 4.46Å; H332-D352 IonicContact CD2-OD1 2.64Å; H332-D352 PolarHBondContact CD2-OD1 2.9Å; H332-D352 IonicContact NE2-OD1 3.98Å
333	L	96.3	Very high	95.2	Very high	19 Å²	19	61.7 Å²	61.7	10%	0.099	30%	0.299	C	S	.	.			trans	-69.1	138.2	176.6	-61.8	-176.4	0	0	0	110.6	T331 F335 Y350 D352 K361	T331-L333 VanDerWaalsContact C-N 3.27Å; T331-L333 PolarHBondContact OG1-N 3.01Å; T331-L333 VanDerWaalsContact OG1-N 3.15Å; L333-F335 HydrophobicContact CB-CE2 3.89Å; L333-F335 HydrophobicContact CB-CZ 4.22Å; L333-F335 HydrophobicContact CD1-CZ 4.39Å; L333-Y350 HydrophobicContact CD1-CD2 4.41Å; L333-Y350 HydrophobicContact CD2-CD2 4.09Å; L333-Y350 HydrophobicContact CD2-CE2 4.26Å; L333-D352 HydrophobicContact CD2-CB 3.92Å; L333-K361 HydrophobicContact CD1-CD 4.11Å
334	E	95.4	Very high	95.3	Very high	39 Å²	39	60.9 Å²	60.9	18%	0.182	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-104.5	138.1	174.6	-172.7	-176.6	158.5	0	0	110.6	R312 Y350 R351 W358	R312-E334 WeakPolarHBondContact CD-OE2 3.49Å; E334-Y350 CarbonylContact O-C 3.57Å; E334-Y350 WeakPolarHBondContact O-CA 3.34Å; E334-R351 HydrophobicContact CB-CG 3.9Å; E334-R351 HydrophobicContact CG-CG 4.47Å; E334-R351 PolarHBondContact N-O 3.21Å; E334-R351 PolarHBondContact O-N 3.39Å; E334-R351 IonicContact OE1-CZ 3.34Å; E334-R351 IonicContact OE1-NE 2.66Å; E334-R351 PolarHBondContact OE1-NE 2.92Å; E334-R351 IonicContact OE1-NH2 2.74Å; E334-R351 PolarHBondContact OE1-NH2 3.29Å; E334-R351 IonicContact OE2-CZ 2.86Å; E334-R351 IonicContact OE2-NE 2.81Å; E334-R351 PolarHBondContact OE2-NE 3.5Å; E334-R351 IonicContact OE2-NH2 3.08Å; E334-R351 PolarHBondContact OE2-NH2 3.45Å; E334-W358 HydrophobicContact CG-CH2 4.19Å
335	F	95.4	Very high	95.4	Very high	20 Å²	20	57.4 Å²	57.4	9%	0.088	29%	0.289	C	S	.	.			trans	-122.1	151.8	174.7	-62.1	-87	0	0	0	108.5	L333 R337 V339 M348 L349 K361 I363 D367	L333-F335 HydrophobicContact CB-CE2 3.89Å; L333-F335 HydrophobicContact CB-CZ 4.22Å; L333-F335 HydrophobicContact CD1-CZ 4.39Å; F335-R337 VanDerWaalsContact CB-O 3.24Å; F335-R337 WeakPolarHBondContact CB-O 3.39Å; F335-R337 PolarHBondContact O-N 2.73Å; F335-V339 HydrophobicContact CB-CG2 4.11Å; F335-V339 HydrophobicContact CD1-CG2 3.72Å; F335-V339 HydrophobicContact CD2-CG2 3.67Å; F335-V339 HydrophobicContact CE1-CG2 4.03Å; F335-V339 HydrophobicContact CE2-CG2 3.98Å; F335-V339 HydrophobicContact CG-CG2 3.54Å; F335-V339 HydrophobicContact CZ-CG2 4.16Å; F335-M348 HydrophobicContact CB-CE 4.27Å; F335-M348 HydrophobicContact CD1-CG 4.35Å; F335-M348 HydrophobicContact CD1-SD 4.38Å; F335-L349 WeakPolarHBondContact CD1-O 3.33Å; F335-K361 HydrophobicContact CE1-CD 4.11Å; F335-K361 HydrophobicContact CE1-CG 4.37Å; F335-K361 HydrophobicContact CZ-CD 4.16Å; F335-I363 HydrophobicContact CD1-CD1 4.1Å; F335-I363 HydrophobicContact CE1-CD1 3.43Å; F335-I363 VanDerWaalsContact CE1-CD1 3.43Å; F335-I363 HydrophobicContact CZ-CD1 4.11Å; F335-D367 HydrophobicContact CE2-CB 4.11Å; F335-D367 HydrophobicContact CZ-CB 3.73Å; F335-D367 WeakPolarHBondContact CZ-OD1 3.43Å
336	P	93.4	Very high	95.4	Very high	73 Å²	73	61.6 Å²	61.6	47%	0.474	31%	0.306	S	S	.	.	S	Bend	trans	-58.6	-19.3	178.4	-24.6	32.9	0	0	0	114.1	L349 W358	P336-L349 WeakPolarHBondContact CD-O 3.36Å; P336-L349 HydrophobicContact CG-CB 3.72Å; P336-L349 HydrophobicContact CG-CD1 4.33Å; P336-W358 VanDerWaalsContact CD-CZ3 3.45Å; P336-W358 HydrophobicContact CG-CE3 4.15Å; P336-W358 HydrophobicContact CG-CH2 4.06Å; P336-W358 HydrophobicContact CG-CZ3 3.75Å
337	R	91.8	Very high	95.5	Very high	121 Å²	121	68.8 Å²	68.8	46%	0.457	34%	0.337	S	S	.	.	S	Bend	trans	-157.6	169.5	169.5	59.7	165.7	173.9	75.9	-0.9	109.4	F335 V339 E343 M348	F335-R337 VanDerWaalsContact CB-O 3.24Å; F335-R337 WeakPolarHBondContact CB-O 3.39Å; F335-R337 PolarHBondContact O-N 2.73Å; R337-V339 PolarHBondContact O-N 3.46Å; R337-E343 IonicContact CZ-OE1 3.09Å; R337-E343 IonicContact CZ-OE2 2.65Å; R337-E343 VanDerWaalsContact NH1-CD 3.33Å; R337-E343 IonicContact NH1-OE1 3.36Å; R337-E343 PolarHBondContact NH1-OE1 3.39Å; R337-E343 IonicContact NH1-OE2 2.75Å; R337-E343 PolarHBondContact NH1-OE2 3.12Å; R337-E343 IonicContact NH2-OE1 3.67Å; R337-E343 PolarHBondContact NH2-OE1 2.73Å; R337-E343 IonicContact NH2-OE2 2.86Å; R337-M348 HydrophobicContact CG-CE 3.72Å
338	R	91.1	Very high	95.6	Very high	86 Å²	86	68.1 Å²	68.1	33%	0.325	33%	0.325	S	S	.	.			trans	-52.4	128.4	171.9	-171.8	176	-178.6	175.8	7.3	111.9	F370	R338-F370 VanDerWaalsContact NH1-CE1 3.31Å
339	V	94.6	Very high	95.9	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.042	31%	0.309	C	S	.	.			trans	-71.8	138.4	175.6	-175.2	0	0	0	0	109.9	F335 R337 E343 M348 I363 D367 L368	F335-V339 HydrophobicContact CB-CG2 4.11Å; F335-V339 HydrophobicContact CD1-CG2 3.72Å; F335-V339 HydrophobicContact CD2-CG2 3.67Å; F335-V339 HydrophobicContact CE1-CG2 4.03Å; F335-V339 HydrophobicContact CE2-CG2 3.98Å; F335-V339 HydrophobicContact CG-CG2 3.54Å; F335-V339 HydrophobicContact CZ-CG2 4.16Å; R337-V339 PolarHBondContact O-N 3.46Å; V339-E343 HydrophobicContact CG1-CB 4.43Å; V339-M348 HydrophobicContact CG2-SD 4.18Å; V339-I363 HydrophobicContact CG1-CD1 4.19Å; V339-I363 HydrophobicContact CG1-CG1 4.3Å; V339-I363 HydrophobicContact CG1-CG2 3.45Å; V339-I363 VanDerWaalsContact CG1-CG2 3.45Å; V339-I363 HydrophobicContact CG2-CD1 4.25Å; V339-D367 WeakPolarHBondContact CB-O 3.49Å; V339-D367 HydrophobicContact CG1-CB 4.44Å; V339-D367 HydrophobicContact CG2-CB 4.4Å; V339-L368 HydrophobicContact CB-CD2 4.49Å; V339-L368 HydrophobicContact CG1-CD2 3.99Å
340	Q	95.2	Very high	96.1	Very high	84 Å²	84	64.5 Å²	64.5	39%	0.393	30%	0.304	S	S	.	.			trans	-110.6	150.4	179.9	-59.2	-175.5	8.1	0	0	111	K342 E343	Q340-K342 HydrophobicContact CB-CG 4.12Å; Q340-K342 PolarHBondContact O-N 2.91Å; Q340-E343 PolarHBondContact N-OE2 2.95Å; Q340-E343 VanDerWaalsContact O-CB 3.3Å; Q340-E343 WeakPolarHBondContact O-CB 3.21Å; Q340-E343 PolarHBondContact O-N 2.87Å
341	R	96.3	Very high	96.1	Very high	179 Å²	179	66.8 Å²	66.8	68%	0.675	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31.3	177.9	-76.4	-173.6	178.3	-146.6	-2	114.1	E343 L344 L368	R341-E343 PolarHBondContact O-N 3.22Å; R341-E343 VanDerWaalsContact O-N 3.13Å; R341-L344 WeakPolarHBondContact O-CD1 3.37Å; R341-L344 WeakPolarHBondContact O-CG 3.37Å; R341-L344 PolarHBondContact O-N 2.94Å; R341-L368 HydrophobicContact CG-CD1 3.72Å; R341-L368 HydrophobicContact CG-CD2 4.16Å
342	K	96.9	Very high	96.1	Very high	138 Å²	138	67.3 Å²	67.3	60%	0.6	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-67.9	-6.1	177.1	76.6	-170.2	-170.4	-161.2	0	114.3	Q340 K346	Q340-K342 HydrophobicContact CB-CG 4.12Å; Q340-K342 PolarHBondContact O-N 2.91Å; K342-K346 WeakPolarHBondContact O-CE 3.33Å; K342-K346 PolarHBondContact O-NZ 3.49Å
343	E	97.1	Very high	96	Very high	16 Å²	16	67.5 Å²	67.5	8%	0.075	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-101.9	-5.6	-178.5	-68.8	152.1	-174.8	0	0	113.1	R337 V339 Q340 R341 G345 K346 I363	R337-E343 IonicContact CZ-OE1 3.09Å; R337-E343 IonicContact CZ-OE2 2.65Å; R337-E343 VanDerWaalsContact NH1-CD 3.33Å; R337-E343 IonicContact NH1-OE1 3.36Å; R337-E343 PolarHBondContact NH1-OE1 3.39Å; R337-E343 IonicContact NH1-OE2 2.75Å; R337-E343 PolarHBondContact NH1-OE2 3.12Å; R337-E343 IonicContact NH2-OE1 3.67Å; R337-E343 PolarHBondContact NH2-OE1 2.73Å; R337-E343 IonicContact NH2-OE2 2.86Å; V339-E343 HydrophobicContact CG1-CB 4.43Å; Q340-E343 PolarHBondContact N-OE2 2.95Å; Q340-E343 VanDerWaalsContact O-CB 3.3Å; Q340-E343 WeakPolarHBondContact O-CB 3.21Å; Q340-E343 PolarHBondContact O-N 2.87Å; R341-E343 PolarHBondContact O-N 3.22Å; R341-E343 VanDerWaalsContact O-N 3.13Å; E343-G345 PolarHBondContact O-N 3.43Å; E343-K346 VanDerWaalsContact O-CB 3.28Å; E343-K346 WeakPolarHBondContact O-CB 3.27Å; E343-K346 PolarHBondContact O-N 2.92Å; E343-I363 WeakPolarHBondContact O-CB 3.3Å
344	L	97.8	Very high	96	Very high	62 Å²	62	71.8 Å²	71.8	33%	0.325	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	131.2	173.8	-68.4	169.2	0	0	0	111.1	R341 K346 I363 E364 L368	R341-L344 WeakPolarHBondContact O-CD1 3.37Å; R341-L344 WeakPolarHBondContact O-CG 3.37Å; R341-L344 PolarHBondContact O-N 2.94Å; L344-K346 PolarHBondContact O-N 3.46Å; L344-I363 HydrophobicContact CD2-CG2 4.19Å; L344-E364 WeakPolarHBondContact CD2-O 3.44Å; L344-L368 HydrophobicContact CD1-CD1 4.39Å; L344-L368 HydrophobicContact CD2-CD1 4.26Å; L344-L368 HydrophobicContact CD2-CG 4.44Å
345	G	97.9	Very high	96	Very high	59 Å²	59	72 Å²	72	61%	0.608	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.3	-176.2	0	0	0	0	0	115.5	E343 I363	E343-G345 PolarHBondContact O-N 3.43Å; G345-I363 PolarHBondContact N-O 3.49Å
346	K	98.3	Very high	96	Very high	118 Å²	118	76.9 Å²	76.9	51%	0.513	37%	0.371	S	S	.	.	S	Bend	trans	-91.8	158.4	174.9	-58.2	-177.2	-177.1	156.5	0	110.9	K342 E343 L344 T362 I363	K342-K346 WeakPolarHBondContact O-CE 3.33Å; K342-K346 PolarHBondContact O-NZ 3.49Å; E343-K346 VanDerWaalsContact O-CB 3.28Å; E343-K346 WeakPolarHBondContact O-CB 3.27Å; E343-K346 PolarHBondContact O-N 2.92Å; L344-K346 PolarHBondContact O-N 3.46Å; K346-T362 WeakPolarHBondContact O-CA 3.38Å; K346-I363 PolarHBondContact O-N 3.27Å
347	K	98.3	Very high	96.1	Very high	157 Å²	157	75.2 Å²	75.2	68%	0.683	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.6	171	-69.6	-169.9	176.9	-173.3	0	110.9	Y360 K361	K347-Y360 HydrophobicContact CB-CD1 4.18Å; K347-K361 CarbonylContact C-O 3.51Å; K347-K361 VanDerWaalsContact CA-O 3.26Å; K347-K361 WeakPolarHBondContact CA-O 3.48Å
348	M	97.9	Very high	96.4	Very high	24 Å²	24	74.4 Å²	74.4	12%	0.118	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.7	173.9	-172.5	163.7	-179.4	0	0	110.2	F335 R337 V339 Y360 K361 I363	F335-M348 HydrophobicContact CB-CE 4.27Å; F335-M348 HydrophobicContact CD1-CG 4.35Å; F335-M348 HydrophobicContact CD1-SD 4.38Å; R337-M348 HydrophobicContact CG-CE 3.72Å; V339-M348 HydrophobicContact CG2-SD 4.18Å; M348-Y360 WeakPolarHBondContact O-CA 3.15Å; M348-K361 PolarHBondContact N-O 2.89Å; M348-K361 PolarHBondContact O-N 2.89Å; M348-I363 HydrophobicContact CB-CD1 3.76Å; M348-I363 HydrophobicContact CB-CG1 3.74Å
349	L	98.3	Very high	96.7	Very high	57 Å²	57	72 Å²	72	30%	0.298	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	136.5	172.1	-70.6	171.5	0	0	0	109.8	F335 P336 W358 A359 Y360	F335-L349 WeakPolarHBondContact CD1-O 3.33Å; P336-L349 WeakPolarHBondContact CD-O 3.36Å; P336-L349 HydrophobicContact CG-CB 3.72Å; P336-L349 HydrophobicContact CG-CD1 4.33Å; L349-W358 HydrophobicContact CB-CE3 4.07Å; L349-W358 HydrophobicContact CD2-CB 4.07Å; L349-A359 CarbonylContact C-O 3.56Å; L349-A359 VanDerWaalsContact CA-O 3.26Å; L349-A359 WeakPolarHBondContact CA-O 3.4Å; L349-Y360 HydrophobicContact CD2-CD1 4.13Å; L349-Y360 HydrophobicContact CD2-CD2 3.99Å; L349-Y360 HydrophobicContact CD2-CE1 3.78Å; L349-Y360 HydrophobicContact CD2-CE2 3.63Å; L349-Y360 HydrophobicContact CD2-CG 4.23Å; L349-Y360 HydrophobicContact CG-CD1 4.32Å; L349-Y360 HydrophobicContact CG-CE1 3.78Å; L349-Y360 HydrophobicContact CG-CE2 4.47Å
350	Y	97.7	Very high	96.9	Very high	44 Å²	44	79 Å²	79	17%	0.173	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	162.9	172.8	86.8	-71	0	0	0	110	L333 E334 D352 M355 W358 A359 K361	L333-Y350 HydrophobicContact CD1-CD2 4.41Å; L333-Y350 HydrophobicContact CD2-CD2 4.09Å; L333-Y350 HydrophobicContact CD2-CE2 4.26Å; E334-Y350 CarbonylContact O-C 3.57Å; E334-Y350 WeakPolarHBondContact O-CA 3.34Å; Y350-D352 HydrophobicContact CE2-CB 4.38Å; Y350-M355 HydrophobicContact CE2-CE 4.24Å; Y350-M355 HydrophobicContact CE2-SD 4.45Å; Y350-M355 WeakPolarHBondContact OH-CE 3.36Å; Y350-W358 VanDerWaalsContact C-CE3 3.49Å; Y350-A359 HydrophobicContact CD1-CB 4.26Å; Y350-A359 VanDerWaalsContact CD1-O 3.24Å; Y350-A359 WeakPolarHBondContact CD1-O 3.29Å; Y350-A359 HydrophobicContact CE1-CB 3.7Å; Y350-A359 PolarHBondContact N-O 2.82Å; Y350-A359 PolarHBondContact O-N 3.39Å; Y350-K361 HydrophobicContact CD1-CB 3.6Å; Y350-K361 HydrophobicContact CD1-CD 3.91Å; Y350-K361 HydrophobicContact CD1-CG 3.67Å; Y350-K361 HydrophobicContact CD2-CD 3.86Å; Y350-K361 HydrophobicContact CE1-CB 3.62Å; Y350-K361 HydrophobicContact CE1-CD 4.33Å; Y350-K361 HydrophobicContact CE1-CG 4.18Å; Y350-K361 HydrophobicContact CE2-CD 4.27Å; Y350-K361 HydrophobicContact CG-CB 4.26Å; Y350-K361 HydrophobicContact CG-CD 3.65Å; Y350-K361 HydrophobicContact CG-CG 3.87Å
351	R	96.5	Very high	97	Very high	54 Å²	54	76.8 Å²	76.8	20%	0.204	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-142.6	149.9	166	66.2	-179.6	-177.4	-175.9	-4.4	111.3	E334 M355 G357 W358	E334-R351 HydrophobicContact CB-CG 3.9Å; E334-R351 HydrophobicContact CG-CG 4.47Å; E334-R351 PolarHBondContact N-O 3.21Å; E334-R351 PolarHBondContact O-N 3.39Å; E334-R351 IonicContact OE1-CZ 3.34Å; E334-R351 IonicContact OE1-NE 2.66Å; E334-R351 PolarHBondContact OE1-NE 2.92Å; E334-R351 IonicContact OE1-NH2 2.74Å; E334-R351 PolarHBondContact OE1-NH2 3.29Å; E334-R351 IonicContact OE2-CZ 2.86Å; E334-R351 IonicContact OE2-NE 2.81Å; E334-R351 PolarHBondContact OE2-NE 3.5Å; E334-R351 IonicContact OE2-NH2 3.08Å; E334-R351 PolarHBondContact OE2-NH2 3.45Å; R351-M355 HydrophobicContact CB-CB 4.17Å; R351-M355 HydrophobicContact CB-SD 4.43Å; R351-G357 VanDerWaalsContact CB-O 3.31Å; R351-G357 WeakPolarHBondContact CB-O 3.41Å; R351-W358 HydrophobicContact CB-CD2 4.38Å; R351-W358 HydrophobicContact CB-CE3 4.12Å; R351-W358 HydrophobicContact CB-CZ3 4.4Å; R351-W358 HydrophobicContact CG-CD2 4.39Å; R351-W358 HydrophobicContact CG-CE3 4.09Å; R351-W358 HydrophobicContact CG-CH2 4.09Å; R351-W358 HydrophobicContact CG-CZ2 4.4Å; R351-W358 HydrophobicContact CG-CZ3 3.92Å
352	D	95.3	Very high	97.1	Very high	22 Å²	22	71.5 Å²	71.5	12%	0.118	37%	0.366	C	S	.	.			trans	-117	177.6	-178.1	-158.3	-4.5	0	0	0	111.2	R312 H332 L333 Y350 N354 M355	R312-D352 PolarHBondContact NH1-O 3.08Å; R312-D352 VanDerWaalsContact NH1-O 3.11Å; H332-D352 IonicContact CD2-OD1 2.64Å; H332-D352 PolarHBondContact CD2-OD1 2.9Å; H332-D352 IonicContact NE2-OD1 3.98Å; L333-D352 HydrophobicContact CD2-CB 3.92Å; Y350-D352 HydrophobicContact CE2-CB 4.38Å; D352-N354 VanDerWaalsContact C-N 3.25Å; D352-N354 PolarHBondContact O-N 3.34Å; D352-M355 HydrophobicContact CB-CG 4.31Å; D352-M355 HydrophobicContact CB-SD 4.38Å; D352-M355 WeakPolarHBondContact O-CB 3.4Å; D352-M355 PolarHBondContact O-N 2.76Å
