A0A087XJF7_POEFO Loading...

Immunoglobulin superfamily containing leucine-rich repeat 2

AlphaFold DB , UniProt , Accession A0A087XJF7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 701 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.4	Low	51.7	Low	222 Å²	222	133.4 Å²	133.4	100%	1.094	67%	0.665	S	S	*	*				0	-42.4	0	-68.1	-159.1	-90.1	0	0	113.8	R3 R4	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.08Å; M1-R4 PolarHBondContact O-N 3.04Å
2	A	52	Low	51	Low	80 Å²	80	138.3 Å²	138.3	66%	0.661	67%	0.67	S	S	*	*	H	α-helix	trans	-37.7	-46.4	-175	0	0	0	0	0	117.5	R4 L5 L6	A2-R4 VanDerWaalsContact C-N 3.29Å; A2-R4 PolarHBondContact O-N 2.62Å; A2-L5 WeakPolarHBondContact O-CB 3.31Å; A2-L5 PolarHBondContact O-N 3.11Å; A2-L6 PolarHBondContact O-N 2.87Å
3	R	48.9	Very low	50.7	Low	224 Å²	224	135 Å²	135	85%	0.845	66%	0.663	S	S	*	*	H	α-helix	trans	-55.9	-34.9	179.7	-101.6	-175.4	175.6	175.7	-1.5	114.6	M1 Q7	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.08Å; R3-Q7 WeakPolarHBondContact O-CG 3.48Å; R3-Q7 PolarHBondContact O-N 3.45Å
4	R	50.5	Low	50.4	Low	200 Å²	200	133.4 Å²	133.4	76%	0.755	67%	0.665	S	S	*	*	H	α-helix	trans	-75.4	-32.4	176	-74.4	-169.5	177.4	-170.3	-0.7	112.5	M1 A2 L6 Q7 L8	M1-R4 PolarHBondContact O-N 3.04Å; A2-R4 VanDerWaalsContact C-N 3.29Å; A2-R4 PolarHBondContact O-N 2.62Å; R4-L6 VanDerWaalsContact C-N 3.35Å; R4-Q7 PolarHBondContact O-N 3.41Å; R4-L8 WeakPolarHBondContact O-CG 3.01Å; R4-L8 PolarHBondContact O-N 3.17Å
5	L	52.5	Low	50.6	Low	118 Å²	118	133.9 Å²	133.9	62%	0.618	67%	0.67	S	S	*	*	H	α-helix	trans	-66.5	-40.3	175.3	-145.9	78.7	0	0	0	110.8	A2 Q7 L8 L9	A2-L5 WeakPolarHBondContact O-CB 3.31Å; A2-L5 PolarHBondContact O-N 3.11Å; L5-Q7 VanDerWaalsContact C-N 3.34Å; L5-Q7 PolarHBondContact O-N 3.42Å; L5-L8 PolarHBondContact O-N 3.24Å; L5-L9 PolarHBondContact O-N 3.47Å
6	L	53.3	Low	50.2	Low	128 Å²	128	132.2 Å²	132.2	67%	0.67	67%	0.669	S	S	*	*	H	α-helix	trans	-64.6	-36.6	175.8	-139.4	78.5	0	0	0	112.5	A2 R4 A10	A2-L6 PolarHBondContact O-N 2.87Å; R4-L6 VanDerWaalsContact C-N 3.35Å; L6-A10 WeakPolarHBondContact O-CB 3.32Å; L6-A10 PolarHBondContact O-N 2.94Å
7	Q	52.4	Low	49.6	Very low	127 Å²	127	127.9 Å²	127.9	59%	0.593	67%	0.666	S	S	*	*	H	α-helix	trans	-70.6	-35.2	175	-72.5	177.4	-55.7	0	0	112.8	R3 R4 L5 A10 L11	R3-Q7 WeakPolarHBondContact O-CG 3.48Å; R3-Q7 PolarHBondContact O-N 3.45Å; R4-Q7 PolarHBondContact O-N 3.41Å; L5-Q7 VanDerWaalsContact C-N 3.34Å; L5-Q7 PolarHBondContact O-N 3.42Å; Q7-A10 PolarHBondContact O-N 3.17Å; Q7-L11 WeakPolarHBondContact O-CD1 3.4Å; Q7-L11 PolarHBondContact O-N 3.47Å
8	L	53.8	Low	49.1	Very low	109 Å²	109	128.3 Å²	128.3	57%	0.571	67%	0.674	S	S	*	*	H	α-helix	trans	-69.6	-40.4	173.8	-74.9	164.7	0	0	0	112	R4 L5 A10 L11 W12	R4-L8 WeakPolarHBondContact O-CG 3.01Å; R4-L8 PolarHBondContact O-N 3.17Å; L5-L8 PolarHBondContact O-N 3.24Å; L8-A10 VanDerWaalsContact C-N 3.35Å; L8-L11 PolarHBondContact O-N 2.92Å; L8-W12 PolarHBondContact O-N 2.88Å
9	L	54.4	Low	49	Very low	94 Å²	94	127.5 Å²	127.5	49%	0.492	68%	0.675	S	S	.	*	H	α-helix	trans	-62	-41.7	171.1	-77.2	163.7	0	0	0	111.6	L5 L11 W12 T13	L5-L9 PolarHBondContact O-N 3.47Å; L9-L11 PolarHBondContact O-N 2.8Å; L9-W12 PolarHBondContact O-N 2.81Å; L9-T13 PolarHBondContact O-N 3.42Å; L9-T13 PolarHBondContact O-OG1 3Å
10	A	51.1	Low	49.5	Very low	49 Å²	49	126.3 Å²	126.3	41%	0.405	67%	0.665	S	S	.	*	H	α-helix	trans	-60.3	-42.2	174.4	0	0	0	0	0	112.4	L6 Q7 L8 T13 T14	L6-A10 WeakPolarHBondContact O-CB 3.32Å; L6-A10 PolarHBondContact O-N 2.94Å; Q7-A10 PolarHBondContact O-N 3.17Å; L8-A10 VanDerWaalsContact C-N 3.35Å; A10-T13 VanDerWaalsContact CA-OG1 3.31Å; A10-T13 WeakPolarHBondContact CA-OG1 3.17Å; A10-T13 PolarHBondContact O-N 3Å; A10-T13 PolarHBondContact O-OG1 2.78Å; A10-T14 PolarHBondContact O-N 2.87Å; A10-T14 VanDerWaalsContact O-N 3.14Å; A10-T14 PolarHBondContact O-OG1 2.84Å
11	L	46.8	Very low	50.4	Low	116 Å²	116	123.8 Å²	123.8	61%	0.607	66%	0.658	S	S	*	*	H	α-helix	trans	-66.1	-35.2	174.8	-101.9	73.8	0	0	0	112.9	Q7 L8 L9 T14 L15	Q7-L11 WeakPolarHBondContact O-CD1 3.4Å; Q7-L11 PolarHBondContact O-N 3.47Å; L8-L11 PolarHBondContact O-N 2.92Å; L9-L11 PolarHBondContact O-N 2.8Å; L11-T14 WeakPolarHBondContact CA-OG1 3.37Å; L11-T14 PolarHBondContact O-N 2.6Å; L11-T14 PolarHBondContact O-OG1 3.27Å; L11-L15 PolarHBondContact O-N 3.13Å
12	W	43.4	Very low	51.9	Low	193 Å²	193	115.1 Å²	115.1	73%	0.731	62%	0.619	S	S	*	*	H	α-helix	trans	-71.4	-32.4	172.7	-84.7	-11.2	0	0	0	112.9	L8 L9 T14 L15	L8-W12 PolarHBondContact O-N 2.88Å; L9-W12 PolarHBondContact O-N 2.81Å; W12-T14 PolarHBondContact O-N 3.12Å; W12-L15 PolarHBondContact O-N 3.28Å
13	T	47.7	Very low	53.6	Low	95 Å²	95	111.9 Å²	111.9	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-71	-11.1	168.7	51.6	0	0	0	0	114	L9 A10 T16	L9-T13 PolarHBondContact O-N 3.42Å; L9-T13 PolarHBondContact O-OG1 3Å; A10-T13 VanDerWaalsContact CA-OG1 3.31Å; A10-T13 WeakPolarHBondContact CA-OG1 3.17Å; A10-T13 PolarHBondContact O-N 3Å; A10-T13 PolarHBondContact O-OG1 2.78Å; T13-T16 PolarHBondContact O-OG1 3.27Å
14	T	46.8	Very low	55.2	Low	112 Å²	112	110.8 Å²	110.8	69%	0.687	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	8.7	165.3	53	0	0	0	0	113.6	A10 L11 W12	A10-T14 PolarHBondContact O-N 2.87Å; A10-T14 VanDerWaalsContact O-N 3.14Å; A10-T14 PolarHBondContact O-OG1 2.84Å; L11-T14 WeakPolarHBondContact CA-OG1 3.37Å; L11-T14 PolarHBondContact O-N 2.6Å; L11-T14 PolarHBondContact O-OG1 3.27Å; W12-T14 PolarHBondContact O-N 3.12Å
15	L	52.3	Low	56.9	Low	141 Å²	141	106.3 Å²	106.3	74%	0.738	59%	0.586	S	S	*	*			trans	-125.7	23.6	174.9	-152.6	72.4	0	0	0	112.6	L11 W12 G17	L11-L15 PolarHBondContact O-N 3.13Å; W12-L15 PolarHBondContact O-N 3.28Å; L15-G17 VanDerWaalsContact C-N 3.33Å; L15-G17 PolarHBondContact O-N 3.08Å
16	T	45.1	Very low	58.7	Low	107 Å²	107	101.5 Å²	101.5	66%	0.656	56%	0.562	S	S	*	*	S	Bend	trans	-82.6	74.9	175.2	51.3	0	0	0	0	111.7	T13	T13-T16 PolarHBondContact O-OG1 3.27Å
17	G	38.9	Very low	60.5	Low	60 Å²	60	98.6 Å²	98.6	62%	0.619	55%	0.547	S	S	*	.			trans	74	129.7	162.1	0	0	0	0	0	116.9	L15 V19	L15-G17 VanDerWaalsContact C-N 3.33Å; L15-G17 PolarHBondContact O-N 3.08Å; G17-V19 PolarHBondContact O-N 2.59Å
18	V	41.6	Very low	62.2	Low	134 Å²	134	94.1 Å²	94.1	81%	0.812	53%	0.53	S	S	*	.			trans	-70.6	87.2	146.2	-178.9	0	0	0	0	105.9	Q20	V18-Q20 PolarHBondContact O-N 3.42Å; V18-Q20 VanDerWaalsContact O-N 3.07Å
19	V	47.9	Very low	63.7	Low	113 Å²	113	92 Å²	92	69%	0.685	52%	0.517	S	S	*	.			trans	-64.1	108.8	160.6	179	0	0	0	0	104.9	G17 S21	G17-V19 PolarHBondContact O-N 2.59Å; V19-S21 PolarHBondContact O-N 3.24Å; V19-S21 PolarHBondContact O-OG 2.97Å
20	Q	58.6	Low	65	Low	103 Å²	103	92.6 Å²	92.6	48%	0.481	52%	0.521	S	S	.	.			trans	-81.3	73.8	-172.2	-155.2	154.2	-13.1	0	0	108.4	V18	V18-Q20 PolarHBondContact O-N 3.42Å; V18-Q20 VanDerWaalsContact O-N 3.07Å
21	S	68.1	Low	65.6	Low	75 Å²	75	95.7 Å²	95.7	52%	0.524	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-65.7	138.6	-163.8	-62.6	0	0	0	0	113.2	V19	V19-S21 PolarHBondContact O-N 3.24Å; V19-S21 PolarHBondContact O-OG 2.97Å
22	C	83.5	Confident	66.3	Low	39 Å²	39	99.8 Å²	99.8	26%	0.264	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-48.5	140.6	165.1	-164.4	0	0	0	0	110.9	E24 C26 C28	C22-E24 PolarHBondContact O-N 2.91Å; C22-C26 PolarHBondContact SG-O 2.77Å; C22-C28 HydrophobicContact CB-CB 3.59Å; C22-C28 WeakPolarHBondContact CB-SG 3.28Å; C22-C28 WeakPolarHBondContact SG-CB 3.38Å; C22-C28 PolarHBondContact SG-N 3.43Å; C22-C28 CovalentContact SG-SG 2.03Å; C22-C28 PolarHBondContact SG-SG 3.34Å
23	P	87.7	Confident	67.2	Low	12 Å²	12	94.7 Å²	94.7	8%	0.078	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-57	139.3	175.6	-19.8	29.5	0	0	0	111	L25 C26 P48 V49 F51	P23-L25 PolarHBondContact O-N 2.83Å; P23-C26 HydrophobicContact CB-CB 4.37Å; P23-C26 WeakPolarHBondContact O-CA 3.27Å; P23-C26 WeakPolarHBondContact O-CB 3.45Å; P23-C26 PolarHBondContact O-N 2.8Å; P23-P48 HydrophobicContact CB-CB 3.54Å; P23-P48 HydrophobicContact CB-CG 4.45Å; P23-P48 HydrophobicContact CG-CB 3.83Å; P23-V49 WeakPolarHBondContact CG-O 3.11Å; P23-F51 HydrophobicContact CG-CD1 4.11Å; P23-F51 HydrophobicContact CG-CE1 4.22Å; P23-F51 HydrophobicContact CG-CG 4.29Å; P23-F51 HydrophobicContact CG-CZ 4.49Å
24	E	82.5	Confident	68.1	Low	201 Å²	201	95.9 Å²	95.9	94%	0.939	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.1	-164.3	-60.6	-175.5	151.6	0	0	115.7	C22	C22-E24 PolarHBondContact O-N 2.91Å
25	L	86.2	Confident	69.9	Low	107 Å²	107	92 Å²	92	56%	0.56	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.8	179.5	-60.7	175.6	0	0	0	113.3	P23 K42 L44	P23-L25 PolarHBondContact O-N 2.83Å; L25-K42 WeakPolarHBondContact O-CD 3.08Å; L25-K42 WeakPolarHBondContact O-CE 3.38Å; L25-K42 WeakPolarHBondContact O-CG 3.43Å; L25-L44 HydrophobicContact CB-CD2 4.37Å; L25-L44 HydrophobicContact CD1-CD2 3.62Å
26	C	90.9	Very high	71.7	Confident	17 Å²	17	88.2 Å²	88.2	12%	0.115	49%	0.488	C	S	.	.	S	Bend	trans	-104.7	158.7	-175.1	-55	0	0	0	0	112.4	C22 P23 D38 C39	C22-C26 PolarHBondContact SG-O 2.77Å; P23-C26 HydrophobicContact CB-CB 4.37Å; P23-C26 WeakPolarHBondContact O-CA 3.27Å; P23-C26 WeakPolarHBondContact O-CB 3.45Å; P23-C26 PolarHBondContact O-N 2.8Å; C26-D38 CarbonylContact C-O 3.58Å; C26-D38 VanDerWaalsContact CA-O 3.22Å; C26-D38 WeakPolarHBondContact CA-O 3.26Å; C26-D38 WeakPolarHBondContact CB-O 3.45Å; C26-C39 HydrophobicContact CB-CB 4.1Å; C26-C39 WeakPolarHBondContact CB-SG 3.38Å; C26-C39 WeakPolarHBondContact SG-CB 3.15Å; C26-C39 CovalentContact SG-SG 2.03Å; C26-C39 PolarHBondContact SG-SG 3.42Å
27	N	90.6	Very high	74	Confident	66 Å²	66	83.1 Å²	83.1	35%	0.353	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	104.1	176.9	161.5	50.3	0	0	0	108.9	Q29 D38	N27-Q29 PolarHBondContact ND2-NE2 3.03Å; N27-Q29 WeakPolarHBondContact OD1-CG 3.04Å; N27-Q29 PolarHBondContact OD1-NE2 3.22Å; N27-D38 HydrophobicContact CB-CB 4.34Å; N27-D38 PolarHBondContact N-O 3.38Å; N27-D38 WeakPolarHBondContact O-CB 3.35Å; N27-D38 PolarHBondContact O-N 3.11Å
28	C	89.2	Confident	76.5	Confident	34 Å²	34	82.5 Å²	82.5	23%	0.23	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.5	178.7	-57.7	0	0	0	0	110.3	C22 F36	C22-C28 HydrophobicContact CB-CB 3.59Å; C22-C28 WeakPolarHBondContact CB-SG 3.28Å; C22-C28 WeakPolarHBondContact SG-CB 3.38Å; C22-C28 PolarHBondContact SG-N 3.43Å; C22-C28 CovalentContact SG-SG 2.03Å; C22-C28 PolarHBondContact SG-SG 3.34Å; C28-F36 CarbonylContact C-O 3.47Å; C28-F36 VanDerWaalsContact CA-O 3.26Å; C28-F36 WeakPolarHBondContact CA-O 3.34Å
29	Q	84.8	Confident	79.1	Confident	64 Å²	64	76.1 Å²	76.1	30%	0.299	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.2	-178	-60	-175	-5.2	0	0	109.7	N27 K31 Q35 F36	N27-Q29 PolarHBondContact ND2-NE2 3.03Å; N27-Q29 WeakPolarHBondContact OD1-CG 3.04Å; N27-Q29 PolarHBondContact OD1-NE2 3.22Å; Q29-K31 VanDerWaalsContact OE1-CE 3.26Å; Q29-Q35 PolarHBondContact O-NE2 3.28Å; Q29-F36 PolarHBondContact N-O 3.01Å; Q29-F36 PolarHBondContact O-N 3.44Å
30	D	80.9	Confident	81.3	Confident	107 Å²	107	71.2 Å²	71.2	57%	0.572	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	124.2	161.2	-174.4	-0.2	0	0	0	108.1	A33	D30-A33 PolarHBondContact OD1-N 2.79Å
31	K	63.6	Low	83	Confident	114 Å²	114	75.5 Å²	75.5	50%	0.496	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	117.3	174.2	-82.6	174.5	168.4	159.4	0	108.1	Q29 A33 H34	Q29-K31 VanDerWaalsContact OE1-CE 3.26Å; K31-A33 VanDerWaalsContact C-N 3.31Å; K31-A33 PolarHBondContact O-N 2.81Å; K31-H34 PolarHBondContact N-O 2.8Å; K31-H34 VanDerWaalsContact N-O 3.1Å; K31-H34 PolarHBondContact O-N 2.88Å
32	F	61.7	Low	84.3	Confident	202 Å²	202	76 Å²	76	89%	0.886	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	44.2	174.7	-49.7	-77.1	0	0	0	113.6	H34	F32-H34 PolarHBondContact O-N 2.68Å
33	A	62	Low	84.8	Confident	86 Å²	86	79.1 Å²	79.1	71%	0.711	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	22.7	-175.7	0	0	0	0	0	114.7	D30 K31	D30-A33 PolarHBondContact OD1-N 2.79Å; K31-A33 VanDerWaalsContact C-N 3.31Å; K31-A33 PolarHBondContact O-N 2.81Å
34	H	67.9	Low	85.1	Confident	119 Å²	119	79.3 Å²	79.3	55%	0.551	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	110	168.5	-72	-7	0	0	0	109.6	K31 F32 F36 T56	K31-H34 PolarHBondContact N-O 2.8Å; K31-H34 VanDerWaalsContact N-O 3.1Å; K31-H34 PolarHBondContact O-N 2.88Å; F32-H34 PolarHBondContact O-N 2.68Å; H34-F36 PolarHBondContact O-N 2.99Å; H34-T56 WeakPolarHBondContact CB-OG1 3.2Å
35	Q	83.7	Confident	85.7	Confident	30 Å²	30	75.3 Å²	75.3	14%	0.14	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	107.3	174.2	-178.9	73.3	74.1	0	0	108.8	Q29 P52 V55 T56 T57	Q29-Q35 PolarHBondContact O-NE2 3.28Å; Q35-P52 HydrophobicContact CG-CG 3.95Å; Q35-V55 HydrophobicContact CG-CB 4.25Å; Q35-V55 HydrophobicContact CG-CG2 4.43Å; Q35-V55 WeakPolarHBondContact O-CA 3.43Å; Q35-V55 VanDerWaalsContact O-CG2 3.29Å; Q35-V55 WeakPolarHBondContact O-CG2 3.41Å; Q35-T56 PolarHBondContact O-N 3.13Å; Q35-T56 PolarHBondContact O-OG1 3.23Å; Q35-T57 PolarHBondContact O-N 2.9Å
36	F	90.2	Very high	86.1	Confident	63 Å²	63	75.6 Å²	75.6	28%	0.276	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.7	174	-179.7	-123.7	0	0	0	109.7	C28 Q29 H34 D38 T57	C28-F36 CarbonylContact C-O 3.47Å; C28-F36 VanDerWaalsContact CA-O 3.26Å; C28-F36 WeakPolarHBondContact CA-O 3.34Å; Q29-F36 PolarHBondContact N-O 3.01Å; Q29-F36 PolarHBondContact O-N 3.44Å; H34-F36 PolarHBondContact O-N 2.99Å; F36-D38 HydrophobicContact CD1-CB 4.28Å; F36-D38 HydrophobicContact CE1-CB 3.62Å; F36-D38 HydrophobicContact CZ-CB 4.02Å; F36-T57 WeakPolarHBondContact CA-O 3.46Å; F36-T57 HydrophobicContact CD2-CG2 3.61Å; F36-T57 HydrophobicContact CE2-CG2 3.77Å
37	A	92.6	Very high	86.3	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	111.8	169.5	0	0	0	0	0	110.2	F51 V55 T57 V58 S59	A37-F51 HydrophobicContact CB-CD1 3.89Å; A37-F51 HydrophobicContact CB-CE1 3.88Å; A37-V55 HydrophobicContact CB-CG2 3.72Å; A37-T57 PolarHBondContact N-O 3.49Å; A37-V58 HydrophobicContact CB-CG2 4.43Å; A37-S59 PolarHBondContact O-N 2.8Å
38	D	92.9	Very high	86.4	Confident	46 Å²	46	73.4 Å²	73.4	25%	0.246	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107	179.4	-169.2	11.2	0	0	0	111.6	C26 N27 F36 A40	C26-D38 CarbonylContact C-O 3.58Å; C26-D38 VanDerWaalsContact CA-O 3.22Å; C26-D38 WeakPolarHBondContact CA-O 3.26Å; C26-D38 WeakPolarHBondContact CB-O 3.45Å; N27-D38 HydrophobicContact CB-CB 4.34Å; N27-D38 PolarHBondContact N-O 3.38Å; N27-D38 WeakPolarHBondContact O-CB 3.35Å; N27-D38 PolarHBondContact O-N 3.11Å; F36-D38 HydrophobicContact CD1-CB 4.28Å; F36-D38 HydrophobicContact CE1-CB 3.62Å; F36-D38 HydrophobicContact CZ-CB 4.02Å; D38-A40 WeakPolarHBondContact OD1-CB 3.38Å; D38-A40 PolarHBondContact OD1-N 2.99Å; D38-A40 VanDerWaalsContact OD1-N 3.17Å
39	C	94.6	Very high	86.4	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	39%	0.39	C	S	.	.			trans	-116.1	16.8	175.4	-58	0	0	0	0	111.4	C26 K42 L44 F51 S59 L60 N63	C26-C39 HydrophobicContact CB-CB 4.1Å; C26-C39 WeakPolarHBondContact CB-SG 3.38Å; C26-C39 WeakPolarHBondContact SG-CB 3.15Å; C26-C39 CovalentContact SG-SG 2.03Å; C26-C39 PolarHBondContact SG-SG 3.42Å; C39-K42 VanDerWaalsContact O-CG 3.24Å; C39-K42 WeakPolarHBondContact O-CG 3.45Å; C39-L44 HydrophobicContact CB-CD1 3.85Å; C39-F51 VanDerWaalsContact SG-CE1 3.56Å; C39-S59 CarbonylContact C-O 3.56Å; C39-S59 VanDerWaalsContact C-O 3.3Å; C39-S59 VanDerWaalsContact CA-O 3.24Å; C39-S59 WeakPolarHBondContact CA-O 3.41Å; C39-S59 VanDerWaalsContact CB-O 3.26Å; C39-S59 WeakPolarHBondContact CB-O 3.42Å; C39-S59 PolarHBondContact N-O 3.17Å; C39-L60 HydrophobicContact CB-CD2 3.56Å; C39-L60 HydrophobicContact CB-CG 4.23Å; C39-N63 PolarHBondContact O-ND2 3.07Å
40	A	94.4	Very high	86.4	Confident	11 Å²	11	77 Å²	77	9%	0.091	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	148.8	-176.7	0	0	0	0	0	112.9	D38 K42 S59 S61	D38-A40 WeakPolarHBondContact OD1-CB 3.38Å; D38-A40 PolarHBondContact OD1-N 2.99Å; D38-A40 VanDerWaalsContact OD1-N 3.17Å; A40-K42 WeakPolarHBondContact O-CE 3.07Å; A40-K42 WeakPolarHBondContact O-CG 3.25Å; A40-S59 PolarHBondContact N-O 3.38Å; A40-S61 WeakPolarHBondContact CA-O 3.46Å; A40-S61 VanDerWaalsContact CB-O 3.3Å; A40-S61 WeakPolarHBondContact CB-O 3.41Å
41	Y	95.4	Very high	86.8	Confident	193 Å²	193	72.3 Å²	72.3	76%	0.757	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	46.1	-179.5	-51.3	-89	0	0	0	113.3	S61 A62	Y41-S61 PolarHBondContact N-O 3.2Å; Y41-A62 VanDerWaalsContact CA-O 3.26Å; Y41-A62 WeakPolarHBondContact CA-O 3.46Å; Y41-A62 HydrophobicContact CD1-CB 3.45Å; Y41-A62 VanDerWaalsContact CD1-CB 3.45Å; Y41-A62 HydrophobicContact CD2-CB 4.24Å; Y41-A62 HydrophobicContact CE1-CB 3.29Å; Y41-A62 HydrophobicContact CE2-CB 4.11Å; Y41-A62 HydrophobicContact CG-CB 3.93Å; Y41-A62 PolarHBondContact N-O 2.98Å
42	K	93.9	Very high	88	Confident	86 Å²	86	67.5 Å²	67.5	37%	0.374	35%	0.349	S	S	.	.	S	Bend	trans	-119.4	9.4	-175.7	-58.2	-56	177.2	-179.8	0	114.3	L25 C39 A40 L44 N63	L25-K42 WeakPolarHBondContact O-CD 3.08Å; L25-K42 WeakPolarHBondContact O-CE 3.38Å; L25-K42 WeakPolarHBondContact O-CG 3.43Å; C39-K42 VanDerWaalsContact O-CG 3.24Å; C39-K42 WeakPolarHBondContact O-CG 3.45Å; A40-K42 WeakPolarHBondContact O-CE 3.07Å; A40-K42 WeakPolarHBondContact O-CG 3.25Å; K42-L44 HydrophobicContact CB-CD1 4.03Å; K42-L44 HydrophobicContact CB-CD2 4.36Å; K42-L44 HydrophobicContact CB-CG 3.77Å; K42-L44 PolarHBondContact O-N 2.94Å; K42-L44 VanDerWaalsContact O-N 3.13Å; K42-N63 VanDerWaalsContact C-OD1 3.3Å; K42-N63 WeakPolarHBondContact CA-OD1 3.11Å; K42-N63 PolarHBondContact N-OD1 3.49Å
43	D	94.7	Very high	89.2	Confident	104 Å²	104	63.8 Å²	63.8	56%	0.556	33%	0.333	S	S	*	.			trans	53.7	26.6	-176.9	-76.2	-53.6	0	0	0	114.7	L45 N63 K64	D43-L45 PolarHBondContact O-N 2.87Å; D43-N63 PolarHBondContact N-OD1 2.61Å; D43-K64 VanDerWaalsContact OD1-CE 3.26Å; D43-K64 WeakPolarHBondContact OD1-CE 3.47Å; D43-K64 IonicContact OD1-NZ 3.43Å; D43-K64 PolarHBondContact OD1-NZ 2.7Å
44	L	94.7	Very high	90.5	Very high	16 Å²	16	62.8 Å²	62.8	8%	0.084	32%	0.316	C	S	.	.			trans	-65.7	126.6	-174.3	-65	168.3	0	0	0	111.8	L25 C39 K42 P48 L60 N63 K64 I65	L25-L44 HydrophobicContact CB-CD2 4.37Å; L25-L44 HydrophobicContact CD1-CD2 3.62Å; C39-L44 HydrophobicContact CB-CD1 3.85Å; K42-L44 HydrophobicContact CB-CD1 4.03Å; K42-L44 HydrophobicContact CB-CD2 4.36Å; K42-L44 HydrophobicContact CB-CG 3.77Å; K42-L44 PolarHBondContact O-N 2.94Å; K42-L44 VanDerWaalsContact O-N 3.13Å; L44-P48 HydrophobicContact CD1-CG 3.71Å; L44-P48 HydrophobicContact CD2-CG 4.08Å; L44-L60 HydrophobicContact CD1-CD2 3.89Å; L44-N63 HydrophobicContact CB-CB 4.08Å; L44-N63 PolarHBondContact N-OD1 3.18Å; L44-K64 CarbonylContact O-C 3.49Å; L44-K64 VanDerWaalsContact O-CA 3.31Å; L44-K64 WeakPolarHBondContact O-CA 3.27Å; L44-K64 PolarHBondContact O-N 2.86Å; L44-I65 HydrophobicContact CB-CG1 4.34Å; L44-I65 WeakPolarHBondContact O-CG1 3.45Å; L44-I65 PolarHBondContact O-N 3.03Å
45	L	95.1	Very high	91.6	Very high	117 Å²	117	57.1 Å²	57.1	61%	0.613	29%	0.29	S	S	*	.	S	Bend	trans	-84.6	-18.5	175.5	-59.8	175.7	0	0	0	113.3	D43 K64	D43-L45 PolarHBondContact O-N 2.87Å; L45-K64 HydrophobicContact CD2-CB 3.91Å
46	K	94.7	Very high	92	Very high	113 Å²	113	56.8 Å²	56.8	49%	0.491	29%	0.29	S	S	.	.	S	Bend	trans	-146.9	162.1	179.3	-70	-161.3	174.7	-162.6	0	110.5	P48 E69	K46-P48 WeakPolarHBondContact O-CD 3.44Å; K46-E69 IonicContact NZ-OE1 3.24Å; K46-E69 PolarHBondContact NZ-OE1 3.47Å
47	V	95.1	Very high	92.2	Very high	16 Å²	16	55 Å²	55	10%	0.097	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-60.1	126.1	169.2	-179.9	0	0	0	0	109.5	F51 L60 I65 L68 F73	V47-F51 HydrophobicContact CG1-CE2 3.89Å; V47-L60 HydrophobicContact CG1-CD1 4.13Å; V47-L60 HydrophobicContact CG2-CD1 4.38Å; V47-I65 HydrophobicContact CG2-CD1 4.34Å; V47-L68 HydrophobicContact CG2-CD2 3.71Å; V47-F73 HydrophobicContact CB-CE1 4.44Å; V47-F73 HydrophobicContact CG1-CD1 4.16Å; V47-F73 HydrophobicContact CG1-CE1 3.66Å; V47-F73 HydrophobicContact CG2-CE1 3.92Å; V47-F73 HydrophobicContact CG2-CZ 3.96Å
48	P	92.2	Very high	92.3	Very high	20 Å²	20	55 Å²	55	13%	0.13	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-65.9	148.3	177.5	-22.3	34.1	0	0	0	113.1	P23 L44 K46 F51 L60	P23-P48 HydrophobicContact CB-CB 3.54Å; P23-P48 HydrophobicContact CB-CG 4.45Å; P23-P48 HydrophobicContact CG-CB 3.83Å; L44-P48 HydrophobicContact CD1-CG 3.71Å; L44-P48 HydrophobicContact CD2-CG 4.08Å; K46-P48 WeakPolarHBondContact O-CD 3.44Å; P48-F51 HydrophobicContact CB-CE2 4.36Å; P48-F51 HydrophobicContact CB-CZ 4.44Å; P48-F51 HydrophobicContact CG-CZ 4.42Å; P48-F51 WeakPolarHBondContact O-CD2 3.31Å; P48-F51 WeakPolarHBondContact O-CE2 3.46Å; P48-L60 HydrophobicContact CG-CD2 4.36Å
49	V	88.8	Confident	92.4	Very high	134 Å²	134	53.7 Å²	53.7	81%	0.812	28%	0.278	S	S	*	.	S	Bend	trans	-89.8	154.7	169.3	-63.7	0	0	0	0	110.8	P23	P23-V49 WeakPolarHBondContact CG-O 3.11Å
50	G	85.7	Confident	92.5	Very high	39 Å²	39	53.7 Å²	53.7	40%	0.402	28%	0.278	S	S	.	.			trans	101.2	3.1	173.7	0	0	0	0	0	116.2
51	F	89.4	Confident	92.6	Very high	10 Å²	10	54.2 Å²	54.2	4%	0.044	28%	0.282	C	S	.	.			trans	-48.5	139.2	174.4	-71.9	-73.1	0	0	0	112.9	P23 A37 C39 V47 P48 V58 L60 I76	P23-F51 HydrophobicContact CG-CD1 4.11Å; P23-F51 HydrophobicContact CG-CE1 4.22Å; P23-F51 HydrophobicContact CG-CG 4.29Å; P23-F51 HydrophobicContact CG-CZ 4.49Å; A37-F51 HydrophobicContact CB-CD1 3.89Å; A37-F51 HydrophobicContact CB-CE1 3.88Å; C39-F51 VanDerWaalsContact SG-CE1 3.56Å; V47-F51 HydrophobicContact CG1-CE2 3.89Å; P48-F51 HydrophobicContact CB-CE2 4.36Å; P48-F51 HydrophobicContact CB-CZ 4.44Å; P48-F51 HydrophobicContact CG-CZ 4.42Å; P48-F51 WeakPolarHBondContact O-CD2 3.31Å; P48-F51 WeakPolarHBondContact O-CE2 3.46Å; F51-V58 HydrophobicContact CE1-CG1 3.98Å; F51-V58 HydrophobicContact CE1-CG2 4.46Å; F51-V58 HydrophobicContact CZ-CG1 3.97Å; F51-L60 HydrophobicContact CZ-CD1 4.31Å; F51-L60 HydrophobicContact CZ-CD2 4.36Å; F51-I76 HydrophobicContact CB-CG2 3.53Å; F51-I76 HydrophobicContact CG-CG2 4.39Å
52	P	88.2	Confident	92.7	Very high	12 Å²	12	46.2 Å²	46.2	8%	0.078	26%	0.255	C	S	.	.			trans	-70.5	136.8	178.5	30.5	-34.5	0	0	0	110.4	Q35 N54 V55	Q35-P52 HydrophobicContact CG-CG 3.95Å; P52-N54 PolarHBondContact O-N 3.32Å; P52-N54 VanDerWaalsContact O-N 3.09Å; P52-V55 HydrophobicContact CG-CB 4.33Å; P52-V55 VanDerWaalsContact O-CB 3.29Å; P52-V55 WeakPolarHBondContact O-CB 3.49Å; P52-V55 VanDerWaalsContact O-CG1 3.24Å; P52-V55 WeakPolarHBondContact O-CG1 3.46Å; P52-V55 PolarHBondContact O-N 3.37Å
53	F	87.5	Confident	92.9	Very high	124 Å²	124	42.6 Å²	42.6	54%	0.544	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.9	-169.4	61.8	-93.7	0	0	0	114.7
54	N	87.9	Confident	93	Very high	66 Å²	66	41.8 Å²	41.8	35%	0.353	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	4.5	177.3	67.8	-36.8	0	0	0	113.4	P52 T56	P52-N54 PolarHBondContact O-N 3.32Å; P52-N54 VanDerWaalsContact O-N 3.09Å; N54-T56 PolarHBondContact O-N 2.83Å
55	V	91.6	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	121.2	-179.7	71.3	0	0	0	0	111	Q35 A37 P52 T57 V58 I76 Q78 V79	Q35-V55 HydrophobicContact CG-CB 4.25Å; Q35-V55 HydrophobicContact CG-CG2 4.43Å; Q35-V55 WeakPolarHBondContact O-CA 3.43Å; Q35-V55 VanDerWaalsContact O-CG2 3.29Å; Q35-V55 WeakPolarHBondContact O-CG2 3.41Å; A37-V55 HydrophobicContact CB-CG2 3.72Å; P52-V55 HydrophobicContact CG-CB 4.33Å; P52-V55 VanDerWaalsContact O-CB 3.29Å; P52-V55 WeakPolarHBondContact O-CB 3.49Å; P52-V55 VanDerWaalsContact O-CG1 3.24Å; P52-V55 WeakPolarHBondContact O-CG1 3.46Å; P52-V55 PolarHBondContact O-N 3.37Å; V55-T57 WeakPolarHBondContact CG2-O 3.49Å; V55-V58 HydrophobicContact CB-CG2 4.43Å; V55-V58 HydrophobicContact CG1-CG2 3.86Å; V55-V58 HydrophobicContact CG2-CG2 3.64Å; V55-I76 HydrophobicContact CG1-CB 3.69Å; V55-I76 HydrophobicContact CG1-CD1 4.47Å; V55-I76 HydrophobicContact CG1-CG2 3.5Å; V55-Q78 CarbonylContact O-C 3.55Å; V55-V79 HydrophobicContact CG1-CG2 3.84Å; V55-V79 VanDerWaalsContact O-CG2 3.31Å; V55-V79 WeakPolarHBondContact O-CG2 3.19Å; V55-V79 PolarHBondContact O-N 2.91Å
56	T	93	Very high	93.3	Very high	22 Å²	22	38.4 Å²	38.4	14%	0.135	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-24.6	-180	58.7	0	0	0	0	112.1	H34 Q35 N54 V79 T80 S81	H34-T56 WeakPolarHBondContact CB-OG1 3.2Å; Q35-T56 PolarHBondContact O-N 3.13Å; Q35-T56 PolarHBondContact O-OG1 3.23Å; N54-T56 PolarHBondContact O-N 2.83Å; T56-V79 CarbonylContact O-C 3.49Å; T56-V79 WeakPolarHBondContact O-CA 3.39Å; T56-T80 PolarHBondContact O-N 2.85Å; T56-T80 PolarHBondContact O-OG1 3.37Å; T56-S81 PolarHBondContact O-N 3.45Å; T56-S81 VanDerWaalsContact O-N 3.17Å
57	T	93.9	Very high	93.3	Very high	27 Å²	27	34.4 Å²	34.4	17%	0.166	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	124.4	179.6	-63.1	0	0	0	0	111	Q35 F36 A37 V55 S81	Q35-T57 PolarHBondContact O-N 2.9Å; F36-T57 WeakPolarHBondContact CA-O 3.46Å; F36-T57 HydrophobicContact CD2-CG2 3.61Å; F36-T57 HydrophobicContact CE2-CG2 3.77Å; A37-T57 PolarHBondContact N-O 3.49Å; V55-T57 WeakPolarHBondContact CG2-O 3.49Å; T57-S81 WeakPolarHBondContact CA-O 3.44Å
58	V	94.9	Very high	93.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.5	178.2	175.2	0	0	0	0	110	A37 F51 V55 L60 I76 V79 S81 L82 W83	A37-V58 HydrophobicContact CB-CG2 4.43Å; F51-V58 HydrophobicContact CE1-CG1 3.98Å; F51-V58 HydrophobicContact CE1-CG2 4.46Å; F51-V58 HydrophobicContact CZ-CG1 3.97Å; V55-V58 HydrophobicContact CB-CG2 4.43Å; V55-V58 HydrophobicContact CG1-CG2 3.86Å; V55-V58 HydrophobicContact CG2-CG2 3.64Å; V58-L60 HydrophobicContact CG1-CD1 3.63Å; V58-L60 HydrophobicContact CG1-CG 3.84Å; V58-I76 HydrophobicContact CG2-CD1 4.07Å; V58-V79 HydrophobicContact CG2-CG2 3.88Å; V58-S81 PolarHBondContact N-O 3.05Å; V58-L82 HydrophobicContact CB-CD1 4.02Å; V58-L82 HydrophobicContact CG1-CD1 4.1Å; V58-W83 PolarHBondContact O-N 2.92Å