353	F	95.4	Very high	97.2	Very high	39 Å²	39	65.1 Å²	65.1	17%	0.171	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.9	-175.5	71.2	-92.7	0	0	0	113	Q313 Q316 Y317 F320 M355	Q313-F353 WeakPolarHBondContact CG-O 3.44Å; Q313-F353 PolarHBondContact NE2-O 2.67Å; Q316-F353 HydrophobicContact CB-CB 3.65Å; Y317-F353 AromaticContact CD2-CD2 3.62Å; Y317-F353 HydrophobicContact CD2-CD2 3.62Å; Y317-F353 AromaticContact CD2-CE2 3.66Å; Y317-F353 HydrophobicContact CD2-CE2 3.66Å; Y317-F353 HydrophobicContact CD2-CG 4.25Å; Y317-F353 HydrophobicContact CD2-CZ 4.32Å; Y317-F353 HydrophobicContact CE2-CE2 4.2Å; Y317-F353 HydrophobicContact CG-CD2 4.32Å; F320-F353 HydrophobicContact CB-CD1 3.82Å; F320-F353 HydrophobicContact CB-CE1 3.99Å; F320-F353 HydrophobicContact CD1-CD1 4.13Å; F320-F353 AromaticContact CD1-CE1 3.43Å; F320-F353 HydrophobicContact CD1-CE1 3.43Å; F320-F353 VanDerWaalsContact CD1-CE1 3.43Å; F320-F353 AromaticContact CD1-CZ 3.8Å; F320-F353 HydrophobicContact CD1-CZ 3.8Å; F320-F353 HydrophobicContact CD2-CD1 4.2Å; F320-F353 AromaticContact CD2-CE1 3.7Å; F320-F353 HydrophobicContact CD2-CE1 3.7Å; F320-F353 AromaticContact CE1-CE1 3.76Å; F320-F353 HydrophobicContact CE1-CE1 3.76Å; F320-F353 AromaticContact CE1-CZ 3.88Å; F320-F353 HydrophobicContact CE1-CZ 3.88Å; F320-F353 HydrophobicContact CE2-CE1 4Å; F320-F353 AromaticContact CG-CD1 3.78Å; F320-F353 HydrophobicContact CG-CD1 3.78Å; F320-F353 AromaticContact CG-CE1 3.4Å; F320-F353 HydrophobicContact CG-CE1 3.4Å; F320-F353 VanDerWaalsContact CG-CE1 3.4Å; F320-F353 HydrophobicContact CG-CZ 4.24Å; F320-F353 HydrophobicContact CZ-CE1 4.03Å; F320-F353 HydrophobicContact CZ-CZ 4.38Å; F353-M355 VanDerWaalsContact C-N 3.3Å; F353-M355 PolarHBondContact O-N 3.43Å
354	N	95.5	Very high	97.2	Very high	108 Å²	108	70 Å²	70	58%	0.578	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	0.4	-179.8	65.2	9.9	0	0	0	113.8	D352	D352-N354 VanDerWaalsContact C-N 3.25Å; D352-N354 PolarHBondContact O-N 3.34Å
355	M	96.1	Very high	97.1	Very high	44 Å²	44	72.3 Å²	72.3	22%	0.217	37%	0.374	C	S	.	.			trans	-104.5	133.2	-176.8	-58.3	-171.4	174	0	0	111.2	R312 Y350 R351 D352 F353 A359	R312-M355 PolarHBondContact NH1-O 3.35Å; R312-M355 PolarHBondContact NH2-O 3.26Å; Y350-M355 HydrophobicContact CE2-CE 4.24Å; Y350-M355 HydrophobicContact CE2-SD 4.45Å; Y350-M355 WeakPolarHBondContact OH-CE 3.36Å; R351-M355 HydrophobicContact CB-CB 4.17Å; R351-M355 HydrophobicContact CB-SD 4.43Å; D352-M355 HydrophobicContact CB-CG 4.31Å; D352-M355 HydrophobicContact CB-SD 4.38Å; D352-M355 WeakPolarHBondContact O-CB 3.4Å; D352-M355 PolarHBondContact O-N 2.76Å; F353-M355 VanDerWaalsContact C-N 3.3Å; F353-M355 PolarHBondContact O-N 3.43Å; M355-A359 HydrophobicContact CE-CB 4.37Å; M355-A359 HydrophobicContact SD-CB 4.33Å
356	T	94.5	Very high	96.9	Very high	122 Å²	122	74.4 Å²	74.4	75%	0.748	37%	0.368	S	S	*	.	S	Bend	trans	-95.1	-25.3	163.9	53.9	0	0	0	0	112
357	G	95.6	Very high	96.8	Very high	38 Å²	38	69 Å²	69	39%	0.392	35%	0.345	S	S	.	.	S	Bend	trans	-100.1	-164.8	174.5	0	0	0	0	0	113.7	R351	R351-G357 VanDerWaalsContact CB-O 3.31Å; R351-G357 WeakPolarHBondContact CB-O 3.41Å
358	W	97.9	Very high	96.7	Very high	105 Å²	105	63 Å²	63	40%	0.398	32%	0.32	S	S	.	.			trans	-117.8	146.9	178.5	-63.6	85.6	0	0	0	111.2	E334 P336 L349 Y350 R351	E334-W358 HydrophobicContact CG-CH2 4.19Å; P336-W358 VanDerWaalsContact CD-CZ3 3.45Å; P336-W358 HydrophobicContact CG-CE3 4.15Å; P336-W358 HydrophobicContact CG-CH2 4.06Å; P336-W358 HydrophobicContact CG-CZ3 3.75Å; L349-W358 HydrophobicContact CB-CE3 4.07Å; L349-W358 HydrophobicContact CD2-CB 4.07Å; Y350-W358 VanDerWaalsContact C-CE3 3.49Å; R351-W358 HydrophobicContact CB-CD2 4.38Å; R351-W358 HydrophobicContact CB-CE3 4.12Å; R351-W358 HydrophobicContact CB-CZ3 4.4Å; R351-W358 HydrophobicContact CG-CD2 4.39Å; R351-W358 HydrophobicContact CG-CE3 4.09Å; R351-W358 HydrophobicContact CG-CH2 4.09Å; R351-W358 HydrophobicContact CG-CZ2 4.4Å; R351-W358 HydrophobicContact CG-CZ3 3.92Å
359	A	98.2	Very high	96.5	Very high	34 Å²	34	64.1 Å²	64.1	28%	0.281	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	167.4	172.7	0	0	0	0	0	110.4	L349 Y350 M355	L349-A359 CarbonylContact C-O 3.56Å; L349-A359 VanDerWaalsContact CA-O 3.26Å; L349-A359 WeakPolarHBondContact CA-O 3.4Å; Y350-A359 HydrophobicContact CD1-CB 4.26Å; Y350-A359 VanDerWaalsContact CD1-O 3.24Å; Y350-A359 WeakPolarHBondContact CD1-O 3.29Å; Y350-A359 HydrophobicContact CE1-CB 3.7Å; Y350-A359 PolarHBondContact N-O 2.82Å; Y350-A359 PolarHBondContact O-N 3.39Å; M355-A359 HydrophobicContact CE-CB 4.37Å; M355-A359 HydrophobicContact SD-CB 4.33Å
360	Y	98.3	Very high	96.3	Very high	154 Å²	154	61.9 Å²	61.9	60%	0.604	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.9	172.4	-75.9	-82.7	0	0	0	110.6	K347 M348 L349	K347-Y360 HydrophobicContact CB-CD1 4.18Å; M348-Y360 WeakPolarHBondContact O-CA 3.15Å; L349-Y360 HydrophobicContact CD2-CD1 4.13Å; L349-Y360 HydrophobicContact CD2-CD2 3.99Å; L349-Y360 HydrophobicContact CD2-CE1 3.78Å; L349-Y360 HydrophobicContact CD2-CE2 3.63Å; L349-Y360 HydrophobicContact CD2-CG 4.23Å; L349-Y360 HydrophobicContact CG-CD1 4.32Å; L349-Y360 HydrophobicContact CG-CE1 3.78Å; L349-Y360 HydrophobicContact CG-CE2 4.47Å
361	K	97.4	Very high	96.1	Very high	38 Å²	38	61 Å²	61	17%	0.165	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	155.5	164.6	74.5	-177.6	-60.8	-99.7	0	111.1	L333 F335 K347 M348 Y350 I363 D367	L333-K361 HydrophobicContact CD1-CD 4.11Å; F335-K361 HydrophobicContact CE1-CD 4.11Å; F335-K361 HydrophobicContact CE1-CG 4.37Å; F335-K361 HydrophobicContact CZ-CD 4.16Å; K347-K361 CarbonylContact C-O 3.51Å; K347-K361 VanDerWaalsContact CA-O 3.26Å; K347-K361 WeakPolarHBondContact CA-O 3.48Å; M348-K361 PolarHBondContact N-O 2.89Å; M348-K361 PolarHBondContact O-N 2.89Å; Y350-K361 HydrophobicContact CD1-CB 3.6Å; Y350-K361 HydrophobicContact CD1-CD 3.91Å; Y350-K361 HydrophobicContact CD1-CG 3.67Å; Y350-K361 HydrophobicContact CD2-CD 3.86Å; Y350-K361 HydrophobicContact CE1-CB 3.62Å; Y350-K361 HydrophobicContact CE1-CD 4.33Å; Y350-K361 HydrophobicContact CE1-CG 4.18Å; Y350-K361 HydrophobicContact CE2-CD 4.27Å; Y350-K361 HydrophobicContact CG-CB 4.26Å; Y350-K361 HydrophobicContact CG-CD 3.65Å; Y350-K361 HydrophobicContact CG-CG 3.87Å; K361-I363 HydrophobicContact CG-CD1 4.42Å; K361-D367 IonicContact NZ-OD1 3.79Å; K361-D367 PolarHBondContact NZ-OD1 3.07Å; K361-D367 IonicContact NZ-OD2 2.71Å; K361-D367 PolarHBondContact NZ-OD2 2.96Å
362	T	98.4	Very high	96.1	Very high	68 Å²	68	58.5 Å²	58.5	42%	0.417	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131.2	165.5	-56.9	0	0	0	0	108.5	K346	K346-T362 WeakPolarHBondContact O-CA 3.38Å
363	I	98.3	Very high	96.1	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.021	30%	0.303	C	S	.	.			trans	-77	132.1	-177.8	-66.7	-56.3	0	0	0	111.2	F335 V339 E343 L344 G345 K346 M348 K361 D367	F335-I363 HydrophobicContact CD1-CD1 4.1Å; F335-I363 HydrophobicContact CE1-CD1 3.43Å; F335-I363 VanDerWaalsContact CE1-CD1 3.43Å; F335-I363 HydrophobicContact CZ-CD1 4.11Å; V339-I363 HydrophobicContact CG1-CD1 4.19Å; V339-I363 HydrophobicContact CG1-CG1 4.3Å; V339-I363 HydrophobicContact CG1-CG2 3.45Å; V339-I363 VanDerWaalsContact CG1-CG2 3.45Å; V339-I363 HydrophobicContact CG2-CD1 4.25Å; E343-I363 WeakPolarHBondContact O-CB 3.3Å; L344-I363 HydrophobicContact CD2-CG2 4.19Å; G345-I363 PolarHBondContact N-O 3.49Å; K346-I363 PolarHBondContact O-N 3.27Å; M348-I363 HydrophobicContact CB-CD1 3.76Å; M348-I363 HydrophobicContact CB-CG1 3.74Å; K361-I363 HydrophobicContact CG-CD1 4.42Å; I363-D367 WeakPolarHBondContact CA-OD2 3.48Å; I363-D367 HydrophobicContact CD1-CB 4.22Å; I363-D367 HydrophobicContact CG2-CB 4.23Å
364	E	97.2	Very high	96	Very high	118 Å²	118	59 Å²	59	55%	0.551	30%	0.303	S	S	*	.			trans	-119	168.1	-179.7	-63.5	172.9	173.4	0	0	110.6	L344 E366 D367	L344-E364 WeakPolarHBondContact CD2-O 3.44Å; E364-E366 PolarHBondContact O-N 3.16Å; E364-D367 PolarHBondContact N-OD2 2.94Å; E364-D367 WeakPolarHBondContact O-CB 3.05Å; E364-D367 PolarHBondContact O-N 2.93Å
365	D	96.2	Very high	95.8	Very high	112 Å²	112	55.6 Å²	55.6	60%	0.599	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.7	-33.5	-179.3	-79.9	-64.1	0	0	0	113	D367 L368	D365-D367 PolarHBondContact O-N 3.17Å; D365-L368 VanDerWaalsContact O-CB 3.31Å; D365-L368 WeakPolarHBondContact O-CB 3.15Å; D365-L368 WeakPolarHBondContact O-CG 3.21Å; D365-L368 PolarHBondContact O-N 3.41Å; D365-L368 VanDerWaalsContact O-N 3.15Å
366	E	94	Very high	95.6	Very high	103 Å²	103	61 Å²	61	48%	0.481	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-63.3	-25.3	177	-65.4	-61.2	144	0	0	113.1	E364 L368 K369	E364-E366 PolarHBondContact O-N 3.16Å; E366-L368 PolarHBondContact O-N 3.28Å; E366-K369 WeakPolarHBondContact O-CB 3.34Å; E366-K369 WeakPolarHBondContact O-CD 3.25Å; E366-K369 VanDerWaalsContact O-CG 3.31Å; E366-K369 WeakPolarHBondContact O-CG 3.45Å; E366-K369 PolarHBondContact O-N 2.7Å; E366-K369 WeakPolarHBondContact OE2-CE 3.45Å; E366-K369 IonicContact OE2-NZ 3.79Å; E366-K369 PolarHBondContact OE2-NZ 3.03Å
367	D	95.8	Very high	95.4	Very high	5 Å²	5	57 Å²	57	3%	0.027	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-77.2	-8.6	178.8	-59.1	-43.9	0	0	0	112.8	F335 V339 K361 I363 E364 D365 K369	F335-D367 HydrophobicContact CE2-CB 4.11Å; F335-D367 HydrophobicContact CZ-CB 3.73Å; F335-D367 WeakPolarHBondContact CZ-OD1 3.43Å; V339-D367 WeakPolarHBondContact CB-O 3.49Å; V339-D367 HydrophobicContact CG1-CB 4.44Å; V339-D367 HydrophobicContact CG2-CB 4.4Å; K361-D367 IonicContact NZ-OD1 3.79Å; K361-D367 PolarHBondContact NZ-OD1 3.07Å; K361-D367 IonicContact NZ-OD2 2.71Å; K361-D367 PolarHBondContact NZ-OD2 2.96Å; I363-D367 WeakPolarHBondContact CA-OD2 3.48Å; I363-D367 HydrophobicContact CD1-CB 4.22Å; I363-D367 HydrophobicContact CG2-CB 4.23Å; E364-D367 PolarHBondContact N-OD2 2.94Å; E364-D367 WeakPolarHBondContact O-CB 3.05Å; E364-D367 PolarHBondContact O-N 2.93Å; D365-D367 PolarHBondContact O-N 3.17Å; D367-K369 PolarHBondContact O-N 3.32Å
368	L	95.8	Very high	95	Very high	31 Å²	31	61 Å²	61	16%	0.162	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-76.6	-8.7	176	-61	173.9	0	0	0	113.2	V339 R341 L344 D365 E366	V339-L368 HydrophobicContact CB-CD2 4.49Å; V339-L368 HydrophobicContact CG1-CD2 3.99Å; R341-L368 HydrophobicContact CG-CD1 3.72Å; R341-L368 HydrophobicContact CG-CD2 4.16Å; L344-L368 HydrophobicContact CD1-CD1 4.39Å; L344-L368 HydrophobicContact CD2-CD1 4.26Å; L344-L368 HydrophobicContact CD2-CG 4.44Å; D365-L368 VanDerWaalsContact O-CB 3.31Å; D365-L368 WeakPolarHBondContact O-CB 3.15Å; D365-L368 WeakPolarHBondContact O-CG 3.21Å; D365-L368 PolarHBondContact O-N 3.41Å; D365-L368 VanDerWaalsContact O-N 3.15Å; E366-L368 PolarHBondContact O-N 3.28Å
369	K	95.1	Very high	94.7	Very high	47 Å²	47	62.6 Å²	62.6	20%	0.204	32%	0.319	C	S	.	.	S	Bend	trans	-61.8	158.8	173.7	-70.8	175.7	177.6	175.3	0	111.4	N328 E329 T331 E366 D367	N328-K369 VanDerWaalsContact O-CE 3.26Å; N328-K369 WeakPolarHBondContact O-CE 3.22Å; N328-K369 VanDerWaalsContact OD1-CE 3.26Å; N328-K369 WeakPolarHBondContact OD1-CE 3.28Å; N328-K369 PolarHBondContact OD1-NZ 3.18Å; E329-K369 WeakPolarHBondContact O-CB 3.27Å; T331-K369 HydrophobicContact CG2-CB 4.16Å; E366-K369 WeakPolarHBondContact O-CB 3.34Å; E366-K369 WeakPolarHBondContact O-CD 3.25Å; E366-K369 VanDerWaalsContact O-CG 3.31Å; E366-K369 WeakPolarHBondContact O-CG 3.45Å; E366-K369 PolarHBondContact O-N 2.7Å; E366-K369 WeakPolarHBondContact OE2-CE 3.45Å; E366-K369 IonicContact OE2-NZ 3.79Å; E366-K369 PolarHBondContact OE2-NZ 3.03Å; D367-K369 PolarHBondContact O-N 3.32Å
370	F	93.6	Very high	94.6	Very high	9 Å²	9	61 Å²	61	4%	0.039	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.7	179.3	-70.3	-91.7	0	0	0	110.7	V5 V9 E329 F330 T331 R338	V5-F370 HydrophobicContact CB-CD2 4.2Å; V5-F370 HydrophobicContact CB-CE1 4.39Å; V5-F370 HydrophobicContact CB-CE2 3.53Å; V5-F370 HydrophobicContact CB-CZ 3.61Å; V5-F370 HydrophobicContact CG1-CD1 3.95Å; V5-F370 HydrophobicContact CG1-CD2 3.68Å; V5-F370 HydrophobicContact CG1-CE1 3.67Å; V5-F370 HydrophobicContact CG1-CE2 3.4Å; V5-F370 VanDerWaalsContact CG1-CE2 3.4Å; V5-F370 HydrophobicContact CG1-CG 3.93Å; V5-F370 HydrophobicContact CG1-CZ 3.37Å; V5-F370 HydrophobicContact CG2-CE2 4.18Å; V9-F370 HydrophobicContact CG2-CD1 4.39Å; V9-F370 HydrophobicContact CG2-CE1 4.01Å; E329-F370 PolarHBondContact O-N 3.01Å; F330-F370 CarbonylContact C-O 3.57Å; F330-F370 WeakPolarHBondContact CA-O 3.42Å; F330-F370 HydrophobicContact CD1-CB 3.56Å; F330-F370 HydrophobicContact CE1-CB 3.63Å; F330-F370 HydrophobicContact CG-CB 4.39Å; F330-F370 HydrophobicContact CZ-CB 4.5Å; T331-F370 PolarHBondContact N-O 3.14Å; R338-F370 VanDerWaalsContact NH1-CE1 3.31Å
371	P	93.3	Very high	94.5	Very high	25 Å²	25	57.2 Å²	57.2	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	143.4	177.9	31	-35.7	0	0	0	110.4	I373 Y374	P371-I373 WeakPolarHBondContact CB-O 3.48Å; P371-I373 WeakPolarHBondContact CG-O 3.31Å; P371-I373 PolarHBondContact O-N 3.05Å; P371-Y374 HydrophobicContact CG-CD2 4.08Å
372	L	96	Very high	94.6	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	28%	0.283	C	S	.	.	S	Bend	trans	-56	-36.9	174.1	175	61.7	0	0	0	112.1	L315 Q316 A319 L326 T331 V382 M383 F409	L315-L372 HydrophobicContact CB-CD2 3.89Å; L315-L372 WeakPolarHBondContact O-CD2 3.16Å; Q316-L372 HydrophobicContact CG-CD2 4.46Å; A319-L372 HydrophobicContact CB-CD2 3.69Å; L326-L372 HydrophobicContact CD2-CD1 3.88Å; T331-L372 WeakPolarHBondContact O-CB 3.4Å; T331-L372 PolarHBondContact O-N 3Å; L372-V382 HydrophobicContact CD1-CG1 4.07Å; L372-M383 HydrophobicContact CD1-CG 3.73Å; L372-M383 HydrophobicContact CD1-SD 4.19Å; L372-M383 PolarHBondContact O-N 3.21Å; L372-F409 HydrophobicContact CD1-CD1 4.29Å; L372-F409 HydrophobicContact CD1-CE1 3.99Å; L372-F409 HydrophobicContact CD1-CE2 4.29Å; L372-F409 HydrophobicContact CD1-CZ 3.98Å; L372-F409 HydrophobicContact CD2-CE1 4.05Å
373	I	96.1	Very high	94.5	Very high	24 Å²	24	52.2 Å²	52.2	12%	0.123	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.3	175.2	-63.7	154.9	0	0	0	107.5	P308 R312 L315 P371	P308-I373 HydrophobicContact CB-CG1 4.1Å; P308-I373 HydrophobicContact CB-CG2 3.74Å; P308-I373 WeakPolarHBondContact O-CD1 3.02Å; R312-I373 HydrophobicContact CB-CD1 3.79Å; R312-I373 HydrophobicContact CG-CD1 3.61Å; L315-I373 HydrophobicContact CD1-CD1 4.03Å; L315-I373 HydrophobicContact CD1-CG1 4.04Å; P371-I373 WeakPolarHBondContact CB-O 3.48Å; P371-I373 WeakPolarHBondContact CG-O 3.31Å; P371-I373 PolarHBondContact O-N 3.05Å
374	Y	92.1	Very high	94.3	Very high	46 Å²	46	54 Å²	54	18%	0.18	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.6	-177	-173.1	-89.1	0	0	0	110.6	V9 F12 P371 A380 R381 A384	V9-Y374 HydrophobicContact CG1-CE1 4.39Å; V9-Y374 HydrophobicContact CG1-CE2 4.14Å; V9-Y374 VanDerWaalsContact CG1-OH 3.22Å; V9-Y374 WeakPolarHBondContact CG1-OH 3.28Å; F12-Y374 AromaticContact CD1-CE1 3.93Å; F12-Y374 HydrophobicContact CD1-CE1 3.93Å; F12-Y374 HydrophobicContact CE1-CE1 4.28Å; P371-Y374 HydrophobicContact CG-CD2 4.08Å; Y374-A380 CarbonylContact O-C 3.6Å; Y374-A380 VanDerWaalsContact O-CA 3.31Å; Y374-A380 WeakPolarHBondContact O-CA 3.27Å; Y374-R381 PolarHBondContact N-O 2.69Å; Y374-R381 PolarHBondContact O-N 2.89Å; Y374-A384 HydrophobicContact CD1-CB 4.27Å; Y374-A384 HydrophobicContact CG-CB 4.32Å
375	G	91.9	Very high	94.3	Very high	38 Å²	38	50.1 Å²	50.1	39%	0.392	26%	0.262	S	S	.	.	S	Bend	trans	91.4	-177.7	-174.9	0	0	0	0	0	112.4
376	E	91.4	Very high	94.3	Very high	157 Å²	157	45.3 Å²	45.3	73%	0.734	24%	0.236	S	C	*	.	S	Bend	trans	-141.3	150.1	-176.3	62.8	-173.2	171.7	0	0	110.4	E309 K378 K379 A380	E309-E376 WeakPolarHBondContact OE1-CA 3.2Å; E376-K378 PolarHBondContact O-N 2.93Å; E376-K379 WeakPolarHBondContact O-CB 3.01Å; E376-K379 PolarHBondContact O-N 3.26Å; E376-K379 VanDerWaalsContact O-N 3.08Å; E376-A380 PolarHBondContact O-N 3.06Å
377	G	91.3	Very high	94.5	Very high	39 Å²	39	41.2 Å²	41.2	40%	0.402	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	52.6	-134.8	-176.4	0	0	0	0	0	112.1	E309 K379 A380	E309-G377 VanDerWaalsContact CD-N 3.25Å; E309-G377 PolarHBondContact OE1-N 3.02Å; E309-G377 VanDerWaalsContact OE2-CA 3.24Å; E309-G377 WeakPolarHBondContact OE2-CA 3.29Å; E309-G377 PolarHBondContact OE2-N 3.15Å; E309-G377 VanDerWaalsContact OE2-N 3.09Å; G377-K379 PolarHBondContact O-N 3.46Å; G377-A380 WeakPolarHBondContact O-CB 3.45Å; G377-A380 PolarHBondContact O-N 3.49Å
378	K	87.3	Confident	94.6	Very high	120 Å²	120	41.4 Å²	41.4	52%	0.522	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-60.8	-16.6	178.9	-59.6	-176.2	175.7	-168.5	0	115.2	E376 R381 D441	E376-K378 PolarHBondContact O-N 2.93Å; K378-R381 PolarHBondContact O-NH1 3.23Å; K378-D441 WeakPolarHBondContact CD-OD2 3.27Å; K378-D441 VanDerWaalsContact CE-CG 3.43Å; K378-D441 WeakPolarHBondContact CE-OD1 3.44Å; K378-D441 WeakPolarHBondContact CE-OD2 3.5Å; K378-D441 PolarHBondContact NZ-O 3.09Å; K378-D441 IonicContact NZ-OD1 3.08Å; K378-D441 PolarHBondContact NZ-OD1 3.21Å; K378-D441 IonicContact NZ-OD2 2.82Å; K378-D441 PolarHBondContact NZ-OD2 3.49Å
379	K	91.5	Very high	94.7	Very high	140 Å²	140	39.9 Å²	39.9	61%	0.609	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-92.6	-3.7	178	-78.8	-177.2	-174.2	179.2	0	112.3	F12 E376 G377	F12-K379 HydrophobicContact CE1-CB 4.3Å; F12-K379 HydrophobicContact CZ-CB 3.72Å; F12-K379 HydrophobicContact CZ-CD 4.2Å; F12-K379 HydrophobicContact CZ-CG 3.94Å; F12-K379 WeakPolarHBondContact CZ-O 3.39Å; E376-K379 WeakPolarHBondContact O-CB 3.01Å; E376-K379 PolarHBondContact O-N 3.26Å; E376-K379 VanDerWaalsContact O-N 3.08Å; G377-K379 PolarHBondContact O-N 3.46Å
380	A	95.4	Very high	94.9	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.213	C	C	.	.			trans	-66	136.4	175.4	0	0	0	0	0	110.6	P308 E309 Y374 E376 G377	P308-A380 HydrophobicContact CB-CB 4.18Å; P308-A380 HydrophobicContact CG-CB 4.35Å; E309-A380 HydrophobicContact CG-CB 3.82Å; Y374-A380 CarbonylContact O-C 3.6Å; Y374-A380 VanDerWaalsContact O-CA 3.31Å; Y374-A380 WeakPolarHBondContact O-CA 3.27Å; E376-A380 PolarHBondContact O-N 3.06Å; G377-A380 WeakPolarHBondContact O-CB 3.45Å; G377-A380 PolarHBondContact O-N 3.49Å
381	R	97.2	Very high	95.1	Very high	74 Å²	74	39.1 Å²	39.1	28%	0.279	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.5	-178.1	-64.1	-66.7	177.9	-89.2	6.4	110.5	Y374 K378 M383 I386 G387	Y374-R381 PolarHBondContact N-O 2.69Å; Y374-R381 PolarHBondContact O-N 2.89Å; K378-R381 PolarHBondContact O-NH1 3.23Å; R381-M383 PolarHBondContact O-N 2.93Å; R381-I386 CarbonylContact C-O 3.59Å; R381-I386 WeakPolarHBondContact CA-O 3.33Å; R381-I386 WeakPolarHBondContact CD-O 3.09Å; R381-G387 VanDerWaalsContact CD-N 3.32Å
382	V	97.8	Very high	95.4	Very high	1 Å²	1	38 Å²	38	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.8	166.9	-174.8	0	0	0	0	108.2	P308 L315 L372 A384 T385 I386 T389 F409	P308-V382 HydrophobicContact CB-CG2 4.18Å; P308-V382 HydrophobicContact CG-CG2 3.89Å; L315-V382 HydrophobicContact CD1-CG2 3.83Å; L315-V382 HydrophobicContact CD2-CG2 4.5Å; L372-V382 HydrophobicContact CD1-CG1 4.07Å; V382-A384 PolarHBondContact O-N 3.39Å; V382-A384 VanDerWaalsContact O-N 3.11Å; V382-T385 WeakPolarHBondContact O-CB 3.36Å; V382-T385 PolarHBondContact O-N 2.9Å; V382-I386 HydrophobicContact CB-CG2 3.91Å; V382-I386 HydrophobicContact CG2-CG2 4.21Å; V382-I386 PolarHBondContact N-O 2.87Å; V382-I386 PolarHBondContact O-N 3.39Å; V382-T389 HydrophobicContact CG2-CG2 3.87Å; V382-F409 HydrophobicContact CG1-CB 4.03Å; V382-F409 HydrophobicContact CG1-CG 4.3Å
383	M	96.6	Very high	95.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.6	42.1	-178.1	-61.1	-174.9	-76.3	0	0	112.4	F330 L372 R381 T385 V399 I404 I406 F409	F330-M383 HydrophobicContact CD1-CB 4.14Å; F330-M383 HydrophobicContact CD1-CG 3.82Å; F330-M383 HydrophobicContact CD1-SD 4.48Å; F330-M383 HydrophobicContact CD2-CG 4.2Å; F330-M383 HydrophobicContact CD2-SD 3.83Å; F330-M383 HydrophobicContact CE1-CB 3.73Å; F330-M383 HydrophobicContact CE1-CG 3.96Å; F330-M383 HydrophobicContact CE2-CB 4.27Å; F330-M383 HydrophobicContact CE2-CG 4.34Å; F330-M383 HydrophobicContact CE2-SD 4.16Å; F330-M383 HydrophobicContact CG-CG 3.96Å; F330-M383 HydrophobicContact CG-SD 4.02Å; F330-M383 HydrophobicContact CZ-CB 3.82Å; F330-M383 HydrophobicContact CZ-CG 4.23Å; L372-M383 HydrophobicContact CD1-CG 3.73Å; L372-M383 HydrophobicContact CD1-SD 4.19Å; L372-M383 PolarHBondContact O-N 3.21Å; R381-M383 PolarHBondContact O-N 2.93Å; M383-T385 PolarHBondContact O-N 3.43Å; M383-T385 VanDerWaalsContact O-N 3.1Å; M383-T385 PolarHBondContact O-OG1 3.29Å; M383-V399 HydrophobicContact CB-CG1 4.5Å; M383-V399 HydrophobicContact CB-CG2 3.46Å; M383-V399 VanDerWaalsContact CB-CG2 3.46Å; M383-V399 HydrophobicContact CE-CG2 3.9Å; M383-V399 HydrophobicContact CG-CG2 4.28Å; M383-V399 HydrophobicContact SD-CG2 3.94Å; M383-I404 HydrophobicContact CE-CG2 3.94Å; M383-I404 HydrophobicContact SD-CG2 3.9Å; M383-I406 HydrophobicContact CE-CD1 3.85Å; M383-F409 HydrophobicContact CE-CD2 3.6Å; M383-F409 HydrophobicContact CE-CE2 3.74Å; M383-F409 HydrophobicContact SD-CE2 4.46Å
384	A	94.8	Very high	95.6	Very high	40 Å²	40	37.3 Å²	37.3	33%	0.331	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	23.3	-177.7	0	0	0	0	0	115.1	Y374 V382	Y374-A384 HydrophobicContact CD1-CB 4.27Å; Y374-A384 HydrophobicContact CG-CB 4.32Å; V382-A384 PolarHBondContact O-N 3.39Å; V382-A384 VanDerWaalsContact O-N 3.11Å
385	T	96.6	Very high	95.8	Very high	38 Å²	38	36 Å²	36	23%	0.233	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-60.9	-171.2	-53.7	0	0	0	0	112.8	V382 M383 L397 V399 I406	V382-T385 WeakPolarHBondContact O-CB 3.36Å; V382-T385 PolarHBondContact O-N 2.9Å; M383-T385 PolarHBondContact O-N 3.43Å; M383-T385 VanDerWaalsContact O-N 3.1Å; M383-T385 PolarHBondContact O-OG1 3.29Å; T385-L397 HydrophobicContact CG2-CD1 3.98Å; T385-L397 HydrophobicContact CG2-CD2 4.11Å; T385-L397 HydrophobicContact CG2-CG 4Å; T385-V399 WeakPolarHBondContact OG1-CA 3.42Å; T385-I406 HydrophobicContact CG2-CD1 3.88Å; T385-I406 HydrophobicContact CG2-CG1 3.88Å
386	I	96.9	Very high	96	Very high	10 Å²	10	38.6 Å²	38.6	5%	0.051	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-117.1	140.6	-171.8	-167.3	166.9	0	0	0	112.9	R381 V382 V388 D394 L397 I406 L410	R381-I386 CarbonylContact C-O 3.59Å; R381-I386 WeakPolarHBondContact CA-O 3.33Å; R381-I386 WeakPolarHBondContact CD-O 3.09Å; V382-I386 HydrophobicContact CB-CG2 3.91Å; V382-I386 HydrophobicContact CG2-CG2 4.21Å; V382-I386 PolarHBondContact N-O 2.87Å; V382-I386 PolarHBondContact O-N 3.39Å; I386-V388 HydrophobicContact CD1-CG2 3.78Å; I386-V388 HydrophobicContact CG1-CG2 3.85Å; I386-V388 WeakPolarHBondContact CG2-O 3.04Å; I386-D394 WeakPolarHBondContact CD1-OD2 3.44Å; I386-L397 HydrophobicContact CB-CD2 4.06Å; I386-L397 HydrophobicContact CD1-CD2 3.86Å; I386-L397 HydrophobicContact CG1-CD2 4.38Å; I386-I406 HydrophobicContact CG2-CG2 3.66Å; I386-L410 HydrophobicContact CD1-CD1 4.09Å; I386-L410 HydrophobicContact CD1-CD2 3.89Å
387	G	97.1	Very high	96.3	Very high	18 Å²	18	33.3 Å²	33.3	19%	0.186	18%	0.178	C	C	.	.	S	Bend	trans	-86.2	-16.6	-178.2	0	0	0	0	0	115.2	P308 R381	P308-G387 WeakPolarHBondContact CD-O 3.2Å; R381-G387 VanDerWaalsContact CD-N 3.32Å
388	V	97.8	Very high	96.5	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.048	17%	0.174	C	C	.	.			trans	-112.2	155.5	175.7	-66.1	0	0	0	0	111.1	T270 D288 I386 L410	T270-V388 HydrophobicContact CG2-CG1 4.15Å; D288-V388 HydrophobicContact CB-CG1 4.29Å; D288-V388 VanDerWaalsContact OD1-CG1 3.3Å; D288-V388 WeakPolarHBondContact OD1-CG1 3.39Å; D288-V388 WeakPolarHBondContact OD2-CG1 3.47Å; I386-V388 HydrophobicContact CD1-CG2 3.78Å; I386-V388 HydrophobicContact CG1-CG2 3.85Å; I386-V388 WeakPolarHBondContact CG2-O 3.04Å; V388-L410 HydrophobicContact CG2-CD1 4.27Å
389	T	98.5	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-117	-5.5	178.9	67.6	0	0	0	0	112.8	F306 T307 P308 E311 R314 L315 V382 L410 S411	F306-T389 PolarHBondContact O-N 3.22Å; F306-T389 PolarHBondContact O-OG1 3.46Å; T307-T389 WeakPolarHBondContact O-CG2 3.47Å; P308-T389 HydrophobicContact CB-CG2 4.38Å; P308-T389 HydrophobicContact CG-CG2 4.11Å; E311-T389 HydrophobicContact CB-CG2 4.31Å; E311-T389 WeakPolarHBondContact CG-OG1 3.4Å; R314-T389 PolarHBondContact NH2-O 3.42Å; L315-T389 HydrophobicContact CD1-CG2 3.78Å; L315-T389 HydrophobicContact CD2-CG2 4.34Å; L315-T389 HydrophobicContact CG-CG2 4.44Å; V382-T389 HydrophobicContact CG2-CG2 3.87Å; T389-L410 WeakPolarHBondContact O-CA 3.45Å; T389-S411 PolarHBondContact O-N 2.97Å
390	R	98.8	Very high	96.7	Very high	39 Å²	39	27.7 Å²	27.7	15%	0.147	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-135.3	148.2	170.4	-56	-170.5	-170.6	-170	13.1	110.8	A286 G287 F306 E311 S411 A413	A286-R390 HydrophobicContact CB-CB 4.06Å; G287-R390 WeakPolarHBondContact CA-O 3.33Å; F306-R390 HydrophobicContact CB-CB 3.94Å; F306-R390 HydrophobicContact CB-CG 3.8Å; F306-R390 HydrophobicContact CD1-CG 4.27Å; F306-R390 VanDerWaalsContact CD1-NE 3.3Å; F306-R390 HydrophobicContact CD2-CB 4.47Å; F306-R390 HydrophobicContact CD2-CG 4.49Å; F306-R390 HydrophobicContact CG-CB 4.24Å; F306-R390 HydrophobicContact CG-CG 3.93Å; E311-R390 VanDerWaalsContact CD-NH2 3.33Å; E311-R390 IonicContact OE1-NH2 3.78Å; E311-R390 PolarHBondContact OE1-NH2 2.79Å; E311-R390 VanDerWaalsContact OE1-NH2 3.14Å; E311-R390 IonicContact OE2-CZ 3.91Å; E311-R390 IonicContact OE2-NE 3.19Å; E311-R390 PolarHBondContact OE2-NE 2.9Å; E311-R390 IonicContact OE2-NH2 3.03Å; E311-R390 PolarHBondContact OE2-NH2 2.7Å; R390-S411 CarbonylContact C-O 3.4Å; R390-S411 WeakPolarHBondContact CA-O 3.38Å; R390-S411 VanDerWaalsContact CB-O 3.29Å; R390-S411 WeakPolarHBondContact CB-O 3.3Å; R390-A413 WeakPolarHBondContact CD-O 3.29Å; R390-A413 PolarHBondContact NH1-O 2.84Å; R390-A413 VanDerWaalsContact NH1-O 3.15Å
391	G	98.5	Very high	96.3	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	17%	0.17	C	C	.	.			trans	157.7	179.1	-175.7	0	0	0	0	0	112.5	C269 S411 S412	C269-G391 CarbonylContact O-C 3.56Å; C269-G391 WeakPolarHBondContact O-CA 3.36Å; G391-S411 PolarHBondContact N-O 2.8Å; G391-S412 VanDerWaalsContact O-CA 3.27Å; G391-S412 WeakPolarHBondContact O-CA 3.33Å
392	L	98.9	Very high	96.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	153	178	-55.6	174.2	0	0	0	110.3	F150 A162 F249 M252 D253 I256 G268 C269 A271	F150-L392 HydrophobicContact CE1-CD1 4.36Å; A162-L392 HydrophobicContact CB-CD1 3.78Å; F249-L392 HydrophobicContact CD1-CD2 4.49Å; M252-L392 HydrophobicContact CG-CD1 3.92Å; D253-L392 HydrophobicContact CB-CD2 3.86Å; I256-L392 HydrophobicContact CD1-CB 3.99Å; G268-L392 CarbonylContact C-O 3.51Å; G268-L392 WeakPolarHBondContact CA-O 3.4Å; C269-L392 PolarHBondContact N-O 3.34Å; C269-L392 PolarHBondContact O-N 2.95Å; A271-L392 HydrophobicContact CB-CD1 3.97Å; A271-L392 HydrophobicContact CB-CG 4.24Å
393	G	98.4	Very high	95.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.6	-150.6	177.1	0	0	0	0	0	113.4	D253 H395 K407	D253-G393 PolarHBondContact OD1-N 2.94Å; G393-H395 PolarHBondContact O-N 3.11Å; G393-H395 VanDerWaalsContact O-N 3.17Å; G393-K407 WeakPolarHBondContact O-CE 3.42Å; G393-K407 PolarHBondContact O-NZ 3.01Å; G393-K407 VanDerWaalsContact O-NZ 3.09Å
394	D	98.1	Very high	95.9	Very high	13 Å²	13	37.4 Å²	37.4	7%	0.07	20%	0.203	C	C	.	.			trans	55.2	28.8	-176.8	-72.2	-45.2	0	0	0	115.5	H153 G267 G268 I386 D396 L397 L410	H153-D394 IonicContact CD2-OD2 2.64Å; H153-D394 IonicContact CE1-OD2 3.05Å; H153-D394 PolarHBondContact CE1-OD2 3.38Å; H153-D394 IonicContact NE2-OD1 3.5Å; H153-D394 IonicContact NE2-OD2 2.91Å; H153-D394 PolarHBondContact NE2-OD2 3.48Å; G267-D394 PolarHBondContact O-N 3.23Å; G268-D394 PolarHBondContact N-OD1 3.18Å; I386-D394 WeakPolarHBondContact CD1-OD2 3.44Å; D394-D396 PolarHBondContact O-N 2.74Å; D394-L397 HydrophobicContact CB-CB 3.82Å; D394-L397 HydrophobicContact CB-CD2 4.1Å; D394-L397 WeakPolarHBondContact O-CB 3.39Å; D394-L397 PolarHBondContact O-N 2.9Å; D394-L397 VanDerWaalsContact O-N 3.1Å; D394-L410 HydrophobicContact CB-CD2 3.53Å
395	H	97.7	Very high	96.1	Very high	17 Å²	17	40.4 Å²	40.4	8%	0.079	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.8	-178.2	-71.6	-75.9	0	0	0	113.7	D253 E257 G393 K407	D253-H395 PolarHBondContact O-NE2 2.88Å; D253-H395 IonicContact OD1-CE1 3.56Å; D253-H395 IonicContact OD1-NE2 3.93Å; D253-H395 PolarHBondContact OD1-NE2 3.22Å; D253-H395 IonicContact OD2-CE1 3.56Å; D253-H395 PolarHBondContact OD2-CE1 2.75Å; D253-H395 IonicContact OD2-NE2 3.05Å; E257-H395 HydrophobicContact CG-CB 4.33Å; E257-H395 IonicContact OE2-CE1 2.73Å; G393-H395 PolarHBondContact O-N 3.11Å; G393-H395 VanDerWaalsContact O-N 3.17Å; H395-K407 VanDerWaalsContact CE1-CE 3.42Å; H395-K407 WeakPolarHBondContact CE1-CE 3.33Å; H395-K407 PolarHBondContact CE1-NZ 3.2Å; H395-K407 VanDerWaalsContact ND1-CE 3.31Å; H395-K407 WeakPolarHBondContact ND1-CE 3.17Å
396	D	95.4	Very high	96.1	Very high	94 Å²	94	38.6 Å²	38.6	50%	0.503	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-0.2	175.8	-72	-43.4	0	0	0	114.1	R260 D394 K398	R260-D396 IonicContact CZ-OD1 3.88Å; R260-D396 IonicContact CZ-OD2 2.64Å; R260-D396 IonicContact NH1-OD1 2.58Å; R260-D396 PolarHBondContact NH1-OD1 3.38Å; R260-D396 IonicContact NH1-OD2 3.63Å; R260-D396 PolarHBondContact NH1-OD2 3.45Å; R260-D396 IonicContact NH2-OD1 2.65Å; D394-D396 PolarHBondContact O-N 2.74Å; D396-K398 PolarHBondContact O-N 3.3Å
397	L	97	Very high	96.2	Very high	46 Å²	46	40 Å²	40	24%	0.241	20%	0.201	C	C	.	.			trans	-66.6	122.8	-174.1	-173.8	64.7	0	0	0	110.2	T385 I386 D394 I406	T385-L397 HydrophobicContact CG2-CD1 3.98Å; T385-L397 HydrophobicContact CG2-CD2 4.11Å; T385-L397 HydrophobicContact CG2-CG 4Å; I386-L397 HydrophobicContact CB-CD2 4.06Å; I386-L397 HydrophobicContact CD1-CD2 3.86Å; I386-L397 HydrophobicContact CG1-CD2 4.38Å; D394-L397 HydrophobicContact CB-CB 3.82Å; D394-L397 HydrophobicContact CB-CD2 4.1Å; D394-L397 WeakPolarHBondContact O-CB 3.39Å; D394-L397 PolarHBondContact O-N 2.9Å; D394-L397 VanDerWaalsContact O-N 3.1Å; L397-I406 HydrophobicContact CB-CB 4.39Å; L397-I406 HydrophobicContact CB-CG1 4.26Å; L397-I406 HydrophobicContact CD2-CB 4.17Å; L397-I406 HydrophobicContact CD2-CG1 3.79Å; L397-I406 HydrophobicContact CD2-CG2 4.34Å; L397-I406 HydrophobicContact CG-CB 4.25Å; L397-I406 HydrophobicContact CG-CG1 3.67Å; L397-I406 PolarHBondContact O-N 2.89Å
398	K	97	Very high	96.2	Very high	72 Å²	72	41.9 Å²	41.9	31%	0.313	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-119.1	152.7	177.9	-70	170	-178.3	177.6	0	110.3	D396 H400 I404 Y405	D396-K398 PolarHBondContact O-N 3.3Å; K398-H400 PolarHBondContact O-N 3.42Å; K398-I404 CarbonylContact C-O 3.42Å; K398-I404 WeakPolarHBondContact CA-O 3.47Å; K398-Y405 HydrophobicContact CD-CE1 4.49Å; K398-Y405 HydrophobicContact CD-CE2 4.48Å; K398-Y405 VanDerWaalsContact CE-CE1 3.47Å; K398-Y405 WeakPolarHBondContact CE-OH 3.48Å; K398-Y405 HydrophobicContact CG-CD1 4.04Å; K398-Y405 HydrophobicContact CG-CD2 4.39Å; K398-Y405 HydrophobicContact CG-CE1 4.14Å; K398-Y405 HydrophobicContact CG-CE2 4.47Å; K398-Y405 HydrophobicContact CG-CG 4.19Å; K398-Y405 PolarHBondContact NZ-OH 3.42Å