59	S	95.6	Very high	93.6	Very high	17 Å²	17	35.2 Å²	35.2	12%	0.119	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	105.4	176.4	-176.9	0	0	0	0	110.2	A37 C39 A40	A37-S59 PolarHBondContact O-N 2.8Å; C39-S59 CarbonylContact C-O 3.56Å; C39-S59 VanDerWaalsContact C-O 3.3Å; C39-S59 VanDerWaalsContact CA-O 3.24Å; C39-S59 WeakPolarHBondContact CA-O 3.41Å; C39-S59 VanDerWaalsContact CB-O 3.26Å; C39-S59 WeakPolarHBondContact CB-O 3.42Å; C39-S59 PolarHBondContact N-O 3.17Å; A40-S59 PolarHBondContact N-O 3.38Å
60	L	96.5	Very high	93.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.			trans	-115.3	9.3	176.7	-77	160.1	0	0	0	112.1	C39 L44 V47 P48 F51 V58 N63 I65 F73 W83 L84 N87	C39-L60 HydrophobicContact CB-CD2 3.56Å; C39-L60 HydrophobicContact CB-CG 4.23Å; L44-L60 HydrophobicContact CD1-CD2 3.89Å; V47-L60 HydrophobicContact CG1-CD1 4.13Å; V47-L60 HydrophobicContact CG2-CD1 4.38Å; P48-L60 HydrophobicContact CG-CD2 4.36Å; F51-L60 HydrophobicContact CZ-CD1 4.31Å; F51-L60 HydrophobicContact CZ-CD2 4.36Å; V58-L60 HydrophobicContact CG1-CD1 3.63Å; V58-L60 HydrophobicContact CG1-CG 3.84Å; L60-N63 PolarHBondContact O-ND2 3.06Å; L60-I65 HydrophobicContact CB-CD1 4.25Å; L60-I65 HydrophobicContact CD2-CD1 4.12Å; L60-F73 HydrophobicContact CD1-CE1 4.1Å; L60-W83 CarbonylContact C-O 3.5Å; L60-W83 WeakPolarHBondContact CA-O 3.42Å; L60-W83 PolarHBondContact N-O 3.31Å; L60-L84 HydrophobicContact CB-CD2 3.69Å; L60-L84 HydrophobicContact CB-CG 4.49Å; L60-L84 HydrophobicContact CD1-CD2 3.99Å; L60-L84 HydrophobicContact CG-CD2 4.49Å; L60-N87 PolarHBondContact O-ND2 2.89Å
61	S	96.9	Very high	93.9	Very high	23 Å²	23	33.9 Å²	33.9	16%	0.161	19%	0.187	C	C	.	.			trans	-62.8	157.1	179.1	-56.9	0	0	0	0	113.4	A40 Y41 N63 W83 A85	A40-S61 WeakPolarHBondContact CA-O 3.46Å; A40-S61 VanDerWaalsContact CB-O 3.3Å; A40-S61 WeakPolarHBondContact CB-O 3.41Å; Y41-S61 PolarHBondContact N-O 3.2Å; S61-N63 PolarHBondContact O-ND2 3.49Å; S61-W83 PolarHBondContact N-O 3.41Å; S61-W83 WeakPolarHBondContact OG-CB 3.42Å; S61-A85 CarbonylContact C-O 3.46Å; S61-A85 WeakPolarHBondContact CA-O 3.44Å; S61-A85 WeakPolarHBondContact CB-O 3.15Å; S61-A85 PolarHBondContact OG-N 2.9Å
62	A	97.2	Very high	94	Very high	25 Å²	25	34.5 Å²	34.5	21%	0.207	19%	0.193	C	C	.	.	S	Bend	trans	55.4	56.8	-179.8	0	0	0	0	0	112.8	Y41 A85 H86	Y41-A62 VanDerWaalsContact CA-O 3.26Å; Y41-A62 WeakPolarHBondContact CA-O 3.46Å; Y41-A62 HydrophobicContact CD1-CB 3.45Å; Y41-A62 VanDerWaalsContact CD1-CB 3.45Å; Y41-A62 HydrophobicContact CD2-CB 4.24Å; Y41-A62 HydrophobicContact CE1-CB 3.29Å; Y41-A62 HydrophobicContact CE2-CB 4.11Å; Y41-A62 HydrophobicContact CG-CB 3.93Å; Y41-A62 PolarHBondContact N-O 2.98Å; A62-A85 PolarHBondContact N-O 2.67Å; A62-H86 WeakPolarHBondContact CA-O 3.36Å; A62-H86 PolarHBondContact N-O 3.24Å; A62-H86 VanDerWaalsContact N-O 3.14Å
63	N	97.4	Very high	94.2	Very high	10 Å²	10	34 Å²	34	5%	0.053	19%	0.19	C	C	.	.	S	Bend	trans	-134.3	-166.1	176.5	-78.9	-65.1	0	0	0	109.7	C39 K42 D43 L44 L60 S61 I65 H86 N87	C39-N63 PolarHBondContact O-ND2 3.07Å; K42-N63 VanDerWaalsContact C-OD1 3.3Å; K42-N63 WeakPolarHBondContact CA-OD1 3.11Å; K42-N63 PolarHBondContact N-OD1 3.49Å; D43-N63 PolarHBondContact N-OD1 2.61Å; L44-N63 HydrophobicContact CB-CB 4.08Å; L44-N63 PolarHBondContact N-OD1 3.18Å; L60-N63 PolarHBondContact O-ND2 3.06Å; S61-N63 PolarHBondContact O-ND2 3.49Å; N63-I65 HydrophobicContact CB-CG1 4.27Å; N63-H86 PolarHBondContact N-O 3.04Å; N63-N87 WeakPolarHBondContact CA-OD1 3.35Å; N63-N87 WeakPolarHBondContact CB-OD1 3.5Å; N63-N87 PolarHBondContact O-OD1 3.43Å
64	K	97.4	Very high	94.3	Very high	86 Å²	86	32.9 Å²	32.9	37%	0.374	19%	0.188	S	C	.	.			trans	-122.8	32	-176.5	-71.7	166.6	174.7	156	0	111.4	D43 L44 L45 T66 N87	D43-K64 VanDerWaalsContact OD1-CE 3.26Å; D43-K64 WeakPolarHBondContact OD1-CE 3.47Å; D43-K64 IonicContact OD1-NZ 3.43Å; D43-K64 PolarHBondContact OD1-NZ 2.7Å; L44-K64 CarbonylContact O-C 3.49Å; L44-K64 VanDerWaalsContact O-CA 3.31Å; L44-K64 WeakPolarHBondContact O-CA 3.27Å; L44-K64 PolarHBondContact O-N 2.86Å; L45-K64 HydrophobicContact CD2-CB 3.91Å; K64-T66 PolarHBondContact O-N 3.24Å; K64-N87 PolarHBondContact N-OD1 2.97Å
65	I	97.8	Very high	94.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.201	C	C	.	.			trans	-70.4	121.9	-178	-58.2	173.6	0	0	0	108.1	L44 V47 L60 N63 L68 L84 N87 E88 I89	L44-I65 HydrophobicContact CB-CG1 4.34Å; L44-I65 WeakPolarHBondContact O-CG1 3.45Å; L44-I65 PolarHBondContact O-N 3.03Å; V47-I65 HydrophobicContact CG2-CD1 4.34Å; L60-I65 HydrophobicContact CB-CD1 4.25Å; L60-I65 HydrophobicContact CD2-CD1 4.12Å; N63-I65 HydrophobicContact CB-CG1 4.27Å; I65-L68 HydrophobicContact CG2-CD2 3.92Å; I65-L84 HydrophobicContact CD1-CD2 4.45Å; I65-N87 HydrophobicContact CB-CB 4.41Å; I65-N87 WeakPolarHBondContact CB-OD1 3.49Å; I65-N87 WeakPolarHBondContact CG1-OD1 3.01Å; I65-N87 PolarHBondContact N-OD1 2.92Å; I65-E88 CarbonylContact O-C 3.51Å; I65-E88 WeakPolarHBondContact O-CA 3.45Å; I65-E88 PolarHBondContact O-N 3.46Å; I65-I89 HydrophobicContact CB-CG1 4.37Å; I65-I89 HydrophobicContact CG2-CG1 4.2Å; I65-I89 VanDerWaalsContact O-CG1 3.26Å; I65-I89 WeakPolarHBondContact O-CG1 2.99Å; I65-I89 PolarHBondContact O-N 2.78Å
66	T	96.9	Very high	94.2	Very high	62 Å²	62	35.5 Å²	35.5	38%	0.38	20%	0.202	S	C	.	.			trans	-94.5	-27.1	-176.6	58.6	0	0	0	0	113.7	K64 E88 I89 D90	K64-T66 PolarHBondContact O-N 3.24Å; T66-E88 HydrophobicContact CG2-CB 4.46Å; T66-I89 WeakPolarHBondContact O-CA 3.22Å; T66-D90 PolarHBondContact O-N 2.92Å
67	S	96.6	Very high	94.1	Very high	29 Å²	29	37 Å²	37	20%	0.203	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.1	-172.1	59.7	0	0	0	0	111.5	S91	S67-S91 WeakPolarHBondContact CA-O 3.36Å; S67-S91 WeakPolarHBondContact CB-OG 3.25Å
68	L	96.8	Very high	94	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.7	172.1	-53.8	-178.6	0	0	0	110.4	V47 I65 F73 L84 I89 S91 I92 Q93 T96	V47-L68 HydrophobicContact CG2-CD2 3.71Å; I65-L68 HydrophobicContact CG2-CD2 3.92Å; L68-F73 HydrophobicContact CD1-CE2 4.22Å; L68-F73 HydrophobicContact CD1-CZ 4.49Å; L68-F73 HydrophobicContact CD2-CZ 4.27Å; L68-L84 HydrophobicContact CD1-CD1 3.94Å; L68-L84 HydrophobicContact CD2-CD2 4.35Å; L68-I89 HydrophobicContact CD1-CD1 4.18Å; L68-I89 HydrophobicContact CD2-CD1 4.04Å; L68-I89 HydrophobicContact CG-CD1 4.12Å; L68-I89 HydrophobicContact CG-CG2 4.2Å; L68-S91 PolarHBondContact N-O 2.83Å; L68-I92 HydrophobicContact CB-CB 4.49Å; L68-I92 HydrophobicContact CB-CG1 4.31Å; L68-I92 HydrophobicContact CB-CG2 4.2Å; L68-I92 HydrophobicContact CD1-CD1 3.96Å; L68-I92 HydrophobicContact CD1-CG1 3.93Å; L68-I92 HydrophobicContact CD1-CG2 4.3Å; L68-I92 HydrophobicContact CG-CG1 4.22Å; L68-Q93 PolarHBondContact O-N 2.84Å; L68-T96 HydrophobicContact CB-CG2 3.97Å
69	E	94.8	Very high	94	Very high	53 Å²	53	40.4 Å²	40.4	25%	0.248	23%	0.225	C	C	.	.			trans	-88.7	149.6	177.4	-67.9	172.4	-142.1	0	0	111	K46 N71 S72 T96	K46-E69 IonicContact NZ-OE1 3.24Å; K46-E69 PolarHBondContact NZ-OE1 3.47Å; E69-N71 VanDerWaalsContact CB-OD1 3.25Å; E69-N71 WeakPolarHBondContact CB-OD1 3.2Å; E69-N71 PolarHBondContact O-N 2.96Å; E69-S72 PolarHBondContact N-OG 2.87Å; E69-S72 VanDerWaalsContact N-OG 3.08Å; E69-S72 WeakPolarHBondContact O-CB 3.36Å; E69-S72 PolarHBondContact O-N 2.92Å; E69-S72 PolarHBondContact O-OG 3.39Å; E69-T96 WeakPolarHBondContact O-CG2 3.29Å
70	S	92.1	Very high	94.1	Very high	54 Å²	54	41.3 Å²	41.3	38%	0.378	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.9	-175	59.8	0	0	0	0	114.9	T96	S70-T96 WeakPolarHBondContact CA-OG1 3.34Å; S70-T96 PolarHBondContact N-OG1 2.94Å
71	N	89.6	Confident	94.1	Very high	91 Å²	91	41.9 Å²	41.9	49%	0.487	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.3	173.4	61	10.5	0	0	0	114	E69 F73 I74	E69-N71 VanDerWaalsContact CB-OD1 3.25Å; E69-N71 WeakPolarHBondContact CB-OD1 3.2Å; E69-N71 PolarHBondContact O-N 2.96Å; N71-F73 VanDerWaalsContact C-N 3.26Å; N71-F73 PolarHBondContact O-N 2.88Å; N71-F73 VanDerWaalsContact O-N 3.14Å; N71-I74 VanDerWaalsContact O-CG2 3.29Å; N71-I74 WeakPolarHBondContact O-CG2 3.25Å; N71-I74 PolarHBondContact O-N 2.69Å
72	S	91.3	Very high	94.1	Very high	23 Å²	23	40.8 Å²	40.8	16%	0.161	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.9	-168.1	-59.8	0	0	0	0	113.5	E69	E69-S72 PolarHBondContact N-OG 2.87Å; E69-S72 VanDerWaalsContact N-OG 3.08Å; E69-S72 WeakPolarHBondContact O-CB 3.36Å; E69-S72 PolarHBondContact O-N 2.92Å; E69-S72 PolarHBondContact O-OG 3.39Å
73	F	93.2	Very high	94.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	10.2	-174	-48.8	-52.1	0	0	0	113.7	V47 L60 L68 N71 N75 I76 L82 L84 T96 L97 L100	V47-F73 HydrophobicContact CB-CE1 4.44Å; V47-F73 HydrophobicContact CG1-CD1 4.16Å; V47-F73 HydrophobicContact CG1-CE1 3.66Å; V47-F73 HydrophobicContact CG2-CE1 3.92Å; V47-F73 HydrophobicContact CG2-CZ 3.96Å; L60-F73 HydrophobicContact CD1-CE1 4.1Å; L68-F73 HydrophobicContact CD1-CE2 4.22Å; L68-F73 HydrophobicContact CD1-CZ 4.49Å; L68-F73 HydrophobicContact CD2-CZ 4.27Å; N71-F73 VanDerWaalsContact C-N 3.26Å; N71-F73 PolarHBondContact O-N 2.88Å; N71-F73 VanDerWaalsContact O-N 3.14Å; F73-N75 PolarHBondContact O-N 2.02Å; F73-N75 VanDerWaalsContact O-N 3.11Å; F73-I76 HydrophobicContact CB-CD1 4.07Å; F73-I76 HydrophobicContact CB-CG1 3.86Å; F73-I76 HydrophobicContact CD1-CD1 3.77Å; F73-I76 HydrophobicContact CD1-CG1 4.5Å; F73-I76 HydrophobicContact CG-CD1 4.33Å; F73-I76 VanDerWaalsContact O-CG1 3.24Å; F73-I76 WeakPolarHBondContact O-CG1 3.43Å; F73-I76 PolarHBondContact O-N 2.62Å; F73-I76 VanDerWaalsContact O-N 3.08Å; F73-L82 HydrophobicContact CD2-CD2 4.24Å; F73-L82 HydrophobicContact CE1-CD1 4.26Å; F73-L82 HydrophobicContact CE1-CD2 4.5Å; F73-L82 HydrophobicContact CE2-CD2 3.89Å; F73-L82 HydrophobicContact CZ-CD1 4.34Å; F73-L82 HydrophobicContact CZ-CD2 4.04Å; F73-L84 HydrophobicContact CE2-CD1 4.46Å; F73-L84 HydrophobicContact CZ-CD1 4.09Å; F73-L84 HydrophobicContact CZ-CD2 4.43Å; F73-T96 HydrophobicContact CD2-CG2 3.83Å; F73-T96 HydrophobicContact CE2-CG2 3.97Å; F73-L97 HydrophobicContact CD2-CD2 4.16Å; F73-L97 HydrophobicContact CE2-CD2 4.05Å; F73-L100 HydrophobicContact CB-CD1 4.24Å; F73-L100 HydrophobicContact CB-CD2 4.07Å; F73-L100 HydrophobicContact CB-CG 4.49Å; F73-L100 HydrophobicContact CD2-CD1 4.26Å; F73-L100 HydrophobicContact CG-CD1 4.43Å
74	I	88.1	Confident	94.2	Very high	100 Å²	100	42.1 Å²	42.1	51%	0.513	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.4	-172.8	-162.4	170.1	0	0	0	113.8	N71	N71-I74 VanDerWaalsContact O-CG2 3.29Å; N71-I74 WeakPolarHBondContact O-CG2 3.25Å; N71-I74 PolarHBondContact O-N 2.69Å
75	N	86.4	Confident	94.2	Very high	118 Å²	118	38.3 Å²	38.3	63%	0.631	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-0.3	-178.2	-65.3	-37.4	0	0	0	114.1	F73	F73-N75 PolarHBondContact O-N 2.02Å; F73-N75 VanDerWaalsContact O-N 3.11Å
76	I	91.6	Very high	94.3	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.015	23%	0.234	C	C	.	.			trans	-127.7	43.4	-169.7	62.1	172.3	0	0	0	113.1	F51 V55 V58 F73 Q78 V79	F51-I76 HydrophobicContact CB-CG2 3.53Å; F51-I76 HydrophobicContact CG-CG2 4.39Å; V55-I76 HydrophobicContact CG1-CB 3.69Å; V55-I76 HydrophobicContact CG1-CD1 4.47Å; V55-I76 HydrophobicContact CG1-CG2 3.5Å; V58-I76 HydrophobicContact CG2-CD1 4.07Å; F73-I76 HydrophobicContact CB-CD1 4.07Å; F73-I76 HydrophobicContact CB-CG1 3.86Å; F73-I76 HydrophobicContact CD1-CD1 3.77Å; F73-I76 HydrophobicContact CD1-CG1 4.5Å; F73-I76 HydrophobicContact CG-CD1 4.33Å; F73-I76 VanDerWaalsContact O-CG1 3.24Å; F73-I76 WeakPolarHBondContact O-CG1 3.43Å; F73-I76 PolarHBondContact O-N 2.62Å; F73-I76 VanDerWaalsContact O-N 3.08Å; I76-Q78 PolarHBondContact O-N 2.9Å; I76-V79 HydrophobicContact CB-CG2 4.01Å; I76-V79 HydrophobicContact CD1-CG2 3.93Å; I76-V79 HydrophobicContact CG1-CG2 4.1Å; I76-V79 WeakPolarHBondContact O-CG2 3.33Å; I76-V79 PolarHBondContact O-N 2.83Å; I76-V79 VanDerWaalsContact O-N 3.12Å
77	T	91.2	Very high	94.3	Very high	54 Å²	54	41.2 Å²	41.2	33%	0.331	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-7.8	-177.5	58.7	0	0	0	0	115.2	P99	T77-P99 HydrophobicContact CG2-CB 4.27Å
78	Q	92.4	Very high	94.4	Very high	98 Å²	98	43.5 Å²	43.5	46%	0.458	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-1.9	175.7	-55.8	-52.8	-67.8	0	0	113.8	V55 I76 T80	V55-Q78 CarbonylContact O-C 3.55Å; I76-Q78 PolarHBondContact O-N 2.9Å; Q78-T80 PolarHBondContact O-N 2.78Å
79	V	95.2	Very high	94.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.			trans	-65.3	121.3	-179.5	173.2	0	0	0	0	111.2	V55 T56 V58 I76 S81 L82 Q102 L103	V55-V79 HydrophobicContact CG1-CG2 3.84Å; V55-V79 VanDerWaalsContact O-CG2 3.31Å; V55-V79 WeakPolarHBondContact O-CG2 3.19Å; V55-V79 PolarHBondContact O-N 2.91Å; T56-V79 CarbonylContact O-C 3.49Å; T56-V79 WeakPolarHBondContact O-CA 3.39Å; V58-V79 HydrophobicContact CG2-CG2 3.88Å; I76-V79 HydrophobicContact CB-CG2 4.01Å; I76-V79 HydrophobicContact CD1-CG2 3.93Å; I76-V79 HydrophobicContact CG1-CG2 4.1Å; I76-V79 WeakPolarHBondContact O-CG2 3.33Å; I76-V79 PolarHBondContact O-N 2.83Å; I76-V79 VanDerWaalsContact O-N 3.12Å; V79-S81 WeakPolarHBondContact CG1-O 3.45Å; V79-L82 HydrophobicContact CG1-CB 4.1Å; V79-Q102 CarbonylContact O-C 3.18Å; V79-L103 HydrophobicContact CG1-CD1 3.93Å; V79-L103 PolarHBondContact O-N 2.82Å
80	T	96.3	Very high	94.5	Very high	36 Å²	36	45 Å²	45	22%	0.221	24%	0.236	C	C	.	.	S	Bend	trans	-95.8	-21.6	170.6	70.3	0	0	0	0	112.3	T56 Q78 Q102 R104 N105	T56-T80 PolarHBondContact O-N 2.85Å; T56-T80 PolarHBondContact O-OG1 3.37Å; Q78-T80 PolarHBondContact O-N 2.78Å; T80-Q102 WeakPolarHBondContact CA-O 3.25Å; T80-Q102 HydrophobicContact CG2-CB 4.39Å; T80-R104 WeakPolarHBondContact O-CA 3.19Å; T80-R104 WeakPolarHBondContact O-CB 2.95Å; T80-R104 PolarHBondContact O-N 3.26Å; T80-N105 PolarHBondContact O-N 2.85Å
81	S	97.2	Very high	94.6	Very high	11 Å²	11	44.9 Å²	44.9	8%	0.077	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	115.6	-177.6	-57.1	0	0	0	0	112.2	T56 T57 V58 V79 N105	T56-S81 PolarHBondContact O-N 3.45Å; T56-S81 VanDerWaalsContact O-N 3.17Å; T57-S81 WeakPolarHBondContact CA-O 3.44Å; V58-S81 PolarHBondContact N-O 3.05Å; V79-S81 WeakPolarHBondContact CG1-O 3.45Å; S81-N105 WeakPolarHBondContact CA-O 3.2Å; S81-N105 PolarHBondContact OG-ND2 3.39Å
82	L	97.7	Very high	95	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	116.1	-179.1	-179.6	58.4	0	0	0	110.5	V58 F73 V79 L84 L97 L100 L103 N105 L106 D107	V58-L82 HydrophobicContact CB-CD1 4.02Å; V58-L82 HydrophobicContact CG1-CD1 4.1Å; F73-L82 HydrophobicContact CD2-CD2 4.24Å; F73-L82 HydrophobicContact CE1-CD1 4.26Å; F73-L82 HydrophobicContact CE1-CD2 4.5Å; F73-L82 HydrophobicContact CE2-CD2 3.89Å; F73-L82 HydrophobicContact CZ-CD1 4.34Å; F73-L82 HydrophobicContact CZ-CD2 4.04Å; V79-L82 HydrophobicContact CG1-CB 4.1Å; L82-L84 HydrophobicContact CD1-CD1 4.22Å; L82-L84 HydrophobicContact CD1-CG 4.24Å; L82-L84 HydrophobicContact CD2-CD1 3.87Å; L82-L84 HydrophobicContact CG-CD1 3.84Å; L82-L84 HydrophobicContact CG-CG 4.22Å; L82-L97 HydrophobicContact CD2-CD2 3.96Å; L82-L100 HydrophobicContact CD2-CD1 3.85Å; L82-L103 HydrophobicContact CB-CD1 3.8Å; L82-N105 PolarHBondContact N-O 2.95Å; L82-L106 HydrophobicContact CB-CD1 4.17Å; L82-L106 HydrophobicContact CD2-CD1 4.09Å; L82-L106 HydrophobicContact CG-CD1 4.19Å; L82-D107 PolarHBondContact O-N 2.81Å
83	W	98	Very high	95.2	Very high	63 Å²	63	44.9 Å²	44.9	24%	0.239	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.2	-179	-42.6	96.3	0	0	0	109.8	V58 L60 S61 N105 D107 L129	V58-W83 PolarHBondContact O-N 2.92Å; L60-W83 CarbonylContact C-O 3.5Å; L60-W83 WeakPolarHBondContact CA-O 3.42Å; L60-W83 PolarHBondContact N-O 3.31Å; S61-W83 PolarHBondContact N-O 3.41Å; S61-W83 WeakPolarHBondContact OG-CB 3.42Å; W83-N105 HydrophobicContact CH2-CB 3.74Å; W83-N105 HydrophobicContact CZ2-CB 3.96Å; W83-N105 HydrophobicContact CZ3-CB 4.45Å; W83-D107 HydrophobicContact CE3-CB 3.53Å; W83-D107 HydrophobicContact CZ3-CB 3.98Å; W83-L129 HydrophobicContact CH2-CD2 4.23Å; W83-L129 HydrophobicContact CZ3-CD2 4.32Å
84	L	98	Very high	95.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.			trans	-128.1	15.2	-177.3	-74.6	159.3	0	0	0	111.3	L60 I65 L68 F73 L82 N87 I89 D107 I108 N111	L60-L84 HydrophobicContact CB-CD2 3.69Å; L60-L84 HydrophobicContact CB-CG 4.49Å; L60-L84 HydrophobicContact CD1-CD2 3.99Å; L60-L84 HydrophobicContact CG-CD2 4.49Å; I65-L84 HydrophobicContact CD1-CD2 4.45Å; L68-L84 HydrophobicContact CD1-CD1 3.94Å; L68-L84 HydrophobicContact CD2-CD2 4.35Å; F73-L84 HydrophobicContact CE2-CD1 4.46Å; F73-L84 HydrophobicContact CZ-CD1 4.09Å; F73-L84 HydrophobicContact CZ-CD2 4.43Å; L82-L84 HydrophobicContact CD1-CD1 4.22Å; L82-L84 HydrophobicContact CD1-CG 4.24Å; L82-L84 HydrophobicContact CD2-CD1 3.87Å; L82-L84 HydrophobicContact CG-CD1 3.84Å; L82-L84 HydrophobicContact CG-CG 4.22Å; L84-N87 PolarHBondContact O-ND2 2.84Å; L84-I89 HydrophobicContact CB-CD1 4.26Å; L84-I89 HydrophobicContact CD2-CD1 4.34Å; L84-D107 CarbonylContact C-O 3.53Å; L84-D107 WeakPolarHBondContact CA-O 3.36Å; L84-D107 PolarHBondContact N-O 2.97Å; L84-I108 HydrophobicContact CB-CG2 4.01Å; L84-I108 HydrophobicContact CD1-CG2 3.95Å; L84-N111 PolarHBondContact O-ND2 2.87Å; L84-N111 VanDerWaalsContact O-ND2 3.09Å
85	A	97.9	Very high	95.5	Very high	6 Å²	6	47.6 Å²	47.6	5%	0.05	25%	0.249	C	C	.	.			trans	-70.1	148.2	-171.8	0	0	0	0	0	112.6	S61 A62 D107 S109	S61-A85 CarbonylContact C-O 3.46Å; S61-A85 WeakPolarHBondContact CA-O 3.44Å; S61-A85 WeakPolarHBondContact CB-O 3.15Å; S61-A85 PolarHBondContact OG-N 2.9Å; A62-A85 PolarHBondContact N-O 2.67Å; A85-D107 PolarHBondContact N-O 2.9Å; A85-S109 CarbonylContact C-O 3.56Å; A85-S109 WeakPolarHBondContact CA-O 3.31Å; A85-S109 WeakPolarHBondContact CB-O 3.02Å
86	H	97.9	Very high	95.9	Very high	111 Å²	111	42 Å²	42	51%	0.514	22%	0.219	S	C	.	.	S	Bend	trans	57.2	63.9	-174.7	-55	-87.2	0	0	0	111.5	A62 N63 S109 N110	A62-H86 WeakPolarHBondContact CA-O 3.36Å; A62-H86 PolarHBondContact N-O 3.24Å; A62-H86 VanDerWaalsContact N-O 3.14Å; N63-H86 PolarHBondContact N-O 3.04Å; H86-S109 PolarHBondContact N-O 2.95Å; H86-S109 VanDerWaalsContact N-O 3.08Å; H86-N110 WeakPolarHBondContact CA-O 3.47Å; H86-N110 HydrophobicContact CB-CB 4.48Å; H86-N110 PolarHBondContact CE1-OD1 2.99Å; H86-N110 PolarHBondContact N-O 3.37Å; H86-N110 WeakPolarHBondContact ND1-CB 3.49Å; H86-N110 PolarHBondContact NE2-ND2 3.26Å
87	N	98.1	Very high	96.1	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.064	22%	0.218	C	C	.	.	S	Bend	trans	-127.8	-170.4	169	-87.9	-82	0	0	0	108.6	L60 N63 K64 I65 L84 I89 N110 N111	L60-N87 PolarHBondContact O-ND2 2.89Å; N63-N87 WeakPolarHBondContact CA-OD1 3.35Å; N63-N87 WeakPolarHBondContact CB-OD1 3.5Å; N63-N87 PolarHBondContact O-OD1 3.43Å; K64-N87 PolarHBondContact N-OD1 2.97Å; I65-N87 HydrophobicContact CB-CB 4.41Å; I65-N87 WeakPolarHBondContact CB-OD1 3.49Å; I65-N87 WeakPolarHBondContact CG1-OD1 3.01Å; I65-N87 PolarHBondContact N-OD1 2.92Å; L84-N87 PolarHBondContact O-ND2 2.84Å; N87-I89 HydrophobicContact CB-CD1 4.13Å; N87-I89 HydrophobicContact CB-CG1 3.96Å; N87-N110 PolarHBondContact N-O 3.32Å; N87-N111 WeakPolarHBondContact CA-OD1 3.16Å; N87-N111 WeakPolarHBondContact CB-OD1 3.15Å; N87-N111 PolarHBondContact N-OD1 2.78Å; N87-N111 PolarHBondContact O-OD1 2.83Å
88	E	97.9	Very high	96.3	Very high	77 Å²	77	40 Å²	40	36%	0.36	21%	0.208	S	C	.	.			trans	-112.8	27.3	178.3	-60.1	-161.9	-128.2	0	0	112	I65 T66 D90 N111 K112	I65-E88 CarbonylContact O-C 3.51Å; I65-E88 WeakPolarHBondContact O-CA 3.45Å; I65-E88 PolarHBondContact O-N 3.46Å; T66-E88 HydrophobicContact CG2-CB 4.46Å; E88-D90 PolarHBondContact O-N 3.5Å; E88-D90 VanDerWaalsContact O-N 3.15Å; E88-N111 PolarHBondContact N-OD1 3.37Å; E88-K112 HydrophobicContact CB-CD 4.36Å; E88-K112 IonicContact OE2-NZ 3.6Å; E88-K112 PolarHBondContact OE2-NZ 2.85Å
89	I	98.3	Very high	96.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.			trans	-66.3	114.6	-170.2	-57.3	166.7	0	0	0	109.7	I65 T66 L68 L84 N87 I92 N111 K112 I113	I65-I89 HydrophobicContact CB-CG1 4.37Å; I65-I89 HydrophobicContact CG2-CG1 4.2Å; I65-I89 VanDerWaalsContact O-CG1 3.26Å; I65-I89 WeakPolarHBondContact O-CG1 2.99Å; I65-I89 PolarHBondContact O-N 2.78Å; T66-I89 WeakPolarHBondContact O-CA 3.22Å; L68-I89 HydrophobicContact CD1-CD1 4.18Å; L68-I89 HydrophobicContact CD2-CD1 4.04Å; L68-I89 HydrophobicContact CG-CD1 4.12Å; L68-I89 HydrophobicContact CG-CG2 4.2Å; L84-I89 HydrophobicContact CB-CD1 4.26Å; L84-I89 HydrophobicContact CD2-CD1 4.34Å; N87-I89 HydrophobicContact CB-CD1 4.13Å; N87-I89 HydrophobicContact CB-CG1 3.96Å; I89-I92 HydrophobicContact CG2-CD1 4.37Å; I89-I92 HydrophobicContact CG2-CG1 3.86Å; I89-N111 HydrophobicContact CB-CB 4.25Å; I89-N111 VanDerWaalsContact CB-OD1 3.31Å; I89-N111 WeakPolarHBondContact CB-OD1 3.13Å; I89-N111 VanDerWaalsContact CG1-OD1 3.3Å; I89-N111 WeakPolarHBondContact CG1-OD1 3.16Å; I89-N111 PolarHBondContact N-OD1 2.64Å; I89-K112 CarbonylContact O-C 3.52Å; I89-K112 VanDerWaalsContact O-CA 3.31Å; I89-K112 WeakPolarHBondContact O-CA 3.33Å; I89-K112 PolarHBondContact O-N 3.19Å; I89-I113 HydrophobicContact CB-CG1 4.33Å; I89-I113 HydrophobicContact CG2-CD1 4.41Å; I89-I113 HydrophobicContact CG2-CG1 4.09Å; I89-I113 VanDerWaalsContact O-CG1 3.26Å; I89-I113 WeakPolarHBondContact O-CG1 3.37Å; I89-I113 PolarHBondContact O-N 3.32Å; I89-I113 VanDerWaalsContact O-N 3.1Å
90	D	96.1	Very high	96.4	Very high	85 Å²	85	37.2 Å²	37.2	46%	0.455	20%	0.199	S	C	.	.			trans	-98.4	-26.6	172.9	62.4	23.8	0	0	0	112.7	T66 E88 K112	T66-D90 PolarHBondContact O-N 2.92Å; E88-D90 PolarHBondContact O-N 3.5Å; E88-D90 VanDerWaalsContact O-N 3.15Å; D90-K112 HydrophobicContact CB-CB 4.28Å
91	S	95	Very high	96.4	Very high	53 Å²	53	39.7 Å²	39.7	37%	0.371	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.6	-168	51.8	0	0	0	0	112.5	S67 L68	S67-S91 WeakPolarHBondContact CA-O 3.36Å; S67-S91 WeakPolarHBondContact CB-OG 3.25Å; L68-S91 PolarHBondContact N-O 2.83Å
92	I	96.7	Very high	96.3	Very high	17 Å²	17	43 Å²	43	9%	0.087	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	120.8	175.5	-56.3	-178.6	0	0	0	106.7	L68 I89 I113 F116 P117	L68-I92 HydrophobicContact CB-CB 4.49Å; L68-I92 HydrophobicContact CB-CG1 4.31Å; L68-I92 HydrophobicContact CB-CG2 4.2Å; L68-I92 HydrophobicContact CD1-CD1 3.96Å; L68-I92 HydrophobicContact CD1-CG1 3.93Å; L68-I92 HydrophobicContact CD1-CG2 4.3Å; L68-I92 HydrophobicContact CG-CG1 4.22Å; I89-I92 HydrophobicContact CG2-CD1 4.37Å; I89-I92 HydrophobicContact CG2-CG1 3.86Å; I92-I113 HydrophobicContact CD1-CD1 3.85Å; I92-F116 HydrophobicContact CD1-CD2 4.01Å; I92-F116 HydrophobicContact CD1-CE2 4.1Å; I92-P117 HydrophobicContact CB-CG 4.18Å; I92-P117 HydrophobicContact CG2-CG 3.77Å
93	Q	95.5	Very high	96.3	Very high	97 Å²	97	43 Å²	43	45%	0.453	22%	0.224	S	C	.	.			trans	-68.9	150	176.4	-67.7	179	-1.5	0	0	110.7	L68 T96	L68-Q93 PolarHBondContact O-N 2.84Å; Q93-T96 VanDerWaalsContact O-CB 3.3Å; Q93-T96 WeakPolarHBondContact O-CB 3.22Å; Q93-T96 PolarHBondContact O-N 2.87Å; Q93-T96 PolarHBondContact O-OG1 2.8Å
94	T	94.1	Very high	96.2	Very high	71 Å²	71	44.7 Å²	44.7	44%	0.436	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	151.4	171.2	42.5	0	0	0	0	111.2	T96 P117	T94-T96 PolarHBondContact O-N 2.89Å; T94-P117 HydrophobicContact CG2-CB 4.02Å
95	N	93.3	Very high	96.2	Very high	87 Å²	87	46.6 Å²	46.6	47%	0.465	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	14.5	-175.7	-55.2	-40.2	0	0	0	115.2	P99 D120	N95-P99 VanDerWaalsContact O-CD 3.25Å; N95-P99 WeakPolarHBondContact O-CD 3.4Å; N95-D120 VanDerWaalsContact C-OD2 3.26Å; N95-D120 VanDerWaalsContact CA-OD2 3.25Å; N95-D120 WeakPolarHBondContact CA-OD2 3.16Å; N95-D120 PolarHBondContact N-OD1 2.86Å; N95-D120 PolarHBondContact N-OD2 2.83Å; N95-D120 VanDerWaalsContact N-OD2 3.15Å
96	T	95.8	Very high	96.3	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.238	C	C	.	.	S	Bend	trans	-76.4	-36.6	175.8	-55.3	0	0	0	0	112.4	L68 E69 S70 F73 Q93 T94 D120	L68-T96 HydrophobicContact CB-CG2 3.97Å; E69-T96 WeakPolarHBondContact O-CG2 3.29Å; S70-T96 WeakPolarHBondContact CA-OG1 3.34Å; S70-T96 PolarHBondContact N-OG1 2.94Å; F73-T96 HydrophobicContact CD2-CG2 3.83Å; F73-T96 HydrophobicContact CE2-CG2 3.97Å; Q93-T96 VanDerWaalsContact O-CB 3.3Å; Q93-T96 WeakPolarHBondContact O-CB 3.22Å; Q93-T96 PolarHBondContact O-N 2.87Å; Q93-T96 PolarHBondContact O-OG1 2.8Å; T94-T96 PolarHBondContact O-N 2.89Å; T96-D120 PolarHBondContact N-OD2 2.79Å
97	L	96.3	Very high	96.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-104.5	-26.4	-178.3	-62	173.4	0	0	0	111.8	F73 L82 P99 L100 L106 F116 D120	F73-L97 HydrophobicContact CD2-CD2 4.16Å; F73-L97 HydrophobicContact CE2-CD2 4.05Å; L82-L97 HydrophobicContact CD2-CD2 3.96Å; L97-P99 VanDerWaalsContact C-N 3.29Å; L97-P99 VanDerWaalsContact O-N 3.13Å; L97-L100 HydrophobicContact CD2-CD1 4.13Å; L97-L100 WeakPolarHBondContact O-CB 3.32Å; L97-L100 PolarHBondContact O-N 2.91Å; L97-L106 HydrophobicContact CD1-CD2 4.01Å; L97-F116 HydrophobicContact CD1-CE2 3.93Å; L97-F116 HydrophobicContact CD1-CZ 3.9Å; L97-D120 HydrophobicContact CB-CB 4.04Å; L97-D120 PolarHBondContact N-OD2 2.73Å
98	A	94.8	Very high	96.3	Very high	14 Å²	14	41 Å²	41	12%	0.116	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-32.9	179.5	0	0	0	0	0	116.1	L100 D120	A98-L100 VanDerWaalsContact C-N 3.26Å; A98-L100 PolarHBondContact O-N 2.8Å; A98-D120 HydrophobicContact CB-CB 4.15Å; A98-D120 PolarHBondContact N-OD2 3.2Å
99	P	94.6	Very high	96.3	Very high	41 Å²	41	37.6 Å²	37.6	27%	0.266	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.7	176.2	-21.6	34.9	0	0	0	114.8	T77 N95 L97 I101	T77-P99 HydrophobicContact CG2-CB 4.27Å; N95-P99 VanDerWaalsContact O-CD 3.25Å; N95-P99 WeakPolarHBondContact O-CD 3.4Å; L97-P99 VanDerWaalsContact C-N 3.29Å; L97-P99 VanDerWaalsContact O-N 3.13Å; P99-I101 PolarHBondContact O-N 2.87Å