399	V	95.8	Very high	96.2	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.042	21%	0.208	C	C	.	.			trans	-58.8	131.5	165.8	176.9	0	0	0	0	108.9	F330 M383 T385 D401 S402 I404 I406	F330-V399 HydrophobicContact CE2-CG1 4.06Å; F330-V399 HydrophobicContact CE2-CG2 4.48Å; F330-V399 HydrophobicContact CZ-CG1 3.8Å; M383-V399 HydrophobicContact CB-CG1 4.5Å; M383-V399 HydrophobicContact CB-CG2 3.46Å; M383-V399 VanDerWaalsContact CB-CG2 3.46Å; M383-V399 HydrophobicContact CE-CG2 3.9Å; M383-V399 HydrophobicContact CG-CG2 4.28Å; M383-V399 HydrophobicContact SD-CG2 3.94Å; T385-V399 WeakPolarHBondContact OG1-CA 3.42Å; V399-D401 PolarHBondContact O-N 2.75Å; V399-S402 VanDerWaalsContact CB-OG 3.29Å; V399-S402 WeakPolarHBondContact CB-OG 3.27Å; V399-S402 WeakPolarHBondContact O-CB 3.26Å; V399-S402 PolarHBondContact O-N 2.9Å; V399-S402 PolarHBondContact O-OG 3.04Å; V399-I404 HydrophobicContact CB-CB 4.31Å; V399-I404 HydrophobicContact CG2-CB 4.13Å; V399-I404 HydrophobicContact CG2-CG2 4.08Å; V399-I404 PolarHBondContact N-O 2.99Å; V399-I406 HydrophobicContact CG2-CD1 3.59Å
400	H	87.3	Confident	96.2	Very high	102 Å²	102	41.8 Å²	41.8	47%	0.472	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	133	-176.5	-175.3	-76.4	0	0	0	112.3	A8 K398 S402	A8-H400 HydrophobicContact CB-CB 4.12Å; K398-H400 PolarHBondContact O-N 3.42Å; H400-S402 PolarHBondContact O-N 3.48Å
401	D	87.4	Confident	96.2	Very high	103 Å²	103	41.6 Å²	41.6	55%	0.551	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	26	-176.8	-66.3	-31.5	0	0	0	115.7	V399	V399-D401 PolarHBondContact O-N 2.75Å
402	S	92.4	Very high	96.2	Very high	20 Å²	20	42.4 Å²	42.4	14%	0.14	22%	0.219	C	C	.	.	S	Bend	trans	-134.2	173.9	179.2	88.5	0	0	0	0	112.8	V399 H400 I404	V399-S402 VanDerWaalsContact CB-OG 3.29Å; V399-S402 WeakPolarHBondContact CB-OG 3.27Å; V399-S402 WeakPolarHBondContact O-CB 3.26Å; V399-S402 PolarHBondContact O-N 2.9Å; V399-S402 PolarHBondContact O-OG 3.04Å; H400-S402 PolarHBondContact O-N 3.48Å; S402-I404 PolarHBondContact OG-N 3.11Å; S402-I404 VanDerWaalsContact OG-N 3.07Å
403	N	93.4	Very high	96.2	Very high	141 Å²	141	44.4 Å²	44.4	75%	0.754	24%	0.236	S	C	*	.	S	Bend	trans	-103.5	17.7	170.4	-71.2	-42.5	0	0	0	112.6
404	I	96.9	Very high	96.2	Very high	16 Å²	16	44.6 Å²	44.6	8%	0.082	24%	0.237	C	C	.	.			trans	-88.1	115.2	-180	-59.3	167.5	0	0	0	108	L325 E329 F330 M383 K398 V399 S402	L325-I404 VanDerWaalsContact O-CG2 3.23Å; L325-I404 WeakPolarHBondContact O-CG2 3.24Å; E329-I404 HydrophobicContact CB-CD1 4.31Å; E329-I404 HydrophobicContact CG-CD1 4.42Å; F330-I404 HydrophobicContact CD2-CD1 3.92Å; F330-I404 HydrophobicContact CE2-CD1 3.81Å; M383-I404 HydrophobicContact CE-CG2 3.94Å; M383-I404 HydrophobicContact SD-CG2 3.9Å; K398-I404 CarbonylContact C-O 3.42Å; K398-I404 WeakPolarHBondContact CA-O 3.47Å; V399-I404 HydrophobicContact CB-CB 4.31Å; V399-I404 HydrophobicContact CG2-CB 4.13Å; V399-I404 HydrophobicContact CG2-CG2 4.08Å; V399-I404 PolarHBondContact N-O 2.99Å; S402-I404 PolarHBondContact OG-N 3.11Å; S402-I404 VanDerWaalsContact OG-N 3.07Å
405	Y	97.5	Very high	96.2	Very high	102 Å²	102	46.6 Å²	46.6	40%	0.4	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-76	147.1	175.5	-75.8	-96.2	0	0	0	111.1	K398	K398-Y405 HydrophobicContact CD-CE1 4.49Å; K398-Y405 HydrophobicContact CD-CE2 4.48Å; K398-Y405 VanDerWaalsContact CE-CE1 3.47Å; K398-Y405 WeakPolarHBondContact CE-OH 3.48Å; K398-Y405 HydrophobicContact CG-CD1 4.04Å; K398-Y405 HydrophobicContact CG-CD2 4.39Å; K398-Y405 HydrophobicContact CG-CE1 4.14Å; K398-Y405 HydrophobicContact CG-CE2 4.47Å; K398-Y405 HydrophobicContact CG-CG 4.19Å; K398-Y405 PolarHBondContact NZ-OH 3.42Å
406	I	98.1	Very high	96.3	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.248	C	C	.	.			trans	-76	-43.9	176.3	-63.9	-52.2	0	0	0	111.3	M383 T385 I386 L397 V399 F409 L410	M383-I406 HydrophobicContact CE-CD1 3.85Å; T385-I406 HydrophobicContact CG2-CD1 3.88Å; T385-I406 HydrophobicContact CG2-CG1 3.88Å; I386-I406 HydrophobicContact CG2-CG2 3.66Å; L397-I406 HydrophobicContact CB-CB 4.39Å; L397-I406 HydrophobicContact CB-CG1 4.26Å; L397-I406 HydrophobicContact CD2-CB 4.17Å; L397-I406 HydrophobicContact CD2-CG1 3.79Å; L397-I406 HydrophobicContact CD2-CG2 4.34Å; L397-I406 HydrophobicContact CG-CB 4.25Å; L397-I406 HydrophobicContact CG-CG1 3.67Å; L397-I406 PolarHBondContact O-N 2.89Å; V399-I406 HydrophobicContact CG2-CD1 3.59Å; I406-F409 WeakPolarHBondContact O-CA 3.31Å; I406-F409 VanDerWaalsContact O-CB 3.26Å; I406-F409 WeakPolarHBondContact O-CB 3.49Å; I406-F409 WeakPolarHBondContact O-CD2 3.48Å; I406-F409 PolarHBondContact O-N 2.49Å; I406-L410 HydrophobicContact CG2-CB 4.01Å
407	K	98	Very high	96.4	Very high	40 Å²	40	46 Å²	46	17%	0.174	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	134.7	167.4	-69.8	-168.6	-170.5	-109.3	0	108.6	D253 G393 H395 L410	D253-K407 VanDerWaalsContact CG-NZ 3.31Å; D253-K407 IonicContact OD1-NZ 3.14Å; D253-K407 PolarHBondContact OD1-NZ 3.44Å; D253-K407 VanDerWaalsContact OD1-NZ 3.09Å; D253-K407 IonicContact OD2-NZ 2.7Å; D253-K407 PolarHBondContact OD2-NZ 3.34Å; G393-K407 WeakPolarHBondContact O-CE 3.42Å; G393-K407 PolarHBondContact O-NZ 3.01Å; G393-K407 VanDerWaalsContact O-NZ 3.09Å; H395-K407 VanDerWaalsContact CE1-CE 3.42Å; H395-K407 WeakPolarHBondContact CE1-CE 3.33Å; H395-K407 PolarHBondContact CE1-NZ 3.2Å; H395-K407 VanDerWaalsContact ND1-CE 3.31Å; H395-K407 WeakPolarHBondContact ND1-CE 3.17Å; K407-L410 HydrophobicContact CG-CB 4.29Å
408	P	97.7	Very high	96.5	Very high	56 Å²	56	47 Å²	47	36%	0.364	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	cis	-96.4	13	16.8	35.1	-33.4	0	0	0	116.6	L318 L325 L410	L318-P408 HydrophobicContact CD2-CB 4.4Å; L318-P408 HydrophobicContact CD2-CG 4.14Å; L325-P408 HydrophobicContact CD1-CG 3.56Å; L325-P408 HydrophobicContact CD2-CG 4.25Å; P408-L410 VanDerWaalsContact C-N 3.28Å; P408-L410 PolarHBondContact O-N 2.77Å
409	F	98.4	Very high	96.5	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-33.3	175.9	-66.1	-72.1	0	0	0	112.6	R314 L315 L318 A319 L325 L326 L372 V382 M383 I406	R314-F409 PolarHBondContact NH1-O 2.9Å; R314-F409 PolarHBondContact NH2-O 3.13Å; L315-F409 HydrophobicContact CD2-CB 3.87Å; L315-F409 HydrophobicContact CD2-CD1 3.9Å; L315-F409 HydrophobicContact CD2-CG 4.36Å; L318-F409 HydrophobicContact CB-CD1 4.47Å; L318-F409 HydrophobicContact CB-CE1 4.17Å; L318-F409 HydrophobicContact CD2-CD1 3.76Å; L318-F409 HydrophobicContact CD2-CE1 4.01Å; L318-F409 HydrophobicContact CD2-CG 4.35Å; L318-F409 HydrophobicContact CG-CD1 4.27Å; L318-F409 HydrophobicContact CG-CE1 4.01Å; A319-F409 HydrophobicContact CB-CE1 3.8Å; A319-F409 HydrophobicContact CB-CZ 3.91Å; L325-F409 HydrophobicContact CB-CE2 3.82Å; L325-F409 HydrophobicContact CB-CZ 3.97Å; L325-F409 HydrophobicContact CD1-CE2 4.4Å; L325-F409 HydrophobicContact CD1-CZ 4.29Å; L326-F409 HydrophobicContact CD2-CZ 4.08Å; L372-F409 HydrophobicContact CD1-CD1 4.29Å; L372-F409 HydrophobicContact CD1-CE1 3.99Å; L372-F409 HydrophobicContact CD1-CE2 4.29Å; L372-F409 HydrophobicContact CD1-CZ 3.98Å; L372-F409 HydrophobicContact CD2-CE1 4.05Å; V382-F409 HydrophobicContact CG1-CB 4.03Å; V382-F409 HydrophobicContact CG1-CG 4.3Å; M383-F409 HydrophobicContact CE-CD2 3.6Å; M383-F409 HydrophobicContact CE-CE2 3.74Å; M383-F409 HydrophobicContact SD-CE2 4.46Å; I406-F409 WeakPolarHBondContact O-CA 3.31Å; I406-F409 VanDerWaalsContact O-CB 3.26Å; I406-F409 WeakPolarHBondContact O-CB 3.49Å; I406-F409 WeakPolarHBondContact O-CD2 3.48Å; I406-F409 PolarHBondContact O-N 2.49Å
410	L	98.6	Very high	96.5	Very high	5 Å²	5	45 Å²	45	3%	0.026	24%	0.235	C	C	.	.	S	Bend	trans	-84.1	116.7	169.4	-178.9	67.2	0	0	0	110.7	I386 V388 T389 D394 I406 K407 P408	I386-L410 HydrophobicContact CD1-CD1 4.09Å; I386-L410 HydrophobicContact CD1-CD2 3.89Å; V388-L410 HydrophobicContact CG2-CD1 4.27Å; T389-L410 WeakPolarHBondContact O-CA 3.45Å; D394-L410 HydrophobicContact CB-CD2 3.53Å; I406-L410 HydrophobicContact CG2-CB 4.01Å; K407-L410 HydrophobicContact CG-CB 4.29Å; P408-L410 VanDerWaalsContact C-N 3.28Å; P408-L410 PolarHBondContact O-N 2.77Å
411	S	98.5	Very high	96.9	Very high	36 Å²	36	40.3 Å²	40.3	25%	0.252	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-108.9	139.5	-178.5	-175.6	0	0	0	0	112.5	T389 R390 G391 A413	T389-S411 PolarHBondContact O-N 2.97Å; R390-S411 CarbonylContact C-O 3.4Å; R390-S411 WeakPolarHBondContact CA-O 3.38Å; R390-S411 VanDerWaalsContact CB-O 3.29Å; R390-S411 WeakPolarHBondContact CB-O 3.3Å; G391-S411 PolarHBondContact N-O 2.8Å; S411-A413 VanDerWaalsContact C-N 3.28Å; S411-A413 WeakPolarHBondContact OG-CB 3.47Å; S411-A413 PolarHBondContact OG-N 3.01Å
412	S	98.6	Very high	97	Very high	17 Å²	17	38.4 Å²	38.4	12%	0.119	21%	0.208	C	C	.	.			trans	-81	-5.4	171.2	49.7	0	0	0	0	114.1	F249 D253 G391 P414	F249-S412 WeakPolarHBondContact CB-O 3.44Å; F249-S412 WeakPolarHBondContact CD1-O 3.43Å; D253-S412 PolarHBondContact OD2-OG 2.89Å; G391-S412 VanDerWaalsContact O-CA 3.27Å; G391-S412 WeakPolarHBondContact O-CA 3.33Å; S412-P414 WeakPolarHBondContact O-CD 3.41Å
413	A	98.3	Very high	97	Very high	42 Å²	42	44.3 Å²	44.3	35%	0.347	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-72.6	119.5	-174.2	0	0	0	0	0	112.2	R390 S411	R390-A413 WeakPolarHBondContact CD-O 3.29Å; R390-A413 PolarHBondContact NH1-O 2.84Å; R390-A413 VanDerWaalsContact NH1-O 3.15Å; S411-A413 VanDerWaalsContact C-N 3.28Å; S411-A413 WeakPolarHBondContact OG-CB 3.47Å; S411-A413 PolarHBondContact OG-N 3.01Å
414	P	98.6	Very high	96.9	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.032	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-76.3	158.1	179	32.5	-34.8	0	0	0	112	E246 F249 A284 N285 A286 S412 V416	E246-P414 HydrophobicContact CG-CG 4.26Å; F249-P414 HydrophobicContact CB-CG 4.15Å; F249-P414 HydrophobicContact CD1-CB 3.89Å; F249-P414 HydrophobicContact CD1-CG 3.89Å; F249-P414 HydrophobicContact CD2-CB 4.46Å; F249-P414 HydrophobicContact CD2-CG 3.88Å; F249-P414 HydrophobicContact CE1-CB 3.8Å; F249-P414 HydrophobicContact CE1-CG 4.2Å; F249-P414 HydrophobicContact CE2-CB 4.37Å; F249-P414 HydrophobicContact CE2-CG 4.19Å; F249-P414 HydrophobicContact CG-CB 4.23Å; F249-P414 HydrophobicContact CG-CG 3.71Å; F249-P414 HydrophobicContact CZ-CB 4.05Å; F249-P414 HydrophobicContact CZ-CG 4.35Å; A284-P414 HydrophobicContact CB-CB 4.03Å; A284-P414 HydrophobicContact CB-CG 4.38Å; N285-P414 CarbonylContact O-C 3.57Å; N285-P414 WeakPolarHBondContact O-CA 3.07Å; A286-P414 HydrophobicContact CB-CB 4.44Å; S412-P414 WeakPolarHBondContact O-CD 3.41Å; P414-V416 HydrophobicContact CG-CG2 4.4Å
415	E	98.4	Very high	96.6	Very high	56 Å²	56	48.4 Å²	48.4	26%	0.262	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133	154	177.1	-169.8	132.6	0	0	108.6	A284 N285 S304 F306 R417	A284-E415 CarbonylContact C-O 3.58Å; A284-E415 VanDerWaalsContact CA-O 3.31Å; A284-E415 WeakPolarHBondContact CA-O 3.22Å; N285-E415 PolarHBondContact N-O 2.81Å; N285-E415 PolarHBondContact O-N 2.98Å; S304-E415 PolarHBondContact OG-OE1 3.19Å; S304-E415 PolarHBondContact OG-OE2 3.35Å; F306-E415 HydrophobicContact CE2-CB 3.93Å; F306-E415 HydrophobicContact CZ-CB 3.43Å; F306-E415 VanDerWaalsContact CZ-CB 3.43Å; F306-E415 HydrophobicContact CZ-CG 4.34Å; F306-E415 WeakPolarHBondContact CZ-OE2 3.4Å; E415-R417 IonicContact OE1-CZ 3.89Å; E415-R417 IonicContact OE1-NE 3.02Å; E415-R417 PolarHBondContact OE1-NE 3.13Å; E415-R417 IonicContact OE1-NH2 3.86Å; E415-R417 PolarHBondContact OE1-NH2 3.25Å; E415-R417 VanDerWaalsContact OE1-NH2 3.08Å
416	V	98.6	Very high	96.5	Very high	22 Å²	22	43.7 Å²	43.7	13%	0.133	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.6	178.3	-170.1	0	0	0	0	110.7	I242 L245 E246 Y282 V283 A284 P414	I242-V416 HydrophobicContact CG1-CB 4.08Å; I242-V416 HydrophobicContact CG1-CG1 3.92Å; I242-V416 HydrophobicContact CG2-CB 4.11Å; I242-V416 HydrophobicContact CG2-CG2 4.09Å; L245-V416 HydrophobicContact CB-CG2 4.33Å; L245-V416 HydrophobicContact CD1-CG1 3.98Å; L245-V416 HydrophobicContact CD1-CG2 4.48Å; E246-V416 HydrophobicContact CG-CG2 4.48Å; Y282-V416 HydrophobicContact CD1-CG1 4.44Å; V283-V416 CarbonylContact O-C 3.51Å; V283-V416 WeakPolarHBondContact O-CA 3.31Å; A284-V416 HydrophobicContact CB-CG2 3.89Å; P414-V416 HydrophobicContact CG-CG2 4.4Å
417	R	98.6	Very high	96.3	Very high	76 Å²	76	45.2 Å²	45.2	29%	0.287	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150	169.9	-64.9	-165.9	-175.7	175.3	3	111.1	Y282 V283 P301 M302 S304 E415	Y282-R417 WeakPolarHBondContact CA-O 3.45Å; V283-R417 PolarHBondContact N-O 2.76Å; V283-R417 PolarHBondContact O-N 2.68Å; P301-R417 PolarHBondContact O-NH1 3.22Å; M302-R417 HydrophobicContact CE-CB 3.98Å; M302-R417 WeakPolarHBondContact O-CD 3.4Å; S304-R417 PolarHBondContact OG-NH2 3.45Å; E415-R417 IonicContact OE1-CZ 3.89Å; E415-R417 IonicContact OE1-NE 3.02Å; E415-R417 PolarHBondContact OE1-NE 3.13Å; E415-R417 IonicContact OE1-NH2 3.86Å; E415-R417 PolarHBondContact OE1-NH2 3.25Å; E415-R417 VanDerWaalsContact OE1-NH2 3.08Å
418	I	98.4	Very high	96.1	Very high	67 Å²	67	44.6 Å²	44.6	34%	0.344	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.1	-178	-56.6	163.7	0	0	0	109.2	E238 I242 K280 L281 Y282	E238-I418 HydrophobicContact CB-CD1 3.62Å; E238-I418 HydrophobicContact CG-CD1 4.06Å; I242-I418 HydrophobicContact CD1-CD1 3.78Å; I242-I418 HydrophobicContact CG1-CD1 4.29Å; K280-I418 HydrophobicContact CB-CG2 4.25Å; K280-I418 HydrophobicContact CD-CG2 4.19Å; K280-I418 HydrophobicContact CG-CG2 4.47Å; L281-I418 CarbonylContact O-C 3.46Å; L281-I418 WeakPolarHBondContact O-CA 3.31Å; Y282-I418 HydrophobicContact CD1-CD1 4.24Å; Y282-I418 HydrophobicContact CD1-CG1 3.73Å; Y282-I418 HydrophobicContact CE1-CD1 3.92Å; Y282-I418 HydrophobicContact CE1-CG1 3.84Å; Y282-I418 HydrophobicContact CE1-CG2 4.43Å
419	Y	97.8	Very high	96	Very high	11 Å²	11	44.6 Å²	44.6	4%	0.043	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.9	167.1	-175.7	-93.6	0	0	0	109.4	K280 L281 I293 R295 I300 M302 L421 Y424 H426	K280-Y419 WeakPolarHBondContact CA-O 3.47Å; L281-Y419 HydrophobicContact CD1-CD1 4.21Å; L281-Y419 PolarHBondContact N-O 2.87Å; L281-Y419 PolarHBondContact O-N 3.33Å; I293-Y419 HydrophobicContact CD1-CD1 3.82Å; I293-Y419 HydrophobicContact CD1-CD2 3.55Å; I293-Y419 HydrophobicContact CD1-CE1 4.06Å; I293-Y419 HydrophobicContact CD1-CE2 3.82Å; I293-Y419 HydrophobicContact CD1-CG 3.54Å; R295-Y419 PolarHBondContact NH1-OH 3.27Å; I300-Y419 HydrophobicContact CD1-CE2 4.12Å; M302-Y419 HydrophobicContact SD-CD2 4.4Å; Y419-L421 HydrophobicContact CD1-CD2 4.04Å; Y419-L421 HydrophobicContact CD1-CG 4.43Å; Y419-L421 HydrophobicContact CE1-CD2 4.01Å; Y419-Y424 HydrophobicContact CE1-CD2 4.35Å; Y419-Y424 HydrophobicContact CE2-CD2 4.01Å; Y419-Y424 AromaticContact CE2-CE2 3.94Å; Y419-Y424 HydrophobicContact CE2-CE2 3.94Å; Y419-Y424 AromaticContact CZ-CD2 3.63Å; Y419-Y424 VanDerWaalsContact OH-CD2 3.24Å; Y419-Y424 WeakPolarHBondContact OH-CD2 3.49Å; Y419-H426 AromaticContact CE1-CE1 3.89Å; Y419-H426 AromaticContact CE1-NE2 3.32Å; Y419-H426 VanDerWaalsContact CE1-NE2 3.32Å; Y419-H426 WeakPolarHBondContact CE1-NE2 3.5Å; Y419-H426 AromaticContact CZ-NE2 3.44Å; Y419-H426 PolarHBondContact OH-NE2 3.48Å
420	D	95.9	Very high	95.9	Very high	27 Å²	27	45 Å²	45	14%	0.144	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107	-178.9	-168.8	-21	0	0	0	109.6	K280 S422 K423	K280-D420 WeakPolarHBondContact CE-OD2 3.41Å; K280-D420 HydrophobicContact CG-CB 4.38Å; D420-S422 PolarHBondContact O-N 3.4Å; D420-S422 WeakPolarHBondContact OD1-CB 3.15Å; D420-S422 PolarHBondContact OD1-N 3.48Å; D420-S422 VanDerWaalsContact OD1-N 3.14Å; D420-S422 PolarHBondContact OD1-OG 3.43Å; D420-K423 HydrophobicContact CB-CB 4.48Å; D420-K423 HydrophobicContact CB-CD 3.86Å; D420-K423 HydrophobicContact CB-CG 3.94Å; D420-K423 PolarHBondContact O-N 3.02Å; D420-K423 VanDerWaalsContact OD2-CE 3.24Å; D420-K423 WeakPolarHBondContact OD2-CE 3.35Å; D420-K423 IonicContact OD2-NZ 2.69Å
421	L	94.9	Very high	95.9	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-65.1	-27.8	-176.3	-65.2	161	0	0	0	111.3	G279 L281 Y419 K423 Y424 H426 L507	G279-L421 VanDerWaalsContact O-CB 3.26Å; G279-L421 WeakPolarHBondContact O-CB 2.81Å; G279-L421 PolarHBondContact O-N 3.42Å; L281-L421 HydrophobicContact CD1-CD2 3.91Å; L281-L421 HydrophobicContact CD1-CG 4.42Å; L281-L421 HydrophobicContact CD2-CD1 4.08Å; L281-L421 HydrophobicContact CG-CD1 3.98Å; L281-L421 HydrophobicContact CG-CD2 4.08Å; L281-L421 HydrophobicContact CG-CG 4.04Å; Y419-L421 HydrophobicContact CD1-CD2 4.04Å; Y419-L421 HydrophobicContact CD1-CG 4.43Å; Y419-L421 HydrophobicContact CE1-CD2 4.01Å; L421-K423 PolarHBondContact O-N 3.39Å; L421-Y424 VanDerWaalsContact O-O 3.05Å; L421-H426 PolarHBondContact O-CE1 2.88Å; L421-L507 HydrophobicContact CD2-CD2 4.07Å
422	S	89.6	Confident	96	Very high	64 Å²	64	43 Å²	43	45%	0.448	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-72.6	-16	-178.2	72	0	0	0	0	114.1	D420 Y424	D420-S422 PolarHBondContact O-N 3.4Å; D420-S422 WeakPolarHBondContact OD1-CB 3.15Å; D420-S422 PolarHBondContact OD1-N 3.48Å; D420-S422 VanDerWaalsContact OD1-N 3.14Å; D420-S422 PolarHBondContact OD1-OG 3.43Å; S422-Y424 VanDerWaalsContact C-N 3.32Å
423	K	91.9	Very high	96	Very high	144 Å²	144	42.2 Å²	42.2	63%	0.626	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-81.9	-11.3	-176.8	-71.1	-174	-177.2	167.3	0	114	D420 L421	D420-K423 HydrophobicContact CB-CB 4.48Å; D420-K423 HydrophobicContact CB-CD 3.86Å; D420-K423 HydrophobicContact CB-CG 3.94Å; D420-K423 PolarHBondContact O-N 3.02Å; D420-K423 VanDerWaalsContact OD2-CE 3.24Å; D420-K423 WeakPolarHBondContact OD2-CE 3.35Å; D420-K423 IonicContact OD2-NZ 2.69Å; L421-K423 PolarHBondContact O-N 3.39Å
424	Y	90.6	Very high	96	Very high	109 Å²	109	40.2 Å²	40.2	43%	0.427	21%	0.21	S	C	.	.	S	Bend	trans	-140.7	145	-172.5	-53	-78.4	0	0	0	109.9	R295 Y419 L421 S422 H426	R295-Y424 VanDerWaalsContact NH1-CD2 3.33Å; R295-Y424 VanDerWaalsContact NH1-CE1 3.29Å; Y419-Y424 HydrophobicContact CE1-CD2 4.35Å; Y419-Y424 HydrophobicContact CE2-CD2 4.01Å; Y419-Y424 AromaticContact CE2-CE2 3.94Å; Y419-Y424 HydrophobicContact CE2-CE2 3.94Å; Y419-Y424 AromaticContact CZ-CD2 3.63Å; Y419-Y424 VanDerWaalsContact OH-CD2 3.24Å; Y419-Y424 WeakPolarHBondContact OH-CD2 3.49Å; L421-Y424 VanDerWaalsContact O-O 3.05Å; S422-Y424 VanDerWaalsContact C-N 3.32Å; Y424-H426 PolarHBondContact O-CE1 3.4Å; Y424-H426 PolarHBondContact O-ND1 2.96Å; Y424-H426 VanDerWaalsContact O-ND1 3.16Å
425	D	90.8	Very high	96	Very high	133 Å²	133	40 Å²	40	71%	0.711	21%	0.208	S	C	*	.			trans	-89	126.4	168.2	-171.5	26.3	0	0	0	108.6	N511	D425-N511 PolarHBondContact OD1-ND2 3.17Å
426	H	95.3	Very high	96	Very high	3 Å²	3	37.3 Å²	37.3	1%	0.014	20%	0.196	C	C	.	.			trans	-108.5	129.6	-175.4	-55.8	87.5	0	0	0	111.1	Y419 L421 Y424 D430 L507 N511	Y419-H426 AromaticContact CE1-CE1 3.89Å; Y419-H426 AromaticContact CE1-NE2 3.32Å; Y419-H426 VanDerWaalsContact CE1-NE2 3.32Å; Y419-H426 WeakPolarHBondContact CE1-NE2 3.5Å; Y419-H426 AromaticContact CZ-NE2 3.44Å; Y419-H426 PolarHBondContact OH-NE2 3.48Å; L421-H426 PolarHBondContact O-CE1 2.88Å; Y424-H426 PolarHBondContact O-CE1 3.4Å; Y424-H426 PolarHBondContact O-ND1 2.96Å; Y424-H426 VanDerWaalsContact O-ND1 3.16Å; H426-D430 VanDerWaalsContact CA-OD2 3.29Å; H426-D430 WeakPolarHBondContact CA-OD2 3.4Å; H426-D430 HydrophobicContact CB-CB 4.12Å; H426-L507 HydrophobicContact CB-CB 3.83Å; H426-N511 PolarHBondContact N-ND2 2.95Å; H426-N511 PolarHBondContact N-OD1 3.17Å; H426-N511 PolarHBondContact ND1-OD1 3.38Å; H426-N511 PolarHBondContact O-ND2 3.2Å
427	G	94.1	Very high	96	Very high	34 Å²	34	37.4 Å²	37.4	35%	0.351	20%	0.195	S	C	.	.			trans	-78.7	173.5	170.4	0	0	0	0	0	113	D429 D430	G427-D429 PolarHBondContact O-N 2.88Å; G427-D430 PolarHBondContact N-OD2 2.99Å; G427-D430 PolarHBondContact O-N 3.11Å
428	A	94.1	Very high	95.9	Very high	27 Å²	27	33.8 Å²	33.8	22%	0.223	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.6	178.4	0	0	0	0	0	113.4	Y467 I508	A428-Y467 WeakPolarHBondContact O-CE1 3.11Å; A428-Y467 PolarHBondContact O-OH 2.9Å; A428-I508 HydrophobicContact CB-CD1 4.18Å
429	D	96.1	Very high	95.9	Very high	56 Å²	56	30.6 Å²	30.6	30%	0.299	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-8	179.5	-61.7	-29.2	0	0	0	113.3	G427 V431 L456 R466	G427-D429 PolarHBondContact O-N 2.88Å; D429-V431 PolarHBondContact O-N 3.1Å; D429-L456 HydrophobicContact CB-CB 4.38Å; D429-L456 HydrophobicContact CB-CD1 4.4Å; D429-L456 VanDerWaalsContact OD1-CB 3.27Å; D429-L456 WeakPolarHBondContact OD1-CB 3.45Å; D429-R466 IonicContact OD1-CZ 3.64Å; D429-R466 IonicContact OD1-NE 3.94Å; D429-R466 IonicContact OD1-NH2 2.61Å; D429-R466 PolarHBondContact OD1-NH2 3.34Å
430	D	97.1	Very high	95.9	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.043	17%	0.165	C	C	.	.			trans	-81.4	117.1	178.3	-63.4	-30.5	0	0	0	109.2	V294 R295 N296 H426 G427 L507	V294-D430 WeakPolarHBondContact O-CA 3.24Å; R295-D430 WeakPolarHBondContact CA-OD1 3.4Å; R295-D430 HydrophobicContact CB-CB 4.35Å; R295-D430 HydrophobicContact CG-CB 4.1Å; N296-D430 PolarHBondContact N-OD1 3.48Å; H426-D430 VanDerWaalsContact CA-OD2 3.29Å; H426-D430 WeakPolarHBondContact CA-OD2 3.4Å; H426-D430 HydrophobicContact CB-CB 4.12Å; G427-D430 PolarHBondContact N-OD2 2.99Å; G427-D430 PolarHBondContact O-N 3.11Å; D430-L507 HydrophobicContact CB-CB 4.36Å; D430-L507 HydrophobicContact CB-CD1 4.39Å; D430-L507 WeakPolarHBondContact O-CB 3.48Å; D430-L507 PolarHBondContact O-N 3.23Å
431	V	98.4	Very high	95.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	148.6	-170.7	-63.2	0	0	0	0	112.1	I293 V294 D429 I433 I452 L456 Y467 V504 I505	I293-V431 WeakPolarHBondContact CA-O 3.38Å; V294-V431 HydrophobicContact CB-CG2 4.4Å; V294-V431 PolarHBondContact N-O 3.09Å; V294-V431 PolarHBondContact O-N 3.17Å; D429-V431 PolarHBondContact O-N 3.1Å; V431-I433 HydrophobicContact CG2-CD1 4.33Å; V431-I433 HydrophobicContact CG2-CG1 4.01Å; V431-I452 HydrophobicContact CG2-CG2 3.69Å; V431-L456 HydrophobicContact CG1-CD1 3.77Å; V431-L456 HydrophobicContact CG2-CD1 4.42Å; V431-Y467 HydrophobicContact CG1-CD1 4.01Å; V431-Y467 HydrophobicContact CG1-CE1 3.8Å; V431-V504 HydrophobicContact CB-CG1 3.97Å; V431-V504 HydrophobicContact CG1-CG1 3.83Å; V431-V504 HydrophobicContact CG2-CG1 4.18Å; V431-I505 CarbonylContact C-O 3.42Å; V431-I505 VanDerWaalsContact CA-O 3.28Å; V431-I505 WeakPolarHBondContact CA-O 3.26Å
432	L	98.8	Very high	96	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.2	161.2	171.2	68.6	0	0	0	108.7	V274 L281 A291 I293 M302 L434 I505 L507	V274-L432 HydrophobicContact CB-CD2 4.48Å; V274-L432 HydrophobicContact CG1-CD2 3.83Å; V274-L432 HydrophobicContact CG2-CD2 4.01Å; L281-L432 HydrophobicContact CD1-CD2 4.16Å; A291-L432 HydrophobicContact CB-CD1 4.32Å; I293-L432 HydrophobicContact CG1-CB 4.07Å; I293-L432 HydrophobicContact CG1-CD1 3.69Å; I293-L432 HydrophobicContact CG1-CG 4.47Å; M302-L432 HydrophobicContact CB-CD1 4.29Å; M302-L432 HydrophobicContact CG-CD1 4.17Å; L432-L434 HydrophobicContact CD1-CD1 4.34Å; L432-L434 HydrophobicContact CD2-CD1 3.87Å; L432-L434 HydrophobicContact CG-CD1 3.68Å; L432-I505 HydrophobicContact CB-CB 4.31Å; L432-I505 HydrophobicContact CD2-CD1 4.2Å; L432-I505 PolarHBondContact N-O 3.28Å; L432-I505 PolarHBondContact O-N 2.91Å; L432-L507 HydrophobicContact CB-CD2 4Å
433	I	98.9	Very high	96.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.8	179.1	-54.4	168	0	0	0	107.9	A291 I292 V294 V431 W440 V448 I452 L474 V502 Y503	A291-I433 CarbonylContact C-O 3.46Å; A291-I433 WeakPolarHBondContact CA-O 3.37Å; I292-I433 HydrophobicContact CD1-CD1 4.4Å; I292-I433 HydrophobicContact CG1-CB 4.17Å; I292-I433 HydrophobicContact CG1-CD1 4.26Å; I292-I433 PolarHBondContact N-O 3.47Å; I292-I433 PolarHBondContact O-N 2.91Å; V294-I433 HydrophobicContact CG2-CD1 3.74Å; V431-I433 HydrophobicContact CG2-CD1 4.33Å; V431-I433 HydrophobicContact CG2-CG1 4.01Å; I433-W440 HydrophobicContact CG2-CH2 4.23Å; I433-W440 HydrophobicContact CG2-CZ2 4.29Å; I433-V448 HydrophobicContact CD1-CG1 3.57Å; I433-V448 HydrophobicContact CG2-CG1 4.38Å; I433-I452 HydrophobicContact CD1-CG1 3.72Å; I433-L474 HydrophobicContact CG2-CD1 4.14Å; I433-V502 HydrophobicContact CG2-CG1 4.35Å; I433-Y503 WeakPolarHBondContact CA-O 3.48Å
434	L	98.8	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.5	169.2	-63.2	62.3	0	0	0	107	W147 L272 V274 A291 L432 V502 Y503 I505	W147-L434 HydrophobicContact CB-CD2 4.45Å; L272-L434 HydrophobicContact CD2-CB 3.93Å; L272-L434 HydrophobicContact CD2-CD2 4.28Å; L272-L434 HydrophobicContact CD2-CG 4.02Å; L272-L434 HydrophobicContact CG-CD2 4.25Å; L272-L434 HydrophobicContact CG-CG 4.44Å; V274-L434 HydrophobicContact CG2-CD1 4.09Å; V274-L434 HydrophobicContact CG2-CD2 3.68Å; V274-L434 HydrophobicContact CG2-CG 4.1Å; A291-L434 HydrophobicContact CB-CG 4.38Å; L432-L434 HydrophobicContact CD1-CD1 4.34Å; L432-L434 HydrophobicContact CD2-CD1 3.87Å; L432-L434 HydrophobicContact CG-CD1 3.68Å; L434-V502 CarbonylContact O-C 3.59Å; L434-V502 WeakPolarHBondContact O-CA 3.26Å; L434-Y503 HydrophobicContact CB-CD2 4.39Å; L434-Y503 HydrophobicContact CD2-CD2 4.29Å; L434-Y503 PolarHBondContact N-O 2.99Å; L434-Y503 PolarHBondContact O-N 3.03Å; L434-I505 HydrophobicContact CD1-CD1 3.56Å; L434-I505 HydrophobicContact CD1-CG1 4.49Å
435	A	98.9	Very high	97	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	158.2	169.1	0	0	0	0	0	113.3	R290 L439 W440 S501 V502	R290-A435 PolarHBondContact N-O 2.65Å; R290-A435 PolarHBondContact O-N 2.83Å; A435-L439 HydrophobicContact CB-CB 3.7Å; A435-L439 HydrophobicContact CB-CD2 3.47Å; A435-L439 VanDerWaalsContact CB-CD2 3.47Å; A435-L439 HydrophobicContact CB-CG 4.17Å; A435-W440 HydrophobicContact CB-CZ2 3.98Å; A435-W440 PolarHBondContact O-NE1 2.75Å; A435-S501 WeakPolarHBondContact CA-O 3.31Å; A435-S501 WeakPolarHBondContact CB-O 3.45Å; A435-V502 HydrophobicContact CB-CB 4.38Å; A435-V502 HydrophobicContact CB-CG1 4.45Å; A435-V502 HydrophobicContact CB-CG2 3.85Å
436	T	98.8	Very high	97.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.			trans	-71.3	166.4	171.1	48	0	0	0	0	111	D94 L149 D151 G438 L439 S501	D94-T436 HydrophobicContact CB-CG2 4.48Å; D94-T436 VanDerWaalsContact OD2-CG2 3.3Å; D94-T436 WeakPolarHBondContact OD2-CG2 3.41Å; D94-T436 PolarHBondContact OD2-OG1 2.86Å; L149-T436 HydrophobicContact CD1-CG2 4.39Å; L149-T436 HydrophobicContact CD2-CG2 3.49Å; L149-T436 VanDerWaalsContact CD2-CG2 3.49Å; L149-T436 HydrophobicContact CG-CG2 3.72Å; D151-T436 HydrophobicContact CB-CG2 3.73Å; D151-T436 WeakPolarHBondContact OD2-CB 3.18Å; T436-G438 PolarHBondContact O-N 3.31Å; T436-G438 VanDerWaalsContact O-N 3.13Å; T436-L439 PolarHBondContact O-N 2.91Å; T436-L439 VanDerWaalsContact O-N 3.11Å; T436-S501 PolarHBondContact N-O 3.47Å; T436-S501 PolarHBondContact OG1-N 3.35Å
437	D	97.6	Very high	97.5	Very high	23 Å²	23	23.4 Å²	23.4	12%	0.123	13%	0.134	C	C	.	.	H	α-helix	trans	-59.2	-28.4	-174.5	76.9	-9.2	0	0	0	111.5	D151 L439 W440 D441	D151-D437 PolarHBondContact OD2-N 3.21Å; D151-D437 VanDerWaalsContact OD2-OD1 3.12Å; D437-L439 CarbonylContact O-C 3.44Å; D437-L439 PolarHBondContact O-N 3.34Å; D437-W440 PolarHBondContact O-N 3.28Å; D437-D441 WeakPolarHBondContact O-CB 3.42Å; D437-D441 PolarHBondContact O-N 2.92Å
438	G	97.9	Very high	97.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.3	-21.6	177.3	0	0	0	0	0	114.8	T436 S496 D499	T436-G438 PolarHBondContact O-N 3.31Å; T436-G438 VanDerWaalsContact O-N 3.13Å; G438-S496 WeakPolarHBondContact CA-OG 3.39Å; G438-S496 WeakPolarHBondContact O-CB 3.28Å; G438-S496 PolarHBondContact O-OG 3.07Å; G438-D499 WeakPolarHBondContact CA-O 3.38Å
439	L	98.6	Very high	97.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-80.8	-57.3	167.3	-172.7	84.4	0	0	0	110.8	A435 T436 D437 D441 V442 L443 V448 L474 A478 I500 V502	A435-L439 HydrophobicContact CB-CB 3.7Å; A435-L439 HydrophobicContact CB-CD2 3.47Å; A435-L439 VanDerWaalsContact CB-CD2 3.47Å; A435-L439 HydrophobicContact CB-CG 4.17Å; T436-L439 PolarHBondContact O-N 2.91Å; T436-L439 VanDerWaalsContact O-N 3.11Å; D437-L439 CarbonylContact O-C 3.44Å; D437-L439 PolarHBondContact O-N 3.34Å; L439-D441 PolarHBondContact O-N 2.76Å; L439-V442 PolarHBondContact O-N 3.43Å; L439-V442 VanDerWaalsContact O-N 3.13Å; L439-L443 HydrophobicContact CD1-CD1 3.96Å; L439-L443 HydrophobicContact CG-CD1 4.41Å; L439-L443 PolarHBondContact O-N 3.48Å; L439-V448 HydrophobicContact CD2-CG2 4.02Å; L439-L474 HydrophobicContact CD1-CB 4.11Å; L439-A478 HydrophobicContact CD1-CB 3.69Å; L439-I500 HydrophobicContact CB-CG2 3.96Å; L439-I500 HydrophobicContact CD1-CG2 4.21Å; L439-V502 HydrophobicContact CD1-CG2 3.97Å; L439-V502 HydrophobicContact CD2-CG2 4.3Å
440	W	97.8	Very high	98	Very high	13 Å²	13	23.4 Å²	23.4	5%	0.049	12%	0.12	C	C	.	.	H	α-helix	trans	-68.1	-21.7	-169.6	-54.6	112.7	0	0	0	113.5	R290 I292 I433 A435 D437 V442 L443 V448	R290-W440 HydrophobicContact CB-CD2 3.97Å; R290-W440 HydrophobicContact CB-CG 3.92Å; R290-W440 HydrophobicContact CB-CZ2 4.31Å; R290-W440 HydrophobicContact CG-CD2 4.48Å; R290-W440 WeakPolarHBondContact O-CZ2 3.23Å; R290-W440 PolarHBondContact O-NE1 3.45Å; I292-W440 HydrophobicContact CD1-CH2 3.76Å; I292-W440 HydrophobicContact CD1-CZ3 3.97Å; I292-W440 HydrophobicContact CG1-CH2 3.88Å; I292-W440 HydrophobicContact CG2-CH2 4.46Å; I433-W440 HydrophobicContact CG2-CH2 4.23Å; I433-W440 HydrophobicContact CG2-CZ2 4.29Å; A435-W440 HydrophobicContact CB-CZ2 3.98Å; A435-W440 PolarHBondContact O-NE1 2.75Å; D437-W440 PolarHBondContact O-N 3.28Å; W440-V442 PolarHBondContact O-N 3.36Å; W440-L443 CarbonylContact C-O 3.56Å; W440-L443 VanDerWaalsContact O-O 3.13Å; W440-V448 HydrophobicContact CE3-CG2 4.34Å; W440-V448 HydrophobicContact CH2-CG1 4.14Å; W440-V448 HydrophobicContact CH2-CG2 4.36Å; W440-V448 HydrophobicContact CZ3-CB 4.11Å; W440-V448 HydrophobicContact CZ3-CG1 4.22Å; W440-V448 HydrophobicContact CZ3-CG2 3.74Å
441	D	95.8	Very high	98	Very high	59 Å²	59	23 Å²	23	32%	0.316	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-30	176	-103.9	12.5	0	0	0	112.3	K378 D437 L439	K378-D441 WeakPolarHBondContact CD-OD2 3.27Å; K378-D441 VanDerWaalsContact CE-CG 3.43Å; K378-D441 WeakPolarHBondContact CE-OD1 3.44Å; K378-D441 WeakPolarHBondContact CE-OD2 3.5Å; K378-D441 PolarHBondContact NZ-O 3.09Å; K378-D441 IonicContact NZ-OD1 3.08Å; K378-D441 PolarHBondContact NZ-OD1 3.21Å; K378-D441 IonicContact NZ-OD2 2.82Å; K378-D441 PolarHBondContact NZ-OD2 3.49Å; D437-D441 WeakPolarHBondContact O-CB 3.42Å; D437-D441 PolarHBondContact O-N 2.92Å; L439-D441 PolarHBondContact O-N 2.76Å