100	L	95.7	Very high	96.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.			trans	-84.5	49.9	-171.8	-55.4	-178.5	0	0	0	112.2	F73 L82 L97 A98 Q102 L103 L124	F73-L100 HydrophobicContact CB-CD1 4.24Å; F73-L100 HydrophobicContact CB-CD2 4.07Å; F73-L100 HydrophobicContact CB-CG 4.49Å; F73-L100 HydrophobicContact CD2-CD1 4.26Å; F73-L100 HydrophobicContact CG-CD1 4.43Å; L82-L100 HydrophobicContact CD2-CD1 3.85Å; L97-L100 HydrophobicContact CD2-CD1 4.13Å; L97-L100 WeakPolarHBondContact O-CB 3.32Å; L97-L100 PolarHBondContact O-N 2.91Å; A98-L100 VanDerWaalsContact C-N 3.26Å; A98-L100 PolarHBondContact O-N 2.8Å; L100-Q102 PolarHBondContact O-N 3.08Å; L100-L103 HydrophobicContact CB-CB 4.15Å; L100-L103 HydrophobicContact CB-CD2 4.45Å; L100-L103 HydrophobicContact CD1-CD2 4.45Å; L100-L103 WeakPolarHBondContact O-CB 3.32Å; L100-L103 PolarHBondContact O-N 2.89Å; L100-L124 HydrophobicContact CB-CD2 4.49Å; L100-L124 WeakPolarHBondContact O-CD2 3.45Å
101	I	94.7	Very high	96.4	Very high	88 Å²	88	36.2 Å²	36.2	45%	0.451	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.3	-171.4	62.6	171.2	0	0	0	115.5	P99 N123	P99-I101 PolarHBondContact O-N 2.87Å; I101-N123 HydrophobicContact CG2-CB 4.34Å
102	Q	95.5	Very high	96.6	Very high	80 Å²	80	37.8 Å²	37.8	37%	0.374	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-0.3	175.3	-61.2	-58	-34.8	0	0	113.9	V79 T80 L100 R104	V79-Q102 CarbonylContact O-C 3.18Å; T80-Q102 WeakPolarHBondContact CA-O 3.25Å; T80-Q102 HydrophobicContact CG2-CB 4.39Å; L100-Q102 PolarHBondContact O-N 3.08Å; Q102-R104 PolarHBondContact O-N 2.85Å
103	L	97.6	Very high	96.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.			trans	-66.9	120	-172.7	-164.7	69	0	0	0	111.8	V79 L82 L100 N105 L106 L124 A126 L127	V79-L103 HydrophobicContact CG1-CD1 3.93Å; V79-L103 PolarHBondContact O-N 2.82Å; L82-L103 HydrophobicContact CB-CD1 3.8Å; L100-L103 HydrophobicContact CB-CB 4.15Å; L100-L103 HydrophobicContact CB-CD2 4.45Å; L100-L103 HydrophobicContact CD1-CD2 4.45Å; L100-L103 WeakPolarHBondContact O-CB 3.32Å; L100-L103 PolarHBondContact O-N 2.89Å; L103-N105 WeakPolarHBondContact CD1-O 3.44Å; L103-L106 HydrophobicContact CD2-CB 3.93Å; L103-L106 HydrophobicContact CD2-CD1 4.26Å; L103-L106 HydrophobicContact CD2-CD2 4.26Å; L103-L106 HydrophobicContact CD2-CG 4.37Å; L103-L124 HydrophobicContact CD2-CD1 4.24Å; L103-A126 CarbonylContact O-C 3.16Å; L103-L127 HydrophobicContact CB-CD1 4.44Å; L103-L127 HydrophobicContact CD2-CD1 4.22Å; L103-L127 HydrophobicContact CG-CD1 4.01Å; L103-L127 VanDerWaalsContact O-CA 3.24Å; L103-L127 WeakPolarHBondContact O-CA 3.44Å; L103-L127 PolarHBondContact O-N 2.81Å
104	R	97.6	Very high	96.7	Very high	99 Å²	99	35.2 Å²	35.2	37%	0.374	18%	0.183	S	C	.	.			trans	-103.9	-37	177.2	-64.6	177.2	178.1	-80.5	-6.4	111.9	T80 Q102 Q128 L129	T80-R104 WeakPolarHBondContact O-CA 3.19Å; T80-R104 WeakPolarHBondContact O-CB 2.95Å; T80-R104 PolarHBondContact O-N 3.26Å; Q102-R104 PolarHBondContact O-N 2.85Å; R104-Q128 PolarHBondContact O-N 3.14Å; R104-L129 PolarHBondContact O-N 3.32Å
105	N	98.1	Very high	96.6	Very high	39 Å²	39	37.2 Å²	37.2	21%	0.209	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.1	-178.8	-54.7	-65.1	0	0	0	110.2	T80 S81 L82 W83 L103 L129	T80-N105 PolarHBondContact O-N 2.85Å; S81-N105 WeakPolarHBondContact CA-O 3.2Å; S81-N105 PolarHBondContact OG-ND2 3.39Å; L82-N105 PolarHBondContact N-O 2.95Å; W83-N105 HydrophobicContact CH2-CB 3.74Å; W83-N105 HydrophobicContact CZ2-CB 3.96Å; W83-N105 HydrophobicContact CZ3-CB 4.45Å; L103-N105 WeakPolarHBondContact CD1-O 3.44Å; N105-L129 HydrophobicContact CB-CB 4.49Å; N105-L129 HydrophobicContact CB-CD2 4.38Å; N105-L129 WeakPolarHBondContact OD1-CB 3.38Å
106	L	98.4	Very high	96.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.6	169.8	-178.8	57.1	0	0	0	110	L82 L97 L103 I108 L127 L129 L130 K131	L82-L106 HydrophobicContact CB-CD1 4.17Å; L82-L106 HydrophobicContact CD2-CD1 4.09Å; L82-L106 HydrophobicContact CG-CD1 4.19Å; L97-L106 HydrophobicContact CD1-CD2 4.01Å; L103-L106 HydrophobicContact CD2-CB 3.93Å; L103-L106 HydrophobicContact CD2-CD1 4.26Å; L103-L106 HydrophobicContact CD2-CD2 4.26Å; L103-L106 HydrophobicContact CD2-CG 4.37Å; L106-I108 HydrophobicContact CD1-CG2 4.03Å; L106-I108 HydrophobicContact CG-CG2 4.44Å; L106-L127 HydrophobicContact CB-CD1 4.06Å; L106-L129 PolarHBondContact N-O 2.7Å; L106-L130 HydrophobicContact CB-CD1 4.08Å; L106-L130 HydrophobicContact CD2-CD1 3.91Å; L106-L130 HydrophobicContact CG-CD1 4.12Å; L106-K131 PolarHBondContact O-N 3.24Å
107	D	98.6	Very high	96.8	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.059	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	104.1	174.9	-166.7	-11.7	0	0	0	110.9	L82 W83 L84 A85 S109 K131	L82-D107 PolarHBondContact O-N 2.81Å; W83-D107 HydrophobicContact CE3-CB 3.53Å; W83-D107 HydrophobicContact CZ3-CB 3.98Å; L84-D107 CarbonylContact C-O 3.53Å; L84-D107 WeakPolarHBondContact CA-O 3.36Å; L84-D107 PolarHBondContact N-O 2.97Å; A85-D107 PolarHBondContact N-O 2.9Å; D107-S109 VanDerWaalsContact OD1-CB 3.25Å; D107-S109 WeakPolarHBondContact OD1-CB 3.45Å; D107-S109 PolarHBondContact OD1-N 2.97Å; D107-S109 PolarHBondContact OD1-OG 2.9Å; D107-K131 HydrophobicContact CB-CB 4.35Å; D107-K131 HydrophobicContact CB-CD 4.48Å; D107-K131 WeakPolarHBondContact OD1-CB 3.47Å; D107-K131 WeakPolarHBondContact OD2-CD 3.48Å; D107-K131 VanDerWaalsContact OD2-CE 3.25Å; D107-K131 WeakPolarHBondContact OD2-CE 3.49Å; D107-K131 IonicContact OD2-NZ 3.13Å; D107-K131 PolarHBondContact OD2-NZ 3.18Å
108	I	98.1	Very high	96.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.			trans	-114	21.6	173.7	51.5	167.9	0	0	0	110.7	L84 L106 N111 I113 F116 K131 M132 N135	L84-I108 HydrophobicContact CB-CG2 4.01Å; L84-I108 HydrophobicContact CD1-CG2 3.95Å; L106-I108 HydrophobicContact CD1-CG2 4.03Å; L106-I108 HydrophobicContact CG-CG2 4.44Å; I108-N111 PolarHBondContact O-ND2 3.5Å; I108-I113 HydrophobicContact CB-CD1 4.07Å; I108-I113 HydrophobicContact CD1-CD1 3.79Å; I108-I113 HydrophobicContact CG1-CD1 4.34Å; I108-F116 HydrophobicContact CD1-CD2 3.77Å; I108-F116 HydrophobicContact CD1-CE2 3.54Å; I108-K131 WeakPolarHBondContact CG1-O 3.33Å; I108-K131 PolarHBondContact N-O 3.25Å; I108-M132 HydrophobicContact CD1-CB 4.4Å; I108-M132 HydrophobicContact CD1-CE 3.83Å; I108-M132 HydrophobicContact CD1-CG 4.03Å; I108-M132 HydrophobicContact CG1-CB 4.31Å; I108-M132 HydrophobicContact CG1-CG 4.07Å; I108-N135 PolarHBondContact O-ND2 3.09Å
109	S	98.5	Very high	96.7	Very high	6 Å²	6	40 Å²	40	4%	0.042	20%	0.198	C	C	.	.			trans	-67.5	155.4	-179.9	66.3	0	0	0	0	112.8	A85 H86 D107 N111 K131 N133	A85-S109 CarbonylContact C-O 3.56Å; A85-S109 WeakPolarHBondContact CA-O 3.31Å; A85-S109 WeakPolarHBondContact CB-O 3.02Å; H86-S109 PolarHBondContact N-O 2.95Å; H86-S109 VanDerWaalsContact N-O 3.08Å; D107-S109 VanDerWaalsContact OD1-CB 3.25Å; D107-S109 WeakPolarHBondContact OD1-CB 3.45Å; D107-S109 PolarHBondContact OD1-N 2.97Å; D107-S109 PolarHBondContact OD1-OG 2.9Å; S109-N111 PolarHBondContact O-ND2 3.44Å; S109-K131 PolarHBondContact N-O 2.93Å; S109-N133 CarbonylContact C-O 3.53Å; S109-N133 WeakPolarHBondContact CA-O 3.31Å; S109-N133 WeakPolarHBondContact CB-O 3.44Å; S109-N133 WeakPolarHBondContact CB-OD1 3.42Å
110	N	98.3	Very high	96.8	Very high	43 Å²	43	38 Å²	38	23%	0.23	19%	0.186	C	C	.	.	S	Bend	trans	58.7	61.5	-178.7	-50.9	-95.2	0	0	0	111.5	H86 N87 N133 N134	H86-N110 WeakPolarHBondContact CA-O 3.47Å; H86-N110 HydrophobicContact CB-CB 4.48Å; H86-N110 PolarHBondContact CE1-OD1 2.99Å; H86-N110 PolarHBondContact N-O 3.37Å; H86-N110 WeakPolarHBondContact ND1-CB 3.49Å; H86-N110 PolarHBondContact NE2-ND2 3.26Å; N87-N110 PolarHBondContact N-O 3.32Å; N110-N133 PolarHBondContact N-O 2.79Å; N110-N134 WeakPolarHBondContact CA-O 3.5Å; N110-N134 HydrophobicContact CB-CB 4.45Å; N110-N134 PolarHBondContact N-O 3.01Å; N110-N134 VanDerWaalsContact N-O 3.09Å; N110-N134 PolarHBondContact OD1-ND2 3.44Å
111	N	98.4	Very high	96.8	Very high	13 Å²	13	38 Å²	38	7%	0.07	19%	0.186	C	C	.	.	S	Bend	trans	-138	-169.7	176.6	-84.8	-76.2	0	0	0	109.1	L84 N87 E88 I89 I108 S109 I113 N134 N135	L84-N111 PolarHBondContact O-ND2 2.87Å; L84-N111 VanDerWaalsContact O-ND2 3.09Å; N87-N111 WeakPolarHBondContact CA-OD1 3.16Å; N87-N111 WeakPolarHBondContact CB-OD1 3.15Å; N87-N111 PolarHBondContact N-OD1 2.78Å; N87-N111 PolarHBondContact O-OD1 2.83Å; E88-N111 PolarHBondContact N-OD1 3.37Å; I89-N111 HydrophobicContact CB-CB 4.25Å; I89-N111 VanDerWaalsContact CB-OD1 3.31Å; I89-N111 WeakPolarHBondContact CB-OD1 3.13Å; I89-N111 VanDerWaalsContact CG1-OD1 3.3Å; I89-N111 WeakPolarHBondContact CG1-OD1 3.16Å; I89-N111 PolarHBondContact N-OD1 2.64Å; I108-N111 PolarHBondContact O-ND2 3.5Å; S109-N111 PolarHBondContact O-ND2 3.44Å; N111-I113 HydrophobicContact CB-CD1 4.16Å; N111-I113 HydrophobicContact CB-CG1 4.05Å; N111-N134 PolarHBondContact N-O 2.88Å; N111-N134 VanDerWaalsContact N-O 3.08Å; N111-N135 WeakPolarHBondContact CA-OD1 3.5Å; N111-N135 WeakPolarHBondContact CB-OD1 3.46Å; N111-N135 PolarHBondContact O-OD1 3.1Å
112	K	97.9	Very high	96.7	Very high	87 Å²	87	37.8 Å²	37.8	38%	0.378	18%	0.179	S	C	.	.			trans	-115	23.4	-176.9	-61.7	174.1	178.2	174.2	0	112.2	E88 I89 D90 V114 N135	E88-K112 HydrophobicContact CB-CD 4.36Å; E88-K112 IonicContact OE2-NZ 3.6Å; E88-K112 PolarHBondContact OE2-NZ 2.85Å; I89-K112 CarbonylContact O-C 3.52Å; I89-K112 VanDerWaalsContact O-CA 3.31Å; I89-K112 WeakPolarHBondContact O-CA 3.33Å; I89-K112 PolarHBondContact O-N 3.19Å; D90-K112 HydrophobicContact CB-CB 4.28Å; K112-V114 PolarHBondContact O-N 3.29Å; K112-V114 VanDerWaalsContact O-N 3.13Å; K112-N135 PolarHBondContact N-OD1 3.03Å
113	I	97.8	Very high	96.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.			trans	-70.1	113.6	-167.6	-58	167.9	0	0	0	109.5	I89 I92 I108 N111 N115 F116 N135 E136 M137	I89-I113 HydrophobicContact CB-CG1 4.33Å; I89-I113 HydrophobicContact CG2-CD1 4.41Å; I89-I113 HydrophobicContact CG2-CG1 4.09Å; I89-I113 VanDerWaalsContact O-CG1 3.26Å; I89-I113 WeakPolarHBondContact O-CG1 3.37Å; I89-I113 PolarHBondContact O-N 3.32Å; I89-I113 VanDerWaalsContact O-N 3.1Å; I92-I113 HydrophobicContact CD1-CD1 3.85Å; I108-I113 HydrophobicContact CB-CD1 4.07Å; I108-I113 HydrophobicContact CD1-CD1 3.79Å; I108-I113 HydrophobicContact CG1-CD1 4.34Å; N111-I113 HydrophobicContact CB-CD1 4.16Å; N111-I113 HydrophobicContact CB-CG1 4.05Å; I113-N115 WeakPolarHBondContact CG2-O 3.42Å; I113-F116 HydrophobicContact CG2-CB 4.19Å; I113-N135 HydrophobicContact CB-CB 4.48Å; I113-N135 WeakPolarHBondContact CB-OD1 3.15Å; I113-N135 WeakPolarHBondContact CG1-OD1 3.44Å; I113-N135 PolarHBondContact N-OD1 2.62Å; I113-E136 CarbonylContact O-C 3.49Å; I113-E136 WeakPolarHBondContact O-CA 3.2Å; I113-E136 PolarHBondContact O-N 3.03Å; I113-M137 HydrophobicContact CB-CG 4.47Å; I113-M137 HydrophobicContact CG2-CG 4.15Å; I113-M137 HydrophobicContact CG2-SD 4.46Å; I113-M137 WeakPolarHBondContact O-CG 3.31Å; I113-M137 PolarHBondContact O-N 3.38Å
114	V	95.8	Very high	96.4	Very high	60 Å²	60	38.7 Å²	38.7	36%	0.364	19%	0.187	S	C	.	.	S	Bend	trans	-91.2	-40.3	174.2	-179	0	0	0	0	111.1	K112 E136	K112-V114 PolarHBondContact O-N 3.29Å; K112-V114 VanDerWaalsContact O-N 3.13Å; V114-E136 HydrophobicContact CG2-CB 3.87Å
115	N	93.6	Very high	96.2	Very high	113 Å²	113	37.8 Å²	37.8	60%	0.604	19%	0.192	S	C	*	.			trans	-124	124.2	-178.9	-63.7	-66.2	0	0	0	109.5	I113	I113-N115 WeakPolarHBondContact CG2-O 3.42Å
116	F	96.2	Very high	96.1	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.061	19%	0.19	C	C	.	.			trans	-113.3	136.5	178.6	-178.8	-90.9	0	0	0	110.2	I92 L97 I108 I113 W118 L121 M132 M137	I92-F116 HydrophobicContact CD1-CD2 4.01Å; I92-F116 HydrophobicContact CD1-CE2 4.1Å; L97-F116 HydrophobicContact CD1-CE2 3.93Å; L97-F116 HydrophobicContact CD1-CZ 3.9Å; I108-F116 HydrophobicContact CD1-CD2 3.77Å; I108-F116 HydrophobicContact CD1-CE2 3.54Å; I113-F116 HydrophobicContact CG2-CB 4.19Å; F116-W118 VanDerWaalsContact C-N 3.31Å; F116-W118 HydrophobicContact CB-CZ2 4.28Å; F116-W118 AromaticContact CD1-CD2 3.65Å; F116-W118 HydrophobicContact CD1-CD2 3.65Å; F116-W118 AromaticContact CD1-CE3 3.61Å; F116-W118 HydrophobicContact CD1-CE3 3.61Å; F116-W118 HydrophobicContact CD1-CG 4.08Å; F116-W118 HydrophobicContact CD1-CH2 4.42Å; F116-W118 HydrophobicContact CD1-CZ2 4.47Å; F116-W118 HydrophobicContact CD1-CZ3 4.01Å; F116-W118 HydrophobicContact CE1-CD2 4.42Å; F116-W118 HydrophobicContact CE1-CE3 4.03Å; F116-W118 HydrophobicContact CE1-CZ3 4.46Å; F116-W118 PolarHBondContact O-N 2.73Å; F116-L121 HydrophobicContact CE1-CD1 3.88Å; F116-L121 HydrophobicContact CE1-CD2 4.03Å; F116-L121 HydrophobicContact CE1-CG 3.81Å; F116-L121 HydrophobicContact CZ-CD2 3.95Å; F116-L121 HydrophobicContact CZ-CG 4.25Å; F116-M132 HydrophobicContact CB-CE 4.25Å; F116-M132 HydrophobicContact CD1-CE 3.69Å; F116-M132 HydrophobicContact CD2-CE 3.57Å; F116-M132 HydrophobicContact CE1-CE 3.91Å; F116-M132 HydrophobicContact CE2-CE 3.8Å; F116-M132 HydrophobicContact CG-CE 3.53Å; F116-M132 HydrophobicContact CZ-CE 3.97Å; F116-M137 HydrophobicContact CB-SD 3.83Å; F116-M137 HydrophobicContact CG-SD 4.47Å
117	P	95.8	Very high	96.1	Very high	15 Å²	15	36.8 Å²	36.8	10%	0.097	19%	0.19	C	C	.	.			trans	-76.4	80.8	177.4	31.8	-35.2	0	0	0	110.5	I92 T94 E119 D120	I92-P117 HydrophobicContact CB-CG 4.18Å; I92-P117 HydrophobicContact CG2-CG 3.77Å; T94-P117 HydrophobicContact CG2-CB 4.02Å; P117-E119 PolarHBondContact O-N 3.33Å; P117-E119 VanDerWaalsContact O-N 3.11Å; P117-D120 WeakPolarHBondContact O-CB 3.49Å; P117-D120 PolarHBondContact O-N 2.94Å
118	W	95.5	Very high	96	Very high	22 Å²	22	39.3 Å²	39.3	8%	0.083	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-55.9	-29.3	-178.7	-59.4	104.5	0	0	0	113.7	F116 D120 L121 M132 M137 N139 L140 P141 A144 F145 F161	F116-W118 VanDerWaalsContact C-N 3.31Å; F116-W118 HydrophobicContact CB-CZ2 4.28Å; F116-W118 AromaticContact CD1-CD2 3.65Å; F116-W118 HydrophobicContact CD1-CD2 3.65Å; F116-W118 AromaticContact CD1-CE3 3.61Å; F116-W118 HydrophobicContact CD1-CE3 3.61Å; F116-W118 HydrophobicContact CD1-CG 4.08Å; F116-W118 HydrophobicContact CD1-CH2 4.42Å; F116-W118 HydrophobicContact CD1-CZ2 4.47Å; F116-W118 HydrophobicContact CD1-CZ3 4.01Å; F116-W118 HydrophobicContact CE1-CD2 4.42Å; F116-W118 HydrophobicContact CE1-CE3 4.03Å; F116-W118 HydrophobicContact CE1-CZ3 4.46Å; F116-W118 PolarHBondContact O-N 2.73Å; W118-D120 VanDerWaalsContact C-N 3.27Å; W118-D120 PolarHBondContact O-N 2.87Å; W118-L121 HydrophobicContact CE3-CD1 3.95Å; W118-L121 HydrophobicContact CZ3-CD1 4.37Å; W118-L121 WeakPolarHBondContact O-CB 3.28Å; W118-L121 PolarHBondContact O-N 3.19Å; W118-L121 VanDerWaalsContact O-N 3.15Å; W118-M132 HydrophobicContact CH2-CE 3.69Å; W118-M132 HydrophobicContact CH2-SD 4Å; W118-M132 HydrophobicContact CZ3-CE 3.67Å; W118-M132 HydrophobicContact CZ3-SD 3.85Å; W118-M137 HydrophobicContact CH2-CE 4.48Å; W118-M137 HydrophobicContact CH2-SD 4.01Å; W118-M137 HydrophobicContact CZ2-SD 3.96Å; W118-N139 WeakPolarHBondContact CZ2-O 3.44Å; W118-N139 PolarHBondContact NE1-O 2.88Å; W118-N139 VanDerWaalsContact NE1-O 3.1Å; W118-L140 HydrophobicContact CD2-CD1 4.28Å; W118-L140 HydrophobicContact CE3-CD1 4.05Å; W118-L140 HydrophobicContact CH2-CD1 3.58Å; W118-L140 HydrophobicContact CZ2-CD1 3.8Å; W118-L140 HydrophobicContact CZ3-CD1 3.7Å; W118-P141 HydrophobicContact CB-CG 4.16Å; W118-P141 HydrophobicContact CG-CG 3.85Å; W118-P141 VanDerWaalsContact NE1-CD 3.32Å; W118-A144 HydrophobicContact CB-CB 4.09Å; W118-A144 HydrophobicContact CD2-CB 3.98Å; W118-A144 HydrophobicContact CE3-CB 3.75Å; W118-A144 HydrophobicContact CG-CB 4.16Å; W118-F145 HydrophobicContact CE3-CE1 4.26Å; W118-F145 AromaticContact CZ3-CE1 3.74Å; W118-F145 HydrophobicContact CZ3-CE1 3.74Å; W118-F145 AromaticContact CZ3-CZ 3.9Å; W118-F145 HydrophobicContact CZ3-CZ 3.9Å; W118-F161 HydrophobicContact CH2-CZ 4.29Å; W118-F161 HydrophobicContact CZ2-CE1 4.29Å; W118-F161 HydrophobicContact CZ2-CZ 4.24Å
119	E	94.6	Very high	96	Very high	108 Å²	108	40.7 Å²	40.7	51%	0.505	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-57.3	-36.1	174.8	-64.1	-60.2	115.5	0	0	113.2	P117 L121 R122	P117-E119 PolarHBondContact O-N 3.33Å; P117-E119 VanDerWaalsContact O-N 3.11Å; E119-L121 PolarHBondContact O-N 2.85Å; E119-L121 VanDerWaalsContact O-N 3.15Å; E119-R122 WeakPolarHBondContact O-CB 3.23Å; E119-R122 WeakPolarHBondContact O-CG 3.44Å; E119-R122 PolarHBondContact O-N 2.01Å; E119-R122 IonicContact OE1-CZ 2.66Å; E119-R122 IonicContact OE1-NE 3.75Å; E119-R122 PolarHBondContact OE1-NE 2.89Å; E119-R122 IonicContact OE1-NH2 3.7Å; E119-R122 PolarHBondContact OE1-NH2 2.02Å; E119-R122 IonicContact OE2-CZ 3.68Å; E119-R122 IonicContact OE2-NE 3.37Å; E119-R122 PolarHBondContact OE2-NE 2.85Å; E119-R122 IonicContact OE2-NH2 2.71Å; E119-R122 PolarHBondContact OE2-NH2 2.91Å
120	D	95.3	Very high	96	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-61.1	-25.5	179.4	-80.7	51.5	0	0	0	112.2	N95 T96 L97 A98 P117 W118 R122 L124	N95-D120 VanDerWaalsContact C-OD2 3.26Å; N95-D120 VanDerWaalsContact CA-OD2 3.25Å; N95-D120 WeakPolarHBondContact CA-OD2 3.16Å; N95-D120 PolarHBondContact N-OD1 2.86Å; N95-D120 PolarHBondContact N-OD2 2.83Å; N95-D120 VanDerWaalsContact N-OD2 3.15Å; T96-D120 PolarHBondContact N-OD2 2.79Å; L97-D120 HydrophobicContact CB-CB 4.04Å; L97-D120 PolarHBondContact N-OD2 2.73Å; A98-D120 HydrophobicContact CB-CB 4.15Å; A98-D120 PolarHBondContact N-OD2 3.2Å; P117-D120 WeakPolarHBondContact O-CB 3.49Å; P117-D120 PolarHBondContact O-N 2.94Å; W118-D120 VanDerWaalsContact C-N 3.27Å; W118-D120 PolarHBondContact O-N 2.87Å; D120-R122 VanDerWaalsContact C-N 3.31Å; D120-R122 PolarHBondContact O-N 3.06Å; D120-L124 WeakPolarHBondContact O-CG 3.31Å
121	L	96.1	Very high	96	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-72	-21.8	177.1	-57.4	-177.6	0	0	0	113	F116 W118 E119 N123 L124 L130 F145 L148	F116-L121 HydrophobicContact CE1-CD1 3.88Å; F116-L121 HydrophobicContact CE1-CD2 4.03Å; F116-L121 HydrophobicContact CE1-CG 3.81Å; F116-L121 HydrophobicContact CZ-CD2 3.95Å; F116-L121 HydrophobicContact CZ-CG 4.25Å; W118-L121 HydrophobicContact CE3-CD1 3.95Å; W118-L121 HydrophobicContact CZ3-CD1 4.37Å; W118-L121 WeakPolarHBondContact O-CB 3.28Å; W118-L121 PolarHBondContact O-N 3.19Å; W118-L121 VanDerWaalsContact O-N 3.15Å; E119-L121 PolarHBondContact O-N 2.85Å; E119-L121 VanDerWaalsContact O-N 3.15Å; L121-N123 PolarHBondContact O-N 3.32Å; L121-N123 VanDerWaalsContact O-N 3.07Å; L121-L124 HydrophobicContact CD2-CD1 3.83Å; L121-L124 PolarHBondContact O-N 3.05Å; L121-L130 HydrophobicContact CD1-CD2 4.11Å; L121-F145 HydrophobicContact CD1-CD1 4.2Å; L121-F145 HydrophobicContact CD1-CE1 4.19Å; L121-L148 HydrophobicContact CB-CD1 4.39Å; L121-L148 HydrophobicContact CB-CD2 4.45Å; L121-L148 HydrophobicContact CD1-CD1 4.3Å; L121-L148 WeakPolarHBondContact O-CD2 3.28Å
122	R	93.5	Very high	95.9	Very high	83 Å²	83	39.8 Å²	39.8	31%	0.313	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-53.7	-37.9	-173.1	-71.4	-168.8	-167.7	-83.5	-4.4	112.4	E119 D120 D143 T147	E119-R122 WeakPolarHBondContact O-CB 3.23Å; E119-R122 WeakPolarHBondContact O-CG 3.44Å; E119-R122 PolarHBondContact O-N 2.01Å; E119-R122 IonicContact OE1-CZ 2.66Å; E119-R122 IonicContact OE1-NE 3.75Å; E119-R122 PolarHBondContact OE1-NE 2.89Å; E119-R122 IonicContact OE1-NH2 3.7Å; E119-R122 PolarHBondContact OE1-NH2 2.02Å; E119-R122 IonicContact OE2-CZ 3.68Å; E119-R122 IonicContact OE2-NE 3.37Å; E119-R122 PolarHBondContact OE2-NE 2.85Å; E119-R122 IonicContact OE2-NH2 2.71Å; E119-R122 PolarHBondContact OE2-NH2 2.91Å; D120-R122 VanDerWaalsContact C-N 3.31Å; D120-R122 PolarHBondContact O-N 3.06Å; R122-D143 IonicContact CZ-OD2 2.6Å; R122-D143 IonicContact NH1-OD2 3.26Å; R122-D143 PolarHBondContact NH1-OD2 3.06Å; R122-D143 IonicContact NH2-OD2 2.64Å; R122-D143 PolarHBondContact NH2-OD2 2.89Å; R122-T147 WeakPolarHBondContact CA-OG1 3Å; R122-T147 VanDerWaalsContact O-CB 3.24Å; R122-T147 WeakPolarHBondContact O-CB 2.97Å; R122-T147 WeakPolarHBondContact O-CG2 2.99Å; R122-T147 PolarHBondContact O-OG1 3.16Å
123	N	90.3	Very high	95.9	Very high	98 Å²	98	36.4 Å²	36.4	52%	0.524	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-87	-11.9	-177.6	-65.6	-21.9	0	0	0	114.3	I101 L121 T125	I101-N123 HydrophobicContact CG2-CB 4.34Å; L121-N123 PolarHBondContact O-N 3.32Å; L121-N123 VanDerWaalsContact O-N 3.07Å; N123-T125 PolarHBondContact O-N 2.91Å
124	L	95.6	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.			trans	-84.2	50.2	-173.4	-48.6	-176.4	0	0	0	111.8	L100 L103 D120 L121 A126 L127 L148	L100-L124 HydrophobicContact CB-CD2 4.49Å; L100-L124 WeakPolarHBondContact O-CD2 3.45Å; L103-L124 HydrophobicContact CD2-CD1 4.24Å; D120-L124 WeakPolarHBondContact O-CG 3.31Å; L121-L124 HydrophobicContact CD2-CD1 3.83Å; L121-L124 PolarHBondContact O-N 3.05Å; L124-A126 PolarHBondContact O-N 3.32Å; L124-L127 HydrophobicContact CB-CB 4.32Å; L124-L127 WeakPolarHBondContact O-CB 3.31Å; L124-L127 PolarHBondContact O-N 3.39Å; L124-L148 HydrophobicContact CB-CD2 4.34Å; L124-L148 VanDerWaalsContact O-CD2 3.28Å; L124-L148 WeakPolarHBondContact O-CD2 3.27Å
125	T	94.5	Very high	96.1	Very high	80 Å²	80	36.5 Å²	36.5	49%	0.491	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.9	-172.4	58.7	0	0	0	0	114.1	N123	N123-T125 PolarHBondContact O-N 2.91Å
126	A	96	Very high	96.3	Very high	19 Å²	19	35.4 Å²	35.4	16%	0.157	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.9	174.3	0	0	0	0	0	114.7	L103 L124 Q128	L103-A126 CarbonylContact O-C 3.16Å; L124-A126 PolarHBondContact O-N 3.32Å; A126-Q128 PolarHBondContact O-N 2.82Å
127	L	97.6	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.			trans	-68.9	123.3	-174.3	-164.1	73.1	0	0	0	111.7	L103 L106 L124 L130 L148 E150 L151	L103-L127 HydrophobicContact CB-CD1 4.44Å; L103-L127 HydrophobicContact CD2-CD1 4.22Å; L103-L127 HydrophobicContact CG-CD1 4.01Å; L103-L127 VanDerWaalsContact O-CA 3.24Å; L103-L127 WeakPolarHBondContact O-CA 3.44Å; L103-L127 PolarHBondContact O-N 2.81Å; L106-L127 HydrophobicContact CB-CD1 4.06Å; L124-L127 HydrophobicContact CB-CB 4.32Å; L124-L127 WeakPolarHBondContact O-CB 3.31Å; L124-L127 PolarHBondContact O-N 3.39Å; L127-L130 HydrophobicContact CD2-CB 4.02Å; L127-L130 HydrophobicContact CD2-CD1 4.35Å; L127-L130 HydrophobicContact CD2-CD2 4.11Å; L127-L130 HydrophobicContact CD2-CG 4.39Å; L127-L148 HydrophobicContact CB-CD2 4.3Å; L127-L148 HydrophobicContact CD2-CD1 4.28Å; L127-E150 CarbonylContact O-C 3.53Å; L127-E150 VanDerWaalsContact O-C 3.31Å; L127-L151 HydrophobicContact CD2-CD1 4.38Å; L127-L151 HydrophobicContact CG-CD1 4.3Å; L127-L151 WeakPolarHBondContact O-CA 3.16Å; L127-L151 PolarHBondContact O-N 3.12Å; L127-L151 VanDerWaalsContact O-N 3.1Å
128	Q	96.9	Very high	96.3	Very high	63 Å²	63	36.8 Å²	36.8	29%	0.294	19%	0.186	S	C	.	.			trans	-112.2	-30.5	-174.5	-73.3	171.5	-41	0	0	112.4	R104 A126 E150 R152 S153	R104-Q128 PolarHBondContact O-N 3.14Å; A126-Q128 PolarHBondContact O-N 2.82Å; Q128-E150 HydrophobicContact CG-CB 4.15Å; Q128-R152 PolarHBondContact O-N 3.27Å; Q128-S153 PolarHBondContact O-N 3.09Å; Q128-S153 VanDerWaalsContact O-N 3.1Å
129	L	97.3	Very high	96	Very high	30 Å²	30	40.7 Å²	40.7	16%	0.157	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	122.7	178.2	170.9	63.9	0	0	0	110.3	W83 R104 N105 L106 K131	W83-L129 HydrophobicContact CH2-CD2 4.23Å; W83-L129 HydrophobicContact CZ3-CD2 4.32Å; R104-L129 PolarHBondContact O-N 3.32Å; N105-L129 HydrophobicContact CB-CB 4.49Å; N105-L129 HydrophobicContact CB-CD2 4.38Å; N105-L129 WeakPolarHBondContact OD1-CB 3.38Å; L106-L129 PolarHBondContact N-O 2.7Å; L129-K131 HydrophobicContact CD1-CG 3.85Å; L129-K131 HydrophobicContact CG-CG 4.3Å
130	L	98.1	Very high	96.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	109.5	174.2	-179.9	52.3	0	0	0	110	L106 L121 L127 M132 F145 L151 S153 L154 R155	L106-L130 HydrophobicContact CB-CD1 4.08Å; L106-L130 HydrophobicContact CD2-CD1 3.91Å; L106-L130 HydrophobicContact CG-CD1 4.12Å; L121-L130 HydrophobicContact CD1-CD2 4.11Å; L127-L130 HydrophobicContact CD2-CB 4.02Å; L127-L130 HydrophobicContact CD2-CD1 4.35Å; L127-L130 HydrophobicContact CD2-CD2 4.11Å; L127-L130 HydrophobicContact CD2-CG 4.39Å; L130-M132 HydrophobicContact CD1-CG 3.66Å; L130-M132 HydrophobicContact CD1-SD 3.97Å; L130-M132 HydrophobicContact CD2-CG 4.49Å; L130-M132 HydrophobicContact CD2-SD 3.87Å; L130-M132 HydrophobicContact CG-CG 3.83Å; L130-M132 HydrophobicContact CG-SD 3.87Å; L130-F145 HydrophobicContact CD2-CD1 4.48Å; L130-F145 HydrophobicContact CD2-CE1 3.98Å; L130-L151 HydrophobicContact CB-CD1 3.84Å; L130-S153 PolarHBondContact N-O 3.4Å; L130-L154 HydrophobicContact CB-CD1 4.05Å; L130-L154 HydrophobicContact CD2-CD1 3.93Å; L130-L154 HydrophobicContact CG-CD1 3.95Å; L130-L154 WeakPolarHBondContact O-CA 3.11Å; L130-R155 PolarHBondContact O-N 2.82Å
131	K	98.3	Very high	96	Very high	42 Å²	42	38.5 Å²	38.5	18%	0.183	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	120.1	172.2	-49	-171.4	-138	155.9	0	110.6	L106 D107 I108 S109 L129 R155	L106-K131 PolarHBondContact O-N 3.24Å; D107-K131 HydrophobicContact CB-CB 4.35Å; D107-K131 HydrophobicContact CB-CD 4.48Å; D107-K131 WeakPolarHBondContact OD1-CB 3.47Å; D107-K131 WeakPolarHBondContact OD2-CD 3.48Å; D107-K131 VanDerWaalsContact OD2-CE 3.25Å; D107-K131 WeakPolarHBondContact OD2-CE 3.49Å; D107-K131 IonicContact OD2-NZ 3.13Å; D107-K131 PolarHBondContact OD2-NZ 3.18Å; I108-K131 WeakPolarHBondContact CG1-O 3.33Å; I108-K131 PolarHBondContact N-O 3.25Å; S109-K131 PolarHBondContact N-O 2.93Å; L129-K131 HydrophobicContact CD1-CG 3.85Å; L129-K131 HydrophobicContact CG-CG 4.3Å; K131-R155 HydrophobicContact CB-CB 4.48Å; K131-R155 HydrophobicContact CG-CG 4.41Å
132	M	97.9	Very high	95.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.			trans	-132.2	11.2	177.6	-42.6	172.9	80.7	0	0	111.3	I108 F116 W118 L130 N135 M137 R155 I156 N159	I108-M132 HydrophobicContact CD1-CB 4.4Å; I108-M132 HydrophobicContact CD1-CE 3.83Å; I108-M132 HydrophobicContact CD1-CG 4.03Å; I108-M132 HydrophobicContact CG1-CB 4.31Å; I108-M132 HydrophobicContact CG1-CG 4.07Å; F116-M132 HydrophobicContact CB-CE 4.25Å; F116-M132 HydrophobicContact CD1-CE 3.69Å; F116-M132 HydrophobicContact CD2-CE 3.57Å; F116-M132 HydrophobicContact CE1-CE 3.91Å; F116-M132 HydrophobicContact CE2-CE 3.8Å; F116-M132 HydrophobicContact CG-CE 3.53Å; F116-M132 HydrophobicContact CZ-CE 3.97Å; W118-M132 HydrophobicContact CH2-CE 3.69Å; W118-M132 HydrophobicContact CH2-SD 4Å; W118-M132 HydrophobicContact CZ3-CE 3.67Å; W118-M132 HydrophobicContact CZ3-SD 3.85Å; L130-M132 HydrophobicContact CD1-CG 3.66Å; L130-M132 HydrophobicContact CD1-SD 3.97Å; L130-M132 HydrophobicContact CD2-CG 4.49Å; L130-M132 HydrophobicContact CD2-SD 3.87Å; L130-M132 HydrophobicContact CG-CG 3.83Å; L130-M132 HydrophobicContact CG-SD 3.87Å; M132-N135 PolarHBondContact O-ND2 3.29Å; M132-M137 HydrophobicContact CB-CE 3.5Å; M132-M137 VanDerWaalsContact CB-CE 3.5Å; M132-M137 HydrophobicContact CE-CE 3.89Å; M132-M137 HydrophobicContact CE-SD 3.69Å; M132-M137 HydrophobicContact CG-CE 4.43Å; M132-M137 HydrophobicContact SD-CE 4.23Å; M132-R155 CarbonylContact C-O 3.56Å; M132-R155 WeakPolarHBondContact CA-O 3.49Å; M132-R155 PolarHBondContact N-O 2.66Å; M132-I156 HydrophobicContact SD-CG2 4.47Å; M132-N159 PolarHBondContact O-ND2 3.16Å
133	N	98.2	Very high	95.9	Very high	16 Å²	16	43 Å²	43	9%	0.086	23%	0.227	C	C	.	.			trans	-66.7	156.8	-177.9	64.7	-90.4	0	0	0	112.4	S109 N110 R155 N157	S109-N133 CarbonylContact C-O 3.53Å; S109-N133 WeakPolarHBondContact CA-O 3.31Å; S109-N133 WeakPolarHBondContact CB-O 3.44Å; S109-N133 WeakPolarHBondContact CB-OD1 3.42Å; N110-N133 PolarHBondContact N-O 2.79Å; N133-R155 HydrophobicContact CB-CB 4.17Å; N133-R155 PolarHBondContact N-O 2.6Å; N133-R155 VanDerWaalsContact N-O 3.12Å; N133-N157 WeakPolarHBondContact CA-O 3.26Å; N133-N157 VanDerWaalsContact CB-O 3.22Å; N133-N157 WeakPolarHBondContact CB-O 3.1Å; N133-N157 VanDerWaalsContact CB-OD1 3.24Å; N133-N157 WeakPolarHBondContact CB-OD1 3.16Å
134	N	98.3	Very high	96.2	Very high	54 Å²	54	38.7 Å²	38.7	29%	0.289	21%	0.206	S	C	.	.	S	Bend	trans	58.8	63.6	-176.7	-48.4	2.8	0	0	0	110.2	N110 N111 N157 N158	N110-N134 WeakPolarHBondContact CA-O 3.5Å; N110-N134 HydrophobicContact CB-CB 4.45Å; N110-N134 PolarHBondContact N-O 3.01Å; N110-N134 VanDerWaalsContact N-O 3.09Å; N110-N134 PolarHBondContact OD1-ND2 3.44Å; N111-N134 PolarHBondContact N-O 2.88Å; N111-N134 VanDerWaalsContact N-O 3.08Å; N134-N157 PolarHBondContact N-O 3.25Å; N134-N157 VanDerWaalsContact N-O 3.15Å; N134-N158 WeakPolarHBondContact CA-O 3.17Å; N134-N158 PolarHBondContact N-O 3.1Å; N134-N158 VanDerWaalsContact N-O 3.08Å; N134-N158 VanDerWaalsContact OD1-CB 3.31Å; N134-N158 WeakPolarHBondContact OD1-CB 3.45Å; N134-N158 PolarHBondContact OD1-ND2 3.15Å
135	N	98.5	Very high	96.1	Very high	9 Å²	9	38.7 Å²	38.7	5%	0.048	21%	0.206	C	C	.	.	S	Bend	trans	-143.5	-175.3	177.9	-89.9	-70.1	0	0	0	109.4	I108 N111 K112 I113 M132 M137 N158 N159	I108-N135 PolarHBondContact O-ND2 3.09Å; N111-N135 WeakPolarHBondContact CA-OD1 3.5Å; N111-N135 WeakPolarHBondContact CB-OD1 3.46Å; N111-N135 PolarHBondContact O-OD1 3.1Å; K112-N135 PolarHBondContact N-OD1 3.03Å; I113-N135 HydrophobicContact CB-CB 4.48Å; I113-N135 WeakPolarHBondContact CB-OD1 3.15Å; I113-N135 WeakPolarHBondContact CG1-OD1 3.44Å; I113-N135 PolarHBondContact N-OD1 2.62Å; M132-N135 PolarHBondContact O-ND2 3.29Å; N135-M137 HydrophobicContact CB-CE 4.44Å; N135-M137 HydrophobicContact CB-CG 4.47Å; N135-N158 PolarHBondContact N-O 3.13Å; N135-N159 VanDerWaalsContact C-OD1 3.3Å; N135-N159 WeakPolarHBondContact CB-OD1 3.39Å; N135-N159 WeakPolarHBondContact O-CA 3.41Å; N135-N159 PolarHBondContact O-OD1 3.08Å
136	E	97.8	Very high	96.1	Very high	89 Å²	89	37.2 Å²	37.2	42%	0.416	20%	0.198	S	C	.	.			trans	-113.7	20.1	-176	-63	-161.5	-135.1	0	0	113.8	I113 V114 V138 R160	I113-E136 CarbonylContact O-C 3.49Å; I113-E136 WeakPolarHBondContact O-CA 3.2Å; I113-E136 PolarHBondContact O-N 3.03Å; V114-E136 HydrophobicContact CG2-CB 3.87Å; E136-V138 PolarHBondContact O-N 3.14Å; E136-R160 HydrophobicContact CB-CG 4.41Å
137	M	97.3	Very high	96	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.202	C	C	.	.			trans	-68.1	127.4	-171.7	-62.1	-176.1	-71.6	0	0	112.3	I113 F116 W118 M132 N135 N159 R160 F161	I113-M137 HydrophobicContact CB-CG 4.47Å; I113-M137 HydrophobicContact CG2-CG 4.15Å; I113-M137 HydrophobicContact CG2-SD 4.46Å; I113-M137 WeakPolarHBondContact O-CG 3.31Å; I113-M137 PolarHBondContact O-N 3.38Å; F116-M137 HydrophobicContact CB-SD 3.83Å; F116-M137 HydrophobicContact CG-SD 4.47Å; W118-M137 HydrophobicContact CH2-CE 4.48Å; W118-M137 HydrophobicContact CH2-SD 4.01Å; W118-M137 HydrophobicContact CZ2-SD 3.96Å; M132-M137 HydrophobicContact CB-CE 3.5Å; M132-M137 VanDerWaalsContact CB-CE 3.5Å; M132-M137 HydrophobicContact CE-CE 3.89Å; M132-M137 HydrophobicContact CE-SD 3.69Å; M132-M137 HydrophobicContact CG-CE 4.43Å; M132-M137 HydrophobicContact SD-CE 4.23Å; N135-M137 HydrophobicContact CB-CE 4.44Å; N135-M137 HydrophobicContact CB-CG 4.47Å; M137-N159 WeakPolarHBondContact CB-OD1 3.25Å; M137-N159 VanDerWaalsContact CE-OD1 3.28Å; M137-N159 WeakPolarHBondContact CE-OD1 3.37Å; M137-N159 PolarHBondContact N-OD1 3.01Å; M137-N159 VanDerWaalsContact N-OD1 3.14Å; M137-R160 CarbonylContact O-C 3.35Å; M137-R160 VanDerWaalsContact O-CA 3.25Å; M137-R160 WeakPolarHBondContact O-CA 3.14Å; M137-R160 WeakPolarHBondContact O-CB 3.31Å; M137-R160 PolarHBondContact O-N 3.46Å; M137-F161 HydrophobicContact CB-CE1 3.78Å; M137-F161 HydrophobicContact CB-CE2 4.27Å; M137-F161 HydrophobicContact CB-CZ 3.52Å; M137-F161 HydrophobicContact CE-CE2 4.13Å; M137-F161 HydrophobicContact CE-CZ 3.79Å; M137-F161 HydrophobicContact CG-CZ 4.47Å; M137-F161 PolarHBondContact O-N 3.23Å; M137-F161 HydrophobicContact SD-CZ 4.25Å
138	V	94.1	Very high	95.9	Very high	56 Å²	56	38.2 Å²	38.2	34%	0.339	20%	0.202	S	C	.	.			trans	-97	-38.3	-178.1	-175.9	0	0	0	0	112.5	E136 R160	E136-V138 PolarHBondContact O-N 3.14Å; V138-R160 HydrophobicContact CG2-CB 3.92Å
139	N	90.7	Very high	95.6	Very high	105 Å²	105	42.1 Å²	42.1	56%	0.561	22%	0.219	S	C	*	.			trans	-116.1	129.6	-167.6	-63.2	-54.2	0	0	0	112.1	W118	W118-N139 WeakPolarHBondContact CZ2-O 3.44Å; W118-N139 PolarHBondContact NE1-O 2.88Å; W118-N139 VanDerWaalsContact NE1-O 3.1Å
140	L	95.3	Very high	95.5	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.084	23%	0.229	C	C	.	.			trans	-123.5	109.8	173.7	176.9	59.6	0	0	0	110.2	W118 A144 F145 I156 F161 I164 T168	W118-L140 HydrophobicContact CD2-CD1 4.28Å; W118-L140 HydrophobicContact CE3-CD1 4.05Å; W118-L140 HydrophobicContact CH2-CD1 3.58Å; W118-L140 HydrophobicContact CZ2-CD1 3.8Å; W118-L140 HydrophobicContact CZ3-CD1 3.7Å; L140-A144 HydrophobicContact CD1-CB 3.76Å; L140-F145 HydrophobicContact CD1-CE1 4.48Å; L140-F145 HydrophobicContact CD1-CE2 3.78Å; L140-F145 HydrophobicContact CD1-CZ 3.69Å; L140-F145 HydrophobicContact CD2-CE2 4.04Å; L140-F145 HydrophobicContact CD2-CZ 4.47Å; L140-F145 HydrophobicContact CG-CE2 4.48Å; L140-I156 HydrophobicContact CD2-CD1 4.4Å; L140-F161 HydrophobicContact CB-CD1 3.94Å; L140-F161 HydrophobicContact CB-CE1 3.73Å; L140-I164 HydrophobicContact CD2-CD1 3.8Å; L140-I164 HydrophobicContact CD2-CG2 4.23Å; L140-T168 HydrophobicContact CD2-CG2 3.89Å; L140-T168 HydrophobicContact CG-CG2 4.07Å
141	P	94.9	Very high	95.4	Very high	46 Å²	46	44.5 Å²	44.5	30%	0.299	23%	0.229	S	C	.	.			trans	-63.1	145.1	175.2	-23.3	33.3	0	0	0	113	W118 D143 A144	W118-P141 HydrophobicContact CB-CG 4.16Å; W118-P141 HydrophobicContact CG-CG 3.85Å; W118-P141 VanDerWaalsContact NE1-CD 3.32Å; P141-D143 PolarHBondContact O-N 2.64Å; P141-A144 HydrophobicContact CB-CB 4.19Å; P141-A144 HydrophobicContact CG-CB 4.48Å; P141-A144 VanDerWaalsContact O-CB 3.23Å; P141-A144 WeakPolarHBondContact O-CB 3.31Å; P141-A144 PolarHBondContact O-N 3.39Å
142	K	93.3	Very high	95.2	Very high	114 Å²	114	47 Å²	47	50%	0.496	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.6	-179.7	178.6	175.1	174.1	132.7	0	113.5	V165 E166 T168	K142-V165 HydrophobicContact CB-CB 4.15Å; K142-V165 HydrophobicContact CB-CG1 4.06Å; K142-V165 HydrophobicContact CD-CG1 3.9Å; K142-V165 HydrophobicContact CG-CB 4.49Å; K142-V165 HydrophobicContact CG-CG1 4.13Å; K142-E166 WeakPolarHBondContact CE-O 3.35Å; K142-E166 PolarHBondContact NZ-O 3.12Å; K142-T168 WeakPolarHBondContact O-CA 3.26Å
143	D	93.8	Very high	95.1	Very high	64 Å²	64	47.9 Å²	47.9	34%	0.342	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	5.9	-177.1	66.8	-42.4	0	0	0	113.9	R122 P141 F145 S146	R122-D143 IonicContact CZ-OD2 2.6Å; R122-D143 IonicContact NH1-OD2 3.26Å; R122-D143 PolarHBondContact NH1-OD2 3.06Å; R122-D143 IonicContact NH2-OD2 2.64Å; R122-D143 PolarHBondContact NH2-OD2 2.89Å; P141-D143 PolarHBondContact O-N 2.64Å; D143-F145 PolarHBondContact O-N 2.85Å; D143-S146 WeakPolarHBondContact O-CB 3.19Å; D143-S146 PolarHBondContact O-N 3.08Å; D143-S146 PolarHBondContact O-OG 2.79Å
144	A	95.1	Very high	95	Very high	8 Å²	8	47.1 Å²	47.1	7%	0.066	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-26.4	-175.9	0	0	0	0	0	115	W118 L140 P141	W118-A144 HydrophobicContact CB-CB 4.09Å; W118-A144 HydrophobicContact CD2-CB 3.98Å; W118-A144 HydrophobicContact CE3-CB 3.75Å; W118-A144 HydrophobicContact CG-CB 4.16Å; L140-A144 HydrophobicContact CD1-CB 3.76Å; P141-A144 HydrophobicContact CB-CB 4.19Å; P141-A144 HydrophobicContact CG-CB 4.48Å; P141-A144 VanDerWaalsContact O-CB 3.23Å; P141-A144 WeakPolarHBondContact O-CB 3.31Å; P141-A144 PolarHBondContact O-N 3.39Å
145	F	95.3	Very high	95	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	9.9	178.3	-47	-53.3	0	0	0	113.4	W118 L121 L130 L140 D143 T147 L148 L154 T168 F169 L172	W118-F145 HydrophobicContact CE3-CE1 4.26Å; W118-F145 AromaticContact CZ3-CE1 3.74Å; W118-F145 HydrophobicContact CZ3-CE1 3.74Å; W118-F145 AromaticContact CZ3-CZ 3.9Å; W118-F145 HydrophobicContact CZ3-CZ 3.9Å; L121-F145 HydrophobicContact CD1-CD1 4.2Å; L121-F145 HydrophobicContact CD1-CE1 4.19Å; L130-F145 HydrophobicContact CD2-CD1 4.48Å; L130-F145 HydrophobicContact CD2-CE1 3.98Å; L140-F145 HydrophobicContact CD1-CE1 4.48Å; L140-F145 HydrophobicContact CD1-CE2 3.78Å; L140-F145 HydrophobicContact CD1-CZ 3.69Å; L140-F145 HydrophobicContact CD2-CE2 4.04Å; L140-F145 HydrophobicContact CD2-CZ 4.47Å; L140-F145 HydrophobicContact CG-CE2 4.48Å; D143-F145 PolarHBondContact O-N 2.85Å; F145-T147 PolarHBondContact O-N 3.37Å; F145-T147 VanDerWaalsContact O-N 3.08Å; F145-L148 HydrophobicContact CB-CD1 4.14Å; F145-L148 HydrophobicContact CD1-CD1 3.81Å; F145-L148 HydrophobicContact CG-CD1 4.44Å; F145-L148 PolarHBondContact O-N 3.15Å; F145-L148 VanDerWaalsContact O-N 3.07Å; F145-L154 HydrophobicContact CD2-CD2 4.12Å; F145-L154 HydrophobicContact CE1-CD1 4.28Å; F145-L154 HydrophobicContact CE1-CD2 4.49Å; F145-L154 HydrophobicContact CE2-CD2 3.64Å; F145-L154 HydrophobicContact CZ-CD1 4.09Å; F145-L154 HydrophobicContact CZ-CD2 3.85Å; F145-T168 HydrophobicContact CD2-CG2 4.01Å; F145-T168 HydrophobicContact CE2-CG2 4.19Å; F145-F169 HydrophobicContact CD2-CD1 4.44Å; F145-F169 HydrophobicContact CD2-CE1 4.48Å; F145-F169 HydrophobicContact CE2-CE1 4.22Å; F145-L172 HydrophobicContact CB-CD1 3.84Å; F145-L172 HydrophobicContact CB-CD2 3.92Å; F145-L172 HydrophobicContact CB-CG 4.17Å; F145-L172 HydrophobicContact CD2-CD1 4.12Å; F145-L172 HydrophobicContact CG-CD1 4.24Å; F145-L172 WeakPolarHBondContact O-CD2 3.11Å
146	S	93.3	Very high	94.9	Very high	48 Å²	48	48 Å²	48	34%	0.336	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.9	-169.5	57.1	0	0	0	0	115.5	D143	D143-S146 WeakPolarHBondContact O-CB 3.19Å; D143-S146 PolarHBondContact O-N 3.08Å; D143-S146 PolarHBondContact O-OG 2.79Å
147	T	93.8	Very high	94.9	Very high	40 Å²	40	43.9 Å²	43.9	25%	0.245	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-11.7	179.8	61.7	0	0	0	0	113.8	R122 F145 K149	R122-T147 WeakPolarHBondContact CA-OG1 3Å; R122-T147 VanDerWaalsContact O-CB 3.24Å; R122-T147 WeakPolarHBondContact O-CB 2.97Å; R122-T147 WeakPolarHBondContact O-CG2 2.99Å; R122-T147 PolarHBondContact O-OG1 3.16Å; F145-T147 PolarHBondContact O-N 3.37Å; F145-T147 VanDerWaalsContact O-N 3.08Å; T147-K149 PolarHBondContact O-N 3.01Å
148	L	95.1	Very high	94.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.			trans	-83.6	54.9	-168.1	-54.9	-177.3	0	0	0	112.6	L121 L124 L127 F145 E150 L151 L172	L121-L148 HydrophobicContact CB-CD1 4.39Å; L121-L148 HydrophobicContact CB-CD2 4.45Å; L121-L148 HydrophobicContact CD1-CD1 4.3Å; L121-L148 WeakPolarHBondContact O-CD2 3.28Å; L124-L148 HydrophobicContact CB-CD2 4.34Å; L124-L148 VanDerWaalsContact O-CD2 3.28Å; L124-L148 WeakPolarHBondContact O-CD2 3.27Å; L127-L148 HydrophobicContact CB-CD2 4.3Å; L127-L148 HydrophobicContact CD2-CD1 4.28Å; F145-L148 HydrophobicContact CB-CD1 4.14Å; F145-L148 HydrophobicContact CD1-CD1 3.81Å; F145-L148 HydrophobicContact CG-CD1 4.44Å; F145-L148 PolarHBondContact O-N 3.15Å; F145-L148 VanDerWaalsContact O-N 3.07Å; L148-E150 PolarHBondContact O-N 3.37Å; L148-L151 HydrophobicContact CB-CB 4.07Å; L148-L151 HydrophobicContact CB-CD2 4.4Å; L148-L151 HydrophobicContact CD1-CD2 4.19Å; L148-L151 WeakPolarHBondContact O-CB 3.29Å; L148-L151 PolarHBondContact O-N 3.43Å; L148-L172 HydrophobicContact CB-CD2 4.09Å; L148-L172 WeakPolarHBondContact O-CD2 3.37Å
149	K	91.6	Very high	95.2	Very high	146 Å²	146	44.2 Å²	44.2	64%	0.635	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.8	-171.7	-65.2	177	-178.7	177.7	0	114	T147	T147-K149 PolarHBondContact O-N 3.01Å
150	E	94.4	Very high	95.5	Very high	80 Å²	80	45.5 Å²	45.5	37%	0.374	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-1.5	178	-74.6	-56.7	136.4	0	0	114.5	L127 Q128 L148 R152	L127-E150 CarbonylContact O-C 3.53Å; L127-E150 VanDerWaalsContact O-C 3.31Å; Q128-E150 HydrophobicContact CG-CB 4.15Å; L148-E150 PolarHBondContact O-N 3.37Å; E150-R152 WeakPolarHBondContact O-CD 3.29Å; E150-R152 VanDerWaalsContact O-CG 3.31Å; E150-R152 WeakPolarHBondContact O-CG 3.25Å; E150-R152 PolarHBondContact O-N 3.08Å; E150-R152 PolarHBondContact O-NE 2.89Å; E150-R152 VanDerWaalsContact O-NE 3.11Å; E150-R152 IonicContact OE1-NH2 2.64Å; E150-R152 PolarHBondContact OE1-NH2 2.94Å; E150-R152 IonicContact OE2-CZ 3.59Å; E150-R152 IonicContact OE2-NE 2.66Å; E150-R152 IonicContact OE2-NH2 2.78Å; E150-R152 PolarHBondContact OE2-NH2 3.03Å
151	L	96.2	Very high	95.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.212	C	C	.	.			trans	-65.9	120.5	-177	-168.7	68	0	0	0	110.8	L127 L130 L148 L154 L172 S173 L174	L127-L151 HydrophobicContact CD2-CD1 4.38Å; L127-L151 HydrophobicContact CG-CD1 4.3Å; L127-L151 WeakPolarHBondContact O-CA 3.16Å; L127-L151 PolarHBondContact O-N 3.12Å; L127-L151 VanDerWaalsContact O-N 3.1Å; L130-L151 HydrophobicContact CB-CD1 3.84Å; L148-L151 HydrophobicContact CB-CB 4.07Å; L148-L151 HydrophobicContact CB-CD2 4.4Å; L148-L151 HydrophobicContact CD1-CD2 4.19Å; L148-L151 WeakPolarHBondContact O-CB 3.29Å; L148-L151 PolarHBondContact O-N 3.43Å; L151-L154 HydrophobicContact CD2-CB 4.24Å; L151-L154 HydrophobicContact CD2-CD1 4.45Å; L151-L172 HydrophobicContact CB-CD2 4.25Å; L151-L172 HydrophobicContact CD2-CD1 4.24Å; L151-L172 HydrophobicContact CD2-CD2 4.22Å; L151-S173 CarbonylContact O-C 3.6Å; L151-L174 HydrophobicContact CB-CD2 4.36Å; L151-L174 HydrophobicContact CD2-CD2 4.05Å; L151-L174 HydrophobicContact CG-CD2 3.88Å
152	R	94.1	Very high	95.6	Very high	93 Å²	93	45.3 Å²	45.3	35%	0.351	22%	0.215	S	C	.	.			trans	-109	-30.9	-178.7	-50.8	-51	172.8	166.1	-0.7	112.7	Q128 E150 S173 S175 H176	Q128-R152 PolarHBondContact O-N 3.27Å; E150-R152 WeakPolarHBondContact O-CD 3.29Å; E150-R152 VanDerWaalsContact O-CG 3.31Å; E150-R152 WeakPolarHBondContact O-CG 3.25Å; E150-R152 PolarHBondContact O-N 3.08Å; E150-R152 PolarHBondContact O-NE 2.89Å; E150-R152 VanDerWaalsContact O-NE 3.11Å; E150-R152 IonicContact OE1-NH2 2.64Å; E150-R152 PolarHBondContact OE1-NH2 2.94Å; E150-R152 IonicContact OE2-CZ 3.59Å; E150-R152 IonicContact OE2-NE 2.66Å; E150-R152 IonicContact OE2-NH2 2.78Å; E150-R152 PolarHBondContact OE2-NH2 3.03Å; R152-S173 PolarHBondContact NH1-O 3.01Å; R152-S175 PolarHBondContact O-N 3.17Å; R152-H176 PolarHBondContact O-N 3.42Å
153	S	95.8	Very high	95.6	Very high	19 Å²	19	42 Å²	42	13%	0.133	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.8	177.7	-167.6	0	0	0	0	112	Q128 L130 H176	Q128-S153 PolarHBondContact O-N 3.09Å; Q128-S153 VanDerWaalsContact O-N 3.1Å; L130-S153 PolarHBondContact N-O 3.4Å; S153-H176 WeakPolarHBondContact CA-O 3.06Å
154	L	97.1	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.3	176.9	178.2	60.3	0	0	0	109.7	L130 F145 L151 I156 F169 L174 H176 L177 Q178	L130-L154 HydrophobicContact CB-CD1 4.05Å; L130-L154 HydrophobicContact CD2-CD1 3.93Å; L130-L154 HydrophobicContact CG-CD1 3.95Å; L130-L154 WeakPolarHBondContact O-CA 3.11Å; F145-L154 HydrophobicContact CD2-CD2 4.12Å; F145-L154 HydrophobicContact CE1-CD1 4.28Å; F145-L154 HydrophobicContact CE1-CD2 4.49Å; F145-L154 HydrophobicContact CE2-CD2 3.64Å; F145-L154 HydrophobicContact CZ-CD1 4.09Å; F145-L154 HydrophobicContact CZ-CD2 3.85Å; L151-L154 HydrophobicContact CD2-CB 4.24Å; L151-L154 HydrophobicContact CD2-CD1 4.45Å; L154-I156 HydrophobicContact CD1-CG2 3.84Å; L154-I156 HydrophobicContact CG-CG2 4.14Å; L154-F169 HydrophobicContact CD2-CE1 4.21Å; L154-L174 HydrophobicContact CB-CD1 4.3Å; L154-L174 HydrophobicContact CB-CD2 3.93Å; L154-H176 PolarHBondContact N-O 3.32Å; L154-H176 VanDerWaalsContact N-O 3.09Å; L154-L177 HydrophobicContact CB-CD1 3.88Å; L154-L177 HydrophobicContact CD2-CD1 3.83Å; L154-L177 HydrophobicContact CG-CD1 3.89Å; L154-L177 WeakPolarHBondContact O-CA 3.47Å; L154-Q178 PolarHBondContact O-N 3.31Å
155	R	97.3	Very high	95.6	Very high	81 Å²	81	41.6 Å²	41.6	31%	0.306	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110	177.3	-52.9	-174.6	-176.6	-158.4	-5.2	110.6	L130 K131 M132 N133 Q178	L130-R155 PolarHBondContact O-N 2.82Å; K131-R155 HydrophobicContact CB-CB 4.48Å; K131-R155 HydrophobicContact CG-CG 4.41Å; M132-R155 CarbonylContact C-O 3.56Å; M132-R155 WeakPolarHBondContact CA-O 3.49Å; M132-R155 PolarHBondContact N-O 2.66Å; N133-R155 HydrophobicContact CB-CB 4.17Å; N133-R155 PolarHBondContact N-O 2.6Å; N133-R155 VanDerWaalsContact N-O 3.12Å; R155-Q178 HydrophobicContact CB-CB 4.48Å; R155-Q178 HydrophobicContact CG-CB 4.42Å
156	I	97.3	Very high	95.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.231	C	C	.	.			trans	-128.8	9.5	-179	59.7	172.2	0	0	0	112.2	M132 L140 L154 N159 F161 I164 F169 Q178 I179 N182	M132-I156 HydrophobicContact SD-CG2 4.47Å; L140-I156 HydrophobicContact CD2-CD1 4.4Å; L154-I156 HydrophobicContact CD1-CG2 3.84Å; L154-I156 HydrophobicContact CG-CG2 4.14Å; I156-N159 PolarHBondContact O-ND2 3.17Å; I156-N159 VanDerWaalsContact O-ND2 3.16Å; I156-F161 HydrophobicContact CB-CE2 3.99Å; I156-I164 HydrophobicContact CD1-CD1 4.43Å; I156-F169 HydrophobicContact CD1-CZ 4.43Å; I156-Q178 CarbonylContact C-O 3.57Å; I156-Q178 WeakPolarHBondContact CG1-O 3.31Å; I156-Q178 PolarHBondContact N-O 2.9Å; I156-I179 HydrophobicContact CD1-CG2 3.83Å; I156-I179 HydrophobicContact CG1-CB 4.26Å; I156-I179 HydrophobicContact CG1-CG2 3.74Å; I156-N182 PolarHBondContact O-ND2 2.96Å
157	N	97.7	Very high	95.4	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	23%	0.226	C	C	.	.			trans	-60.9	158.5	172.5	61.9	-77.3	0	0	0	112.4	N133 N134 N159 Q178 Y180	N133-N157 WeakPolarHBondContact CA-O 3.26Å; N133-N157 VanDerWaalsContact CB-O 3.22Å; N133-N157 WeakPolarHBondContact CB-O 3.1Å; N133-N157 VanDerWaalsContact CB-OD1 3.24Å; N133-N157 WeakPolarHBondContact CB-OD1 3.16Å; N134-N157 PolarHBondContact N-O 3.25Å; N134-N157 VanDerWaalsContact N-O 3.15Å; N157-N159 PolarHBondContact O-ND2 3.32Å; N157-Q178 HydrophobicContact CB-CB 4.23Å; N157-Q178 PolarHBondContact N-O 3.04Å; N157-Q178 VanDerWaalsContact OD1-CB 3.32Å; N157-Q178 WeakPolarHBondContact OD1-CB 3.13Å; N157-Y180 CarbonylContact C-O 3.59Å; N157-Y180 WeakPolarHBondContact CA-O 3.26Å; N157-Y180 HydrophobicContact CB-CD1 4.04Å; N157-Y180 HydrophobicContact CB-CD2 3.78Å; N157-Y180 HydrophobicContact CB-CE1 4.08Å; N157-Y180 HydrophobicContact CB-CE2 3.79Å; N157-Y180 HydrophobicContact CB-CG 3.89Å; N157-Y180 WeakPolarHBondContact CB-O 3.37Å; N157-Y180 WeakPolarHBondContact ND2-CE2 3.45Å; N157-Y180 PolarHBondContact ND2-OH 3.27Å
158	N	97.9	Very high	95.4	Very high	61 Å²	61	44.6 Å²	44.6	33%	0.326	22%	0.215	S	C	.	.	S	Bend	trans	50.6	60.5	-174.5	-55.5	-52.6	0	0	0	111.7	N134 N135 Y180 S181	N134-N158 WeakPolarHBondContact CA-O 3.17Å; N134-N158 PolarHBondContact N-O 3.1Å; N134-N158 VanDerWaalsContact N-O 3.08Å; N134-N158 VanDerWaalsContact OD1-CB 3.31Å; N134-N158 WeakPolarHBondContact OD1-CB 3.45Å; N134-N158 PolarHBondContact OD1-ND2 3.15Å; N135-N158 PolarHBondContact N-O 3.13Å; N158-Y180 PolarHBondContact N-O 3.33Å; N158-S181 VanDerWaalsContact CA-O 3.25Å; N158-S181 WeakPolarHBondContact CA-O 3.22Å; N158-S181 PolarHBondContact N-O 3.05Å; N158-S181 WeakPolarHBondContact OD1-CB 3.44Å
159	N	98.4	Very high	95.2	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.027	22%	0.217	C	C	.	.	S	Bend	trans	-131.4	-166.4	172.3	-90.2	-83.8	0	0	0	109	M132 N135 M137 I156 N157 F161 N182 P183	M132-N159 PolarHBondContact O-ND2 3.16Å; N135-N159 VanDerWaalsContact C-OD1 3.3Å; N135-N159 WeakPolarHBondContact CB-OD1 3.39Å; N135-N159 WeakPolarHBondContact O-CA 3.41Å; N135-N159 PolarHBondContact O-OD1 3.08Å; M137-N159 WeakPolarHBondContact CB-OD1 3.25Å; M137-N159 VanDerWaalsContact CE-OD1 3.28Å; M137-N159 WeakPolarHBondContact CE-OD1 3.37Å; M137-N159 PolarHBondContact N-OD1 3.01Å; M137-N159 VanDerWaalsContact N-OD1 3.14Å; I156-N159 PolarHBondContact O-ND2 3.17Å; I156-N159 VanDerWaalsContact O-ND2 3.16Å; N157-N159 PolarHBondContact O-ND2 3.32Å; N159-F161 HydrophobicContact CB-CD2 3.55Å; N159-F161 HydrophobicContact CB-CE2 3.5Å; N159-F161 HydrophobicContact CB-CG 4.48Å; N159-F161 HydrophobicContact CB-CZ 4.42Å; N159-N182 VanDerWaalsContact CA-OD1 3.29Å; N159-N182 WeakPolarHBondContact CA-OD1 3.18Å; N159-N182 WeakPolarHBondContact CB-OD1 3.42Å; N159-N182 PolarHBondContact N-OD1 3.01Å; N159-N182 PolarHBondContact O-OD1 3.26Å; N159-P183 WeakPolarHBondContact O-CD 3.4Å
160	R	97.8	Very high	95	Very high	132 Å²	132	43.1 Å²	43.1	50%	0.498	22%	0.222	S	C	.	.			trans	-114.4	22	-178.4	-54	-61.1	-68.1	-81.2	0.9	112.6	E136 M137 V138 T162 N182	E136-R160 HydrophobicContact CB-CG 4.41Å; M137-R160 CarbonylContact O-C 3.35Å; M137-R160 VanDerWaalsContact O-CA 3.25Å; M137-R160 WeakPolarHBondContact O-CA 3.14Å; M137-R160 WeakPolarHBondContact O-CB 3.31Å; M137-R160 PolarHBondContact O-N 3.46Å; V138-R160 HydrophobicContact CG2-CB 3.92Å; R160-T162 PolarHBondContact O-N 3.24Å; R160-N182 PolarHBondContact N-OD1 3.35Å
161	F	97.1	Very high	94.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.			trans	-65.7	117.8	179.6	-60.7	-62.1	0	0	0	110.9	W118 M137 L140 I156 N159 I164 N182 P183 F184	W118-F161 HydrophobicContact CH2-CZ 4.29Å; W118-F161 HydrophobicContact CZ2-CE1 4.29Å; W118-F161 HydrophobicContact CZ2-CZ 4.24Å; M137-F161 HydrophobicContact CB-CE1 3.78Å; M137-F161 HydrophobicContact CB-CE2 4.27Å; M137-F161 HydrophobicContact CB-CZ 3.52Å; M137-F161 HydrophobicContact CE-CE2 4.13Å; M137-F161 HydrophobicContact CE-CZ 3.79Å; M137-F161 HydrophobicContact CG-CZ 4.47Å; M137-F161 PolarHBondContact O-N 3.23Å; M137-F161 HydrophobicContact SD-CZ 4.25Å; L140-F161 HydrophobicContact CB-CD1 3.94Å; L140-F161 HydrophobicContact CB-CE1 3.73Å; I156-F161 HydrophobicContact CB-CE2 3.99Å; N159-F161 HydrophobicContact CB-CD2 3.55Å; N159-F161 HydrophobicContact CB-CE2 3.5Å; N159-F161 HydrophobicContact CB-CG 4.48Å; N159-F161 HydrophobicContact CB-CZ 4.42Å; F161-I164 HydrophobicContact CB-CD1 4.28Å; F161-N182 HydrophobicContact CB-CB 4.44Å; F161-N182 VanDerWaalsContact CD2-OD1 3.29Å; F161-N182 WeakPolarHBondContact CD2-OD1 3.5Å; F161-N182 PolarHBondContact N-OD1 3.35Å; F161-N182 VanDerWaalsContact N-OD1 3.12Å; F161-P183 WeakPolarHBondContact O-CD 3.15Å; F161-F184 HydrophobicContact CB-CE1 4.45Å
162	T	95	Very high	94.1	Very high	58 Å²	58	42 Å²	42	36%	0.356	22%	0.224	S	C	.	.	S	Bend	trans	-87.9	-20	178.1	55.5	0	0	0	0	113	R160 P183 F184 T185	R160-T162 PolarHBondContact O-N 3.24Å; T162-P183 WeakPolarHBondContact CA-O 3.35Å; T162-F184 WeakPolarHBondContact O-CA 3.19Å; T162-T185 PolarHBondContact O-N 3.49Å
163	T	94.3	Very high	93.7	Very high	44 Å²	44	41 Å²	41	27%	0.27	23%	0.231	S	C	.	.			trans	-155.9	163.5	172.9	-171.8	0	0	0	0	110.1
164	I	94.8	Very high	93.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.228	C	C	.	.			trans	-122.5	126.7	168.1	-48	-67.1	0	0	0	106.2	L140 I156 F161 T168 F169 F184 W192 L193	L140-I164 HydrophobicContact CD2-CD1 3.8Å; L140-I164 HydrophobicContact CD2-CG2 4.23Å; I156-I164 HydrophobicContact CD1-CD1 4.43Å; F161-I164 HydrophobicContact CB-CD1 4.28Å; I164-T168 HydrophobicContact CG2-CG2 4.17Å; I164-F169 HydrophobicContact CG2-CE1 4.39Å; I164-F169 HydrophobicContact CG2-CE2 4.16Å; I164-F169 HydrophobicContact CG2-CZ 3.86Å; I164-F184 HydrophobicContact CD1-CE1 4.14Å; I164-F184 HydrophobicContact CG1-CE1 3.88Å; I164-F184 HydrophobicContact CG1-CZ 4.39Å; I164-W192 HydrophobicContact CB-CZ2 3.91Å; I164-W192 HydrophobicContact CG2-CH2 4.19Å; I164-W192 HydrophobicContact CG2-CZ2 3.75Å; I164-W192 WeakPolarHBondContact O-CZ2 3.46Å; I164-W192 PolarHBondContact O-NE1 3.25Å; I164-L193 HydrophobicContact CB-CD2 4.46Å; I164-L193 HydrophobicContact CG1-CD2 4.16Å
165	V	93.2	Very high	93	Very high	62 Å²	62	44.2 Å²	44.2	38%	0.376	25%	0.252	S	S	.	.			trans	-74	141.4	-174.7	-174.9	0	0	0	0	110.8	K142 G167 T168 W192	K142-V165 HydrophobicContact CB-CB 4.15Å; K142-V165 HydrophobicContact CB-CG1 4.06Å; K142-V165 HydrophobicContact CD-CG1 3.9Å; K142-V165 HydrophobicContact CG-CB 4.49Å; K142-V165 HydrophobicContact CG-CG1 4.13Å; V165-G167 PolarHBondContact O-N 2.95Å; V165-T168 WeakPolarHBondContact O-CB 3.26Å; V165-T168 PolarHBondContact O-N 3.07Å; V165-T168 VanDerWaalsContact O-N 3.08Å; V165-T168 PolarHBondContact O-OG1 2.8Å; V165-W192 WeakPolarHBondContact O-CZ2 3.37Å
166	E	92.4	Very high	92.7	Very high	126 Å²	126	43.4 Å²	43.4	59%	0.589	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	130.9	177.4	-171.9	-175.5	-164.3	0	0	111.5	K142 W192	K142-E166 WeakPolarHBondContact CE-O 3.35Å; K142-E166 PolarHBondContact NZ-O 3.12Å; E166-W192 HydrophobicContact CB-CB 4.32Å; E166-W192 HydrophobicContact CB-CD2 4.12Å; E166-W192 HydrophobicContact CB-CG 3.75Å; E166-W192 HydrophobicContact CG-CB 3.93Å; E166-W192 HydrophobicContact CG-CD2 4.1Å; E166-W192 HydrophobicContact CG-CG 3.77Å