442	V	97.2	Very high	98	Very high	23 Å²	23	23.2 Å²	23.2	14%	0.139	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-9.5	-174.8	-62.3	0	0	0	0	113.2	L439 W440 A478 I489 R493	L439-V442 PolarHBondContact O-N 3.43Å; L439-V442 VanDerWaalsContact O-N 3.13Å; W440-V442 PolarHBondContact O-N 3.36Å; V442-A478 HydrophobicContact CG2-CB 3.58Å; V442-I489 HydrophobicContact CB-CD1 4.24Å; V442-I489 WeakPolarHBondContact O-CD1 3.49Å; V442-R493 PolarHBondContact O-NH2 3.01Å
443	L	97.6	Very high	97.8	Very high	9 Å²	9	26.6 Å²	26.6	5%	0.047	14%	0.14	C	C	.	.	S	Bend	trans	-127.7	132.4	174	-59.1	178.6	0	0	0	111.1	L439 W440 E447 V448 R477 A478 I489	L439-L443 HydrophobicContact CD1-CD1 3.96Å; L439-L443 HydrophobicContact CG-CD1 4.41Å; L439-L443 PolarHBondContact O-N 3.48Å; W440-L443 CarbonylContact C-O 3.56Å; W440-L443 VanDerWaalsContact O-O 3.13Å; L443-E447 HydrophobicContact CB-CB 4.44Å; L443-E447 HydrophobicContact CD2-CB 4.41Å; L443-V448 HydrophobicContact CB-CG2 3.83Å; L443-V448 HydrophobicContact CD1-CG2 4.17Å; L443-R477 HydrophobicContact CD1-CB 4.02Å; L443-A478 HydrophobicContact CD1-CB 3.94Å; L443-A478 HydrophobicContact CG-CB 4.24Å; L443-I489 HydrophobicContact CD2-CD1 4.47Å
444	S	97.4	Very high	97.7	Very high	41 Å²	41	31.1 Å²	31.1	29%	0.287	16%	0.161	S	C	.	.			trans	-72.1	163.8	170	57.3	0	0	0	0	112.2	E446 E447 V448	S444-E446 PolarHBondContact O-N 3.05Å; S444-E447 WeakPolarHBondContact CB-OE2 3.3Å; S444-E447 PolarHBondContact N-OE2 3Å; S444-E447 PolarHBondContact O-N 3.45Å; S444-E447 WeakPolarHBondContact OG-CB 3.26Å; S444-E447 VanDerWaalsContact OG-CG 3.25Å; S444-E447 WeakPolarHBondContact OG-CG 3.4Å; S444-E447 PolarHBondContact OG-N 2.96Å; S444-E447 PolarHBondContact OG-OE2 3.32Å; S444-V448 WeakPolarHBondContact O-CG2 3.31Å; S444-V448 PolarHBondContact O-N 3Å
445	N	98.1	Very high	97.6	Very high	28 Å²	28	33.4 Å²	33.4	15%	0.15	17%	0.171	C	C	.	.	H	α-helix	trans	-58	-38.4	174.6	-68	-11	0	0	0	110.9	R290 I292 I299 V448 A449	R290-N445 PolarHBondContact NH1-OD1 3.35Å; I292-N445 HydrophobicContact CD1-CB 4.32Å; I299-N445 HydrophobicContact CD1-CB 4.28Å; I299-N445 HydrophobicContact CG2-CB 4.14Å; N445-V448 PolarHBondContact O-N 3.17Å; N445-A449 VanDerWaalsContact O-CB 3.29Å; N445-A449 WeakPolarHBondContact O-CB 3.48Å; N445-A449 PolarHBondContact O-N 3.36Å
446	E	98.2	Very high	97.5	Very high	119 Å²	119	33.4 Å²	33.4	56%	0.556	17%	0.171	S	C	*	.	H	α-helix	trans	-66.2	-45.3	178.9	-64.8	69.9	-153.9	0	0	111.5	I299 S444 V448 A449 E450	I299-E446 HydrophobicContact CD1-CG 4.16Å; S444-E446 PolarHBondContact O-N 3.05Å; E446-V448 VanDerWaalsContact C-N 3.33Å; E446-V448 PolarHBondContact O-N 2.68Å; E446-A449 PolarHBondContact O-N 2.94Å; E446-E450 VanDerWaalsContact O-CB 3.27Å; E446-E450 WeakPolarHBondContact O-CB 3.46Å; E446-E450 PolarHBondContact O-N 3Å
447	E	97.9	Very high	97.3	Very high	50 Å²	50	36.8 Å²	36.8	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-39.3	176.2	-76	164.9	132.9	0	0	111.9	L443 S444 A451 R493	L443-E447 HydrophobicContact CB-CB 4.44Å; L443-E447 HydrophobicContact CD2-CB 4.41Å; S444-E447 WeakPolarHBondContact CB-OE2 3.3Å; S444-E447 PolarHBondContact N-OE2 3Å; S444-E447 PolarHBondContact O-N 3.45Å; S444-E447 WeakPolarHBondContact OG-CB 3.26Å; S444-E447 VanDerWaalsContact OG-CG 3.25Å; S444-E447 WeakPolarHBondContact OG-CG 3.4Å; S444-E447 PolarHBondContact OG-N 2.96Å; S444-E447 PolarHBondContact OG-OE2 3.32Å; E447-A451 WeakPolarHBondContact O-CB 3.12Å; E447-A451 PolarHBondContact O-N 3.2Å; E447-R493 IonicContact OE1-CZ 3.32Å; E447-R493 VanDerWaalsContact OE1-CZ 3.31Å; E447-R493 IonicContact OE1-NH1 3.63Å; E447-R493 PolarHBondContact OE1-NH1 3.45Å; E447-R493 IonicContact OE1-NH2 3.57Å; E447-R493 PolarHBondContact OE1-NH2 2.94Å; E447-R493 IonicContact OE2-NH1 3.91Å; E447-R493 IonicContact OE2-NH2 3.84Å; E447-R493 PolarHBondContact OE2-NH2 3.42Å
448	V	98.4	Very high	97.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-45.5	176.3	171.3	0	0	0	0	111.2	I292 I433 L439 W440 L443 S444 N445 E446 A451 I452 L474	I292-V448 HydrophobicContact CD1-CB 4.47Å; I292-V448 HydrophobicContact CD1-CG1 4.15Å; I433-V448 HydrophobicContact CD1-CG1 3.57Å; I433-V448 HydrophobicContact CG2-CG1 4.38Å; L439-V448 HydrophobicContact CD2-CG2 4.02Å; W440-V448 HydrophobicContact CE3-CG2 4.34Å; W440-V448 HydrophobicContact CH2-CG1 4.14Å; W440-V448 HydrophobicContact CH2-CG2 4.36Å; W440-V448 HydrophobicContact CZ3-CB 4.11Å; W440-V448 HydrophobicContact CZ3-CG1 4.22Å; W440-V448 HydrophobicContact CZ3-CG2 3.74Å; L443-V448 HydrophobicContact CB-CG2 3.83Å; L443-V448 HydrophobicContact CD1-CG2 4.17Å; S444-V448 WeakPolarHBondContact O-CG2 3.31Å; S444-V448 PolarHBondContact O-N 3Å; N445-V448 PolarHBondContact O-N 3.17Å; E446-V448 VanDerWaalsContact C-N 3.33Å; E446-V448 PolarHBondContact O-N 2.68Å; V448-A451 PolarHBondContact O-N 3.48Å; V448-I452 WeakPolarHBondContact O-CG1 3.48Å; V448-I452 PolarHBondContact O-N 3.18Å; V448-L474 HydrophobicContact CB-CD2 4.45Å; V448-L474 HydrophobicContact CG1-CD1 4.07Å; V448-L474 HydrophobicContact CG1-CD2 3.98Å; V448-L474 HydrophobicContact CG2-CD2 4.48Å
449	A	98.4	Very high	97	Very high	7 Å²	7	43.8 Å²	43.8	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-40.4	178.8	0	0	0	0	0	112.2	V294 I299 N445 E446 I452 T453	V294-A449 HydrophobicContact CG1-CB 4.12Å; V294-A449 HydrophobicContact CG2-CB 3.79Å; I299-A449 HydrophobicContact CD1-CB 3.58Å; I299-A449 HydrophobicContact CG1-CB 3.62Å; N445-A449 VanDerWaalsContact O-CB 3.29Å; N445-A449 WeakPolarHBondContact O-CB 3.48Å; N445-A449 PolarHBondContact O-N 3.36Å; E446-A449 PolarHBondContact O-N 2.94Å; A449-I452 PolarHBondContact O-N 2.82Å; A449-T453 VanDerWaalsContact O-CB 3.3Å; A449-T453 WeakPolarHBondContact O-CB 3.32Å; A449-T453 PolarHBondContact O-N 3.34Å; A449-T453 PolarHBondContact O-OG1 2.91Å
450	E	97.7	Very high	96.7	Very high	110 Å²	110	48.5 Å²	48.5	51%	0.514	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-46.3	174.2	-177.9	179.2	-177.9	0	0	111	E446 I452 T453 Q454	E446-E450 VanDerWaalsContact O-CB 3.27Å; E446-E450 WeakPolarHBondContact O-CB 3.46Å; E446-E450 PolarHBondContact O-N 3Å; E450-I452 VanDerWaalsContact C-N 3.35Å; E450-I452 PolarHBondContact O-N 2.73Å; E450-T453 PolarHBondContact O-N 3.01Å; E450-Q454 HydrophobicContact CG-CG 4.39Å; E450-Q454 WeakPolarHBondContact O-CB 3.39Å; E450-Q454 VanDerWaalsContact O-CG 3.28Å; E450-Q454 WeakPolarHBondContact O-CG 3.19Å; E450-Q454 PolarHBondContact O-N 3.46Å; E450-Q454 PolarHBondContact OE1-NE2 3.35Å
451	A	97.4	Very high	96.2	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-46.9	177.6	0	0	0	0	0	111.8	E447 V448 Q454 F455 L474	E447-A451 WeakPolarHBondContact O-CB 3.12Å; E447-A451 PolarHBondContact O-N 3.2Å; V448-A451 PolarHBondContact O-N 3.48Å; A451-Q454 PolarHBondContact O-N 2.95Å; A451-F455 WeakPolarHBondContact O-CB 3.19Å; A451-F455 PolarHBondContact O-N 3.03Å; A451-L474 HydrophobicContact CB-CD2 3.8Å
452	I	97.6	Very high	95.9	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-46	178	-71.6	-59.1	0	0	0	112.1	V294 V431 I433 V448 A449 E450 Q454 F455 L456 A470 L474 V504	V294-I452 HydrophobicContact CG1-CG2 4.49Å; V431-I452 HydrophobicContact CG2-CG2 3.69Å; I433-I452 HydrophobicContact CD1-CG1 3.72Å; V448-I452 WeakPolarHBondContact O-CG1 3.48Å; V448-I452 PolarHBondContact O-N 3.18Å; A449-I452 PolarHBondContact O-N 2.82Å; E450-I452 VanDerWaalsContact C-N 3.35Å; E450-I452 PolarHBondContact O-N 2.73Å; I452-Q454 PolarHBondContact O-N 3.44Å; I452-F455 PolarHBondContact O-N 2.99Å; I452-L456 HydrophobicContact CG2-CD1 3.61Å; I452-L456 HydrophobicContact CG2-CG 4.16Å; I452-L456 PolarHBondContact O-N 3.24Å; I452-A470 HydrophobicContact CD1-CB 3.95Å; I452-L474 HydrophobicContact CD1-CD1 3.89Å; I452-L474 HydrophobicContact CD1-CD2 4.45Å; I452-L474 HydrophobicContact CD1-CG 4.17Å; I452-L474 HydrophobicContact CG1-CD1 4.18Å; I452-L474 HydrophobicContact CG1-CD2 4.41Å; I452-V504 HydrophobicContact CD1-CG2 4.35Å
453	T	96	Very high	95.6	Very high	72 Å²	72	57 Å²	57	44%	0.442	31%	0.307	S	S	.	.	H	α-helix	trans	-65.5	-27.2	-179.2	-54.8	0	0	0	0	111.8	A449 E450 P457	A449-T453 VanDerWaalsContact O-CB 3.3Å; A449-T453 WeakPolarHBondContact O-CB 3.32Å; A449-T453 PolarHBondContact O-N 3.34Å; A449-T453 PolarHBondContact O-OG1 2.91Å; E450-T453 PolarHBondContact O-N 3.01Å; T453-P457 VanDerWaalsContact O-CD 3.23Å; T453-P457 WeakPolarHBondContact O-CD 3.29Å; T453-P457 VanDerWaalsContact O-CG 3.27Å; T453-P457 WeakPolarHBondContact O-CG 3.36Å
454	Q	95.5	Very high	95.3	Very high	95 Å²	95	60.5 Å²	60.5	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-83.9	-35.3	172.9	-71.1	173.2	3.7	0	0	112.6	E450 A451 I452 N458	E450-Q454 HydrophobicContact CG-CG 4.39Å; E450-Q454 WeakPolarHBondContact O-CB 3.39Å; E450-Q454 VanDerWaalsContact O-CG 3.28Å; E450-Q454 WeakPolarHBondContact O-CG 3.19Å; E450-Q454 PolarHBondContact O-N 3.46Å; E450-Q454 PolarHBondContact OE1-NE2 3.35Å; A451-Q454 PolarHBondContact O-N 2.95Å; I452-Q454 PolarHBondContact O-N 3.44Å; Q454-N458 PolarHBondContact O-ND2 2.81Å
455	F	96.8	Very high	95.1	Very high	49 Å²	49	60.8 Å²	60.8	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-78.9	-55.9	-172.9	-171.6	-87	0	0	0	112.4	A451 I452 N458 C459 L469 A470 D473	A451-F455 WeakPolarHBondContact O-CB 3.19Å; A451-F455 PolarHBondContact O-N 3.03Å; I452-F455 PolarHBondContact O-N 2.99Å; F455-N458 PolarHBondContact O-N 2.7Å; F455-N458 VanDerWaalsContact O-N 3.12Å; F455-C459 WeakPolarHBondContact CE1-SG 3.38Å; F455-L469 HydrophobicContact CE1-CB 3.88Å; F455-L469 HydrophobicContact CZ-CB 3.72Å; F455-A470 HydrophobicContact CD1-CB 3.77Å; F455-A470 HydrophobicContact CE1-CB 4Å; F455-D473 HydrophobicContact CD2-CB 3.84Å; F455-D473 HydrophobicContact CE2-CB 3.9Å; F455-D473 HydrophobicContact CG-CB 4.43Å
456	L	96.5	Very high	94.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-60.3	-43.5	-169.6	-67	178.1	0	0	0	113.8	D429 V431 I452 N458 C459 R466 Y467 A470	D429-L456 HydrophobicContact CB-CB 4.38Å; D429-L456 HydrophobicContact CB-CD1 4.4Å; D429-L456 VanDerWaalsContact OD1-CB 3.27Å; D429-L456 WeakPolarHBondContact OD1-CB 3.45Å; V431-L456 HydrophobicContact CG1-CD1 3.77Å; V431-L456 HydrophobicContact CG2-CD1 4.42Å; I452-L456 HydrophobicContact CG2-CD1 3.61Å; I452-L456 HydrophobicContact CG2-CG 4.16Å; I452-L456 PolarHBondContact O-N 3.24Å; L456-N458 PolarHBondContact O-N 3.44Å; L456-C459 WeakPolarHBondContact O-CB 3.28Å; L456-C459 PolarHBondContact O-N 3.04Å; L456-R466 HydrophobicContact CD2-CG 3.88Å; L456-R466 PolarHBondContact O-NH1 3.01Å; L456-R466 PolarHBondContact O-NH2 3.14Å; L456-Y467 HydrophobicContact CD1-CE1 4.29Å; L456-Y467 HydrophobicContact CD2-CD1 3.99Å; L456-Y467 HydrophobicContact CD2-CE1 4.16Å; L456-A470 HydrophobicContact CD2-CB 3.68Å; L456-A470 HydrophobicContact CG-CB 4.45Å
457	P	95.4	Very high	94.9	Very high	71 Å²	71	54.9 Å²	54.9	46%	0.461	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-61.6	-19.3	179.5	-25.7	36.4	0	0	0	114.6	T453	T453-P457 VanDerWaalsContact O-CD 3.23Å; T453-P457 WeakPolarHBondContact O-CD 3.29Å; T453-P457 VanDerWaalsContact O-CG 3.27Å; T453-P457 WeakPolarHBondContact O-CG 3.36Å
458	N	95.1	Very high	94.9	Very high	145 Å²	145	52.7 Å²	52.7	78%	0.775	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-89.2	-5.8	178	-69	-50	0	0	0	113.4	Q454 F455 L456	Q454-N458 PolarHBondContact O-ND2 2.81Å; F455-N458 PolarHBondContact O-N 2.7Å; F455-N458 VanDerWaalsContact O-N 3.12Å; L456-N458 PolarHBondContact O-N 3.44Å
459	C	93.6	Very high	94.9	Very high	25 Å²	25	55.4 Å²	55.4	17%	0.169	30%	0.302	C	S	.	.	S	Bend	trans	-91.9	155	172.8	-62.7	0	0	0	0	110.8	F455 L456 P461 R466	F455-C459 WeakPolarHBondContact CE1-SG 3.38Å; L456-C459 WeakPolarHBondContact O-CB 3.28Å; L456-C459 PolarHBondContact O-N 3.04Å; C459-P461 WeakPolarHBondContact O-CD 3.43Å; C459-R466 HydrophobicContact CB-CG 3.83Å; C459-R466 PolarHBondContact O-NH1 3.18Å
460	D	92.1	Very high	94.9	Very high	98 Å²	98	55 Å²	55	52%	0.524	30%	0.3	S	S	.	.			trans	-64.2	126.4	167.1	-174.7	-17	0	0	0	109.3	D462 D463 R466	D460-D462 PolarHBondContact O-N 3.33Å; D460-D462 PolarHBondContact OD1-N 3.44Å; D460-D463 HydrophobicContact CB-CB 4.06Å; D460-D463 WeakPolarHBondContact O-CB 3.5Å; D460-D463 PolarHBondContact O-N 3.42Å; D460-D463 VanDerWaalsContact O-N 3.12Å; D460-R466 PolarHBondContact O-NH1 2.78Å
461	P	88.1	Confident	94.9	Very high	82 Å²	82	49.8 Å²	49.8	53%	0.532	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.5	176.2	-26.8	36.7	0	0	0	114	C459	C459-P461 WeakPolarHBondContact O-CD 3.43Å
462	D	88.4	Confident	95	Very high	145 Å²	145	52 Å²	52	78%	0.775	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.1	-180	-64.9	-41.2	0	0	0	112.6	D460 P464	D460-D462 PolarHBondContact O-N 3.33Å; D460-D462 PolarHBondContact OD1-N 3.44Å; D462-P464 VanDerWaalsContact O-CD 3.24Å; D462-P464 WeakPolarHBondContact O-CD 3.34Å
463	D	92.1	Very high	95	Very high	46 Å²	46	53 Å²	53	25%	0.246	29%	0.29	C	S	.	.			trans	-64.7	115.4	175.7	177.4	3.7	0	0	0	110.1	D460 H465 R466	D460-D463 HydrophobicContact CB-CB 4.06Å; D460-D463 WeakPolarHBondContact O-CB 3.5Å; D460-D463 PolarHBondContact O-N 3.42Å; D460-D463 VanDerWaalsContact O-N 3.12Å; D463-H465 PolarHBondContact O-N 2.98Å; D463-H465 WeakPolarHBondContact OD1-CB 3.44Å; D463-H465 IonicContact OD1-CD2 2.92Å; D463-H465 PolarHBondContact OD1-N 3.28Å; D463-R466 HydrophobicContact CB-CB 4.27Å; D463-R466 VanDerWaalsContact O-CB 3.26Å; D463-R466 WeakPolarHBondContact O-CB 3.3Å; D463-R466 PolarHBondContact O-N 2.91Å
464	P	89.7	Confident	95.2	Very high	84 Å²	84	49.6 Å²	49.6	55%	0.545	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-5.2	-178.3	33.2	-40.4	0	0	0	113.5	R73 D462	R73-P464 PolarHBondContact NE-O 3.4Å; D462-P464 VanDerWaalsContact O-CD 3.24Å; D462-P464 WeakPolarHBondContact O-CD 3.34Å
465	H	93.8	Very high	95.3	Very high	47 Å²	47	45 Å²	45	22%	0.218	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-4.3	175.2	-65	-72.8	0	0	0	114.2	R73 D463 Y467 T468 L469	R73-H465 PolarHBondContact NH1-CE1 2.92Å; R73-H465 PolarHBondContact NH2-CD2 3.43Å; R73-H465 PolarHBondContact NH2-CE1 3Å; R73-H465 PolarHBondContact NH2-NE2 3.42Å; D463-H465 PolarHBondContact O-N 2.98Å; D463-H465 WeakPolarHBondContact OD1-CB 3.44Å; D463-H465 IonicContact OD1-CD2 2.92Å; D463-H465 PolarHBondContact OD1-N 3.28Å; H465-Y467 VanDerWaalsContact C-N 3.3Å; H465-Y467 PolarHBondContact O-N 3.36Å; H465-Y467 VanDerWaalsContact O-N 3.1Å; H465-T468 WeakPolarHBondContact O-CA 3.48Å; H465-T468 WeakPolarHBondContact O-CB 3.26Å; H465-T468 PolarHBondContact O-N 2.85Å; H465-L469 HydrophobicContact CB-CD1 4.44Å; H465-L469 HydrophobicContact CB-CG 4.37Å; H465-L469 PolarHBondContact O-N 2.84Å
466	R	95.3	Very high	95.4	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-40	-54.5	-176.5	178.6	-172.8	-173.2	95.4	-5.9	113.4	D429 L456 C459 D460 D463 L469 A470	D429-R466 IonicContact OD1-CZ 3.64Å; D429-R466 IonicContact OD1-NE 3.94Å; D429-R466 IonicContact OD1-NH2 2.61Å; D429-R466 PolarHBondContact OD1-NH2 3.34Å; L456-R466 HydrophobicContact CD2-CG 3.88Å; L456-R466 PolarHBondContact O-NH1 3.01Å; L456-R466 PolarHBondContact O-NH2 3.14Å; C459-R466 HydrophobicContact CB-CG 3.83Å; C459-R466 PolarHBondContact O-NH1 3.18Å; D460-R466 PolarHBondContact O-NH1 2.78Å; D463-R466 HydrophobicContact CB-CB 4.27Å; D463-R466 VanDerWaalsContact O-CB 3.26Å; D463-R466 WeakPolarHBondContact O-CB 3.3Å; D463-R466 PolarHBondContact O-N 2.91Å; R466-L469 PolarHBondContact O-N 3.2Å; R466-A470 PolarHBondContact O-N 3.1Å; R466-A470 VanDerWaalsContact O-N 3.07Å