167	G	91.3	Very high	92.6	Very high	23 Å²	23	43.4 Å²	43.4	24%	0.237	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-3.9	-178.7	0	0	0	0	0	115.2	V165 F169 S170	V165-G167 PolarHBondContact O-N 2.95Å; G167-F169 PolarHBondContact O-N 3.03Å; G167-F169 VanDerWaalsContact O-N 3.11Å; G167-S170 WeakPolarHBondContact O-CB 3.32Å; G167-S170 PolarHBondContact O-N 3.18Å; G167-S170 PolarHBondContact O-OG 3.02Å
168	T	94.3	Very high	92.5	Very high	3 Å²	3	44 Å²	44	2%	0.018	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.2	178.2	-56.4	0	0	0	0	113.2	L140 K142 F145 I164 V165	L140-T168 HydrophobicContact CD2-CG2 3.89Å; L140-T168 HydrophobicContact CG-CG2 4.07Å; K142-T168 WeakPolarHBondContact O-CA 3.26Å; F145-T168 HydrophobicContact CD2-CG2 4.01Å; F145-T168 HydrophobicContact CE2-CG2 4.19Å; I164-T168 HydrophobicContact CG2-CG2 4.17Å; V165-T168 WeakPolarHBondContact O-CB 3.26Å; V165-T168 PolarHBondContact O-N 3.07Å; V165-T168 VanDerWaalsContact O-N 3.08Å; V165-T168 PolarHBondContact O-OG1 2.8Å
169	F	91.1	Very high	92.4	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.048	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	2.8	176.8	-52	-38.3	0	0	0	114.2	F145 L154 I156 I164 G167 A171 L172 L177 W192 L193 W196	F145-F169 HydrophobicContact CD2-CD1 4.44Å; F145-F169 HydrophobicContact CD2-CE1 4.48Å; F145-F169 HydrophobicContact CE2-CE1 4.22Å; L154-F169 HydrophobicContact CD2-CE1 4.21Å; I156-F169 HydrophobicContact CD1-CZ 4.43Å; I164-F169 HydrophobicContact CG2-CE1 4.39Å; I164-F169 HydrophobicContact CG2-CE2 4.16Å; I164-F169 HydrophobicContact CG2-CZ 3.86Å; G167-F169 PolarHBondContact O-N 3.03Å; G167-F169 VanDerWaalsContact O-N 3.11Å; F169-A171 VanDerWaalsContact C-N 3.31Å; F169-A171 PolarHBondContact O-N 3.11Å; F169-L172 HydrophobicContact CD1-CD1 4.22Å; F169-L172 PolarHBondContact O-N 3.13Å; F169-L172 VanDerWaalsContact O-N 3.16Å; F169-L177 HydrophobicContact CD2-CD2 4.2Å; F169-L177 HydrophobicContact CE2-CD2 3.79Å; F169-L177 HydrophobicContact CZ-CD1 4.48Å; F169-L177 HydrophobicContact CZ-CD2 4.05Å; F169-W192 AromaticContact CD2-CH2 3.78Å; F169-W192 HydrophobicContact CD2-CH2 3.78Å; F169-W192 HydrophobicContact CD2-CZ3 4.31Å; F169-W192 HydrophobicContact CE2-CH2 4.02Å; F169-L193 HydrophobicContact CE2-CD1 4.32Å; F169-W196 HydrophobicContact CD2-CH2 4.27Å; F169-W196 HydrophobicContact CD2-CZ2 4.13Å
170	S	87.8	Confident	92.2	Very high	104 Å²	104	42.4 Å²	42.4	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.1	-170.2	68.3	0	0	0	0	114.3	G167 L172	G167-S170 WeakPolarHBondContact O-CB 3.32Å; G167-S170 PolarHBondContact O-N 3.18Å; G167-S170 PolarHBondContact O-OG 3.02Å; S170-L172 VanDerWaalsContact C-N 3.34Å
171	A	84.1	Confident	92.2	Very high	41 Å²	41	38.7 Å²	38.7	34%	0.339	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.8	177.1	0	0	0	0	0	113.9	F169	F169-A171 VanDerWaalsContact C-N 3.31Å; F169-A171 PolarHBondContact O-N 3.11Å
172	L	87.4	Confident	92.2	Very high	16 Å²	16	39 Å²	39	8%	0.084	24%	0.24	C	C	.	.			trans	-103.1	133.7	-165.9	-60.1	-178.5	0	0	0	113.8	F145 L148 L151 F169 S170 L174	F145-L172 HydrophobicContact CB-CD1 3.84Å; F145-L172 HydrophobicContact CB-CD2 3.92Å; F145-L172 HydrophobicContact CB-CG 4.17Å; F145-L172 HydrophobicContact CD2-CD1 4.12Å; F145-L172 HydrophobicContact CG-CD1 4.24Å; F145-L172 WeakPolarHBondContact O-CD2 3.11Å; L148-L172 HydrophobicContact CB-CD2 4.09Å; L148-L172 WeakPolarHBondContact O-CD2 3.37Å; L151-L172 HydrophobicContact CB-CD2 4.25Å; L151-L172 HydrophobicContact CD2-CD1 4.24Å; L151-L172 HydrophobicContact CD2-CD2 4.22Å; F169-L172 HydrophobicContact CD1-CD1 4.22Å; F169-L172 PolarHBondContact O-N 3.13Å; F169-L172 VanDerWaalsContact O-N 3.16Å; S170-L172 VanDerWaalsContact C-N 3.34Å; L172-L174 HydrophobicContact CB-CG 3.96Å; L172-L174 HydrophobicContact CD1-CD1 4.18Å; L172-L174 HydrophobicContact CD1-CD2 4.34Å; L172-L174 HydrophobicContact CD1-CG 4.2Å; L172-L174 PolarHBondContact O-N 3.36Å
173	S	86.3	Confident	92.3	Very high	71 Å²	71	38 Å²	38	50%	0.497	23%	0.234	S	C	.	.			trans	-100.2	52.4	171.6	-65	0	0	0	0	111.6	L151 R152	L151-S173 CarbonylContact O-C 3.6Å; R152-S173 PolarHBondContact NH1-O 3.01Å
174	L	88.5	Confident	92.4	Very high	13 Å²	13	35.9 Å²	35.9	7%	0.068	22%	0.221	C	C	.	.			trans	-59.9	150	179.5	-65.5	178.3	0	0	0	111.6	L151 L154 L172 L177 I202	L151-L174 HydrophobicContact CB-CD2 4.36Å; L151-L174 HydrophobicContact CD2-CD2 4.05Å; L151-L174 HydrophobicContact CG-CD2 3.88Å; L154-L174 HydrophobicContact CB-CD1 4.3Å; L154-L174 HydrophobicContact CB-CD2 3.93Å; L172-L174 HydrophobicContact CB-CG 3.96Å; L172-L174 HydrophobicContact CD1-CD1 4.18Å; L172-L174 HydrophobicContact CD1-CD2 4.34Å; L172-L174 HydrophobicContact CD1-CG 4.2Å; L172-L174 PolarHBondContact O-N 3.36Å; L174-L177 HydrophobicContact CD1-CB 4.03Å; L174-L177 HydrophobicContact CD1-CD1 3.97Å; L174-L177 HydrophobicContact CD1-CD2 4.43Å; L174-L177 HydrophobicContact CD1-CG 4.35Å; L174-I202 HydrophobicContact CB-CD1 4.1Å; L174-I202 HydrophobicContact CB-CG1 4.41Å; L174-I202 HydrophobicContact CB-CG2 4Å
175	S	89.8	Confident	92.4	Very high	73 Å²	73	38.3 Å²	38.3	51%	0.51	24%	0.236	S	C	.	.	S	Bend	trans	-105.8	-29.8	164.4	-48.6	0	0	0	0	111.3	R152 S203	R152-S175 PolarHBondContact O-N 3.17Å; S175-S203 VanDerWaalsContact O-CB 3.23Å; S175-S203 WeakPolarHBondContact O-CB 3.48Å; S175-S203 PolarHBondContact O-N 3.29Å
176	H	90.8	Very high	92.5	Very high	64 Å²	64	35.4 Å²	35.4	30%	0.296	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	126	-174	-173.9	99.4	0	0	0	111.8	R152 S153 L154 S203 P205	R152-H176 PolarHBondContact O-N 3.42Å; S153-H176 WeakPolarHBondContact CA-O 3.06Å; L154-H176 PolarHBondContact N-O 3.32Å; L154-H176 VanDerWaalsContact N-O 3.09Å; H176-S203 WeakPolarHBondContact CA-O 3.34Å; H176-S203 VanDerWaalsContact CE1-CB 3.48Å; H176-S203 WeakPolarHBondContact CE1-CB 3.32Å; H176-S203 PolarHBondContact CE1-OG 3.38Å; H176-P205 WeakPolarHBondContact NE2-CG 3.44Å
177	L	94.3	Very high	92.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	128.4	179.2	178.8	65.5	0	0	0	110.9	L154 F169 L174 I179 W196 I202 S203 P205	L154-L177 HydrophobicContact CB-CD1 3.88Å; L154-L177 HydrophobicContact CD2-CD1 3.83Å; L154-L177 HydrophobicContact CG-CD1 3.89Å; L154-L177 WeakPolarHBondContact O-CA 3.47Å; F169-L177 HydrophobicContact CD2-CD2 4.2Å; F169-L177 HydrophobicContact CE2-CD2 3.79Å; F169-L177 HydrophobicContact CZ-CD1 4.48Å; F169-L177 HydrophobicContact CZ-CD2 4.05Å; L174-L177 HydrophobicContact CD1-CB 4.03Å; L174-L177 HydrophobicContact CD1-CD1 3.97Å; L174-L177 HydrophobicContact CD1-CD2 4.43Å; L174-L177 HydrophobicContact CD1-CG 4.35Å; L177-I179 HydrophobicContact CD1-CG2 3.78Å; L177-I179 HydrophobicContact CD2-CG2 3.82Å; L177-I179 HydrophobicContact CG-CG2 3.67Å; L177-W196 HydrophobicContact CD2-CH2 3.46Å; L177-W196 VanDerWaalsContact CD2-CH2 3.46Å; L177-W196 HydrophobicContact CD2-CZ2 4.49Å; L177-W196 HydrophobicContact CD2-CZ3 3.78Å; L177-I202 HydrophobicContact CB-CG2 4.15Å; L177-S203 PolarHBondContact N-O 3.03Å; L177-P205 VanDerWaalsContact O-CD 3.22Å; L177-P205 WeakPolarHBondContact O-CD 3.3Å
178	Q	95.2	Very high	92.4	Very high	17 Å²	17	29.9 Å²	29.9	8%	0.079	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.2	172.2	-67.2	179.3	-56.4	0	0	110.3	L154 R155 I156 N157 Y180 P205	L154-Q178 PolarHBondContact O-N 3.31Å; R155-Q178 HydrophobicContact CB-CB 4.48Å; R155-Q178 HydrophobicContact CG-CB 4.42Å; I156-Q178 CarbonylContact C-O 3.57Å; I156-Q178 WeakPolarHBondContact CG1-O 3.31Å; I156-Q178 PolarHBondContact N-O 2.9Å; N157-Q178 HydrophobicContact CB-CB 4.23Å; N157-Q178 PolarHBondContact N-O 3.04Å; N157-Q178 VanDerWaalsContact OD1-CB 3.32Å; N157-Q178 WeakPolarHBondContact OD1-CB 3.13Å; Q178-Y180 HydrophobicContact CB-CD1 4.42Å; Q178-Y180 HydrophobicContact CB-CE1 4.17Å; Q178-Y180 HydrophobicContact CG-CE1 4.23Å; Q178-P205 HydrophobicContact CG-CG 3.92Å
179	I	95.6	Very high	92.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	20%	0.203	C	C	.	.			trans	-124.5	-2.6	178.9	76.1	174.3	0	0	0	114.6	I156 L177 N182 F184 L193 I197 I210	I156-I179 HydrophobicContact CD1-CG2 3.83Å; I156-I179 HydrophobicContact CG1-CB 4.26Å; I156-I179 HydrophobicContact CG1-CG2 3.74Å; L177-I179 HydrophobicContact CD1-CG2 3.78Å; L177-I179 HydrophobicContact CD2-CG2 3.82Å; L177-I179 HydrophobicContact CG-CG2 3.67Å; I179-N182 PolarHBondContact O-ND2 3.18Å; I179-F184 HydrophobicContact CB-CZ 4.47Å; I179-F184 HydrophobicContact CD1-CE2 4.34Å; I179-F184 HydrophobicContact CD1-CZ 4.12Å; I179-F184 HydrophobicContact CG1-CE2 4.43Å; I179-F184 HydrophobicContact CG1-CZ 4.37Å; I179-L193 HydrophobicContact CD1-CD1 4.15Å; I179-L193 HydrophobicContact CD1-CD2 4.04Å; I179-I197 HydrophobicContact CD1-CD1 4.42Å; I179-I210 HydrophobicContact CD1-CD1 4.17Å; I179-I210 HydrophobicContact CD1-CG2 4.12Å; I179-I210 HydrophobicContact CG1-CD1 3.76Å; I179-I210 HydrophobicContact CG1-CG1 4.06Å; I179-I210 HydrophobicContact CG1-CG2 4.19Å
180	Y	95.9	Very high	92.3	Very high	31 Å²	31	31.2 Å²	31.2	12%	0.122	20%	0.201	C	C	.	.			trans	-59.1	163.8	-173.9	62.2	-107.1	0	0	0	113.5	N157 N158 Q178 N182 E206 Q209	N157-Y180 CarbonylContact C-O 3.59Å; N157-Y180 WeakPolarHBondContact CA-O 3.26Å; N157-Y180 HydrophobicContact CB-CD1 4.04Å; N157-Y180 HydrophobicContact CB-CD2 3.78Å; N157-Y180 HydrophobicContact CB-CE1 4.08Å; N157-Y180 HydrophobicContact CB-CE2 3.79Å; N157-Y180 HydrophobicContact CB-CG 3.89Å; N157-Y180 WeakPolarHBondContact CB-O 3.37Å; N157-Y180 WeakPolarHBondContact ND2-CE2 3.45Å; N157-Y180 PolarHBondContact ND2-OH 3.27Å; N158-Y180 PolarHBondContact N-O 3.33Å; Q178-Y180 HydrophobicContact CB-CD1 4.42Å; Q178-Y180 HydrophobicContact CB-CE1 4.17Å; Q178-Y180 HydrophobicContact CG-CE1 4.23Å; Y180-N182 VanDerWaalsContact C-N 3.32Å; Y180-N182 PolarHBondContact O-N 3Å; Y180-E206 HydrophobicContact CD1-CB 4.2Å; Y180-E206 HydrophobicContact CE1-CB 4.48Å; Y180-Q209 HydrophobicContact CG-CB 4.33Å
181	S	96.4	Very high	92.5	Very high	53 Å²	53	27.7 Å²	27.7	37%	0.371	17%	0.173	S	C	.	.	S	Bend	trans	52.3	49.3	-178	-60.6	0	0	0	0	112.9	N158 Q209	N158-S181 VanDerWaalsContact CA-O 3.25Å; N158-S181 WeakPolarHBondContact CA-O 3.22Å; N158-S181 PolarHBondContact N-O 3.05Å; N158-S181 WeakPolarHBondContact OD1-CB 3.44Å; S181-Q209 PolarHBondContact N-O 3.04Å; S181-Q209 VanDerWaalsContact N-O 3.1Å
182	N	97.8	Very high	92.9	Very high	8 Å²	8	27.5 Å²	27.5	4%	0.043	16%	0.163	C	C	.	.			trans	-115.9	144.9	164.9	-88.2	-77.3	0	0	0	108.3	I156 N159 R160 F161 I179 Y180 F184	I156-N182 PolarHBondContact O-ND2 2.96Å; N159-N182 VanDerWaalsContact CA-OD1 3.29Å; N159-N182 WeakPolarHBondContact CA-OD1 3.18Å; N159-N182 WeakPolarHBondContact CB-OD1 3.42Å; N159-N182 PolarHBondContact N-OD1 3.01Å; N159-N182 PolarHBondContact O-OD1 3.26Å; R160-N182 PolarHBondContact N-OD1 3.35Å; F161-N182 HydrophobicContact CB-CB 4.44Å; F161-N182 VanDerWaalsContact CD2-OD1 3.29Å; F161-N182 WeakPolarHBondContact CD2-OD1 3.5Å; F161-N182 PolarHBondContact N-OD1 3.35Å; F161-N182 VanDerWaalsContact N-OD1 3.12Å; I179-N182 PolarHBondContact O-ND2 3.18Å; Y180-N182 VanDerWaalsContact C-N 3.32Å; Y180-N182 PolarHBondContact O-N 3Å; N182-F184 HydrophobicContact CB-CD1 4.43Å; N182-F184 HydrophobicContact CB-CD2 4.1Å; N182-F184 HydrophobicContact CB-CE1 3.95Å; N182-F184 HydrophobicContact CB-CE2 3.6Å; N182-F184 HydrophobicContact CB-CG 4.49Å; N182-F184 HydrophobicContact CB-CZ 3.52Å; N182-F184 PolarHBondContact O-N 3.17Å
183	P	97	Very high	93.2	Very high	35 Å²	35	26.7 Å²	26.7	23%	0.227	16%	0.159	C	C	.	.			trans	-79.4	64.4	-173.9	34.6	-38.1	0	0	0	111.6	N159 F161 T162 T185 E213	N159-P183 WeakPolarHBondContact O-CD 3.4Å; F161-P183 WeakPolarHBondContact O-CD 3.15Å; T162-P183 WeakPolarHBondContact CA-O 3.35Å; P183-T185 PolarHBondContact O-N 3.48Å; P183-E213 HydrophobicContact CB-CB 3.94Å; P183-E213 HydrophobicContact CB-CG 3.97Å
184	F	96.9	Very high	93.5	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	131.8	-172.6	-67.9	-59.7	0	0	0	112.9	F161 T162 I164 I179 N182 C186 L190 I210 C212 E213 A214 V223	F161-F184 HydrophobicContact CB-CE1 4.45Å; T162-F184 WeakPolarHBondContact O-CA 3.19Å; I164-F184 HydrophobicContact CD1-CE1 4.14Å; I164-F184 HydrophobicContact CG1-CE1 3.88Å; I164-F184 HydrophobicContact CG1-CZ 4.39Å; I179-F184 HydrophobicContact CB-CZ 4.47Å; I179-F184 HydrophobicContact CD1-CE2 4.34Å; I179-F184 HydrophobicContact CD1-CZ 4.12Å; I179-F184 HydrophobicContact CG1-CE2 4.43Å; I179-F184 HydrophobicContact CG1-CZ 4.37Å; N182-F184 HydrophobicContact CB-CD1 4.43Å; N182-F184 HydrophobicContact CB-CD2 4.1Å; N182-F184 HydrophobicContact CB-CE1 3.95Å; N182-F184 HydrophobicContact CB-CE2 3.6Å; N182-F184 HydrophobicContact CB-CG 4.49Å; N182-F184 HydrophobicContact CB-CZ 3.52Å; N182-F184 PolarHBondContact O-N 3.17Å; F184-C186 PolarHBondContact O-N 2.97Å; F184-L190 HydrophobicContact CB-CD2 3.86Å; F184-L190 HydrophobicContact CD1-CD1 4.34Å; F184-L190 HydrophobicContact CG-CD2 4.31Å; F184-I210 HydrophobicContact CD2-CG2 4.17Å; F184-I210 HydrophobicContact CE2-CG2 3.87Å; F184-C212 WeakPolarHBondContact O-CA 3.06Å; F184-E213 PolarHBondContact O-N 3.03Å; F184-A214 PolarHBondContact O-N 2.96Å; F184-V223 HydrophobicContact CB-CG2 4.48Å; F184-V223 HydrophobicContact CD2-CG2 4.23Å
185	T	94.8	Very high	93.7	Very high	52 Å²	52	26.6 Å²	26.6	32%	0.319	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	103.2	166.3	-59.6	0	0	0	0	108.1	T162 P183 S187 A214	T162-T185 PolarHBondContact O-N 3.49Å; P183-T185 PolarHBondContact O-N 3.48Å; T185-S187 PolarHBondContact O-N 2.98Å; T185-A214 CarbonylContact C-O 3.6Å; T185-A214 WeakPolarHBondContact CA-O 3.36Å; T185-A214 HydrophobicContact CG2-CB 4.36Å
186	C	94.3	Very high	93.8	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.014	14%	0.137	C	C	.	.			trans	-80.3	83.9	-179.5	-68.1	0	0	0	0	111	F184 L190 C212 A214 P215 L218 I226	F184-C186 PolarHBondContact O-N 2.97Å; C186-L190 HydrophobicContact CB-CD2 4.47Å; C186-C212 HydrophobicContact CB-CB 3.78Å; C186-C212 WeakPolarHBondContact CB-SG 3.13Å; C186-C212 WeakPolarHBondContact SG-CA 2.96Å; C186-C212 WeakPolarHBondContact SG-CB 3.31Å; C186-C212 CovalentContact SG-SG 2.01Å; C186-C212 PolarHBondContact SG-SG 3.01Å; C186-A214 PolarHBondContact N-O 3.08Å; C186-P215 VanDerWaalsContact O-CD 3.25Å; C186-P215 WeakPolarHBondContact O-CD 3.47Å; C186-L218 HydrophobicContact CB-CB 4.48Å; C186-L218 HydrophobicContact CB-CD1 3.89Å; C186-L218 WeakPolarHBondContact O-CD1 3.37Å; C186-I226 HydrophobicContact CB-CD1 3.68Å; C186-I226 HydrophobicContact CB-CG1 4.07Å; C186-I226 WeakPolarHBondContact SG-CD1 3.35Å
187	S	91.6	Very high	93.9	Very high	16 Å²	16	23.5 Å²	23.5	11%	0.112	13%	0.128	C	C	.	.	S	Bend	trans	-123.3	-170	175.8	61.2	0	0	0	0	110.5	T185 S189 L190 E332	T185-S187 PolarHBondContact O-N 2.98Å; S187-S189 VanDerWaalsContact C-N 3.26Å; S187-S189 PolarHBondContact O-N 3.09Å; S187-S189 PolarHBondContact OG-OG 3.14Å; S187-L190 PolarHBondContact O-N 2.94Å; S187-E332 WeakPolarHBondContact CB-OE1 3.22Å; S187-E332 WeakPolarHBondContact CB-OE2 3.14Å; S187-E332 VanDerWaalsContact OG-CD 3.28Å; S187-E332 PolarHBondContact OG-OE1 2.87Å; S187-E332 PolarHBondContact OG-OE2 3.32Å
188	C	90.8	Very high	93.5	Very high	17 Å²	17	29.9 Å²	29.9	12%	0.115	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-62.3	-32	-177.9	-60.7	0	0	0	0	112.7	L190 E191 C231 E332 L333	C188-L190 PolarHBondContact O-N 3.25Å; C188-L190 VanDerWaalsContact O-N 3.16Å; C188-E191 PolarHBondContact O-N 2.95Å; C188-C231 HydrophobicContact CB-CB 3.76Å; C188-C231 WeakPolarHBondContact CB-SG 3.46Å; C188-C231 WeakPolarHBondContact SG-CB 3.48Å; C188-C231 CovalentContact SG-SG 2.02Å; C188-C231 PolarHBondContact SG-SG 3.09Å; C188-E332 WeakPolarHBondContact CA-OE1 3.25Å; C188-E332 WeakPolarHBondContact CB-OE1 3.32Å; C188-E332 PolarHBondContact N-OE1 2.87Å; C188-L333 HydrophobicContact CB-CD2 3.65Å
189	S	90.6	Very high	93.2	Very high	42 Å²	42	34.4 Å²	34.4	29%	0.294	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-66.1	-11.9	175.1	61.6	0	0	0	0	114.4	S187 W192 E332	S187-S189 VanDerWaalsContact C-N 3.26Å; S187-S189 PolarHBondContact O-N 3.09Å; S187-S189 PolarHBondContact OG-OG 3.14Å; S189-W192 PolarHBondContact O-NE1 3.04Å; S189-E332 WeakPolarHBondContact CB-OE2 3.26Å; S189-E332 PolarHBondContact N-OE1 2.97Å; S189-E332 PolarHBondContact N-OE2 3.07Å; S189-E332 PolarHBondContact OG-OE2 3.47Å
190	L	93	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-105.1	-4.1	178.4	-149.3	73.9	0	0	0	113.6	F184 C186 S187 C188 W192 L193 R194 V223 I226	F184-L190 HydrophobicContact CB-CD2 3.86Å; F184-L190 HydrophobicContact CD1-CD1 4.34Å; F184-L190 HydrophobicContact CG-CD2 4.31Å; C186-L190 HydrophobicContact CB-CD2 4.47Å; S187-L190 PolarHBondContact O-N 2.94Å; C188-L190 PolarHBondContact O-N 3.25Å; C188-L190 VanDerWaalsContact O-N 3.16Å; L190-W192 VanDerWaalsContact C-N 3.29Å; L190-W192 PolarHBondContact O-N 3.1Å; L190-L193 HydrophobicContact CD1-CB 4.29Å; L190-L193 HydrophobicContact CD1-CD2 3.75Å; L190-L193 HydrophobicContact CG-CB 4.22Å; L190-L193 HydrophobicContact CG-CD2 4.15Å; L190-L193 WeakPolarHBondContact O-CB 3.34Å; L190-L193 PolarHBondContact O-N 3.21Å; L190-R194 PolarHBondContact O-N 3.08Å; L190-V223 HydrophobicContact CD2-CG1 4.12Å; L190-V223 HydrophobicContact CD2-CG2 4.12Å; L190-I226 HydrophobicContact CD2-CD1 4.38Å
191	E	91.5	Very high	92.4	Very high	30 Å²	30	44.7 Å²	44.7	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-38.5	-179.6	-76	-142.9	129.2	0	0	112.7	C188 L193 R194 D195 K228 L229	C188-E191 PolarHBondContact O-N 2.95Å; E191-L193 PolarHBondContact O-N 3.46Å; E191-R194 VanDerWaalsContact CD-NH2 3.32Å; E191-R194 WeakPolarHBondContact O-CB 3.47Å; E191-R194 PolarHBondContact O-N 2.61Å; E191-R194 IonicContact OE1-CZ 2.72Å; E191-R194 IonicContact OE1-NH1 2.69Å; E191-R194 PolarHBondContact OE1-NH1 3.02Å; E191-R194 IonicContact OE1-NH2 3.42Å; E191-R194 PolarHBondContact OE1-NH2 2.98Å; E191-R194 IonicContact OE2-NH2 3.4Å; E191-D195 PolarHBondContact O-N 2.86Å; E191-D195 VanDerWaalsContact O-N 3.07Å; E191-K228 WeakPolarHBondContact OE1-CA 3.12Å; E191-L229 HydrophobicContact CG-CD1 4.4Å; E191-L229 PolarHBondContact OE1-N 3.02Å
192	W	92.6	Very high	92	Very high	36 Å²	36	44 Å²	44	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-32.5	176.5	81.1	-88.6	0	0	0	111.8	I164 V165 E166 F169 S189 L190 W196	I164-W192 HydrophobicContact CB-CZ2 3.91Å; I164-W192 HydrophobicContact CG2-CH2 4.19Å; I164-W192 HydrophobicContact CG2-CZ2 3.75Å; I164-W192 WeakPolarHBondContact O-CZ2 3.46Å; I164-W192 PolarHBondContact O-NE1 3.25Å; V165-W192 WeakPolarHBondContact O-CZ2 3.37Å; E166-W192 HydrophobicContact CB-CB 4.32Å; E166-W192 HydrophobicContact CB-CD2 4.12Å; E166-W192 HydrophobicContact CB-CG 3.75Å; E166-W192 HydrophobicContact CG-CB 3.93Å; E166-W192 HydrophobicContact CG-CD2 4.1Å; E166-W192 HydrophobicContact CG-CG 3.77Å; F169-W192 AromaticContact CD2-CH2 3.78Å; F169-W192 HydrophobicContact CD2-CH2 3.78Å; F169-W192 HydrophobicContact CD2-CZ3 4.31Å; F169-W192 HydrophobicContact CE2-CH2 4.02Å; S189-W192 PolarHBondContact O-NE1 3.04Å; L190-W192 VanDerWaalsContact C-N 3.29Å; L190-W192 PolarHBondContact O-N 3.1Å; W192-W196 HydrophobicContact CE3-CB 4.04Å; W192-W196 HydrophobicContact CE3-CG 4.39Å; W192-W196 HydrophobicContact CZ3-CB 4.09Å; W192-W196 HydrophobicContact CZ3-CD2 4.5Å; W192-W196 HydrophobicContact CZ3-CG 4.01Å; W192-W196 WeakPolarHBondContact O-CB 3.39Å; W192-W196 PolarHBondContact O-N 3.3Å
193	L	93.9	Very high	91.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-77.3	-35.3	-178.3	-176.3	65.2	0	0	0	111.2	I164 F169 I179 L190 E191 W196 I197 V223	I164-L193 HydrophobicContact CB-CD2 4.46Å; I164-L193 HydrophobicContact CG1-CD2 4.16Å; F169-L193 HydrophobicContact CE2-CD1 4.32Å; I179-L193 HydrophobicContact CD1-CD1 4.15Å; I179-L193 HydrophobicContact CD1-CD2 4.04Å; L190-L193 HydrophobicContact CD1-CB 4.29Å; L190-L193 HydrophobicContact CD1-CD2 3.75Å; L190-L193 HydrophobicContact CG-CB 4.22Å; L190-L193 HydrophobicContact CG-CD2 4.15Å; L190-L193 WeakPolarHBondContact O-CB 3.34Å; L190-L193 PolarHBondContact O-N 3.21Å; E191-L193 PolarHBondContact O-N 3.46Å; L193-W196 HydrophobicContact CD1-CE3 4.27Å; L193-I197 HydrophobicContact CD1-CD1 4.24Å; L193-I197 HydrophobicContact CD1-CG1 4.32Å; L193-I197 HydrophobicContact CG-CD1 3.98Å; L193-I197 HydrophobicContact CG-CG1 4.48Å; L193-I197 WeakPolarHBondContact O-CB 3.44Å; L193-I197 WeakPolarHBondContact O-CD1 3.1Å; L193-I197 WeakPolarHBondContact O-CG1 3.18Å; L193-I197 PolarHBondContact O-N 2.97Å; L193-V223 HydrophobicContact CD2-CG1 4.45Å; L193-V223 HydrophobicContact CG-CG1 4.39Å
194	R	92.9	Very high	91.2	Very high	14 Å²	14	45.8 Å²	45.8	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-58.6	166.2	172.8	-165.8	67.2	-136.6	-12.7	109.6	L190 E191 W196 I197 E198 V223 I226	L190-R194 PolarHBondContact O-N 3.08Å; E191-R194 VanDerWaalsContact CD-NH2 3.32Å; E191-R194 WeakPolarHBondContact O-CB 3.47Å; E191-R194 PolarHBondContact O-N 2.61Å; E191-R194 IonicContact OE1-CZ 2.72Å; E191-R194 IonicContact OE1-NH1 2.69Å; E191-R194 PolarHBondContact OE1-NH1 3.02Å; E191-R194 IonicContact OE1-NH2 3.42Å; E191-R194 PolarHBondContact OE1-NH2 2.98Å; E191-R194 IonicContact OE2-NH2 3.4Å; R194-W196 VanDerWaalsContact C-N 3.27Å; R194-W196 PolarHBondContact O-N 3.12Å; R194-I197 PolarHBondContact O-N 3.5Å; R194-E198 PolarHBondContact O-N 3.06Å; R194-V223 VanDerWaalsContact CB-O 3.31Å; R194-V223 WeakPolarHBondContact CB-O 3.38Å; R194-V223 VanDerWaalsContact CG-O 3.31Å; R194-V223 WeakPolarHBondContact CG-O 3.42Å; R194-I226 WeakPolarHBondContact CD-O 3.36Å; R194-I226 PolarHBondContact NH1-O 3.2Å
195	D	91.9	Very high	90.8	Very high	68 Å²	68	47 Å²	47	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-34.9	-173.8	-62.9	-11.6	0	0	0	111.3	E191 T199	E191-D195 PolarHBondContact O-N 2.86Å; E191-D195 VanDerWaalsContact O-N 3.07Å; D195-T199 WeakPolarHBondContact O-CB 3.13Å; D195-T199 WeakPolarHBondContact O-CG2 3.49Å; D195-T199 PolarHBondContact O-N 3.24Å; D195-T199 PolarHBondContact O-OG1 3.12Å
196	W	92.6	Very high	90.4	Very high	49 Å²	49	48.7 Å²	48.7	19%	0.186	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-41.7	174.9	-175.4	94	0	0	0	112.9	F169 L177 W192 L193 R194 E198 T199 T200 I202 V204	F169-W196 HydrophobicContact CD2-CH2 4.27Å; F169-W196 HydrophobicContact CD2-CZ2 4.13Å; L177-W196 HydrophobicContact CD2-CH2 3.46Å; L177-W196 VanDerWaalsContact CD2-CH2 3.46Å; L177-W196 HydrophobicContact CD2-CZ2 4.49Å; L177-W196 HydrophobicContact CD2-CZ3 3.78Å; W192-W196 HydrophobicContact CE3-CB 4.04Å; W192-W196 HydrophobicContact CE3-CG 4.39Å; W192-W196 HydrophobicContact CZ3-CB 4.09Å; W192-W196 HydrophobicContact CZ3-CD2 4.5Å; W192-W196 HydrophobicContact CZ3-CG 4.01Å; W192-W196 WeakPolarHBondContact O-CB 3.39Å; W192-W196 PolarHBondContact O-N 3.3Å; L193-W196 HydrophobicContact CD1-CE3 4.27Å; R194-W196 VanDerWaalsContact C-N 3.27Å; R194-W196 PolarHBondContact O-N 3.12Å; W196-E198 VanDerWaalsContact C-N 3.28Å; W196-E198 PolarHBondContact O-N 2.62Å; W196-T199 PolarHBondContact O-N 3.08Å; W196-T200 HydrophobicContact CD2-CG2 4.46Å; W196-T200 HydrophobicContact CE3-CG2 4.13Å; W196-T200 HydrophobicContact CH2-CG2 4.2Å; W196-T200 HydrophobicContact CZ3-CG2 3.98Å; W196-T200 WeakPolarHBondContact O-CB 3.25Å; W196-T200 VanDerWaalsContact O-CG2 3.31Å; W196-T200 WeakPolarHBondContact O-CG2 3.24Å; W196-T200 PolarHBondContact O-N 2.84Å; W196-I202 HydrophobicContact CH2-CD1 4.13Å; W196-I202 HydrophobicContact CZ2-CD1 3.62Å; W196-V204 HydrophobicContact CH2-CG2 4.39Å; W196-V204 HydrophobicContact CZ3-CG2 4.07Å
197	I	91.4	Very high	90.1	Very high	22 Å²	22	51.3 Å²	51.3	11%	0.113	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-35.6	178.1	-72.6	165.9	0	0	0	111.2	I179 L193 R194 I210 V223	I179-I197 HydrophobicContact CD1-CD1 4.42Å; L193-I197 HydrophobicContact CD1-CD1 4.24Å; L193-I197 HydrophobicContact CD1-CG1 4.32Å; L193-I197 HydrophobicContact CG-CD1 3.98Å; L193-I197 HydrophobicContact CG-CG1 4.48Å; L193-I197 WeakPolarHBondContact O-CB 3.44Å; L193-I197 WeakPolarHBondContact O-CD1 3.1Å; L193-I197 WeakPolarHBondContact O-CG1 3.18Å; L193-I197 PolarHBondContact O-N 2.97Å; R194-I197 PolarHBondContact O-N 3.5Å; I197-I210 HydrophobicContact CD1-CD1 3.91Å; I197-I210 HydrophobicContact CD1-CG2 4.04Å; I197-V223 HydrophobicContact CD1-CB 4.5Å; I197-V223 HydrophobicContact CD1-CG1 4.11Å
198	E	87.1	Confident	89.9	Confident	134 Å²	134	53.7 Å²	53.7	63%	0.626	29%	0.286	S	S	*	.	H	α-helix	trans	-76.9	-28.6	177.7	-63.4	-158.2	130.2	0	0	113.9	R194 W196	R194-E198 PolarHBondContact O-N 3.06Å; W196-E198 VanDerWaalsContact C-N 3.28Å; W196-E198 PolarHBondContact O-N 2.62Å
199	T	89.1	Confident	90.1	Very high	112 Å²	112	56.2 Å²	56.2	69%	0.687	30%	0.296	S	S	*	.	H	α-helix	trans	-105.1	-12.1	-172.6	58	0	0	0	0	114.9	D195 W196	D195-T199 WeakPolarHBondContact O-CB 3.13Å; D195-T199 WeakPolarHBondContact O-CG2 3.49Å; D195-T199 PolarHBondContact O-N 3.24Å; D195-T199 PolarHBondContact O-OG1 3.12Å; W196-T199 PolarHBondContact O-N 3.08Å
200	T	88	Confident	90.3	Very high	36 Å²	36	54.3 Å²	54.3	22%	0.221	28%	0.283	C	S	.	.			trans	-70.2	148.2	-176.5	-169.2	0	0	0	0	113.2	W196 I202 V204	W196-T200 HydrophobicContact CD2-CG2 4.46Å; W196-T200 HydrophobicContact CE3-CG2 4.13Å; W196-T200 HydrophobicContact CH2-CG2 4.2Å; W196-T200 HydrophobicContact CZ3-CG2 3.98Å; W196-T200 WeakPolarHBondContact O-CB 3.25Å; W196-T200 VanDerWaalsContact O-CG2 3.31Å; W196-T200 WeakPolarHBondContact O-CG2 3.24Å; W196-T200 PolarHBondContact O-N 2.84Å; T200-I202 WeakPolarHBondContact OG1-CB 3.32Å; T200-I202 PolarHBondContact OG1-N 2.89Å; T200-V204 HydrophobicContact CG2-CG2 4.2Å
201	K	86.4	Confident	90.5	Very high	213 Å²	213	57.4 Å²	57.4	93%	0.926	30%	0.299	S	S	*	.			trans	-94.4	-0.1	171.8	-62.7	179.5	-178.9	176.5	0	112.8