467	Y	97.8	Very high	95.4	Very high	18 Å²	18	50.9 Å²	50.9	7%	0.071	27%	0.273	C	S	.	.	H	α-helix	trans	-75.7	-27.4	-176.9	-55.8	-67.8	0	0	0	113.4	A77 G79 A428 V431 L456 H465 A470 A471 V504 P506	A77-Y467 HydrophobicContact CB-CD2 4.49Å; A77-Y467 VanDerWaalsContact O-CD2 3.23Å; A77-Y467 WeakPolarHBondContact O-CD2 3.41Å; G79-Y467 VanDerWaalsContact CA-C 3.49Å; A428-Y467 WeakPolarHBondContact O-CE1 3.11Å; A428-Y467 PolarHBondContact O-OH 2.9Å; V431-Y467 HydrophobicContact CG1-CD1 4.01Å; V431-Y467 HydrophobicContact CG1-CE1 3.8Å; L456-Y467 HydrophobicContact CD1-CE1 4.29Å; L456-Y467 HydrophobicContact CD2-CD1 3.99Å; L456-Y467 HydrophobicContact CD2-CE1 4.16Å; H465-Y467 VanDerWaalsContact C-N 3.3Å; H465-Y467 PolarHBondContact O-N 3.36Å; H465-Y467 VanDerWaalsContact O-N 3.1Å; Y467-A470 PolarHBondContact O-N 3.24Å; Y467-A471 PolarHBondContact O-N 3.41Å; Y467-V504 HydrophobicContact CD1-CG1 3.92Å; Y467-V504 HydrophobicContact CG-CG1 4.48Å; Y467-P506 HydrophobicContact CD1-CB 4.47Å; Y467-P506 HydrophobicContact CD2-CB 4.28Å; Y467-P506 HydrophobicContact CD2-CG 3.94Å; Y467-P506 HydrophobicContact CE1-CB 3.89Å; Y467-P506 HydrophobicContact CE2-CB 3.66Å; Y467-P506 HydrophobicContact CE2-CG 3.66Å; Y467-P506 HydrophobicContact CG-CG 4.49Å; Y467-P506 VanDerWaalsContact CZ-CB 3.44Å
468	T	97.7	Very high	95.6	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-41.8	173.2	-62.1	0	0	0	0	110.4	I67 H465 A470 A471 Q472	I67-T468 HydrophobicContact CB-CG2 3.82Å; I67-T468 HydrophobicContact CD1-CG2 4.48Å; I67-T468 HydrophobicContact CG2-CG2 4.15Å; H465-T468 WeakPolarHBondContact O-CA 3.48Å; H465-T468 WeakPolarHBondContact O-CB 3.26Å; H465-T468 PolarHBondContact O-N 2.85Å; T468-A470 VanDerWaalsContact C-N 3.32Å; T468-A471 PolarHBondContact O-N 3.41Å; T468-Q472 WeakPolarHBondContact O-CB 3.48Å; T468-Q472 PolarHBondContact O-N 2.87Å
469	L	97.6	Very high	95.7	Very high	57 Å²	57	42.7 Å²	42.7	30%	0.298	22%	0.222	S	C	.	.	H	α-helix	trans	-66.1	-36.3	175.5	-63.3	174.6	0	0	0	111.6	F455 H465 R466 Q472 D473	F455-L469 HydrophobicContact CE1-CB 3.88Å; F455-L469 HydrophobicContact CZ-CB 3.72Å; H465-L469 HydrophobicContact CB-CD1 4.44Å; H465-L469 HydrophobicContact CB-CG 4.37Å; H465-L469 PolarHBondContact O-N 2.84Å; R466-L469 PolarHBondContact O-N 3.2Å; L469-Q472 WeakPolarHBondContact O-CB 3.42Å; L469-Q472 PolarHBondContact O-N 2.91Å; L469-D473 PolarHBondContact O-N 2.85Å
470	A	98.3	Very high	95.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-43.5	172.9	0	0	0	0	0	112.4	I452 F455 L456 R466 Y467 T468 Q472 D473 L474 V504	I452-A470 HydrophobicContact CD1-CB 3.95Å; F455-A470 HydrophobicContact CD1-CB 3.77Å; F455-A470 HydrophobicContact CE1-CB 4Å; L456-A470 HydrophobicContact CD2-CB 3.68Å; L456-A470 HydrophobicContact CG-CB 4.45Å; R466-A470 PolarHBondContact O-N 3.1Å; R466-A470 VanDerWaalsContact O-N 3.07Å; Y467-A470 PolarHBondContact O-N 3.24Å; T468-A470 VanDerWaalsContact C-N 3.32Å; A470-Q472 VanDerWaalsContact C-N 3.31Å; A470-Q472 PolarHBondContact O-N 3.01Å; A470-D473 PolarHBondContact O-N 2.77Å; A470-L474 PolarHBondContact O-N 3.03Å; A470-L474 VanDerWaalsContact O-N 3.11Å; A470-V504 HydrophobicContact CB-CG1 4.39Å; A470-V504 HydrophobicContact CB-CG2 4.4Å
471	A	98.8	Very high	95.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-42.2	173.5	0	0	0	0	0	111.2	A81 Y467 T468 D473 L474 V475 V502 V504	A81-A471 HydrophobicContact CB-CB 3.9Å; Y467-A471 PolarHBondContact O-N 3.41Å; T468-A471 PolarHBondContact O-N 3.41Å; A471-D473 PolarHBondContact O-N 2.85Å; A471-L474 PolarHBondContact O-N 2.94Å; A471-V475 WeakPolarHBondContact O-CG2 3.3Å; A471-V475 PolarHBondContact O-N 2.78Å; A471-V502 HydrophobicContact CB-CG1 4.32Å; A471-V504 HydrophobicContact CB-CB 4.47Å; A471-V504 HydrophobicContact CB-CG2 3.87Å
472	Q	98.6	Very high	96	Very high	48 Å²	48	42.3 Å²	42.3	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-42	175.9	-168.2	-176.2	27	0	0	111.9	I65 I67 A81 T468 L469 A470 V475 M476	I65-Q472 HydrophobicContact CG2-CG 3.97Å; I67-Q472 HydrophobicContact CG2-CB 4.04Å; I67-Q472 HydrophobicContact CG2-CG 4Å; A81-Q472 HydrophobicContact CB-CB 4.27Å; T468-Q472 WeakPolarHBondContact O-CB 3.48Å; T468-Q472 PolarHBondContact O-N 2.87Å; L469-Q472 WeakPolarHBondContact O-CB 3.42Å; L469-Q472 PolarHBondContact O-N 2.91Å; A470-Q472 VanDerWaalsContact C-N 3.31Å; A470-Q472 PolarHBondContact O-N 3.01Å; Q472-V475 PolarHBondContact O-N 3.08Å; Q472-M476 HydrophobicContact CG-CE 4.2Å; Q472-M476 WeakPolarHBondContact O-CB 3.5Å; Q472-M476 VanDerWaalsContact O-CG 3.32Å; Q472-M476 WeakPolarHBondContact O-CG 3.28Å; Q472-M476 PolarHBondContact O-N 2.82Å
473	D	98.4	Very high	96	Very high	22 Å²	22	40.3 Å²	40.3	12%	0.118	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-44.2	176.3	-172.5	59.7	0	0	0	111.7	F455 L469 A470 A471 M476 R477	F455-D473 HydrophobicContact CD2-CB 3.84Å; F455-D473 HydrophobicContact CE2-CB 3.9Å; F455-D473 HydrophobicContact CG-CB 4.43Å; L469-D473 PolarHBondContact O-N 2.85Å; A470-D473 PolarHBondContact O-N 2.77Å; A471-D473 PolarHBondContact O-N 2.85Å; D473-M476 HydrophobicContact CB-CE 4.35Å; D473-M476 PolarHBondContact O-N 3.13Å; D473-R477 VanDerWaalsContact O-CG 3.27Å; D473-R477 WeakPolarHBondContact O-CG 3.41Å; D473-R477 PolarHBondContact O-N 2.87Å; D473-R477 IonicContact OD1-NE 3.43Å; D473-R477 IonicContact OD1-NH2 2.7Å; D473-R477 IonicContact OD2-CZ 2.77Å; D473-R477 VanDerWaalsContact OD2-CZ 3.31Å; D473-R477 IonicContact OD2-NE 3.58Å; D473-R477 PolarHBondContact OD2-NE 3.39Å; D473-R477 IonicContact OD2-NH2 3.02Å; D473-R477 PolarHBondContact OD2-NH2 3.24Å
474	L	98.7	Very high	95.6	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-45.9	175	-68.2	-178.9	0	0	0	112.1	I433 L439 V448 A451 I452 A470 A471 M476 R477 A478 V502 V504	I433-L474 HydrophobicContact CG2-CD1 4.14Å; L439-L474 HydrophobicContact CD1-CB 4.11Å; V448-L474 HydrophobicContact CB-CD2 4.45Å; V448-L474 HydrophobicContact CG1-CD1 4.07Å; V448-L474 HydrophobicContact CG1-CD2 3.98Å; V448-L474 HydrophobicContact CG2-CD2 4.48Å; A451-L474 HydrophobicContact CB-CD2 3.8Å; I452-L474 HydrophobicContact CD1-CD1 3.89Å; I452-L474 HydrophobicContact CD1-CD2 4.45Å; I452-L474 HydrophobicContact CD1-CG 4.17Å; I452-L474 HydrophobicContact CG1-CD1 4.18Å; I452-L474 HydrophobicContact CG1-CD2 4.41Å; A470-L474 PolarHBondContact O-N 3.03Å; A470-L474 VanDerWaalsContact O-N 3.11Å; A471-L474 PolarHBondContact O-N 2.94Å; L474-M476 PolarHBondContact O-N 3.03Å; L474-R477 PolarHBondContact O-N 3.21Å; L474-A478 PolarHBondContact O-N 2.92Å; L474-V502 HydrophobicContact CB-CG1 4.33Å; L474-V502 HydrophobicContact CD1-CG1 3.92Å; L474-V504 HydrophobicContact CD1-CG2 4.23Å
475	V	98.7	Very high	95.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-43.8	176	173.6	0	0	0	0	111.1	I65 A81 V83 A471 Q472 R477 A478 R479 I500 V502	I65-V475 HydrophobicContact CD1-CG1 4Å; I65-V475 HydrophobicContact CG1-CG1 3.97Å; I65-V475 HydrophobicContact CG2-CB 4.32Å; I65-V475 HydrophobicContact CG2-CG1 3.87Å; A81-V475 HydrophobicContact CB-CB 4.45Å; A81-V475 HydrophobicContact CB-CG2 3.83Å; V83-V475 HydrophobicContact CB-CG1 3.89Å; V83-V475 HydrophobicContact CG1-CG1 3.48Å; V83-V475 VanDerWaalsContact CG1-CG1 3.48Å; A471-V475 WeakPolarHBondContact O-CG2 3.3Å; A471-V475 PolarHBondContact O-N 2.78Å; Q472-V475 PolarHBondContact O-N 3.08Å; V475-R477 VanDerWaalsContact C-N 3.32Å; V475-R477 PolarHBondContact O-N 3.47Å; V475-A478 PolarHBondContact O-N 3.35Å; V475-R479 WeakPolarHBondContact O-CB 3.31Å; V475-R479 PolarHBondContact O-N 3.34Å; V475-I500 HydrophobicContact CG2-CG2 4.26Å; V475-V502 HydrophobicContact CG2-CB 4.09Å; V475-V502 HydrophobicContact CG2-CG2 3.59Å
476	M	98	Very high	94.8	Very high	77 Å²	77	51.6 Å²	51.6	38%	0.379	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-43.7	176.4	-78.2	-172.3	-63.8	0	0	111.8	I65 Q472 D473 L474 G480	I65-M476 HydrophobicContact CD1-CB 4.17Å; I65-M476 HydrophobicContact CD1-CG 3.21Å; I65-M476 HydrophobicContact CD1-SD 4.47Å; Q472-M476 HydrophobicContact CG-CE 4.2Å; Q472-M476 WeakPolarHBondContact O-CB 3.5Å; Q472-M476 VanDerWaalsContact O-CG 3.32Å; Q472-M476 WeakPolarHBondContact O-CG 3.28Å; Q472-M476 PolarHBondContact O-N 2.82Å; D473-M476 HydrophobicContact CB-CE 4.35Å; D473-M476 PolarHBondContact O-N 3.13Å; L474-M476 PolarHBondContact O-N 3.03Å; M476-G480 WeakPolarHBondContact O-CA 3.35Å; M476-G480 PolarHBondContact O-N 2.83Å
477	R	98.1	Very high	94.6	Very high	94 Å²	94	53.1 Å²	53.1	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-41.3	179.4	-73.6	171.6	-171.6	-104.1	2.9	112.8	L443 D473 L474 V475 I489	L443-R477 HydrophobicContact CD1-CB 4.02Å; D473-R477 VanDerWaalsContact O-CG 3.27Å; D473-R477 WeakPolarHBondContact O-CG 3.41Å; D473-R477 PolarHBondContact O-N 2.87Å; D473-R477 IonicContact OD1-NE 3.43Å; D473-R477 IonicContact OD1-NH2 2.7Å; D473-R477 IonicContact OD2-CZ 2.77Å; D473-R477 VanDerWaalsContact OD2-CZ 3.31Å; D473-R477 IonicContact OD2-NE 3.58Å; D473-R477 PolarHBondContact OD2-NE 3.39Å; D473-R477 IonicContact OD2-NH2 3.02Å; D473-R477 PolarHBondContact OD2-NH2 3.24Å; L474-R477 PolarHBondContact O-N 3.21Å; V475-R477 VanDerWaalsContact C-N 3.32Å; V475-R477 PolarHBondContact O-N 3.47Å; R477-I489 WeakPolarHBondContact O-CG2 3.43Å
478	A	98.1	Very high	94.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-77.8	-41.8	179.8	0	0	0	0	0	112.8	L439 V442 L443 L474 V475 G480 I489 G495 S496 I500	L439-A478 HydrophobicContact CD1-CB 3.69Å; V442-A478 HydrophobicContact CG2-CB 3.58Å; L443-A478 HydrophobicContact CD1-CB 3.94Å; L443-A478 HydrophobicContact CG-CB 4.24Å; L474-A478 PolarHBondContact O-N 2.92Å; V475-A478 PolarHBondContact O-N 3.35Å; A478-G480 VanDerWaalsContact C-N 3.29Å; A478-G480 PolarHBondContact O-N 2.71Å; A478-I489 WeakPolarHBondContact O-CG2 3.25Å; A478-G495 WeakPolarHBondContact O-CA 3.48Å; A478-S496 PolarHBondContact O-N 2.74Å; A478-I500 HydrophobicContact CB-CD1 3.85Å
479	R	97.6	Very high	94.3	Very high	44 Å²	44	54.3 Å²	54.3	17%	0.166	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-40.8	174.2	-172.3	-172.3	72.1	136.2	0.4	111.3	A62 R63 V83 V475 W487 I500	A62-R479 PolarHBondContact O-NH1 3.32Å; R63-R479 PolarHBondContact O-NH1 2.64Å; V83-R479 HydrophobicContact CG1-CB 4.28Å; V83-R479 HydrophobicContact CG1-CG 4.26Å; V83-R479 HydrophobicContact CG2-CG 4.49Å; V475-R479 WeakPolarHBondContact O-CB 3.31Å; V475-R479 PolarHBondContact O-N 3.34Å; R479-W487 HydrophobicContact CG-CE3 4.06Å; R479-W487 HydrophobicContact CG-CZ3 4.09Å; R479-I500 HydrophobicContact CB-CD1 4.05Å
480	G	95.5	Very high	93.8	Very high	6 Å²	6	55 Å²	55	6%	0.062	27%	0.271	C	S	.	.			trans	73.2	-162.7	-176	0	0	0	0	0	113.4	M476 A478 R488	M476-G480 WeakPolarHBondContact O-CA 3.35Å; M476-G480 PolarHBondContact O-N 2.83Å; A478-G480 VanDerWaalsContact C-N 3.29Å; A478-G480 PolarHBondContact O-N 2.71Å; G480-R488 CarbonylContact C-O 3.54Å; G480-R488 VanDerWaalsContact CA-O 3.26Å; G480-R488 WeakPolarHBondContact CA-O 3.47Å
481	V	93.3	Very high	93.4	Very high	98 Å²	98	62.1 Å²	62.1	59%	0.594	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.8	-179.6	-177.1	0	0	0	0	109.5	K483 R488	V481-K483 PolarHBondContact O-N 3.15Å; V481-R488 PolarHBondContact N-O 2.91Å; V481-R488 PolarHBondContact O-N 2.74Å
482	L	90.8	Very high	92.9	Very high	94 Å²	94	66.2 Å²	66.2	49%	0.492	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	123	175.6	-173.7	62.8	0	0	0	110.5	W487	L482-W487 HydrophobicContact CB-CD2 4.32Å; L482-W487 HydrophobicContact CB-CE3 4.29Å; L482-W487 HydrophobicContact CB-CH2 4.28Å; L482-W487 HydrophobicContact CB-CZ2 4.31Å; L482-W487 HydrophobicContact CB-CZ3 4.27Å; L482-W487 HydrophobicContact CD1-CD2 4.37Å; L482-W487 HydrophobicContact CD1-CG 4.44Å
483	K	89.9	Confident	92.6	Very high	102 Å²	102	68.5 Å²	68.5	44%	0.443	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	174.4	170.8	-58.1	-172	-169.2	171.5	0	109.6	V481 R485 G486 R488 D492	V481-K483 PolarHBondContact O-N 3.15Å; K483-R485 PolarHBondContact O-N 3.27Å; K483-G486 PolarHBondContact N-O 2.86Å; K483-G486 PolarHBondContact O-N 3.3Å; K483-R488 HydrophobicContact CB-CG 4.42Å; K483-R488 HydrophobicContact CD-CB 3.96Å; K483-R488 HydrophobicContact CD-CG 4.05Å; K483-R488 HydrophobicContact CG-CB 4.27Å; K483-R488 HydrophobicContact CG-CG 4.37Å; K483-D492 IonicContact NZ-OD1 3.92Å; K483-D492 PolarHBondContact NZ-OD1 3.46Å
484	D	82.9	Confident	92.4	Very high	178 Å²	178	73.1 Å²	73.1	95%	0.952	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-24.6	-179.6	-61.4	-23	0	0	0	114.6
485	R	79.4	Confident	92.3	Very high	210 Å²	210	73.6 Å²	73.6	79%	0.792	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	20.5	-179.5	-59.7	-175.7	178.7	-176	-0.4	113.7	K483 R488	K483-R485 PolarHBondContact O-N 3.27Å; R485-R488 PolarHBondContact O-NH1 3.46Å; R485-R488 PolarHBondContact O-NH2 2.83Å
486	G	87.3	Confident	92.1	Very high	27 Å²	27	73.8 Å²	73.8	28%	0.278	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	98.3	-169.1	-178.3	0	0	0	0	0	113.4	K483	K483-G486 PolarHBondContact N-O 2.86Å; K483-G486 PolarHBondContact O-N 3.3Å
487	W	91.4	Very high	92	Very high	35 Å²	35	72.1 Å²	72.1	13%	0.133	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132	179.2	-64.5	92.1	0	0	0	111.4	I61 R63 R479 L482 G495	I61-W487 WeakPolarHBondContact O-CZ2 3.46Å; R63-W487 HydrophobicContact CB-CH2 4.07Å; R63-W487 HydrophobicContact CB-CZ2 3.89Å; R63-W487 VanDerWaalsContact CD-CE2 3.48Å; R63-W487 HydrophobicContact CG-CH2 4.48Å; R63-W487 HydrophobicContact CG-CZ2 3.8Å; R479-W487 HydrophobicContact CG-CE3 4.06Å; R479-W487 HydrophobicContact CG-CZ3 4.09Å; L482-W487 HydrophobicContact CB-CD2 4.32Å; L482-W487 HydrophobicContact CB-CE3 4.29Å; L482-W487 HydrophobicContact CB-CH2 4.28Å; L482-W487 HydrophobicContact CB-CZ2 4.31Å; L482-W487 HydrophobicContact CB-CZ3 4.27Å; L482-W487 HydrophobicContact CD1-CD2 4.37Å; L482-W487 HydrophobicContact CD1-CG 4.44Å; W487-G495 PolarHBondContact O-N 2.91Å
488	R	93.9	Very high	91.9	Very high	35 Å²	35	68.7 Å²	68.7	13%	0.132	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.8	-175.3	-69.4	-64.9	-174.1	-81.5	0.9	111.9	G480 V481 K483 R485 D492 R493	G480-R488 CarbonylContact C-O 3.54Å; G480-R488 VanDerWaalsContact CA-O 3.26Å; G480-R488 WeakPolarHBondContact CA-O 3.47Å; V481-R488 PolarHBondContact N-O 2.91Å; V481-R488 PolarHBondContact O-N 2.74Å; K483-R488 HydrophobicContact CB-CG 4.42Å; K483-R488 HydrophobicContact CD-CB 3.96Å; K483-R488 HydrophobicContact CD-CG 4.05Å; K483-R488 HydrophobicContact CG-CB 4.27Å; K483-R488 HydrophobicContact CG-CG 4.37Å; R485-R488 PolarHBondContact O-NH1 3.46Å; R485-R488 PolarHBondContact O-NH2 2.83Å; R488-D492 WeakPolarHBondContact CD-O 3.33Å; R488-R493 WeakPolarHBondContact CA-O 3.38Å; R488-R493 WeakPolarHBondContact CD-O 3.41Å