202	I	88.1	Confident	90.7	Very high	37 Å²	37	56.1 Å²	56.1	19%	0.19	29%	0.293	C	S	.	.	S	Bend	trans	-80.6	142.3	-177.2	-64.7	162.3	0	0	0	109	L174 L177 W196 T200 V204	L174-I202 HydrophobicContact CB-CD1 4.1Å; L174-I202 HydrophobicContact CB-CG1 4.41Å; L174-I202 HydrophobicContact CB-CG2 4Å; L177-I202 HydrophobicContact CB-CG2 4.15Å; W196-I202 HydrophobicContact CH2-CD1 4.13Å; W196-I202 HydrophobicContact CZ2-CD1 3.62Å; T200-I202 WeakPolarHBondContact OG1-CB 3.32Å; T200-I202 PolarHBondContact OG1-N 2.89Å; I202-V204 PolarHBondContact O-N 2.85Å; I202-V204 VanDerWaalsContact O-N 3.12Å
203	S	88.9	Confident	90.9	Very high	58 Å²	58	58.8 Å²	58.8	41%	0.406	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-67.8	112.4	173.8	-173.9	0	0	0	0	109.8	S175 H176 L177	S175-S203 VanDerWaalsContact O-CB 3.23Å; S175-S203 WeakPolarHBondContact O-CB 3.48Å; S175-S203 PolarHBondContact O-N 3.29Å; H176-S203 WeakPolarHBondContact CA-O 3.34Å; H176-S203 VanDerWaalsContact CE1-CB 3.48Å; H176-S203 WeakPolarHBondContact CE1-CB 3.32Å; H176-S203 PolarHBondContact CE1-OG 3.38Å; L177-S203 PolarHBondContact N-O 3.03Å
204	V	89.6	Confident	90.9	Very high	24 Å²	24	60.2 Å²	60.2	15%	0.145	32%	0.318	C	S	.	.			trans	-113.3	96.3	172.2	-177.4	0	0	0	0	108.1	W196 T200 I202 I210	W196-V204 HydrophobicContact CH2-CG2 4.39Å; W196-V204 HydrophobicContact CZ3-CG2 4.07Å; T200-V204 HydrophobicContact CG2-CG2 4.2Å; I202-V204 PolarHBondContact O-N 2.85Å; I202-V204 VanDerWaalsContact O-N 3.12Å; V204-I210 HydrophobicContact CG1-CD1 3.71Å
205	P	87.1	Confident	90.9	Very high	26 Å²	26	61.5 Å²	61.5	17%	0.169	33%	0.329	C	S	.	.	S	Bend	trans	-66.1	150.7	177.1	-18.7	31.8	0	0	0	112.1	H176 L177 Q178	H176-P205 WeakPolarHBondContact NE2-CG 3.44Å; L177-P205 VanDerWaalsContact O-CD 3.22Å; L177-P205 WeakPolarHBondContact O-CD 3.3Å; Q178-P205 HydrophobicContact CG-CG 3.92Å
206	E	87.5	Confident	90.8	Very high	86 Å²	86	65 Å²	65	40%	0.402	34%	0.343	S	S	.	.			trans	50.5	48.9	172.7	-60	175.4	-98.5	0	0	114	Y180 S208 Q209	Y180-E206 HydrophobicContact CD1-CB 4.2Å; Y180-E206 HydrophobicContact CE1-CB 4.48Å; E206-S208 PolarHBondContact O-N 2.69Å; E206-Q209 HydrophobicContact CB-CG 4.47Å; E206-Q209 PolarHBondContact O-N 3.22Å; E206-Q209 PolarHBondContact OE2-NE2 2.82Å
207	P	87	Confident	90.7	Very high	57 Å²	57	69.9 Å²	69.9	37%	0.37	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-62.7	-19.8	-178.3	28.8	-36	0	0	0	112.6	Q209 I210	P207-Q209 PolarHBondContact O-N 2.78Å; P207-I210 HydrophobicContact CB-CD1 4.38Å; P207-I210 PolarHBondContact O-N 3.22Å
208	S	89	Confident	90.7	Very high	66 Å²	66	69.5 Å²	69.5	46%	0.462	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-65.9	-15.7	171.8	48.2	0	0	0	0	114.7	E206 L211 Q222	E206-S208 PolarHBondContact O-N 2.69Å; S208-L211 WeakPolarHBondContact O-CD2 3.22Å; S208-Q222 PolarHBondContact O-NE2 2.77Å
209	Q	93.4	Very high	91.1	Very high	71 Å²	71	67 Å²	67	33%	0.332	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-101.8	4.3	174.5	-65.4	178	23.3	0	0	113.1	Y180 S181 E206 P207 L211	Y180-Q209 HydrophobicContact CG-CB 4.33Å; S181-Q209 PolarHBondContact N-O 3.04Å; S181-Q209 VanDerWaalsContact N-O 3.1Å; E206-Q209 HydrophobicContact CB-CG 4.47Å; E206-Q209 PolarHBondContact O-N 3.22Å; E206-Q209 PolarHBondContact OE2-NE2 2.82Å; P207-Q209 PolarHBondContact O-N 2.78Å; Q209-L211 PolarHBondContact O-N 2.73Å
210	I	95.5	Very high	91.4	Very high	2 Å²	2	64 Å²	64	1%	0.01	34%	0.344	C	S	.	.			trans	-85.2	86.6	169	-52.3	175.4	0	0	0	106.5	I179 F184 I197 V204 P207 Q222 V223	I179-I210 HydrophobicContact CD1-CD1 4.17Å; I179-I210 HydrophobicContact CD1-CG2 4.12Å; I179-I210 HydrophobicContact CG1-CD1 3.76Å; I179-I210 HydrophobicContact CG1-CG1 4.06Å; I179-I210 HydrophobicContact CG1-CG2 4.19Å; F184-I210 HydrophobicContact CD2-CG2 4.17Å; F184-I210 HydrophobicContact CE2-CG2 3.87Å; I197-I210 HydrophobicContact CD1-CD1 3.91Å; I197-I210 HydrophobicContact CD1-CG2 4.04Å; V204-I210 HydrophobicContact CG1-CD1 3.71Å; P207-I210 HydrophobicContact CB-CD1 4.38Å; P207-I210 PolarHBondContact O-N 3.22Å; I210-Q222 CarbonylContact O-C 3.59Å; I210-Q222 WeakPolarHBondContact O-CA 3.39Å; I210-V223 HydrophobicContact CG2-CB 3.81Å; I210-V223 HydrophobicContact CG2-CG2 3.77Å; I210-V223 PolarHBondContact O-N 2.9Å
211	L	96.5	Very high	91.8	Very high	65 Å²	65	64.6 Å²	64.6	34%	0.34	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-109.9	151.8	-171.2	-59	-177.1	0	0	0	112.7	S208 Q209 V221 Q222	S208-L211 WeakPolarHBondContact O-CD2 3.22Å; Q209-L211 PolarHBondContact O-N 2.73Å; L211-V221 CarbonylContact C-O 3.59Å; L211-V221 WeakPolarHBondContact CA-O 3.49Å; L211-Q222 HydrophobicContact CD2-CB 4.35Å; L211-Q222 HydrophobicContact CD2-CG 3.53Å
212	C	97	Very high	92.2	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.014	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.9	166.7	-58.5	0	0	0	0	110.8	F184 C186 L218 K219 G220 V221	F184-C212 WeakPolarHBondContact O-CA 3.06Å; C186-C212 HydrophobicContact CB-CB 3.78Å; C186-C212 WeakPolarHBondContact CB-SG 3.13Å; C186-C212 WeakPolarHBondContact SG-CA 2.96Å; C186-C212 WeakPolarHBondContact SG-CB 3.31Å; C186-C212 CovalentContact SG-SG 2.01Å; C186-C212 PolarHBondContact SG-SG 3.01Å; C212-L218 HydrophobicContact CB-CB 4.33Å; C212-L218 WeakPolarHBondContact CB-O 3.37Å; C212-K219 WeakPolarHBondContact O-CA 3.43Å; C212-G220 PolarHBondContact O-N 2.92Å; C212-V221 PolarHBondContact N-O 3.37Å; C212-V221 PolarHBondContact SG-O 2.79Å; C212-V221 VanDerWaalsContact SG-O 3.39Å
213	E	97	Very high	92.5	Very high	93 Å²	93	55.1 Å²	55.1	44%	0.435	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-26.7	169.6	175.6	54.8	-159.3	0	0	111.7	P183 F184 K219	P183-E213 HydrophobicContact CB-CB 3.94Å; P183-E213 HydrophobicContact CB-CG 3.97Å; F184-E213 PolarHBondContact O-N 3.03Å; E213-K219 WeakPolarHBondContact O-CG 3.21Å; E213-K219 PolarHBondContact O-NZ 2.9Å; E213-K219 VanDerWaalsContact OE1-CE 3.25Å; E213-K219 WeakPolarHBondContact OE1-CE 3.1Å; E213-K219 IonicContact OE1-NZ 3.56Å; E213-K219 PolarHBondContact OE1-NZ 2.64Å; E213-K219 WeakPolarHBondContact OE2-CE 3.38Å; E213-K219 IonicContact OE2-NZ 3.62Å
214	A	93.4	Very high	92.7	Very high	29 Å²	29	53.4 Å²	53.4	24%	0.24	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	162.9	173.9	0	0	0	0	0	110.1	F184 T185 C186	F184-A214 PolarHBondContact O-N 2.96Å; T185-A214 CarbonylContact C-O 3.6Å; T185-A214 WeakPolarHBondContact CA-O 3.36Å; T185-A214 HydrophobicContact CG2-CB 4.36Å; C186-A214 PolarHBondContact N-O 3.08Å
215	P	91.9	Very high	92.8	Very high	42 Å²	42	58.9 Å²	58.9	27%	0.273	32%	0.315	S	S	.	.	S	Bend	cis	-65.8	163.4	-15.1	31.6	-37	0	0	0	111.7	C186 H217 L218 K219	C186-P215 VanDerWaalsContact O-CD 3.25Å; C186-P215 WeakPolarHBondContact O-CD 3.47Å; P215-H217 WeakPolarHBondContact CG-CE1 3.44Å; P215-H217 PolarHBondContact O-N 2.98Å; P215-L218 HydrophobicContact CG-CB 4.42Å; P215-L218 HydrophobicContact CG-CD1 4.31Å; P215-L218 HydrophobicContact CG-CG 4.38Å; P215-L218 CarbonylContact O-C 3.53Å; P215-L218 PolarHBondContact O-N 2.96Å; P215-K219 PolarHBondContact O-N 3.43Å
216	E	90.8	Very high	93.1	Very high	140 Å²	140	57.9 Å²	57.9	65%	0.654	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-53	-32.1	-174.9	-68.7	-62.9	131.2	0	0	114.3	L218 K219	E216-L218 VanDerWaalsContact C-N 3.27Å; E216-L218 PolarHBondContact O-N 3.17Å; E216-K219 WeakPolarHBondContact O-CB 3.24Å; E216-K219 PolarHBondContact O-N 3.31Å; E216-K219 IonicContact OE1-NZ 2.94Å; E216-K219 PolarHBondContact OE1-NZ 3.26Å; E216-K219 IonicContact OE2-NZ 3.91Å
217	H	89.4	Confident	93.2	Very high	153 Å²	153	57.5 Å²	57.5	71%	0.708	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-76.6	-7.7	178	69.1	-97	0	0	0	114.8	P215	P215-H217 WeakPolarHBondContact CG-CE1 3.44Å; P215-H217 PolarHBondContact O-N 2.98Å
218	L	92.6	Very high	93.2	Very high	13 Å²	13	62.9 Å²	62.9	7%	0.068	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-115.5	3	170.5	-65.8	179.1	0	0	0	112.3	C186 C212 P215 E216 G220 V221 I226 P227	C186-L218 HydrophobicContact CB-CB 4.48Å; C186-L218 HydrophobicContact CB-CD1 3.89Å; C186-L218 WeakPolarHBondContact O-CD1 3.37Å; C212-L218 HydrophobicContact CB-CB 4.33Å; C212-L218 WeakPolarHBondContact CB-O 3.37Å; P215-L218 HydrophobicContact CG-CB 4.42Å; P215-L218 HydrophobicContact CG-CD1 4.31Å; P215-L218 HydrophobicContact CG-CG 4.38Å; P215-L218 CarbonylContact O-C 3.53Å; P215-L218 PolarHBondContact O-N 2.96Å; E216-L218 VanDerWaalsContact C-N 3.27Å; E216-L218 PolarHBondContact O-N 3.17Å; L218-G220 PolarHBondContact O-N 3.25Å; L218-V221 HydrophobicContact CD2-CG2 4.46Å; L218-V221 WeakPolarHBondContact O-CB 3.34Å; L218-V221 VanDerWaalsContact O-CG2 3.25Å; L218-V221 WeakPolarHBondContact O-CG2 3.39Å; L218-V221 PolarHBondContact O-N 3.27Å; L218-I226 HydrophobicContact CD1-CG2 4.16Å; L218-P227 HydrophobicContact CD2-CG 4.42Å
219	K	95.8	Very high	93.2	Very high	82 Å²	82	61.8 Å²	61.8	36%	0.357	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	128.1	-175.9	-166.8	-179.1	-153.9	90.1	0	111.4	C212 E213 P215 E216 V221	C212-K219 WeakPolarHBondContact O-CA 3.43Å; E213-K219 WeakPolarHBondContact O-CG 3.21Å; E213-K219 PolarHBondContact O-NZ 2.9Å; E213-K219 VanDerWaalsContact OE1-CE 3.25Å; E213-K219 WeakPolarHBondContact OE1-CE 3.1Å; E213-K219 IonicContact OE1-NZ 3.56Å; E213-K219 PolarHBondContact OE1-NZ 2.64Å; E213-K219 WeakPolarHBondContact OE2-CE 3.38Å; E213-K219 IonicContact OE2-NZ 3.62Å; P215-K219 PolarHBondContact O-N 3.43Å; E216-K219 WeakPolarHBondContact O-CB 3.24Å; E216-K219 PolarHBondContact O-N 3.31Å; E216-K219 IonicContact OE1-NZ 2.94Å; E216-K219 PolarHBondContact OE1-NZ 3.26Å; E216-K219 IonicContact OE2-NZ 3.91Å; K219-V221 VanDerWaalsContact C-N 3.3Å; K219-V221 PolarHBondContact O-N 2.81Å
220	G	94.9	Very high	92.9	Very high	49 Å²	49	66.7 Å²	66.7	51%	0.505	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-1.4	-175.2	0	0	0	0	0	115.5	C212 L218	C212-G220 PolarHBondContact O-N 2.92Å; L218-G220 PolarHBondContact O-N 3.25Å
221	V	95.1	Very high	92.7	Very high	48 Å²	48	68.7 Å²	68.7	29%	0.291	36%	0.357	S	S	.	.			trans	-74.2	143.2	172.7	-179.6	0	0	0	0	109.8	L211 C212 L218 K219 K225	L211-V221 CarbonylContact C-O 3.59Å; L211-V221 WeakPolarHBondContact CA-O 3.49Å; C212-V221 PolarHBondContact N-O 3.37Å; C212-V221 PolarHBondContact SG-O 2.79Å; C212-V221 VanDerWaalsContact SG-O 3.39Å; L218-V221 HydrophobicContact CD2-CG2 4.46Å; L218-V221 WeakPolarHBondContact O-CB 3.34Å; L218-V221 VanDerWaalsContact O-CG2 3.25Å; L218-V221 WeakPolarHBondContact O-CG2 3.39Å; L218-V221 PolarHBondContact O-N 3.27Å; K219-V221 VanDerWaalsContact C-N 3.3Å; K219-V221 PolarHBondContact O-N 2.81Å; V221-K225 HydrophobicContact CG1-CB 4.46Å
222	Q	95.3	Very high	92.5	Very high	51 Å²	51	71 Å²	71	24%	0.238	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-72.4	136.7	174.7	-73.7	165.2	-4.8	0	0	110.4	S208 I210 L211 S224 K225 I226	S208-Q222 PolarHBondContact O-NE2 2.77Å; I210-Q222 CarbonylContact O-C 3.59Å; I210-Q222 WeakPolarHBondContact O-CA 3.39Å; L211-Q222 HydrophobicContact CD2-CB 4.35Å; L211-Q222 HydrophobicContact CD2-CG 3.53Å; Q222-S224 VanDerWaalsContact C-N 3.29Å; Q222-S224 PolarHBondContact O-N 2.93Å; Q222-K225 HydrophobicContact CB-CB 4.37Å; Q222-K225 HydrophobicContact CB-CD 4.31Å; Q222-K225 HydrophobicContact CB-CG 4.39Å; Q222-K225 CarbonylContact O-C 3.51Å; Q222-K225 WeakPolarHBondContact O-CA 3.3Å; Q222-K225 PolarHBondContact O-N 2.66Å; Q222-I226 PolarHBondContact O-N 2.91Å
223	V	95.3	Very high	92.3	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-58.9	-39	-175.4	169.8	0	0	0	0	112.2	F184 L190 L193 R194 I197 I210 K225 I226	F184-V223 HydrophobicContact CB-CG2 4.48Å; F184-V223 HydrophobicContact CD2-CG2 4.23Å; L190-V223 HydrophobicContact CD2-CG1 4.12Å; L190-V223 HydrophobicContact CD2-CG2 4.12Å; L193-V223 HydrophobicContact CD2-CG1 4.45Å; L193-V223 HydrophobicContact CG-CG1 4.39Å; R194-V223 VanDerWaalsContact CB-O 3.31Å; R194-V223 WeakPolarHBondContact CB-O 3.38Å; R194-V223 VanDerWaalsContact CG-O 3.31Å; R194-V223 WeakPolarHBondContact CG-O 3.42Å; I197-V223 HydrophobicContact CD1-CB 4.5Å; I197-V223 HydrophobicContact CD1-CG1 4.11Å; I210-V223 HydrophobicContact CG2-CB 3.81Å; I210-V223 HydrophobicContact CG2-CG2 3.77Å; I210-V223 PolarHBondContact O-N 2.9Å; V223-K225 PolarHBondContact O-N 2.84Å; V223-K225 VanDerWaalsContact O-N 3.14Å; V223-I226 HydrophobicContact CB-CD1 4.23Å; V223-I226 HydrophobicContact CG1-CD1 3.94Å; V223-I226 HydrophobicContact CG2-CD1 4.42Å; V223-I226 VanDerWaalsContact O-CD1 3.28Å; V223-I226 WeakPolarHBondContact O-CD1 3.46Å; V223-I226 VanDerWaalsContact O-CG1 3.27Å; V223-I226 WeakPolarHBondContact O-CG1 3.25Å; V223-I226 PolarHBondContact O-N 3.17Å
224	S	92.6	Very high	92.2	Very high	22 Å²	22	70 Å²	70	15%	0.154	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-62.8	-16.2	173.1	50.2	0	0	0	0	114.4	Q222	Q222-S224 VanDerWaalsContact C-N 3.29Å; Q222-S224 PolarHBondContact O-N 2.93Å
225	K	92.6	Very high	92.3	Very high	139 Å²	139	72.9 Å²	72.9	60%	0.604	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-110.7	13	-177.8	-63	178.7	-178.3	159.8	0	113.7	V221 Q222 V223	V221-K225 HydrophobicContact CG1-CB 4.46Å; Q222-K225 HydrophobicContact CB-CB 4.37Å; Q222-K225 HydrophobicContact CB-CD 4.31Å; Q222-K225 HydrophobicContact CB-CG 4.39Å; Q222-K225 CarbonylContact O-C 3.51Å; Q222-K225 WeakPolarHBondContact O-CA 3.3Å; Q222-K225 PolarHBondContact O-N 2.66Å; V223-K225 PolarHBondContact O-N 2.84Å; V223-K225 VanDerWaalsContact O-N 3.14Å
226	I	92.1	Very high	92.5	Very high	6 Å²	6	71 Å²	71	3%	0.031	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-61.7	122.4	171.7	-61.5	160.4	0	0	0	108.3	C186 L190 R194 L218 Q222 V223 L229	C186-I226 HydrophobicContact CB-CD1 3.68Å; C186-I226 HydrophobicContact CB-CG1 4.07Å; C186-I226 WeakPolarHBondContact SG-CD1 3.35Å; L190-I226 HydrophobicContact CD2-CD1 4.38Å; R194-I226 WeakPolarHBondContact CD-O 3.36Å; R194-I226 PolarHBondContact NH1-O 3.2Å; L218-I226 HydrophobicContact CD1-CG2 4.16Å; Q222-I226 PolarHBondContact O-N 2.91Å; V223-I226 HydrophobicContact CB-CD1 4.23Å; V223-I226 HydrophobicContact CG1-CD1 3.94Å; V223-I226 HydrophobicContact CG2-CD1 4.42Å; V223-I226 VanDerWaalsContact O-CD1 3.28Å; V223-I226 WeakPolarHBondContact O-CD1 3.46Å; V223-I226 VanDerWaalsContact O-CG1 3.27Å; V223-I226 WeakPolarHBondContact O-CG1 3.25Å; V223-I226 PolarHBondContact O-N 3.17Å; I226-L229 HydrophobicContact CG2-CD1 4.36Å; I226-L229 HydrophobicContact CG2-CD2 4.38Å; I226-L229 HydrophobicContact CG2-CG 4.27Å
227	P	90.2	Very high	92.7	Very high	78 Å²	78	66.8 Å²	66.8	51%	0.506	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-60.5	148.2	176.6	28	-35.6	0	0	0	110.3	L218 L229	L218-P227 HydrophobicContact CD2-CG 4.42Å; P227-L229 WeakPolarHBondContact O-CD2 3.23Å; P227-L229 PolarHBondContact O-N 2.96Å; P227-L229 VanDerWaalsContact O-N 3.09Å
228	K	87.6	Confident	92.9	Very high	169 Å²	169	60.1 Å²	60.1	74%	0.735	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-60	118.6	-179.8	-171.8	161.2	-172.4	157.7	0	110.8	E191	E191-K228 WeakPolarHBondContact OE1-CA 3.12Å
229	L	87.6	Confident	92.9	Very high	44 Å²	44	62.1 Å²	62.1	23%	0.23	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-82	152.4	-173.2	-59.6	179.6	0	0	0	110.5	E191 I226 P227	E191-L229 HydrophobicContact CG-CD1 4.4Å; E191-L229 PolarHBondContact OE1-N 3.02Å; I226-L229 HydrophobicContact CG2-CD1 4.36Å; I226-L229 HydrophobicContact CG2-CD2 4.38Å; I226-L229 HydrophobicContact CG2-CG 4.27Å; P227-L229 WeakPolarHBondContact O-CD2 3.23Å; P227-L229 PolarHBondContact O-N 2.96Å; P227-L229 VanDerWaalsContact O-N 3.09Å
230	Q	88.8	Confident	92.8	Very high	173 Å²	173	60.5 Å²	60.5	81%	0.808	33%	0.33	S	S	*	.			trans	-97.4	104	170.7	-65.9	-176	18.7	0	0	107.7	S264	Q230-S264 WeakPolarHBondContact O-CB 3.25Å; Q230-S264 PolarHBondContact O-OG 2.86Å
231	C	90.9	Very high	92.6	Very high	44 Å²	44	66.8 Å²	66.8	30%	0.297	34%	0.338	S	S	.	.			trans	-109.1	127.3	-168.5	-60.4	0	0	0	0	110.4	C188 L333	C188-C231 HydrophobicContact CB-CB 3.76Å; C188-C231 WeakPolarHBondContact CB-SG 3.46Å; C188-C231 WeakPolarHBondContact SG-CB 3.48Å; C188-C231 CovalentContact SG-SG 2.02Å; C188-C231 PolarHBondContact SG-SG 3.09Å; C231-L333 HydrophobicContact CB-CD1 4.47Å; C231-L333 HydrophobicContact CB-CD2 4.3Å; C231-L333 HydrophobicContact CB-CG 4.42Å
232	E	92.3	Very high	92.2	Very high	115 Å²	115	66.6 Å²	66.6	54%	0.537	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127	-175.6	-66.6	-171	166.7	0	0	110.6	S264 N331	E232-S264 PolarHBondContact N-O 2.63Å; E232-S264 PolarHBondContact O-N 2.83Å; E232-N331 PolarHBondContact O-ND2 2.89Å
233	A	92.8	Very high	91.8	Very high	61 Å²	61	67.4 Å²	67.4	50%	0.504	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	150.2	167	0	0	0	0	0	110.6	L333	A233-L333 HydrophobicContact CB-CB 4.13Å
234	P	95.1	Very high	91.3	Very high	12 Å²	12	68.9 Å²	68.9	8%	0.078	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	147.2	-171.8	29.7	-34.6	0	0	0	111.3	K262 P267 A329 N331 G334 A336	P234-K262 CarbonylContact C-O 3.57Å; P234-K262 VanDerWaalsContact CA-O 3.23Å; P234-K262 WeakPolarHBondContact CA-O 3.44Å; P234-P267 HydrophobicContact CB-CB 3.96Å; P234-P267 HydrophobicContact CB-CG 4.16Å; P234-A329 HydrophobicContact CB-CB 4.14Å; P234-A329 WeakPolarHBondContact CG-O 3.31Å; P234-N331 WeakPolarHBondContact CD-OD1 3Å; P234-G334 WeakPolarHBondContact CD-O 3.48Å; P234-G334 VanDerWaalsContact CG-O 3.31Å; P234-G334 WeakPolarHBondContact CG-O 3.43Å; P234-A336 HydrophobicContact CB-CB 4.43Å; P234-A336 HydrophobicContact CG-CB 4.14Å; P234-A336 WeakPolarHBondContact O-CB 3.47Å
235	N	95.2	Very high	90.8	Very high	90 Å²	90	75.3 Å²	75.3	48%	0.481	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.6	171.7	-172.3	-4	0	0	0	109.1	T261 K262	N235-T261 WeakPolarHBondContact O-CA 3.05Å; N235-K262 PolarHBondContact N-O 2.03Å; N235-K262 PolarHBondContact O-N 3.11Å
236	V	95.9	Very high	90.2	Very high	3 Å²	3	75.1 Å²	75.1	2%	0.018	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.9	-176.7	179.7	0	0	0	0	110.1	T261 C327 A329 A336 R338	V236-T261 HydrophobicContact CG2-CG2 4.37Å; V236-C327 HydrophobicContact CG1-CB 4.08Å; V236-A329 HydrophobicContact CG2-CB 3.46Å; V236-A329 VanDerWaalsContact CG2-CB 3.46Å; V236-A336 HydrophobicContact CG2-CB 4.01Å; V236-R338 HydrophobicContact CB-CB 4.4Å; V236-R338 HydrophobicContact CG1-CB 3.86Å; V236-R338 VanDerWaalsContact O-CZ 3.27Å; V236-R338 PolarHBondContact O-NE 2.91Å; V236-R338 PolarHBondContact O-NH2 2.97Å
237	T	94.1	Very high	89.7	Confident	50 Å²	50	77.5 Å²	77.5	31%	0.307	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.1	169.5	30.7	0	0	0	0	109.1	E260	T237-E260 PolarHBondContact N-O 2.79Å; T237-E260 PolarHBondContact O-N 3.38Å; T237-E260 VanDerWaalsContact O-O 3.11Å; T237-E260 PolarHBondContact OG1-O 2.83Å
238	I	93.9	Very high	89.4	Confident	14 Å²	14	77.9 Å²	77.9	7%	0.072	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.1	173.7	-62.7	170.4	0	0	0	107	L257 N258 W271 C327 R338 V340	I238-L257 HydrophobicContact CG2-CB 4.27Å; I238-N258 VanDerWaalsContact CA-O 3.31Å; I238-N258 WeakPolarHBondContact CA-O 3.08Å; I238-W271 HydrophobicContact CD1-CH2 3.85Å; I238-W271 HydrophobicContact CD1-CZ3 3.97Å; I238-W271 HydrophobicContact CG1-CH2 4.09Å; I238-W271 HydrophobicContact CG2-CH2 4.02Å; I238-C327 HydrophobicContact CD1-CB 3.84Å; I238-C327 HydrophobicContact CG1-CB 4.06Å; I238-R338 HydrophobicContact CD1-CB 3.98Å; I238-R338 HydrophobicContact CD1-CG 4.28Å; I238-R338 WeakPolarHBondContact CD1-O 3.44Å; I238-R338 HydrophobicContact CG1-CB 4.27Å; I238-V340 HydrophobicContact CB-CG2 4.01Å; I238-V340 HydrophobicContact CD1-CG2 4.06Å; I238-V340 HydrophobicContact CG2-CG2 3.74Å
239	T	93.3	Very high	89.4	Confident	54 Å²	54	70.1 Å²	70.1	33%	0.331	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	153.7	168.6	67.7	0	0	0	0	109.1	N258 E260	T239-N258 PolarHBondContact N-O 2.73Å; T239-N258 PolarHBondContact O-N 3.46Å; T239-E260 WeakPolarHBondContact CB-OE1 3.01Å; T239-E260 WeakPolarHBondContact CG2-OE1 3.49Å; T239-E260 PolarHBondContact OG1-OE1 2.99Å
240	Y	93.3	Very high	89.4	Confident	49 Å²	49	73.1 Å²	73.1	19%	0.192	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	151.4	-167.4	48.8	-109.8	0	0	0	112.7	P242 N243 I244 E245 T256	Y240-P242 CarbonylContact C-O 3.16Å; Y240-P242 WeakPolarHBondContact CD2-O 3.4Å; Y240-N243 HydrophobicContact CE2-CB 4.24Å; Y240-I244 HydrophobicContact CD1-CD1 4.06Å; Y240-I244 HydrophobicContact CD2-CB 4.21Å; Y240-I244 HydrophobicContact CD2-CD1 3.94Å; Y240-I244 HydrophobicContact CD2-CG1 3.91Å; Y240-I244 HydrophobicContact CE2-CB 4.28Å; Y240-I244 HydrophobicContact CE2-CG1 4.49Å; Y240-I244 HydrophobicContact CG-CD1 3.6Å; Y240-I244 HydrophobicContact CG-CG1 4.12Å; Y240-E245 WeakPolarHBondContact OH-CG 3.15Å; Y240-E245 PolarHBondContact OH-OE1 2.76Å; Y240-T256 CarbonylContact C-O 3.6Å; Y240-T256 VanDerWaalsContact CA-O 3.25Å; Y240-T256 WeakPolarHBondContact CA-O 3.49Å
241	R	90.7	Very high	89.3	Confident	181 Å²	181	71.9 Å²	71.9	68%	0.683	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	126.6	178.8	-61.6	-177.3	-177.7	178.7	1.1	109.5	T256	R241-T256 PolarHBondContact N-O 3.2Å; R241-T256 PolarHBondContact O-N 2.9Å
242	P	87.1	Confident	89	Confident	43 Å²	43	71.7 Å²	71.7	28%	0.279	38%	0.378	S	S	.	.	S	Bend	cis	-63	174	-6.8	30.4	-37.4	0	0	0	112.8	Y240 I244 T247 L249 I253 S254	Y240-P242 CarbonylContact C-O 3.16Å; Y240-P242 WeakPolarHBondContact CD2-O 3.4Å; P242-I244 PolarHBondContact O-N 3.22Å; P242-I244 VanDerWaalsContact O-N 3.11Å; P242-T247 HydrophobicContact CB-CG2 4.09Å; P242-T247 HydrophobicContact CG-CG2 4.28Å; P242-L249 HydrophobicContact CG-CD2 4.16Å; P242-I253 HydrophobicContact CG-CG2 4.41Å; P242-S254 WeakPolarHBondContact CD-O 3.45Å
243	N	87.1	Confident	88.9	Confident	68 Å²	68	68.9 Å²	68.9	36%	0.364	37%	0.366	S	S	.	.			trans	-71.6	104.2	-179.6	179.9	-50	0	0	0	110.4	Y240 E245 N246 T247	Y240-N243 HydrophobicContact CE2-CB 4.24Å; N243-E245 VanDerWaalsContact C-N 3.33Å; N243-E245 PolarHBondContact O-N 2.97Å; N243-E245 PolarHBondContact OD1-N 2.89Å; N243-N246 CarbonylContact O-C 3.58Å; N243-N246 PolarHBondContact O-N 2.72Å; N243-N246 PolarHBondContact OD1-N 3.15Å; N243-N246 PolarHBondContact OD1-ND2 3.02Å; N243-T247 WeakPolarHBondContact O-CA 3.38Å; N243-T247 WeakPolarHBondContact O-CB 3.48Å; N243-T247 PolarHBondContact O-N 3.22Å; N243-T247 PolarHBondContact O-OG1 2.04Å
244	I	85.2	Confident	88.8	Confident	32 Å²	32	69.5 Å²	69.5	16%	0.164	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.4	-171.5	-56.6	156.1	0	0	0	112.5	Y240 P242 N246 L249 V255 L257 V340 L342	Y240-I244 HydrophobicContact CD1-CD1 4.06Å; Y240-I244 HydrophobicContact CD2-CB 4.21Å; Y240-I244 HydrophobicContact CD2-CD1 3.94Å; Y240-I244 HydrophobicContact CD2-CG1 3.91Å; Y240-I244 HydrophobicContact CE2-CB 4.28Å; Y240-I244 HydrophobicContact CE2-CG1 4.49Å; Y240-I244 HydrophobicContact CG-CD1 3.6Å; Y240-I244 HydrophobicContact CG-CG1 4.12Å; P242-I244 PolarHBondContact O-N 3.22Å; P242-I244 VanDerWaalsContact O-N 3.11Å; I244-N246 VanDerWaalsContact C-N 3.26Å; I244-N246 PolarHBondContact O-N 3.44Å; I244-L249 HydrophobicContact CG2-CD1 4.46Å; I244-V255 HydrophobicContact CD1-CG1 4.47Å; I244-L257 HydrophobicContact CD1-CD2 3.86Å; I244-V340 HydrophobicContact CD1-CG1 3.77Å; I244-L342 HydrophobicContact CD1-CD2 3.41Å; I244-L342 VanDerWaalsContact CD1-CD2 3.41Å; I244-L342 HydrophobicContact CG1-CD2 4.09Å; I244-L342 HydrophobicContact CG2-CD2 4.33Å
245	E	81.6	Confident	88.6	Confident	157 Å²	157	68.9 Å²	68.9	73%	0.734	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-27.5	177	-73.1	165.9	-146.8	0	0	112.5	Y240 N243	Y240-E245 WeakPolarHBondContact OH-CG 3.15Å; Y240-E245 PolarHBondContact OH-OE1 2.76Å; N243-E245 VanDerWaalsContact C-N 3.33Å; N243-E245 PolarHBondContact O-N 2.97Å; N243-E245 PolarHBondContact OD1-N 2.89Å
246	N	79.6	Confident	88.5	Confident	135 Å²	135	66.6 Å²	66.6	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-6.6	-175.6	-63.6	-78.6	0	0	0	114.4	N243 I244	N243-N246 CarbonylContact O-C 3.58Å; N243-N246 PolarHBondContact O-N 2.72Å; N243-N246 PolarHBondContact OD1-N 3.15Å; N243-N246 PolarHBondContact OD1-ND2 3.02Å; I244-N246 VanDerWaalsContact C-N 3.26Å; I244-N246 PolarHBondContact O-N 3.44Å
247	T	82.4	Confident	88.4	Confident	56 Å²	56	66.5 Å²	66.5	34%	0.344	35%	0.352	S	S	.	.	S	Bend	trans	-118.6	122.2	-174.1	-44.7	0	0	0	0	110.7	P242 N243 L249	P242-T247 HydrophobicContact CB-CG2 4.09Å; P242-T247 HydrophobicContact CG-CG2 4.28Å; N243-T247 WeakPolarHBondContact O-CA 3.38Å; N243-T247 WeakPolarHBondContact O-CB 3.48Å; N243-T247 PolarHBondContact O-N 3.22Å; N243-T247 PolarHBondContact O-OG1 2.04Å; T247-L249 PolarHBondContact O-N 3.23Å
248	V	83.6	Confident	88.4	Confident	85 Å²	85	66 Å²	66	52%	0.515	35%	0.347	S	S	.	.			trans	-68.9	123.2	171.7	-178.1	0	0	0	0	109.6	H250 A345	V248-H250 PolarHBondContact O-CD2 3.22Å; V248-A345 HydrophobicContact CG1-CB 3.34Å
249	L	87.2	Confident	88.4	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.031	35%	0.345	C	S	.	.			trans	-81.8	131.5	177.4	-58.8	179.6	0	0	0	110.5	P242 I244 T247 V255 L342 L344 A345	P242-L249 HydrophobicContact CG-CD2 4.16Å; I244-L249 HydrophobicContact CG2-CD1 4.46Å; T247-L249 PolarHBondContact O-N 3.23Å; L249-V255 HydrophobicContact CD1-CG2 4.47Å; L249-V255 HydrophobicContact CD2-CG2 3.98Å; L249-L342 HydrophobicContact CD1-CB 4.45Å; L249-L342 HydrophobicContact CD1-CD2 4.16Å; L249-L344 HydrophobicContact CB-CD2 4.02Å; L249-A345 PolarHBondContact O-N 3.23Å
250	H	86.8	Confident	88.4	Confident	108 Å²	108	67.3 Å²	67.3	50%	0.5	35%	0.35	S	S	.	.			trans	-121.8	156.2	178	-62.5	-71.8	0	0	0	110.5	V248 G252 I253 L344	V248-H250 PolarHBondContact O-CD2 3.22Å; H250-G252 PolarHBondContact O-N 3.17Å; H250-I253 HydrophobicContact CB-CD1 3.9Å; H250-I253 HydrophobicContact CB-CG1 4.33Å; H250-I253 WeakPolarHBondContact O-CB 3.4Å; H250-I253 WeakPolarHBondContact O-CG1 3.23Å; H250-I253 PolarHBondContact O-N 3.48Å; H250-L344 WeakPolarHBondContact O-CD2 3.32Å
251	E	87.4	Confident	88.3	Confident	147 Å²	147	67 Å²	67	69%	0.687	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	136	-177.8	-172.1	168	-156	0	0	111.5	I253 M317 L344	E251-I253 VanDerWaalsContact C-N 3.34Å; E251-I253 PolarHBondContact O-N 3.06Å; E251-M317 WeakPolarHBondContact CA-O 3.49Å; E251-L344 HydrophobicContact CB-CD1 4.22Å
252	G	85.4	Confident	88.4	Confident	39 Å²	39	65.5 Å²	65.5	40%	0.402	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	-10.3	-178.3	0	0	0	0	0	115.9	H250 M317	H250-G252 PolarHBondContact O-N 3.17Å; G252-M317 PolarHBondContact N-O 3.45Å
253	I	89.1	Confident	88.5	Confident	56 Å²	56	64.4 Å²	64.4	29%	0.287	35%	0.348	S	S	.	.			trans	-63.1	141.1	172.3	-68.1	-174.3	0	0	0	110.2	P242 H250 E251 V255 M317	P242-I253 HydrophobicContact CG-CG2 4.41Å; H250-I253 HydrophobicContact CB-CD1 3.9Å; H250-I253 HydrophobicContact CB-CG1 4.33Å; H250-I253 WeakPolarHBondContact O-CB 3.4Å; H250-I253 WeakPolarHBondContact O-CG1 3.23Å; H250-I253 PolarHBondContact O-N 3.48Å; E251-I253 VanDerWaalsContact C-N 3.34Å; E251-I253 PolarHBondContact O-N 3.06Å; I253-V255 HydrophobicContact CG2-CG2 4.4Å; I253-M317 VanDerWaalsContact O-CB 3.26Å; I253-M317 WeakPolarHBondContact O-CB 3.1Å; I253-M317 PolarHBondContact O-N 2.91Å
254	S	90.1	Very high	88.5	Confident	74 Å²	74	63.2 Å²	63.2	52%	0.517	35%	0.345	S	S	.	.			trans	-86.2	137.1	169.5	54.6	0	0	0	0	111.3	P242 I314 P315	P242-S254 WeakPolarHBondContact CD-O 3.45Å; S254-I314 VanDerWaalsContact CA-O 3.27Å; S254-I314 WeakPolarHBondContact CA-O 3.48Å; S254-P315 WeakPolarHBondContact CB-O 3.48Å
255	V	92.4	Very high	88.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129	179.1	-178	0	0	0	0	109.4	I244 L249 I253 L257 I314 L342	I244-V255 HydrophobicContact CD1-CG1 4.47Å; L249-V255 HydrophobicContact CD1-CG2 4.47Å; L249-V255 HydrophobicContact CD2-CG2 3.98Å; I253-V255 HydrophobicContact CG2-CG2 4.4Å; V255-L257 HydrophobicContact CG1-CD2 4.1Å; V255-I314 HydrophobicContact CB-CB 4.46Å; V255-I314 HydrophobicContact CB-CD1 4.42Å; V255-I314 PolarHBondContact N-O 3.34Å; V255-I314 PolarHBondContact O-N 3.37Å; V255-L342 HydrophobicContact CG1-CD1 4.08Å; V255-L342 HydrophobicContact CG1-CD2 4.25Å
256	T	93.2	Very high	89	Confident	42 Å²	42	63.7 Å²	63.7	26%	0.258	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128	177.6	-55.3	0	0	0	0	109.7	Y240 R241 T311 A313	Y240-T256 CarbonylContact C-O 3.6Å; Y240-T256 VanDerWaalsContact CA-O 3.25Å; Y240-T256 WeakPolarHBondContact CA-O 3.49Å; R241-T256 PolarHBondContact N-O 3.2Å; R241-T256 PolarHBondContact O-N 2.9Å; T256-T311 HydrophobicContact CG2-CG2 3.41Å; T256-T311 VanDerWaalsContact CG2-CG2 3.41Å; T256-A313 HydrophobicContact CG2-CB 4.35Å
257	L	93.9	Very high	89.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.9	175.1	-51.8	-179.7	0	0	0	108.8	I238 I244 V255 W271 T311 L312 Y325	I238-L257 HydrophobicContact CG2-CB 4.27Å; I244-L257 HydrophobicContact CD1-CD2 3.86Å; V255-L257 HydrophobicContact CG1-CD2 4.1Å; L257-W271 HydrophobicContact CB-CH2 3.69Å; L257-W271 HydrophobicContact CB-CZ2 3.97Å; L257-W271 HydrophobicContact CD1-CH2 4.08Å; L257-W271 HydrophobicContact CD1-CZ3 4.24Å; L257-T311 CarbonylContact O-C 3.04Å; L257-T311 WeakPolarHBondContact O-CA 3.44Å; L257-L312 PolarHBondContact N-O 3.03Å; L257-L312 PolarHBondContact O-N 2.79Å; L257-Y325 HydrophobicContact CD1-CD1 3.78Å; L257-Y325 HydrophobicContact CD1-CG 3.69Å
258	N	93.3	Very high	89.9	Confident	39 Å²	39	60.3 Å²	60.3	21%	0.209	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.8	174.2	-63.1	-1.6	0	0	0	108.8	I238 T239 E260 T311	I238-N258 VanDerWaalsContact CA-O 3.31Å; I238-N258 WeakPolarHBondContact CA-O 3.08Å; T239-N258 PolarHBondContact N-O 2.73Å; T239-N258 PolarHBondContact O-N 3.46Å; N258-E260 PolarHBondContact O-N 3.07Å; N258-T311 WeakPolarHBondContact OD1-CG2 3.18Å; N258-T311 PolarHBondContact OD1-OG1 2.05Å
259	C	93.6	Very high	90.3	Very high	4 Å²	4	57 Å²	57	3%	0.027	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	103.9	167.6	-170.9	0	0	0	0	110.3	T261 V269 W271 G310 C327	C259-T261 VanDerWaalsContact SG-CG2 3.59Å; C259-V269 HydrophobicContact CB-CG1 4.43Å; C259-W271 HydrophobicContact CB-CH2 4.47Å; C259-W271 HydrophobicContact CB-CZ2 3.65Å; C259-G310 WeakPolarHBondContact CB-O 3.27Å; C259-G310 PolarHBondContact N-O 2.86Å; C259-C327 HydrophobicContact CB-CB 3.7Å; C259-C327 WeakPolarHBondContact CB-SG 3.38Å; C259-C327 WeakPolarHBondContact SG-CB 3.47Å; C259-C327 CovalentContact SG-SG 2.02Å; C259-C327 PolarHBondContact SG-SG 2.64Å
260	E	93.1	Very high	90.6	Very high	92 Å²	92	57.3 Å²	57.3	43%	0.43	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.9	175.4	-70.2	170.3	-138.7	0	0	108.9	T237 T239 N258	T237-E260 PolarHBondContact N-O 2.79Å; T237-E260 PolarHBondContact O-N 3.38Å; T237-E260 VanDerWaalsContact O-O 3.11Å; T237-E260 PolarHBondContact OG1-O 2.83Å; T239-E260 WeakPolarHBondContact CB-OE1 3.01Å; T239-E260 WeakPolarHBondContact CG2-OE1 3.49Å; T239-E260 PolarHBondContact OG1-OE1 2.99Å; N258-E260 PolarHBondContact O-N 3.07Å
261	T	92.1	Very high	90.9	Very high	42 Å²	42	52.1 Å²	52.1	26%	0.258	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.7	-174.3	60.2	0	0	0	0	112	N235 V236 C259 V269 A329	N235-T261 WeakPolarHBondContact O-CA 3.05Å; V236-T261 HydrophobicContact CG2-CG2 4.37Å; C259-T261 VanDerWaalsContact SG-CG2 3.59Å; T261-V269 HydrophobicContact CG2-CG1 4.19Å; T261-V269 HydrophobicContact CG2-CG2 3.83Å; T261-A329 HydrophobicContact CG2-CB 3.84Å
262	K	91.5	Very high	91.2	Very high	151 Å²	151	47.1 Å²	47.1	66%	0.657	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	162.5	169.8	-61	-175.5	-178.9	-176.9	0	110.1	P234 N235	P234-K262 CarbonylContact C-O 3.57Å; P234-K262 VanDerWaalsContact CA-O 3.23Å; P234-K262 WeakPolarHBondContact CA-O 3.44Å; N235-K262 PolarHBondContact N-O 2.03Å; N235-K262 PolarHBondContact O-N 3.11Å
263	G	89.9	Confident	91.5	Very high	19 Å²	19	45.3 Å²	45.3	20%	0.196	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.2	156.7	179.9	0	0	0	0	0	111.4	P265	G263-P265 CarbonylContact C-O 3.47Å; G263-P265 CarbonylContact O-C 3.51Å
264	S	87.9	Confident	91.6	Very high	44 Å²	44	45.5 Å²	45.5	31%	0.308	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	114.6	179.9	-176.7	0	0	0	0	109.6	Q230 E232	Q230-S264 WeakPolarHBondContact O-CB 3.25Å; Q230-S264 PolarHBondContact O-OG 2.86Å; E232-S264 PolarHBondContact N-O 2.63Å; E232-S264 PolarHBondContact O-N 2.83Å
265	P	88.3	Confident	91.6	Very high	43 Å²	43	42 Å²	42	28%	0.279	22%	0.221	S	C	.	.	S	Bend	cis	-63.7	164	1.4	-21.8	34.5	0	0	0	114.2	G263 N331 E332	G263-P265 CarbonylContact C-O 3.47Å; G263-P265 CarbonylContact O-C 3.51Å; P265-N331 WeakPolarHBondContact O-CB 3.02Å; P265-N331 PolarHBondContact O-ND2 2.97Å; P265-E332 VanDerWaalsContact CD-OE1 3.31Å; P265-E332 WeakPolarHBondContact CD-OE1 3.46Å; P265-E332 HydrophobicContact CG-CG 3.91Å; P265-E332 WeakPolarHBondContact CG-OE1 3.29Å
266	M	87.3	Confident	91.2	Very high	155 Å²	155	44.4 Å²	44.4	76%	0.764	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-54.9	122.5	177.8	178.3	174.7	173.4	0	0	110.7
267	P	91.4	Very high	90.5	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.052	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-78	148.7	-172.8	30.5	-35.4	0	0	0	113.2	P234 A329 V330 N331	P234-P267 HydrophobicContact CB-CB 3.96Å; P234-P267 HydrophobicContact CB-CG 4.16Å; P267-A329 HydrophobicContact CB-CB 4.02Å; P267-A329 HydrophobicContact CG-CB 4.14Å; P267-V330 CarbonylContact C-O 3.58Å; P267-V330 WeakPolarHBondContact CA-O 3.21Å; P267-V330 WeakPolarHBondContact CB-O 3.49Å; P267-N331 HydrophobicContact CB-CB 4.14Å
268	Q	91	Very high	90.1	Very high	113 Å²	113	56 Å²	56	53%	0.528	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.7	167.2	-173.1	179.4	15.9	0	0	109.6	A329 V330	Q268-A329 WeakPolarHBondContact O-CA 3.46Å; Q268-V330 PolarHBondContact N-O 2.63Å; Q268-V330 PolarHBondContact O-N 3.5Å
269	V	91.8	Very high	89.9	Confident	15 Å²	15	59.8 Å²	59.8	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.8	-175.1	-168.8	0	0	0	0	110.8	C259 T261 L284 C327 S328	C259-V269 HydrophobicContact CB-CG1 4.43Å; T261-V269 HydrophobicContact CG2-CG1 4.19Å; T261-V269 HydrophobicContact CG2-CG2 3.83Å; V269-L284 HydrophobicContact CB-CB 4.42Å; V269-L284 HydrophobicContact CB-CD1 4.41Å; V269-L284 HydrophobicContact CG1-CD1 4.35Å; V269-L284 PolarHBondContact O-N 3.15Å; V269-C327 WeakPolarHBondContact CG1-SG 3.17Å; V269-S328 WeakPolarHBondContact CA-O 3.28Å
270	N	92.9	Very high	89.7	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.064	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	122.6	-177.6	162.2	77.7	0	0	0	110.3	E272 R281 S328	N270-E272 PolarHBondContact ND2-OE1 2.88Å; N270-R281 PolarHBondContact ND2-NE 3.24Å; N270-R281 WeakPolarHBondContact OD1-CG 3.35Å; N270-R281 PolarHBondContact OD1-NE 2.92Å; N270-S328 PolarHBondContact N-O 3.24Å; N270-S328 PolarHBondContact ND2-OG 3.15Å; N270-S328 PolarHBondContact O-N 3.43Å; N270-S328 PolarHBondContact O-OG 2.95Å
271	W	92.8	Very high	89.5	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.8	173	-83.5	107.1	0	0	0	110.7	I238 L257 C259 R281 F282 G310 L312 T326 C327	I238-W271 HydrophobicContact CD1-CH2 3.85Å; I238-W271 HydrophobicContact CD1-CZ3 3.97Å; I238-W271 HydrophobicContact CG1-CH2 4.09Å; I238-W271 HydrophobicContact CG2-CH2 4.02Å; L257-W271 HydrophobicContact CB-CH2 3.69Å; L257-W271 HydrophobicContact CB-CZ2 3.97Å; L257-W271 HydrophobicContact CD1-CH2 4.08Å; L257-W271 HydrophobicContact CD1-CZ3 4.24Å; C259-W271 HydrophobicContact CB-CH2 4.47Å; C259-W271 HydrophobicContact CB-CZ2 3.65Å; W271-R281 CarbonylContact O-C 3.44Å; W271-R281 WeakPolarHBondContact O-CA 3.16Å; W271-F282 HydrophobicContact CB-CB 4.27Å; W271-F282 HydrophobicContact CB-CD2 4.3Å; W271-F282 PolarHBondContact N-O 2.92Å; W271-F282 PolarHBondContact O-N 3.06Å; W271-G310 PolarHBondContact NE1-O 2.81Å; W271-L312 HydrophobicContact CB-CD1 4.13Å; W271-L312 HydrophobicContact CD2-CB 4.26Å; W271-L312 HydrophobicContact CD2-CD1 3.97Å; W271-L312 HydrophobicContact CE3-CD1 4.33Å; W271-L312 HydrophobicContact CG-CB 4.47Å; W271-L312 HydrophobicContact CG-CD1 3.91Å; W271-L312 HydrophobicContact CZ2-CB 4.18Å; W271-T326 WeakPolarHBondContact CA-O 3.2Å; W271-C327 HydrophobicContact CD2-CB 4.05Å; W271-C327 HydrophobicContact CE3-CB 3.89Å; W271-C327 HydrophobicContact CH2-CB 3.99Å; W271-C327 HydrophobicContact CZ2-CB 4.15Å; W271-C327 HydrophobicContact CZ3-CB 3.85Å
272	E	93.4	Very high	89.2	Confident	42 Å²	42	63.5 Å²	63.5	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.3	174.7	-75.5	173	-168.7	0	0	108.6	N270 F279 R281 T326	N270-E272 PolarHBondContact ND2-OE1 2.88Å; E272-F279 HydrophobicContact CB-CE2 3.97Å; E272-F279 HydrophobicContact CB-CZ 4.25Å; E272-F279 HydrophobicContact CG-CE2 4.14Å; E272-F279 HydrophobicContact CG-CZ 3.91Å; E272-R281 HydrophobicContact CG-CG 4.04Å; E272-R281 IonicContact OE1-CZ 2.9Å; E272-R281 IonicContact OE1-NE 3.91Å; E272-R281 PolarHBondContact OE1-NE 2.99Å; E272-R281 IonicContact OE1-NH2 3.65Å; E272-T326 PolarHBondContact N-O 3.37Å; E272-T326 PolarHBondContact O-N 2.79Å
273	V	92.3	Very high	88.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.2	-172.3	178	0	0	0	0	109.3	A275 F279 Y280 F282 F304 L312 Y325	V273-A275 HydrophobicContact CG1-CB 3.93Å; V273-F279 CarbonylContact O-C 3.57Å; V273-F279 WeakPolarHBondContact O-CA 3.11Å; V273-Y280 HydrophobicContact CB-CD2 4.39Å; V273-Y280 HydrophobicContact CG1-CD2 4.28Å; V273-Y280 PolarHBondContact N-O 3.11Å; V273-Y280 PolarHBondContact O-N 3.34Å; V273-F282 HydrophobicContact CG2-CD2 4.42Å; V273-F282 HydrophobicContact CG2-CE2 4.16Å; V273-F304 HydrophobicContact CG1-CE1 4.43Å; V273-F304 HydrophobicContact CG1-CE2 4.43Å; V273-F304 HydrophobicContact CG1-CZ 4.08Å; V273-L312 HydrophobicContact CG2-CD1 3.76Å; V273-Y325 HydrophobicContact CB-CD1 4.28Å; V273-Y325 HydrophobicContact CB-CE1 4.31Å; V273-Y325 HydrophobicContact CG1-CD1 3.74Å; V273-Y325 HydrophobicContact CG1-CE1 3.37Å; V273-Y325 HydrophobicContact CG1-CE2 4.36Å; V273-Y325 HydrophobicContact CG1-CG 4.37Å; V273-Y325 HydrophobicContact CG2-CD1 3.62Å; V273-Y325 HydrophobicContact CG2-CE1 3.95Å; V273-Y325 HydrophobicContact CG2-CG 4.44Å
274	I	92.2	Very high	88.5	Confident	60 Å²	60	59.9 Å²	59.9	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	101.8	169.5	-59.8	164.7	0	0	0	106.1	R278 F279 G323 N324	I274-R278 WeakPolarHBondContact CA-O 3.05Å; I274-F279 HydrophobicContact CG1-CD2 3.92Å; I274-G323 CarbonylContact O-C 3.44Å; I274-G323 VanDerWaalsContact O-CA 3.22Å; I274-G323 WeakPolarHBondContact O-CA 3.48Å; I274-N324 PolarHBondContact N-O 3.5Å; I274-N324 PolarHBondContact O-N 2.89Å
275	A	88.8	Confident	87.6	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.3	-177.3	0	0	0	0	0	110.5	V273 S277 R278 Y280 F304 K320	V273-A275 HydrophobicContact CG1-CB 3.93Å; A275-S277 PolarHBondContact O-N 2.78Å; A275-R278 PolarHBondContact N-O 3.02Å; A275-R278 PolarHBondContact O-N 2.93Å; A275-Y280 HydrophobicContact CB-CE2 4.18Å; A275-F304 HydrophobicContact CB-CZ 4.06Å; A275-K320 CarbonylContact C-O 3.6Å
276	G	83.9	Confident	86.2	Confident	49 Å²	49	63.1 Å²	63.1	51%	0.505	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-121.1	-163.4	0	0	0	0	0	110.9	K320 D322	G276-K320 PolarHBondContact N-O 3.4Å; G276-D322 PolarHBondContact N-O 2.97Å
277	S	79	Confident	84.7	Confident	124 Å²	124	60 Å²	60	87%	0.867	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	17.7	174.3	57.5	0	0	0	0	113.9	A275	A275-S277 PolarHBondContact O-N 2.78Å
278	R	86.4	Confident	82.8	Confident	162 Å²	162	64 Å²	64	61%	0.611	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.5	-175.8	-66	-178	176.9	-164.4	-1.2	112.1	I274 A275 Y280	I274-R278 WeakPolarHBondContact CA-O 3.05Å; A275-R278 PolarHBondContact N-O 3.02Å; A275-R278 PolarHBondContact O-N 2.93Å; R278-Y280 HydrophobicContact CB-CE2 3.65Å; R278-Y280 WeakPolarHBondContact CB-OH 3.33Å; R278-Y280 WeakPolarHBondContact CD-OH 3.36Å
279	F	89.4	Confident	80.9	Confident	118 Å²	118	65 Å²	65	52%	0.518	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.3	171.9	178.7	-102.1	0	0	0	110.5	E272 V273 I274 R281	E272-F279 HydrophobicContact CB-CE2 3.97Å; E272-F279 HydrophobicContact CB-CZ 4.25Å; E272-F279 HydrophobicContact CG-CE2 4.14Å; E272-F279 HydrophobicContact CG-CZ 3.91Å; V273-F279 CarbonylContact O-C 3.57Å; V273-F279 WeakPolarHBondContact O-CA 3.11Å; I274-F279 HydrophobicContact CG1-CD2 3.92Å; F279-R281 HydrophobicContact CE1-CB 3.91Å; F279-R281 HydrophobicContact CZ-CB 4.18Å
280	Y	88.2	Confident	79.1	Confident	35 Å²	35	70 Å²	70	14%	0.137	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.8	173	-47.2	-96.5	0	0	0	108.8	V273 A275 R278 F282 R303 F304	V273-Y280 HydrophobicContact CB-CD2 4.39Å; V273-Y280 HydrophobicContact CG1-CD2 4.28Å; V273-Y280 PolarHBondContact N-O 3.11Å; V273-Y280 PolarHBondContact O-N 3.34Å; A275-Y280 HydrophobicContact CB-CE2 4.18Å; R278-Y280 HydrophobicContact CB-CE2 3.65Å; R278-Y280 WeakPolarHBondContact CB-OH 3.33Å; R278-Y280 WeakPolarHBondContact CD-OH 3.36Å; Y280-F282 HydrophobicContact CG-CZ 4.3Å; Y280-R303 PolarHBondContact OH-NH1 2.73Å; Y280-R303 PolarHBondContact OH-NH2 3.16Å; Y280-F304 HydrophobicContact CD1-CE2 4.4Å; Y280-F304 AromaticContact CD2-CE2 3.79Å; Y280-F304 HydrophobicContact CD2-CE2 3.79Å; Y280-F304 HydrophobicContact CD2-CZ 4.5Å; Y280-F304 HydrophobicContact CE1-CE2 4.38Å; Y280-F304 AromaticContact CE2-CE2 3.79Å; Y280-F304 HydrophobicContact CE2-CE2 3.79Å; Y280-F304 HydrophobicContact CE2-CZ 4.36Å; Y280-F304 HydrophobicContact CG-CE2 4.11Å
281	R	88.9	Confident	77.4	Confident	152 Å²	152	74.1 Å²	74.1	57%	0.574	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.7	179.1	-172.3	175.3	-175.5	178.3	8.6	110.1	N270 W271 E272 F279	N270-R281 PolarHBondContact ND2-NE 3.24Å; N270-R281 WeakPolarHBondContact OD1-CG 3.35Å; N270-R281 PolarHBondContact OD1-NE 2.92Å; W271-R281 CarbonylContact O-C 3.44Å; W271-R281 WeakPolarHBondContact O-CA 3.16Å; E272-R281 HydrophobicContact CG-CG 4.04Å; E272-R281 IonicContact OE1-CZ 2.9Å; E272-R281 IonicContact OE1-NE 3.91Å; E272-R281 PolarHBondContact OE1-NE 2.99Å; E272-R281 IonicContact OE1-NH2 3.65Å; F279-R281 HydrophobicContact CE1-CB 3.91Å; F279-R281 HydrophobicContact CZ-CB 4.18Å
282	F	86.9	Confident	75.9	Confident	30 Å²	30	80.8 Å²	80.8	13%	0.132	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	90.5	-177.2	-50.6	-73.7	0	0	0	109.3	W271 V273 Y280 T300 F304 I306 L312	W271-F282 HydrophobicContact CB-CB 4.27Å; W271-F282 HydrophobicContact CB-CD2 4.3Å; W271-F282 PolarHBondContact N-O 2.92Å; W271-F282 PolarHBondContact O-N 3.06Å; V273-F282 HydrophobicContact CG2-CD2 4.42Å; V273-F282 HydrophobicContact CG2-CE2 4.16Å; Y280-F282 HydrophobicContact CG-CZ 4.3Å; F282-T300 HydrophobicContact CE1-CG2 4.17Å; F282-T300 HydrophobicContact CZ-CG2 4.4Å; F282-F304 HydrophobicContact CE2-CB 4.49Å; F282-F304 HydrophobicContact CE2-CD2 4.24Å; F282-F304 HydrophobicContact CZ-CB 4.31Å; F282-F304 AromaticContact CZ-CD2 3.96Å; F282-F304 HydrophobicContact CZ-CD2 3.96Å; F282-F304 HydrophobicContact CZ-CG 4.49Å; F282-I306 HydrophobicContact CB-CD1 4.4Å; F282-I306 HydrophobicContact CB-CG1 4Å; F282-I306 HydrophobicContact CB-CG2 4.4Å; F282-I306 HydrophobicContact CD1-CD1 3.63Å; F282-I306 HydrophobicContact CD1-CG1 4.18Å; F282-I306 HydrophobicContact CD2-CD1 3.85Å; F282-I306 HydrophobicContact CD2-CG1 3.98Å; F282-I306 HydrophobicContact CE1-CD1 3.72Å; F282-I306 HydrophobicContact CE2-CD1 3.94Å; F282-I306 HydrophobicContact CG-CD1 3.69Å; F282-I306 HydrophobicContact CG-CG1 3.79Å; F282-I306 HydrophobicContact CZ-CD1 3.87Å; F282-L312 HydrophobicContact CD2-CD1 4.38Å
283	P	84.7	Confident	74.6	Confident	83 Å²	83	82 Å²	82	54%	0.539	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.8	170.3	30.5	-33.1	0	0	0	109.6
284	L	81.7	Confident	73.6	Confident	11 Å²	11	84.6 Å²	84.6	6%	0.058	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-87.2	142.4	175.3	-77.9	78.6	0	0	0	110.5	V269 I306 F307	V269-L284 HydrophobicContact CB-CB 4.42Å; V269-L284 HydrophobicContact CB-CD1 4.41Å; V269-L284 HydrophobicContact CG1-CD1 4.35Å; V269-L284 PolarHBondContact O-N 3.15Å; L284-I306 HydrophobicContact CD1-CG2 4.26Å; L284-I306 HydrophobicContact CG-CG2 4.49Å; L284-F307 WeakPolarHBondContact CD2-O 3.2Å
285	P	68.8	Low	72.6	Confident	54 Å²	54	85.3 Å²	85.3	35%	0.351	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-70.1	140	171.4	30.6	-34.1	0	0	0	110.2	T287 I295 K308	P285-T287 PolarHBondContact O-N 3.15Å; P285-I295 HydrophobicContact CG-CD1 4.37Å; P285-K308 HydrophobicContact CG-CG 4.21Å
286	S	59.3	Low	71.4	Confident	100 Å²	100	86.9 Å²	86.9	70%	0.699	50%	0.496	S	S	*	.	S	Bend	trans	-77.7	2.8	-179.5	38	0	0	0	0	114.6
287	T	55.8	Low	70.2	Confident	89 Å²	89	89.3 Å²	89.3	55%	0.546	50%	0.497	S	S	.	.			trans	-99.2	117.6	-176.5	47.9	0	0	0	0	112.9	P285 E289	P285-T287 PolarHBondContact O-N 3.15Å; T287-E289 PolarHBondContact O-N 2.72Å
288	A	49.7	Very low	69	Low	92 Å²	92	92.2 Å²	92.2	76%	0.76	49%	0.494	S	S	*	.			trans	-76.3	32.4	-170.9	0	0	0	0	0	115.9	V290	A288-V290 PolarHBondContact O-N 2.75Å; A288-V290 VanDerWaalsContact O-N 3.08Å
289	E	51.6	Low	67.5	Low	134 Å²	134	89.8 Å²	89.8	63%	0.626	50%	0.498	S	S	*	.			trans	-73	97.7	168.1	-76.6	-176	170.3	0	0	109.9	T287 N291 K308	T287-E289 PolarHBondContact O-N 2.72Å; E289-N291 VanDerWaalsContact C-N 3.31Å; E289-N291 PolarHBondContact O-N 3.42Å; E289-K308 WeakPolarHBondContact O-CD 3.43Å; E289-K308 WeakPolarHBondContact O-CE 3.33Å; E289-K308 PolarHBondContact O-NZ 2.96Å
290	V	54.2	Low	66.2	Low	122 Å²	122	84.6 Å²	84.6	74%	0.739	48%	0.476	S	S	*	.			trans	-72.3	82.8	-177.8	-171.6	0	0	0	0	110.9	A288	A288-V290 PolarHBondContact O-N 2.75Å; A288-V290 VanDerWaalsContact O-N 3.08Å
291	N	58.2	Low	64.9	Low	97 Å²	97	89.4 Å²	89.4	52%	0.519	50%	0.504	S	S	.	.			trans	-96.3	125.1	162.6	-67.4	-25.2	0	0	0	108.2	E289 A293	E289-N291 VanDerWaalsContact C-N 3.31Å; E289-N291 PolarHBondContact O-N 3.42Å; N291-A293 PolarHBondContact O-N 2.77Å; N291-A293 VanDerWaalsContact O-N 3.11Å
292	D	60.4	Low	64.1	Low	140 Å²	140	87.1 Å²	87.1	75%	0.749	50%	0.503	S	S	*	.			trans	-71	-0.5	178.7	-62.7	-48.3	0	0	0	113.9	F307	D292-F307 WeakPolarHBondContact O-CE1 3.3Å
293	A	67.2	Low	63.8	Low	67 Å²	67	88.8 Å²	88.8	55%	0.554	51%	0.508	S	S	*	.	S	Bend	trans	-72.2	130.4	174.7	0	0	0	0	0	110.9	N291	N291-A293 PolarHBondContact O-N 2.77Å; N291-A293 VanDerWaalsContact O-N 3.11Å
294	P	70.9	Confident	64	Low	56 Å²	56	84.8 Å²	84.8	36%	0.364	48%	0.483	S	S	.	.			trans	-69.3	147	176.5	30.4	-35.4	0	0	0	111.2	N296 L305 I306 F307	P294-N296 PolarHBondContact O-N 2.93Å; P294-N296 VanDerWaalsContact O-N 3.17Å; P294-L305 HydrophobicContact CB-CB 4.19Å; P294-I306 CarbonylContact C-O 3.51Å; P294-I306 VanDerWaalsContact CA-O 3.28Å; P294-I306 WeakPolarHBondContact CA-O 3.21Å; P294-F307 HydrophobicContact CB-CD1 4.37Å; P294-F307 HydrophobicContact CB-CE1 4.12Å; P294-F307 HydrophobicContact CB-CZ 4.3Å
295	I	71.4	Confident	64.3	Low	75 Å²	75	86.1 Å²	86.1	39%	0.385	49%	0.49	S	S	.	.			trans	-78.5	2.1	-170.5	-49.8	161.4	0	0	0	112	P285 D297 I306 K308	P285-I295 HydrophobicContact CG-CD1 4.37Å; I295-D297 PolarHBondContact O-N 2.7Å; I295-I306 PolarHBondContact N-O 2.72Å; I295-K308 HydrophobicContact CD1-CB 4.47Å; I295-K308 HydrophobicContact CD1-CG 3.8Å; I295-K308 HydrophobicContact CG1-CG 4.11Å
296	N	63.6	Low	65.1	Low	35 Å²	35	83.9 Å²	83.9	19%	0.187	47%	0.474	C	S	.	.			trans	-59.6	131.8	-163.3	-46.5	-20.9	0	0	0	113.9	P294 F304 L305 I306	P294-N296 PolarHBondContact O-N 2.93Å; P294-N296 VanDerWaalsContact O-N 3.17Å; N296-F304 VanDerWaalsContact CG-O 3.31Å; N296-F304 PolarHBondContact ND2-O 2.95Å; N296-F304 VanDerWaalsContact ND2-O 3.17Å; N296-F304 PolarHBondContact OD1-O 3.31Å; N296-L305 WeakPolarHBondContact ND2-CD2 3.4Å; N296-L305 WeakPolarHBondContact OD1-CA 3.04Å; N296-I306 PolarHBondContact OD1-N 3.02Å
297	D	56.8	Low	66.4	Low	99 Å²	99	81.5 Å²	81.5	53%	0.529	45%	0.451	S	S	.	.			trans	-72.6	146.1	159.1	179.7	32.4	0	0	0	111.2	I295 T299 T300	I295-D297 PolarHBondContact O-N 2.7Å; D297-T299 PolarHBondContact O-N 2.87Å; D297-T299 VanDerWaalsContact O-N 3.13Å; D297-T299 WeakPolarHBondContact OD2-CB 3.26Å; D297-T299 WeakPolarHBondContact OD2-CG2 3.24Å; D297-T299 PolarHBondContact OD2-OG1 2.94Å; D297-T300 PolarHBondContact O-N 3.07Å; D297-T300 PolarHBondContact O-OG1 2.95Å
298	K	55.8	Low	67.5	Low	186 Å²	186	80.1 Å²	80.1	81%	0.809	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-60.6	-22.8	-176.4	-66.7	177.5	179.9	174.2	0	112.7	T300 N301	K298-T300 PolarHBondContact O-N 3.25Å; K298-T300 VanDerWaalsContact O-N 3.12Å; K298-N301 PolarHBondContact O-N 3.1Å
299	T	54.7	Low	69.1	Low	111 Å²	111	81.3 Å²	81.3	68%	0.681	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-57.3	-20.7	176.8	52.1	0	0	0	0	114.8	D297	D297-T299 PolarHBondContact O-N 2.87Å; D297-T299 VanDerWaalsContact O-N 3.13Å; D297-T299 WeakPolarHBondContact OD2-CB 3.26Å; D297-T299 WeakPolarHBondContact OD2-CG2 3.24Å; D297-T299 PolarHBondContact OD2-OG1 2.94Å
300	T	60.9	Low	70.8	Confident	8 Å²	8	75.1 Å²	75.1	5%	0.049	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-84.2	-14.1	-178.1	58.8	0	0	0	0	114.9	F282 D297 K298 N302 R303	F282-T300 HydrophobicContact CE1-CG2 4.17Å; F282-T300 HydrophobicContact CZ-CG2 4.4Å; D297-T300 PolarHBondContact O-N 3.07Å; D297-T300 PolarHBondContact O-OG1 2.95Å; K298-T300 PolarHBondContact O-N 3.25Å; K298-T300 VanDerWaalsContact O-N 3.12Å; T300-N302 VanDerWaalsContact C-N 3.28Å; T300-N302 PolarHBondContact O-N 3.23Å; T300-R303 PolarHBondContact O-NE 2.8Å; T300-R303 VanDerWaalsContact O-NE 3.08Å
301	N	61.3	Low	72.5	Confident	136 Å²	136	70 Å²	70	73%	0.727	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	40.7	-167.4	-75.9	-2.4	0	0	0	113.5	K298 R303	K298-N301 PolarHBondContact O-N 3.1Å; N301-R303 PolarHBondContact O-N 3.04Å
302	N	71.6	Confident	74.2	Confident	105 Å²	105	65.4 Å²	65.4	56%	0.561	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	16.4	177.4	-61.7	-13.5	0	0	0	115.9	T300 F304 L305	T300-N302 VanDerWaalsContact C-N 3.28Å; T300-N302 PolarHBondContact O-N 3.23Å; N302-F304 VanDerWaalsContact C-N 3.28Å; N302-F304 PolarHBondContact O-N 3.47Å; N302-L305 HydrophobicContact CB-CD2 4.18Å; N302-L305 WeakPolarHBondContact O-CD2 3.41Å
303	R	81.8	Confident	75.6	Confident	64 Å²	64	59.3 Å²	59.3	24%	0.242	32%	0.318	C	S	.	.	S	Bend	trans	-69.1	-26.4	179.9	-64.3	-179	-60.1	122.7	3.4	113.5	Y280 T300 N301 P315 E321	Y280-R303 PolarHBondContact OH-NH1 2.73Å; Y280-R303 PolarHBondContact OH-NH2 3.16Å; T300-R303 PolarHBondContact O-NE 2.8Å; T300-R303 VanDerWaalsContact O-NE 3.08Å; N301-R303 PolarHBondContact O-N 3.04Å; R303-P315 WeakPolarHBondContact O-CD 3.28Å; R303-E321 IonicContact CZ-OE1 2.77Å; R303-E321 IonicContact NH1-OE1 2.64Å; R303-E321 PolarHBondContact NH1-OE1 3.29Å
304	F	88.2	Confident	76.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-125.7	132.5	171.7	-52.3	-56.8	0	0	0	108.1	V273 A275 Y280 F282 N296 N302 I306 L312 A313 I314 E321 Y325	V273-F304 HydrophobicContact CG1-CE1 4.43Å; V273-F304 HydrophobicContact CG1-CE2 4.43Å; V273-F304 HydrophobicContact CG1-CZ 4.08Å; A275-F304 HydrophobicContact CB-CZ 4.06Å; Y280-F304 HydrophobicContact CD1-CE2 4.4Å; Y280-F304 AromaticContact CD2-CE2 3.79Å; Y280-F304 HydrophobicContact CD2-CE2 3.79Å; Y280-F304 HydrophobicContact CD2-CZ 4.5Å; Y280-F304 HydrophobicContact CE1-CE2 4.38Å; Y280-F304 AromaticContact CE2-CE2 3.79Å; Y280-F304 HydrophobicContact CE2-CE2 3.79Å; Y280-F304 HydrophobicContact CE2-CZ 4.36Å; Y280-F304 HydrophobicContact CG-CE2 4.11Å; F282-F304 HydrophobicContact CE2-CB 4.49Å; F282-F304 HydrophobicContact CE2-CD2 4.24Å; F282-F304 HydrophobicContact CZ-CB 4.31Å; F282-F304 AromaticContact CZ-CD2 3.96Å; F282-F304 HydrophobicContact CZ-CD2 3.96Å; F282-F304 HydrophobicContact CZ-CG 4.49Å; N296-F304 VanDerWaalsContact CG-O 3.31Å; N296-F304 PolarHBondContact ND2-O 2.95Å; N296-F304 VanDerWaalsContact ND2-O 3.17Å; N296-F304 PolarHBondContact OD1-O 3.31Å; N302-F304 VanDerWaalsContact C-N 3.28Å; N302-F304 PolarHBondContact O-N 3.47Å; F304-I306 HydrophobicContact CB-CD1 3.84Å; F304-L312 HydrophobicContact CD1-CD2 4.42Å; F304-A313 CarbonylContact C-O 3.56Å; F304-I314 HydrophobicContact CD1-CG1 4.15Å; F304-I314 HydrophobicContact CE1-CG1 4.41Å; F304-E321 HydrophobicContact CE1-CG 3.97Å; F304-E321 HydrophobicContact CZ-CG 4.17Å; F304-Y325 HydrophobicContact CD1-CE1 4.42Å; F304-Y325 AromaticContact CE1-CE1 3.99Å; F304-Y325 HydrophobicContact CE1-CE1 3.99Å; F304-Y325 WeakPolarHBondContact CE1-OH 3.42Å