489	I	94	Very high	92	Very high	12 Å²	12	68.7 Å²	68.7	6%	0.062	36%	0.36	C	S	.	.			trans	-99.5	-169.9	175.1	63.1	169.4	0	0	0	110.2	V442 L443 R477 A478 D492 R493	V442-I489 HydrophobicContact CB-CD1 4.24Å; V442-I489 WeakPolarHBondContact O-CD1 3.49Å; L443-I489 HydrophobicContact CD2-CD1 4.47Å; R477-I489 WeakPolarHBondContact O-CG2 3.43Å; A478-I489 WeakPolarHBondContact O-CG2 3.25Å; I489-D492 PolarHBondContact O-N 2.81Å; I489-R493 HydrophobicContact CD1-CB 4.03Å; I489-R493 VanDerWaalsContact CD1-NH2 3.33Å; I489-R493 HydrophobicContact CG1-CB 3.71Å; I489-R493 PolarHBondContact N-O 3.07Å
490	S	88.8	Confident	92	Very high	73 Å²	73	66.6 Å²	66.6	51%	0.51	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-53	148.6	175.2	55.7	0	0	0	0	111.4	D492 R493	S490-D492 PolarHBondContact O-N 3.22Å; S490-D492 VanDerWaalsContact O-N 3.14Å; S490-R493 PolarHBondContact O-N 3.31Å
491	N	88.6	Confident	92.2	Very high	148 Å²	148	66.3 Å²	66.3	79%	0.791	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	59.2	21.2	-176.4	-54.1	-32.5	0	0	0	115	R493	N491-R493 PolarHBondContact O-N 3.22Å
492	D	88.6	Confident	92.4	Very high	87 Å²	87	61.7 Å²	61.7	47%	0.465	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	60.3	23.1	178.3	-145.8	49.6	0	0	0	114.3	K483 R488 I489 S490	K483-D492 IonicContact NZ-OD1 3.92Å; K483-D492 PolarHBondContact NZ-OD1 3.46Å; R488-D492 WeakPolarHBondContact CD-O 3.33Å; I489-D492 PolarHBondContact O-N 2.81Å; S490-D492 PolarHBondContact O-N 3.22Å; S490-D492 VanDerWaalsContact O-N 3.14Å
493	R	93.8	Very high	92.8	Very high	95 Å²	95	57.2 Å²	57.2	36%	0.358	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-67.9	155	167.6	-49.7	-166	-48.8	-135.7	-0.2	109.9	V442 E447 R488 I489 S490 N491 G495	V442-R493 PolarHBondContact O-NH2 3.01Å; E447-R493 IonicContact OE1-CZ 3.32Å; E447-R493 VanDerWaalsContact OE1-CZ 3.31Å; E447-R493 IonicContact OE1-NH1 3.63Å; E447-R493 PolarHBondContact OE1-NH1 3.45Å; E447-R493 IonicContact OE1-NH2 3.57Å; E447-R493 PolarHBondContact OE1-NH2 2.94Å; E447-R493 IonicContact OE2-NH1 3.91Å; E447-R493 IonicContact OE2-NH2 3.84Å; E447-R493 PolarHBondContact OE2-NH2 3.42Å; R488-R493 WeakPolarHBondContact CA-O 3.38Å; R488-R493 WeakPolarHBondContact CD-O 3.41Å; I489-R493 HydrophobicContact CD1-CB 4.03Å; I489-R493 VanDerWaalsContact CD1-NH2 3.33Å; I489-R493 HydrophobicContact CG1-CB 3.71Å; I489-R493 PolarHBondContact N-O 3.07Å; S490-R493 PolarHBondContact O-N 3.31Å; N491-R493 PolarHBondContact O-N 3.22Å; R493-G495 PolarHBondContact O-N 3.24Å
494	L	93.7	Very high	93.2	Very high	120 Å²	120	52.3 Å²	52.3	63%	0.628	28%	0.276	S	S	*	.	B	Isolated β-bridge	trans	-58.7	130.7	172	-75.5	161.6	0	0	0	109.8
495	G	95.1	Very high	94	Very high	11 Å²	11	44 Å²	44	11%	0.113	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-74.1	169.4	166.2	0	0	0	0	0	111.8	A478 W487 R493 G497	A478-G495 WeakPolarHBondContact O-CA 3.48Å; W487-G495 PolarHBondContact O-N 2.91Å; R493-G495 PolarHBondContact O-N 3.24Å; G495-G497 PolarHBondContact O-N 2.9Å
496	S	96.4	Very high	94.8	Very high	3 Å²	3	34 Å²	34	2%	0.021	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-63.1	129.1	-176.9	-174.8	0	0	0	0	111	R63 G438 A478 D498	R63-S496 PolarHBondContact NH1-O 2.97Å; R63-S496 PolarHBondContact NH2-O 3.46Å; G438-S496 WeakPolarHBondContact CA-OG 3.39Å; G438-S496 WeakPolarHBondContact O-CB 3.28Å; G438-S496 PolarHBondContact O-OG 3.07Å; A478-S496 PolarHBondContact O-N 2.74Å; S496-D498 VanDerWaalsContact C-N 3.34Å; S496-D498 PolarHBondContact OG-N 2.64Å
497	G	94.9	Very high	95.3	Very high	43 Å²	43	32.8 Å²	32.8	44%	0.443	18%	0.181	S	C	.	.			trans	-86.7	-8.7	171	0	0	0	0	0	113.1	N85 A86 G495	N85-G497 WeakPolarHBondContact CB-O 3.44Å; A86-G497 PolarHBondContact N-O 3.3Å; G495-G497 PolarHBondContact O-N 2.9Å
498	D	96.8	Very high	95.4	Very high	22 Å²	22	33.8 Å²	33.8	12%	0.118	19%	0.188	C	C	.	.	S	Bend	trans	-100.4	171.8	-174.9	-129	-32.7	0	0	0	113	R63 N85 K88 S496	R63-D498 PolarHBondContact NH2-O 3.44Å; N85-D498 VanDerWaalsContact CA-C 3.47Å; N85-D498 WeakPolarHBondContact CA-O 3.44Å; N85-D498 VanDerWaalsContact CB-C 3.43Å; K88-D498 IonicContact NZ-OD1 3.87Å; K88-D498 PolarHBondContact NZ-OD1 2.61Å; K88-D498 IonicContact NZ-OD2 2.58Å; K88-D498 PolarHBondContact NZ-OD2 3.14Å; S496-D498 VanDerWaalsContact C-N 3.34Å; S496-D498 PolarHBondContact OG-N 2.64Å
499	D	98.5	Very high	95.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.			trans	-61.1	140.2	167.4	-73.7	-44.3	0	0	0	108.8	I84 N85 N92 E93 G438	I84-D499 WeakPolarHBondContact CA-OD1 3.44Å; N85-D499 PolarHBondContact N-OD1 2.85Å; N85-D499 PolarHBondContact ND2-OD1 2.72Å; N85-D499 VanDerWaalsContact ND2-OD1 3.13Å; N85-D499 PolarHBondContact ND2-OD2 3.38Å; N92-D499 WeakPolarHBondContact CA-OD1 3.4Å; N92-D499 WeakPolarHBondContact CA-OD2 3.35Å; N92-D499 WeakPolarHBondContact CB-OD1 3.09Å; N92-D499 WeakPolarHBondContact ND2-CB 3.35Å; N92-D499 PolarHBondContact ND2-OD1 2.65Å; E93-D499 PolarHBondContact N-OD2 3.14Å; G438-D499 WeakPolarHBondContact CA-O 3.38Å
500	I	98.8	Very high	94.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.7	179.6	-39.9	175.3	0	0	0	107.4	E82 V83 L439 V475 A478 R479 V502	E82-I500 CarbonylContact C-O 3.6Å; E82-I500 WeakPolarHBondContact CA-O 3.48Å; E82-I500 WeakPolarHBondContact CB-O 3.45Å; V83-I500 HydrophobicContact CG1-CB 3.86Å; V83-I500 HydrophobicContact CG1-CD1 3.75Å; V83-I500 HydrophobicContact CG1-CG1 3.84Å; V83-I500 PolarHBondContact N-O 3.15Å; V83-I500 PolarHBondContact O-N 3.34Å; L439-I500 HydrophobicContact CB-CG2 3.96Å; L439-I500 HydrophobicContact CD1-CG2 4.21Å; V475-I500 HydrophobicContact CG2-CG2 4.26Å; A478-I500 HydrophobicContact CB-CD1 3.85Å; R479-I500 HydrophobicContact CB-CD1 4.05Å; I500-V502 HydrophobicContact CG2-CG2 4.08Å
501	S	98.9	Very high	94.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.1	177	-58.1	0	0	0	0	108.9	D94 A435 T436	D94-S501 VanDerWaalsContact CB-OG 3.26Å; D94-S501 WeakPolarHBondContact CB-OG 3.37Å; D94-S501 WeakPolarHBondContact OD2-CB 3.31Å; D94-S501 PolarHBondContact OD2-OG 3.41Å; A435-S501 WeakPolarHBondContact CA-O 3.31Å; A435-S501 WeakPolarHBondContact CB-O 3.45Å; T436-S501 PolarHBondContact N-O 3.47Å; T436-S501 PolarHBondContact OG1-N 3.35Å
502	V	98.9	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.4	-170	-176.7	0	0	0	0	111	Y80 A81 I433 L434 A435 L439 A471 L474 V475 I500 V504	Y80-V502 WeakPolarHBondContact CA-O 3.48Å; Y80-V502 WeakPolarHBondContact CD2-O 3.23Å; A81-V502 PolarHBondContact N-O 2.89Å; A81-V502 VanDerWaalsContact N-O 3.08Å; A81-V502 PolarHBondContact O-N 3.16Å; I433-V502 HydrophobicContact CG2-CG1 4.35Å; L434-V502 CarbonylContact O-C 3.59Å; L434-V502 WeakPolarHBondContact O-CA 3.26Å; A435-V502 HydrophobicContact CB-CB 4.38Å; A435-V502 HydrophobicContact CB-CG1 4.45Å; A435-V502 HydrophobicContact CB-CG2 3.85Å; L439-V502 HydrophobicContact CD1-CG2 3.97Å; L439-V502 HydrophobicContact CD2-CG2 4.3Å; A471-V502 HydrophobicContact CB-CG1 4.32Å; L474-V502 HydrophobicContact CB-CG1 4.33Å; L474-V502 HydrophobicContact CD1-CG1 3.92Å; V475-V502 HydrophobicContact CG2-CB 4.09Å; V475-V502 HydrophobicContact CG2-CG2 3.59Å; I500-V502 HydrophobicContact CG2-CG2 4.08Å; V502-V504 HydrophobicContact CG1-CG2 4.36Å
503	Y	98.9	Very high	93	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.4	161.8	-76.3	-74.1	0	0	0	111.4	F46 L74 T78 G79 Y80 A96 S97 C98 S148 L149 I433 L434	F46-Y503 VanDerWaalsContact CE1-OH 3.25Å; F46-Y503 WeakPolarHBondContact CE1-OH 3.26Å; F46-Y503 HydrophobicContact CZ-CE1 4.42Å; F46-Y503 WeakPolarHBondContact CZ-OH 3.24Å; L74-Y503 HydrophobicContact CD1-CE1 3.97Å; T78-Y503 HydrophobicContact CG2-CD1 3.46Å; T78-Y503 VanDerWaalsContact CG2-CD1 3.46Å; T78-Y503 HydrophobicContact CG2-CE1 3.96Å; T78-Y503 HydrophobicContact CG2-CG 4.5Å; G79-Y503 WeakPolarHBondContact O-CA 3.49Å; Y80-Y503 AromaticContact CD2-CD1 3.53Å; Y80-Y503 HydrophobicContact CD2-CD1 3.53Å; Y80-Y503 AromaticContact CD2-CD2 3.99Å; Y80-Y503 HydrophobicContact CD2-CD2 3.99Å; Y80-Y503 AromaticContact CD2-CE1 3.37Å; Y80-Y503 HydrophobicContact CD2-CE1 3.37Å; Y80-Y503 AromaticContact CD2-CE2 3.84Å; Y80-Y503 HydrophobicContact CD2-CE2 3.84Å; Y80-Y503 AromaticContact CD2-CG 3.85Å; Y80-Y503 HydrophobicContact CD2-CG 3.85Å; Y80-Y503 AromaticContact CD2-CZ 3.55Å; Y80-Y503 HydrophobicContact CE2-CD1 4.44Å; Y80-Y503 HydrophobicContact CE2-CD2 4.15Å; Y80-Y503 HydrophobicContact CE2-CE1 4.13Å; Y80-Y503 AromaticContact CE2-CE2 3.81Å; Y80-Y503 HydrophobicContact CE2-CE2 3.81Å; Y80-Y503 HydrophobicContact CE2-CG 4.47Å; Y80-Y503 AromaticContact CE2-CZ 3.82Å; Y80-Y503 HydrophobicContact CG-CD1 4.29Å; Y80-Y503 HydrophobicContact CG-CE1 4.07Å; A96-Y503 HydrophobicContact CB-CE2 3.98Å; A96-Y503 WeakPolarHBondContact CB-OH 2.95Å; S97-Y503 PolarHBondContact O-OH 3.15Å; C98-Y503 HydrophobicContact CB-CE1 4.27Å; S148-Y503 WeakPolarHBondContact O-CE2 2.98Å; L149-Y503 HydrophobicContact CD1-CD2 4.3Å; L149-Y503 HydrophobicContact CD1-CE2 4.12Å; I433-Y503 WeakPolarHBondContact CA-O 3.48Å; L434-Y503 HydrophobicContact CB-CD2 4.39Å; L434-Y503 HydrophobicContact CD2-CD2 4.29Å; L434-Y503 PolarHBondContact N-O 2.99Å; L434-Y503 PolarHBondContact O-N 3.03Å
504	V	98.7	Very high	91.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	111.6	164	179.2	0	0	0	0	107.8	G79 V431 I452 Y467 A470 A471 L474 V502	G79-V504 PolarHBondContact N-O 3.19Å; G79-V504 PolarHBondContact O-N 2.97Å; V431-V504 HydrophobicContact CB-CG1 3.97Å; V431-V504 HydrophobicContact CG1-CG1 3.83Å; V431-V504 HydrophobicContact CG2-CG1 4.18Å; I452-V504 HydrophobicContact CD1-CG2 4.35Å; Y467-V504 HydrophobicContact CD1-CG1 3.92Å; Y467-V504 HydrophobicContact CG-CG1 4.48Å; A470-V504 HydrophobicContact CB-CG1 4.39Å; A470-V504 HydrophobicContact CB-CG2 4.4Å; A471-V504 HydrophobicContact CB-CB 4.47Å; A471-V504 HydrophobicContact CB-CG2 3.87Å; L474-V504 HydrophobicContact CD1-CG2 4.23Å; V502-V504 HydrophobicContact CG1-CG2 4.36Å
505	I	98.5	Very high	91	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.1	-172.2	-55.8	168.1	0	0	0	109.1	T78 W147 V431 L432 L434	T78-I505 HydrophobicContact CG2-CG1 3.88Å; W147-I505 HydrophobicContact CB-CD1 4.25Å; W147-I505 HydrophobicContact CD2-CD1 3.74Å; W147-I505 HydrophobicContact CE3-CD1 4.4Å; W147-I505 HydrophobicContact CG-CD1 3.64Å; W147-I505 HydrophobicContact CH2-CG2 4.26Å; W147-I505 HydrophobicContact CZ2-CD1 4.49Å; W147-I505 HydrophobicContact CZ2-CG2 3.77Å; V431-I505 CarbonylContact C-O 3.42Å; V431-I505 VanDerWaalsContact CA-O 3.28Å; V431-I505 WeakPolarHBondContact CA-O 3.26Å; L432-I505 HydrophobicContact CB-CB 4.31Å; L432-I505 HydrophobicContact CD2-CD1 4.2Å; L432-I505 PolarHBondContact N-O 3.28Å; L432-I505 PolarHBondContact O-N 2.91Å; L434-I505 HydrophobicContact CD1-CD1 3.56Å; L434-I505 HydrophobicContact CD1-CG1 4.49Å
506	P	97.2	Very high	90.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	137	179	27.6	-33.9	0	0	0	113.4	W76 A77 Y467 I508	W76-P506 VanDerWaalsContact CD1-O 3.31Å; W76-P506 PolarHBondContact NE1-O 3.03Å; W76-P506 WeakPolarHBondContact O-CG 3.42Å; A77-P506 HydrophobicContact CB-CG 4.25Å; Y467-P506 HydrophobicContact CD1-CB 4.47Å; Y467-P506 HydrophobicContact CD2-CB 4.28Å; Y467-P506 HydrophobicContact CD2-CG 3.94Å; Y467-P506 HydrophobicContact CE1-CB 3.89Å; Y467-P506 HydrophobicContact CE2-CB 3.66Å; Y467-P506 HydrophobicContact CE2-CG 3.66Å; Y467-P506 HydrophobicContact CG-CG 4.49Å; Y467-P506 VanDerWaalsContact CZ-CB 3.44Å; P506-I508 HydrophobicContact CB-CG2 4.26Å
507	L	96.9	Very high	90.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	19%	0.186	C	C	.	.	S	Bend	trans	-87.8	-20.6	178.8	-60.7	-179.5	0	0	0	113.2	L281 I293 L421 H426 D430 L432 H509 G510	L281-L507 HydrophobicContact CD1-CD2 3.7Å; I293-L507 HydrophobicContact CD1-CD1 4.25Å; I293-L507 HydrophobicContact CG1-CD1 4.18Å; I293-L507 HydrophobicContact CG2-CD1 3.65Å; L421-L507 HydrophobicContact CD2-CD2 4.07Å; H426-L507 HydrophobicContact CB-CB 3.83Å; D430-L507 HydrophobicContact CB-CB 4.36Å; D430-L507 HydrophobicContact CB-CD1 4.39Å; D430-L507 WeakPolarHBondContact O-CB 3.48Å; D430-L507 PolarHBondContact O-N 3.23Å; L432-L507 HydrophobicContact CB-CD2 4Å; L507-H509 PolarHBondContact O-N 3.24Å; L507-H509 VanDerWaalsContact O-N 3.1Å; L507-G510 WeakPolarHBondContact O-CA 3.41Å; L507-G510 PolarHBondContact O-N 3.04Å
508	I	94.1	Very high	90.2	Very high	56 Å²	56	32.5 Å²	32.5	29%	0.287	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-54.2	-32.4	-178.6	-169.3	167.6	0	0	0	114	A428 P506 G510 N511	A428-I508 HydrophobicContact CB-CD1 4.18Å; P506-I508 HydrophobicContact CB-CG2 4.26Å; I508-G510 PolarHBondContact O-N 2.58Å; I508-N511 WeakPolarHBondContact O-CB 3.4Å; I508-N511 PolarHBondContact O-N 2.7Å
509	H	89.6	Confident	89.8	Confident	52 Å²	52	33.2 Å²	33.2	24%	0.241	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-70.5	-19.9	178.2	-60.5	-35	0	0	0	112.7	W76 L507 N511 K512	W76-H509 AromaticContact CD1-CD2 3.95Å; W76-H509 HydrophobicContact CD2-CB 3.97Å; W76-H509 VanDerWaalsContact CE2-CB 3.43Å; W76-H509 HydrophobicContact CE3-CB 4.48Å; W76-H509 HydrophobicContact CG-CB 4.47Å; W76-H509 HydrophobicContact CH2-CB 4.07Å; W76-H509 VanDerWaalsContact CZ2-C 3.43Å; W76-H509 HydrophobicContact CZ2-CB 3.52Å; W76-H509 PolarHBondContact O-CD2 3.25Å; L507-H509 PolarHBondContact O-N 3.24Å; L507-H509 VanDerWaalsContact O-N 3.1Å; H509-N511 PolarHBondContact O-N 3.12Å; H509-K512 PolarHBondContact O-N 3.29Å
510	G	82.9	Confident	89.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-63.1	-29.2	172.1	0	0	0	0	0	112.9	L507 I508 K512 L513	L507-G510 WeakPolarHBondContact O-CA 3.41Å; L507-G510 PolarHBondContact O-N 3.04Å; I508-G510 PolarHBondContact O-N 2.58Å; G510-K512 PolarHBondContact O-N 3.09Å; G510-K512 VanDerWaalsContact O-N 3.11Å; G510-L513 WeakPolarHBondContact O-CB 3.34Å; G510-L513 PolarHBondContact O-N 2.95Å
511	N	83.3	Confident	88.5	Confident	42 Å²	42	37.9 Å²	37.9	23%	0.225	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-64.9	-15.6	177.7	-51.5	-6.5	0	0	0	112.5	D425 H426 I508 H509 S514	D425-N511 PolarHBondContact OD1-ND2 3.17Å; H426-N511 PolarHBondContact N-ND2 2.95Å; H426-N511 PolarHBondContact N-OD1 3.17Å; H426-N511 PolarHBondContact ND1-OD1 3.38Å; H426-N511 PolarHBondContact O-ND2 3.2Å; I508-N511 WeakPolarHBondContact O-CB 3.4Å; I508-N511 PolarHBondContact O-N 2.7Å; H509-N511 PolarHBondContact O-N 3.12Å; N511-S514 PolarHBondContact O-OG 2.92Å
512	K	77	Confident	87.7	Confident	177 Å²	177	40.8 Å²	40.8	77%	0.77	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-86	-13.1	174	-61.8	-178.9	-178.6	176.6	0	113.1	H509 G510	H509-K512 PolarHBondContact O-N 3.29Å; G510-K512 PolarHBondContact O-N 3.09Å; G510-K512 VanDerWaalsContact O-N 3.11Å
513	L	71.1	Confident	86.8	Confident	83 Å²	83	44.3 Å²	44.3	44%	0.435	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-11.8	178.7	-61.8	-178	0	0	0	112.9	W76 C276 G510	W76-L513 HydrophobicContact CH2-CD1 3.49Å; W76-L513 VanDerWaalsContact CH2-CD1 3.49Å; W76-L513 HydrophobicContact CH2-CG 3.93Å; W76-L513 HydrophobicContact CZ2-CD1 4.24Å; W76-L513 HydrophobicContact CZ3-CD1 4.34Å; C276-L513 VanDerWaalsContact SG-CD1 3.56Å; G510-L513 WeakPolarHBondContact O-CB 3.34Å; G510-L513 PolarHBondContact O-N 2.95Å
514	S	52.9	Low	85.7	Confident	116 Å²	116	48.3 Å²	48.3	81%	0.811	25%	0.254	S	S	*	.			trans	-84.2	0	-178.1	58.7	0	0	0	0	113.7	N511	N511-S514 PolarHBondContact O-OG 2.92Å

Retrieved 514 of 514 residues in 96.2 ms (Link to these results)

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