305	L	87.3	Confident	77.6	Confident	39 Å²	39	55.4 Å²	55.4	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.2	174.7	-45.8	-178	0	0	0	108.6	P294 N296 N302 F307 L312 A313 P315	P294-L305 HydrophobicContact CB-CB 4.19Å; N296-L305 WeakPolarHBondContact ND2-CD2 3.4Å; N296-L305 WeakPolarHBondContact OD1-CA 3.04Å; N302-L305 HydrophobicContact CB-CD2 4.18Å; N302-L305 WeakPolarHBondContact O-CD2 3.41Å; L305-F307 HydrophobicContact CB-CE2 3.8Å; L305-F307 HydrophobicContact CB-CZ 4.13Å; L305-L312 CarbonylContact O-C 3.56Å; L305-L312 WeakPolarHBondContact O-CA 3.22Å; L305-A313 HydrophobicContact CB-CB 4.32Å; L305-A313 PolarHBondContact N-O 3.14Å; L305-A313 PolarHBondContact O-N 3.13Å; L305-P315 HydrophobicContact CD1-CG 3.77Å; L305-P315 HydrophobicContact CD2-CG 4.26Å; L305-P315 HydrophobicContact CG-CG 3.79Å
306	I	87.5	Confident	78.4	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.2	-177.8	-58.5	84.4	0	0	0	109	F282 L284 P294 I295 N296 F304 T311 L312	F282-I306 HydrophobicContact CB-CD1 4.4Å; F282-I306 HydrophobicContact CB-CG1 4Å; F282-I306 HydrophobicContact CB-CG2 4.4Å; F282-I306 HydrophobicContact CD1-CD1 3.63Å; F282-I306 HydrophobicContact CD1-CG1 4.18Å; F282-I306 HydrophobicContact CD2-CD1 3.85Å; F282-I306 HydrophobicContact CD2-CG1 3.98Å; F282-I306 HydrophobicContact CE1-CD1 3.72Å; F282-I306 HydrophobicContact CE2-CD1 3.94Å; F282-I306 HydrophobicContact CG-CD1 3.69Å; F282-I306 HydrophobicContact CG-CG1 3.79Å; F282-I306 HydrophobicContact CZ-CD1 3.87Å; L284-I306 HydrophobicContact CD1-CG2 4.26Å; L284-I306 HydrophobicContact CG-CG2 4.49Å; P294-I306 CarbonylContact C-O 3.51Å; P294-I306 VanDerWaalsContact CA-O 3.28Å; P294-I306 WeakPolarHBondContact CA-O 3.21Å; I295-I306 PolarHBondContact N-O 2.72Å; N296-I306 PolarHBondContact OD1-N 3.02Å; F304-I306 HydrophobicContact CB-CD1 3.84Å; I306-T311 WeakPolarHBondContact CA-O 3.43Å; I306-L312 HydrophobicContact CG1-CD1 4.17Å; I306-L312 HydrophobicContact CG1-CG 4.2Å
307	F	84.9	Confident	79.6	Confident	50 Å²	50	56.6 Å²	56.6	22%	0.219	29%	0.289	C	S	.	.			trans	-111.3	151.8	-177.5	-59.4	-95.3	0	0	0	110.8	L284 D292 P294 L305 N309 G310 T311 A313	L284-F307 WeakPolarHBondContact CD2-O 3.2Å; D292-F307 WeakPolarHBondContact O-CE1 3.3Å; P294-F307 HydrophobicContact CB-CD1 4.37Å; P294-F307 HydrophobicContact CB-CE1 4.12Å; P294-F307 HydrophobicContact CB-CZ 4.3Å; L305-F307 HydrophobicContact CB-CE2 3.8Å; L305-F307 HydrophobicContact CB-CZ 4.13Å; F307-N309 WeakPolarHBondContact CB-OD1 3.4Å; F307-N309 PolarHBondContact O-N 3.22Å; F307-G310 PolarHBondContact O-N 2.9Å; F307-T311 HydrophobicContact CD2-CG2 4.02Å; F307-T311 PolarHBondContact N-O 2.91Å; F307-A313 HydrophobicContact CE2-CB 4.18Å
308	K	79.8	Confident	81.1	Confident	60 Å²	60	53.4 Å²	53.4	26%	0.261	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.4	-178.4	-69.6	-176.2	176.8	-169.2	0	114.5	P285 E289 I295 G310	P285-K308 HydrophobicContact CG-CG 4.21Å; E289-K308 WeakPolarHBondContact O-CD 3.43Å; E289-K308 WeakPolarHBondContact O-CE 3.33Å; E289-K308 PolarHBondContact O-NZ 2.96Å; I295-K308 HydrophobicContact CD1-CB 4.47Å; I295-K308 HydrophobicContact CD1-CG 3.8Å; I295-K308 HydrophobicContact CG1-CG 4.11Å; K308-G310 VanDerWaalsContact C-N 3.3Å; K308-G310 PolarHBondContact O-N 2.86Å
309	N	84.1	Confident	82.5	Confident	118 Å²	118	49.1 Å²	49.1	63%	0.631	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	10.4	-179.5	70.1	-3.3	0	0	0	114.6	F307 T311	F307-N309 WeakPolarHBondContact CB-OD1 3.4Å; F307-N309 PolarHBondContact O-N 3.22Å; N309-T311 PolarHBondContact ND2-OG1 3.04Å; N309-T311 WeakPolarHBondContact OD1-CB 3.41Å; N309-T311 PolarHBondContact OD1-N 2.94Å; N309-T311 PolarHBondContact OD1-OG1 2.83Å
310	G	86.9	Confident	84	Confident	4 Å²	4	50.9 Å²	50.9	4%	0.041	26%	0.261	C	S	.	.	S	Bend	trans	90.2	-4.3	-176.7	0	0	0	0	0	115.1	C259 W271 F307 K308	C259-G310 WeakPolarHBondContact CB-O 3.27Å; C259-G310 PolarHBondContact N-O 2.86Å; W271-G310 PolarHBondContact NE1-O 2.81Å; F307-G310 PolarHBondContact O-N 2.9Å; K308-G310 VanDerWaalsContact C-N 3.3Å; K308-G310 PolarHBondContact O-N 2.86Å
311	T	90.3	Very high	85.4	Confident	14 Å²	14	50.8 Å²	50.8	9%	0.086	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.6	-179.2	-54.7	0	0	0	0	112.3	T256 L257 N258 I306 F307 N309	T256-T311 HydrophobicContact CG2-CG2 3.41Å; T256-T311 VanDerWaalsContact CG2-CG2 3.41Å; L257-T311 CarbonylContact O-C 3.04Å; L257-T311 WeakPolarHBondContact O-CA 3.44Å; N258-T311 WeakPolarHBondContact OD1-CG2 3.18Å; N258-T311 PolarHBondContact OD1-OG1 2.05Å; I306-T311 WeakPolarHBondContact CA-O 3.43Å; F307-T311 HydrophobicContact CD2-CG2 4.02Å; F307-T311 PolarHBondContact N-O 2.91Å; N309-T311 PolarHBondContact ND2-OG1 3.04Å; N309-T311 WeakPolarHBondContact OD1-CB 3.41Å; N309-T311 PolarHBondContact OD1-N 2.94Å; N309-T311 PolarHBondContact OD1-OG1 2.83Å
312	L	91.9	Very high	86.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117	166.2	-175.2	156.2	0	0	0	108.5	L257 W271 V273 F282 F304 L305 I306 I314 Y325	L257-L312 PolarHBondContact N-O 3.03Å; L257-L312 PolarHBondContact O-N 2.79Å; W271-L312 HydrophobicContact CB-CD1 4.13Å; W271-L312 HydrophobicContact CD2-CB 4.26Å; W271-L312 HydrophobicContact CD2-CD1 3.97Å; W271-L312 HydrophobicContact CE3-CD1 4.33Å; W271-L312 HydrophobicContact CG-CB 4.47Å; W271-L312 HydrophobicContact CG-CD1 3.91Å; W271-L312 HydrophobicContact CZ2-CB 4.18Å; V273-L312 HydrophobicContact CG2-CD1 3.76Å; F282-L312 HydrophobicContact CD2-CD1 4.38Å; F304-L312 HydrophobicContact CD1-CD2 4.42Å; L305-L312 CarbonylContact O-C 3.56Å; L305-L312 WeakPolarHBondContact O-CA 3.22Å; I306-L312 HydrophobicContact CG1-CD1 4.17Å; I306-L312 HydrophobicContact CG1-CG 4.2Å; L312-I314 HydrophobicContact CD2-CD1 4.42Å; L312-I314 HydrophobicContact CD2-CG1 3.85Å; L312-Y325 HydrophobicContact CD2-CD1 4.07Å; L312-Y325 HydrophobicContact CD2-CE1 4.09Å
313	A	91.3	Very high	87.7	Confident	13 Å²	13	41.7 Å²	41.7	11%	0.107	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	141.8	175.4	0	0	0	0	0	111.8	T256 F304 L305 F307	T256-A313 HydrophobicContact CG2-CB 4.35Å; F304-A313 CarbonylContact C-O 3.56Å; L305-A313 HydrophobicContact CB-CB 4.32Å; L305-A313 PolarHBondContact N-O 3.14Å; L305-A313 PolarHBondContact O-N 3.13Å; F307-A313 HydrophobicContact CE2-CB 4.18Å
314	I	92.1	Very high	88.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	103.8	177.8	-50.2	175.9	0	0	0	105.8	S254 V255 F304 L312 H316 M317 E321 Y325 L342	S254-I314 VanDerWaalsContact CA-O 3.27Å; S254-I314 WeakPolarHBondContact CA-O 3.48Å; V255-I314 HydrophobicContact CB-CB 4.46Å; V255-I314 HydrophobicContact CB-CD1 4.42Å; V255-I314 PolarHBondContact N-O 3.34Å; V255-I314 PolarHBondContact O-N 3.37Å; F304-I314 HydrophobicContact CD1-CG1 4.15Å; F304-I314 HydrophobicContact CE1-CG1 4.41Å; L312-I314 HydrophobicContact CD2-CD1 4.42Å; L312-I314 HydrophobicContact CD2-CG1 3.85Å; I314-H316 PolarHBondContact O-N 2.87Å; I314-M317 HydrophobicContact CG2-SD 4.39Å; I314-E321 HydrophobicContact CG2-CB 4.41Å; I314-E321 HydrophobicContact CG2-CG 4.17Å; I314-Y325 HydrophobicContact CD1-CD1 4.4Å; I314-Y325 HydrophobicContact CD1-CE1 3.58Å; I314-Y325 HydrophobicContact CD1-CE2 4.43Å; I314-Y325 HydrophobicContact CG1-CE1 4.35Å; I314-L342 HydrophobicContact CD1-CD1 3.29Å
315	P	88.6	Confident	88.7	Confident	39 Å²	39	40.2 Å²	40.2	25%	0.253	21%	0.211	S	C	.	.	S	Bend	trans	-66.9	-34.9	-171	-25.7	36.9	0	0	0	114	S254 R303 L305	S254-P315 WeakPolarHBondContact CB-O 3.48Å; R303-P315 WeakPolarHBondContact O-CD 3.28Å; L305-P315 HydrophobicContact CD1-CG 3.77Å; L305-P315 HydrophobicContact CD2-CG 4.26Å; L305-P315 HydrophobicContact CG-CG 3.79Å
316	H	87.6	Confident	89.1	Confident	135 Å²	135	39 Å²	39	63%	0.625	21%	0.205	S	C	*	.	S	Bend	trans	-142.4	109.7	-179.7	-58.6	-55.7	0	0	0	109.4	I314	I314-H316 PolarHBondContact O-N 2.87Å
317	M	88.2	Confident	89.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.			trans	-73.4	125.4	177.5	-170	69.7	-169.3	0	0	111.1	E251 G252 I253 I314 E321 D322 L342 L344	E251-M317 WeakPolarHBondContact CA-O 3.49Å; G252-M317 PolarHBondContact N-O 3.45Å; I253-M317 VanDerWaalsContact O-CB 3.26Å; I253-M317 WeakPolarHBondContact O-CB 3.1Å; I253-M317 PolarHBondContact O-N 2.91Å; I314-M317 HydrophobicContact CG2-SD 4.39Å; M317-E321 VanDerWaalsContact CE-C 3.42Å; M317-E321 HydrophobicContact CE-CB 3.99Å; M317-E321 HydrophobicContact SD-CB 3.71Å; M317-D322 HydrophobicContact CE-CB 4.49Å; M317-D322 WeakPolarHBondContact CE-OD1 3.34Å; M317-L342 HydrophobicContact CE-CB 3.94Å; M317-L342 HydrophobicContact SD-CD1 4.4Å; M317-L344 HydrophobicContact CB-CD2 4.16Å; M317-L344 HydrophobicContact CE-CG 4.39Å; M317-L344 HydrophobicContact CG-CD1 4.41Å; M317-L344 HydrophobicContact CG-CD2 3.46Å; M317-L344 VanDerWaalsContact CG-CD2 3.46Å; M317-L344 HydrophobicContact CG-CG 3.89Å
318	T	88.6	Confident	90	Very high	33 Å²	33	36.4 Å²	36.4	20%	0.202	19%	0.194	C	C	.	.			trans	-128.8	173.8	168	84.4	0	0	0	0	110.4	K320 E321 D322	T318-K320 PolarHBondContact O-N 2.85Å; T318-K320 PolarHBondContact OG1-N 3.35Å; T318-E321 WeakPolarHBondContact CB-OE2 3.33Å; T318-E321 PolarHBondContact N-OE2 3.04Å; T318-E321 PolarHBondContact O-N 2.93Å; T318-E321 PolarHBondContact OG1-OE2 3.3Å; T318-D322 PolarHBondContact O-N 2.9Å
319	T	85.6	Confident	90.7	Very high	96 Å²	96	33.6 Å²	33.6	59%	0.589	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-6.2	176.1	54.1	0	0	0	0	114.6	D322 L344	T319-D322 WeakPolarHBondContact CA-OD2 3.46Å; T319-L344 HydrophobicContact CG2-CD1 4.09Å
320	K	86.6	Confident	91.1	Very high	147 Å²	147	31.1 Å²	31.1	64%	0.639	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-18.4	171.8	-60.9	165.8	-173	161.4	0	112.9	A275 G276 T318	A275-K320 CarbonylContact C-O 3.6Å; G276-K320 PolarHBondContact N-O 3.4Å; T318-K320 PolarHBondContact O-N 2.85Å; T318-K320 PolarHBondContact OG1-N 3.35Å
321	E	89.5	Confident	91.4	Very high	6 Å²	6	31.9 Å²	31.9	3%	0.028	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-8.8	179.4	-73.9	65.4	-133.1	0	0	111.9	R303 F304 I314 M317 T318 G323 Y325	R303-E321 IonicContact CZ-OE1 2.77Å; R303-E321 IonicContact NH1-OE1 2.64Å; R303-E321 PolarHBondContact NH1-OE1 3.29Å; F304-E321 HydrophobicContact CE1-CG 3.97Å; F304-E321 HydrophobicContact CZ-CG 4.17Å; I314-E321 HydrophobicContact CG2-CB 4.41Å; I314-E321 HydrophobicContact CG2-CG 4.17Å; M317-E321 VanDerWaalsContact CE-C 3.42Å; M317-E321 HydrophobicContact CE-CB 3.99Å; M317-E321 HydrophobicContact SD-CB 3.71Å; T318-E321 WeakPolarHBondContact CB-OE2 3.33Å; T318-E321 PolarHBondContact N-OE2 3.04Å; T318-E321 PolarHBondContact O-N 2.93Å; T318-E321 PolarHBondContact OG1-OE2 3.3Å; E321-G323 PolarHBondContact O-N 2.59Å; E321-Y325 WeakPolarHBondContact O-CE2 3.43Å; E321-Y325 PolarHBondContact O-OH 3.13Å
322	D	89.8	Confident	91.3	Very high	38 Å²	38	34.9 Å²	34.9	20%	0.203	19%	0.187	C	C	.	.			trans	-57.4	131.4	170.1	-73.8	-22.5	0	0	0	111.2	G276 M317 T318 T319 A343 L344	G276-D322 PolarHBondContact N-O 2.97Å; M317-D322 HydrophobicContact CE-CB 4.49Å; M317-D322 WeakPolarHBondContact CE-OD1 3.34Å; T318-D322 PolarHBondContact O-N 2.9Å; T319-D322 WeakPolarHBondContact CA-OD2 3.46Å; D322-A343 VanDerWaalsContact OD1-CA 3.27Å; D322-A343 WeakPolarHBondContact OD1-CA 3.29Å; D322-L344 PolarHBondContact OD1-N 3.29Å
323	G	92.1	Very high	91.1	Very high	12 Å²	12	38.7 Å²	38.7	12%	0.124	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.7	-150.7	-177.5	0	0	0	0	0	115.4	I274 E321 K341 L342	I274-G323 CarbonylContact O-C 3.44Å; I274-G323 VanDerWaalsContact O-CA 3.22Å; I274-G323 WeakPolarHBondContact O-CA 3.48Å; E321-G323 PolarHBondContact O-N 2.59Å; G323-K341 CarbonylContact O-C 3.59Å; G323-K341 WeakPolarHBondContact O-CA 3.33Å; G323-K341 VanDerWaalsContact O-CG 3.29Å; G323-K341 WeakPolarHBondContact O-CG 3.49Å; G323-L342 PolarHBondContact N-O 3.18Å; G323-L342 PolarHBondContact O-N 2.77Å
324	N	94.6	Very high	91.1	Very high	33 Å²	33	39.5 Å²	39.5	18%	0.176	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.3	-175.7	-56.2	-92.9	0	0	0	111.1	I274	I274-N324 PolarHBondContact N-O 3.5Å; I274-N324 PolarHBondContact O-N 2.89Å
325	Y	94.9	Very high	91.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	103.4	-178.4	-67.4	-104.8	0	0	0	107.6	L257 V273 F304 L312 I314 E321 V340 L342	L257-Y325 HydrophobicContact CD1-CD1 3.78Å; L257-Y325 HydrophobicContact CD1-CG 3.69Å; V273-Y325 HydrophobicContact CB-CD1 4.28Å; V273-Y325 HydrophobicContact CB-CE1 4.31Å; V273-Y325 HydrophobicContact CG1-CD1 3.74Å; V273-Y325 HydrophobicContact CG1-CE1 3.37Å; V273-Y325 HydrophobicContact CG1-CE2 4.36Å; V273-Y325 HydrophobicContact CG1-CG 4.37Å; V273-Y325 HydrophobicContact CG2-CD1 3.62Å; V273-Y325 HydrophobicContact CG2-CE1 3.95Å; V273-Y325 HydrophobicContact CG2-CG 4.44Å; F304-Y325 HydrophobicContact CD1-CE1 4.42Å; F304-Y325 AromaticContact CE1-CE1 3.99Å; F304-Y325 HydrophobicContact CE1-CE1 3.99Å; F304-Y325 WeakPolarHBondContact CE1-OH 3.42Å; L312-Y325 HydrophobicContact CD2-CD1 4.07Å; L312-Y325 HydrophobicContact CD2-CE1 4.09Å; I314-Y325 HydrophobicContact CD1-CD1 4.4Å; I314-Y325 HydrophobicContact CD1-CE1 3.58Å; I314-Y325 HydrophobicContact CD1-CE2 4.43Å; I314-Y325 HydrophobicContact CG1-CE1 4.35Å; E321-Y325 WeakPolarHBondContact O-CE2 3.43Å; E321-Y325 PolarHBondContact O-OH 3.13Å; Y325-V340 PolarHBondContact N-O 2.03Å; Y325-V340 PolarHBondContact O-N 3.17Å; Y325-L342 HydrophobicContact CD2-CB 4.25Å; Y325-L342 HydrophobicContact CD2-CD1 3.83Å; Y325-L342 HydrophobicContact CD2-CG 3.71Å; Y325-L342 HydrophobicContact CE1-CD1 4.46Å; Y325-L342 HydrophobicContact CE2-CB 3.95Å; Y325-L342 HydrophobicContact CE2-CD1 3.56Å; Y325-L342 HydrophobicContact CE2-CG 3.75Å; Y325-L342 HydrophobicContact CG-CD1 4.43Å
326	T	95.9	Very high	91.6	Very high	13 Å²	13	44.3 Å²	44.3	8%	0.08	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.9	-178.4	-55.9	0	0	0	0	109.3	W271 E272 E337 R338 S339	W271-T326 WeakPolarHBondContact CA-O 3.2Å; E272-T326 PolarHBondContact N-O 3.37Å; E272-T326 PolarHBondContact O-N 2.79Å; T326-E337 HydrophobicContact CG2-CB 4.26Å; T326-R338 CarbonylContact C-O 3.3Å; T326-R338 WeakPolarHBondContact CA-O 3.49Å; T326-S339 PolarHBondContact OG1-OG 3.11Å; T326-S339 VanDerWaalsContact OG1-OG 3.08Å
327	C	95.8	Very high	92	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.3	162.3	-172.7	0	0	0	0	109.4	V236 I238 C259 V269 W271 E337 R338	V236-C327 HydrophobicContact CG1-CB 4.08Å; I238-C327 HydrophobicContact CD1-CB 3.84Å; I238-C327 HydrophobicContact CG1-CB 4.06Å; C259-C327 HydrophobicContact CB-CB 3.7Å; C259-C327 WeakPolarHBondContact CB-SG 3.38Å; C259-C327 WeakPolarHBondContact SG-CB 3.47Å; C259-C327 CovalentContact SG-SG 2.02Å; C259-C327 PolarHBondContact SG-SG 2.64Å; V269-C327 WeakPolarHBondContact CG1-SG 3.17Å; W271-C327 HydrophobicContact CD2-CB 4.05Å; W271-C327 HydrophobicContact CE3-CB 3.89Å; W271-C327 HydrophobicContact CH2-CB 3.99Å; W271-C327 HydrophobicContact CZ2-CB 4.15Å; W271-C327 HydrophobicContact CZ3-CB 3.85Å; C327-E337 CarbonylContact O-C 3.48Å; C327-E337 WeakPolarHBondContact O-CA 3.29Å; C327-E337 WeakPolarHBondContact O-CB 3.27Å; C327-R338 PolarHBondContact N-O 3.08Å; C327-R338 PolarHBondContact O-N 3.14Å
328	S	95.3	Very high	92.4	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.4	174.9	60.3	0	0	0	0	110.2	V269 N270 A336	V269-S328 WeakPolarHBondContact CA-O 3.28Å; N270-S328 PolarHBondContact N-O 3.24Å; N270-S328 PolarHBondContact ND2-OG 3.15Å; N270-S328 PolarHBondContact O-N 3.43Å; N270-S328 PolarHBondContact O-OG 2.95Å; S328-A336 WeakPolarHBondContact CA-O 3.35Å
329	A	94.9	Very high	92.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.1	176.6	0	0	0	0	0	110	P234 V236 T261 P267 Q268 K335 A336	P234-A329 HydrophobicContact CB-CB 4.14Å; P234-A329 WeakPolarHBondContact CG-O 3.31Å; V236-A329 HydrophobicContact CG2-CB 3.46Å; V236-A329 VanDerWaalsContact CG2-CB 3.46Å; T261-A329 HydrophobicContact CG2-CB 3.84Å; P267-A329 HydrophobicContact CB-CB 4.02Å; P267-A329 HydrophobicContact CG-CB 4.14Å; Q268-A329 WeakPolarHBondContact O-CA 3.46Å; A329-K335 WeakPolarHBondContact O-CA 3.04Å; A329-A336 PolarHBondContact N-O 2.98Å; A329-A336 PolarHBondContact O-N 3.38Å
330	V	93.3	Very high	93.1	Very high	66 Å²	66	46.3 Å²	46.3	40%	0.4	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.4	-176.1	-174.6	0	0	0	0	110.2	P267 Q268 G334 K335	P267-V330 CarbonylContact C-O 3.58Å; P267-V330 WeakPolarHBondContact CA-O 3.21Å; P267-V330 WeakPolarHBondContact CB-O 3.49Å; Q268-V330 PolarHBondContact N-O 2.63Å; Q268-V330 PolarHBondContact O-N 3.5Å; V330-G334 WeakPolarHBondContact CA-O 3.43Å; V330-K335 HydrophobicContact CG2-CB 4.12Å; V330-K335 HydrophobicContact CG2-CD 4.3Å; V330-K335 HydrophobicContact CG2-CG 3.91Å
331	N	92	Very high	93.4	Very high	20 Å²	20	46.2 Å²	46.2	11%	0.107	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	-177.5	160.7	73.1	11.3	0	0	0	109.8	E232 P234 P265 P267 L333 G334	E232-N331 PolarHBondContact O-ND2 2.89Å; P234-N331 WeakPolarHBondContact CD-OD1 3Å; P265-N331 WeakPolarHBondContact O-CB 3.02Å; P265-N331 PolarHBondContact O-ND2 2.97Å; P267-N331 HydrophobicContact CB-CB 4.14Å; N331-L333 PolarHBondContact O-N 3.04Å; N331-L333 WeakPolarHBondContact OD1-CA 3.24Å; N331-L333 WeakPolarHBondContact OD1-CB 3.25Å; N331-L333 PolarHBondContact OD1-N 3.44Å; N331-G334 PolarHBondContact N-O 2.96Å; N331-G334 PolarHBondContact O-N 2.94Å; N331-G334 VanDerWaalsContact O-N 3.08Å; N331-G334 PolarHBondContact OD1-N 2.91Å
332	E	87.9	Confident	93.5	Very high	77 Å²	77	45.9 Å²	45.9	36%	0.36	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11.9	179.4	44.3	168	-153.7	0	0	115.1	S187 C188 S189 P265	S187-E332 WeakPolarHBondContact CB-OE1 3.22Å; S187-E332 WeakPolarHBondContact CB-OE2 3.14Å; S187-E332 VanDerWaalsContact OG-CD 3.28Å; S187-E332 PolarHBondContact OG-OE1 2.87Å; S187-E332 PolarHBondContact OG-OE2 3.32Å; C188-E332 WeakPolarHBondContact CA-OE1 3.25Å; C188-E332 WeakPolarHBondContact CB-OE1 3.32Å; C188-E332 PolarHBondContact N-OE1 2.87Å; S189-E332 WeakPolarHBondContact CB-OE2 3.26Å; S189-E332 PolarHBondContact N-OE1 2.97Å; S189-E332 PolarHBondContact N-OE2 3.07Å; S189-E332 PolarHBondContact OG-OE2 3.47Å; P265-E332 VanDerWaalsContact CD-OE1 3.31Å; P265-E332 WeakPolarHBondContact CD-OE1 3.46Å; P265-E332 HydrophobicContact CG-CG 3.91Å; P265-E332 WeakPolarHBondContact CG-OE1 3.29Å
333	L	89.5	Confident	93.5	Very high	80 Å²	80	46.6 Å²	46.6	42%	0.419	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-13.8	172.8	-72.7	-60.3	0	0	0	112.7	C188 C231 A233 N331	C188-L333 HydrophobicContact CB-CD2 3.65Å; C231-L333 HydrophobicContact CB-CD1 4.47Å; C231-L333 HydrophobicContact CB-CD2 4.3Å; C231-L333 HydrophobicContact CB-CG 4.42Å; A233-L333 HydrophobicContact CB-CB 4.13Å; N331-L333 PolarHBondContact O-N 3.04Å; N331-L333 WeakPolarHBondContact OD1-CA 3.24Å; N331-L333 WeakPolarHBondContact OD1-CB 3.25Å; N331-L333 PolarHBondContact OD1-N 3.44Å
334	G	90.8	Very high	93.3	Very high	30 Å²	30	47.1 Å²	47.1	31%	0.309	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	154.7	-167.8	175.1	0	0	0	0	0	116.1	P234 V330 N331	P234-G334 WeakPolarHBondContact CD-O 3.48Å; P234-G334 VanDerWaalsContact CG-O 3.31Å; P234-G334 WeakPolarHBondContact CG-O 3.43Å; V330-G334 WeakPolarHBondContact CA-O 3.43Å; N331-G334 PolarHBondContact N-O 2.96Å; N331-G334 PolarHBondContact O-N 2.94Å; N331-G334 VanDerWaalsContact O-N 3.08Å; N331-G334 PolarHBondContact OD1-N 2.91Å
335	K	94.3	Very high	92.7	Very high	118 Å²	118	47.5 Å²	47.5	51%	0.513	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.5	175.3	177.7	-180	-171.6	-152.9	0	110.3	A329 V330 E337	A329-K335 WeakPolarHBondContact O-CA 3.04Å; V330-K335 HydrophobicContact CG2-CB 4.12Å; V330-K335 HydrophobicContact CG2-CD 4.3Å; V330-K335 HydrophobicContact CG2-CG 3.91Å; K335-E337 WeakPolarHBondContact CE-OE2 3.29Å; K335-E337 IonicContact NZ-OE2 2.7Å; K335-E337 PolarHBondContact NZ-OE2 3.01Å
336	A	96.2	Very high	91.6	Very high	24 Å²	24	53.3 Å²	53.3	20%	0.198	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.2	164.2	0	0	0	0	0	110.5	P234 V236 S328 A329	P234-A336 HydrophobicContact CB-CB 4.43Å; P234-A336 HydrophobicContact CG-CB 4.14Å; P234-A336 WeakPolarHBondContact O-CB 3.47Å; V236-A336 HydrophobicContact CG2-CB 4.01Å; S328-A336 WeakPolarHBondContact CA-O 3.35Å; A329-A336 PolarHBondContact N-O 2.98Å; A329-A336 PolarHBondContact O-N 3.38Å
337	E	96	Very high	89.8	Confident	107 Å²	107	57.6 Å²	57.6	50%	0.5	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	155.2	178.7	59.3	-174.6	-116.9	0	0	111.5	T326 C327 K335	T326-E337 HydrophobicContact CG2-CB 4.26Å; C327-E337 CarbonylContact O-C 3.48Å; C327-E337 WeakPolarHBondContact O-CA 3.29Å; C327-E337 WeakPolarHBondContact O-CB 3.27Å; K335-E337 WeakPolarHBondContact CE-OE2 3.29Å; K335-E337 IonicContact NZ-OE2 2.7Å; K335-E337 PolarHBondContact NZ-OE2 3.01Å
338	R	96.2	Very high	87.6	Confident	114 Å²	114	63.5 Å²	63.5	43%	0.43	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	140.7	173.1	-168.3	177.9	-62.9	-115.3	-0.5	109.2	V236 I238 T326 C327	V236-R338 HydrophobicContact CB-CB 4.4Å; V236-R338 HydrophobicContact CG1-CB 3.86Å; V236-R338 VanDerWaalsContact O-CZ 3.27Å; V236-R338 PolarHBondContact O-NE 2.91Å; V236-R338 PolarHBondContact O-NH2 2.97Å; I238-R338 HydrophobicContact CD1-CB 3.98Å; I238-R338 HydrophobicContact CD1-CG 4.28Å; I238-R338 WeakPolarHBondContact CD1-O 3.44Å; I238-R338 HydrophobicContact CG1-CB 4.27Å; T326-R338 CarbonylContact C-O 3.3Å; T326-R338 WeakPolarHBondContact CA-O 3.49Å; C327-R338 PolarHBondContact N-O 3.08Å; C327-R338 PolarHBondContact O-N 3.14Å
339	S	95.4	Very high	85.1	Confident	63 Å²	63	73 Å²	73	44%	0.441	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.1	176.9	-65.2	0	0	0	0	111.2	T326	T326-S339 PolarHBondContact OG1-OG 3.11Å; T326-S339 VanDerWaalsContact OG1-OG 3.08Å
340	V	94.3	Very high	82.5	Confident	22 Å²	22	82.3 Å²	82.3	13%	0.133	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.5	164.9	175.5	0	0	0	0	108.4	I238 I244 Y325 L342	I238-V340 HydrophobicContact CB-CG2 4.01Å; I238-V340 HydrophobicContact CD1-CG2 4.06Å; I238-V340 HydrophobicContact CG2-CG2 3.74Å; I244-V340 HydrophobicContact CD1-CG1 3.77Å; Y325-V340 PolarHBondContact N-O 2.03Å; Y325-V340 PolarHBondContact O-N 3.17Å; V340-L342 HydrophobicContact CG1-CD2 4.22Å
341	K	92.6	Very high	79.7	Confident	144 Å²	144	82 Å²	82	63%	0.626	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.9	174.7	-170.4	-176.7	177.6	-177.2	0	109.7	G323	G323-K341 CarbonylContact O-C 3.59Å; G323-K341 WeakPolarHBondContact O-CA 3.33Å; G323-K341 VanDerWaalsContact O-CG 3.29Å; G323-K341 WeakPolarHBondContact O-CG 3.49Å
342	L	92.1	Very high	76.9	Confident	0 Å²	0	86.7 Å²	86.7	0%	0	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.5	169.2	-56.8	-172.9	0	0	0	109.4	I244 L249 V255 I314 M317 G323 Y325 V340	I244-L342 HydrophobicContact CD1-CD2 3.41Å; I244-L342 VanDerWaalsContact CD1-CD2 3.41Å; I244-L342 HydrophobicContact CG1-CD2 4.09Å; I244-L342 HydrophobicContact CG2-CD2 4.33Å; L249-L342 HydrophobicContact CD1-CB 4.45Å; L249-L342 HydrophobicContact CD1-CD2 4.16Å; V255-L342 HydrophobicContact CG1-CD1 4.08Å; V255-L342 HydrophobicContact CG1-CD2 4.25Å; I314-L342 HydrophobicContact CD1-CD1 3.29Å; M317-L342 HydrophobicContact CE-CB 3.94Å; M317-L342 HydrophobicContact SD-CD1 4.4Å; G323-L342 PolarHBondContact N-O 3.18Å; G323-L342 PolarHBondContact O-N 2.77Å; Y325-L342 HydrophobicContact CD2-CB 4.25Å; Y325-L342 HydrophobicContact CD2-CD1 3.83Å; Y325-L342 HydrophobicContact CD2-CG 3.71Å; Y325-L342 HydrophobicContact CE1-CD1 4.46Å; Y325-L342 HydrophobicContact CE2-CB 3.95Å; Y325-L342 HydrophobicContact CE2-CD1 3.56Å; Y325-L342 HydrophobicContact CE2-CG 3.75Å; Y325-L342 HydrophobicContact CG-CD1 4.43Å; V340-L342 HydrophobicContact CG1-CD2 4.22Å
343	A	88.7	Confident	74.2	Confident	52 Å²	52	90.3 Å²	90.3	43%	0.43	52%	0.516	S	S	.	.			trans	-151.1	131.2	171.7	0	0	0	0	0	109.3	D322	D322-A343 VanDerWaalsContact OD1-CA 3.27Å; D322-A343 WeakPolarHBondContact OD1-CA 3.29Å
344	L	88.6	Confident	71.5	Confident	24 Å²	24	91.7 Å²	91.7	13%	0.126	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-65.2	146.7	166.5	-71.2	-177.4	0	0	0	111	L249 H250 E251 M317 T319 D322	L249-L344 HydrophobicContact CB-CD2 4.02Å; H250-L344 WeakPolarHBondContact O-CD2 3.32Å; E251-L344 HydrophobicContact CB-CD1 4.22Å; M317-L344 HydrophobicContact CB-CD2 4.16Å; M317-L344 HydrophobicContact CE-CG 4.39Å; M317-L344 HydrophobicContact CG-CD1 4.41Å; M317-L344 HydrophobicContact CG-CD2 3.46Å; M317-L344 VanDerWaalsContact CG-CD2 3.46Å; M317-L344 HydrophobicContact CG-CG 3.89Å; T319-L344 HydrophobicContact CG2-CD1 4.09Å; D322-L344 PolarHBondContact OD1-N 3.29Å
345	A	81.8	Confident	68.8	Low	40 Å²	40	96.5 Å²	96.5	33%	0.331	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-66.7	142.9	168.9	0	0	0	0	0	111.4	V248 L249 S347	V248-A345 HydrophobicContact CG1-CB 3.34Å; L249-A345 PolarHBondContact O-N 3.23Å; A345-S347 PolarHBondContact O-N 2.97Å
346	P	71.4	Confident	66	Low	122 Å²	122	96.4 Å²	96.4	79%	0.792	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-61	125.6	170.9	27	-33.7	0	0	0	109.3
347	S	58.1	Low	62.6	Low	104 Å²	104	102.7 Å²	102.7	73%	0.727	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.2	133.8	173.2	49.9	0	0	0	0	109.8	A345 K349	A345-S347 PolarHBondContact O-N 2.97Å; S347-K349 PolarHBondContact O-N 3.07Å
348	P	50.8	Low	59.5	Low	123 Å²	123	102.4 Å²	102.4	80%	0.799	61%	0.607	S	S	*	*			trans	-64.5	114.6	-179.3	25.1	-33	0	0	0	109	Q350	P348-Q350 PolarHBondContact O-N 2.77Å
349	K	43.1	Very low	56.3	Low	204 Å²	204	103.6 Å²	103.6	89%	0.887	63%	0.627	S	S	*	*			trans	-58	114.9	173.6	-68.6	-178.5	179.3	178.5	0	108.2	S347 G351	S347-K349 PolarHBondContact O-N 3.07Å; K349-G351 PolarHBondContact O-N 3.38Å
350	Q	39.8	Very low	53.1	Low	195 Å²	195	108.7 Å²	108.7	91%	0.911	65%	0.648	S	S	*	*			trans	-58.5	115.8	169.9	-79.1	-178.9	-46.4	0	0	108.5	P348 S352	P348-Q350 PolarHBondContact O-N 2.77Å; Q350-S352 PolarHBondContact O-N 3.08Å
351	G	33.9	Very low	49.9	Very low	60 Å²	60	114.5 Å²	114.5	62%	0.619	68%	0.678	S	S	*	*			trans	-62.5	120	174.6	0	0	0	0	0	109.5	K349 N353	K349-G351 PolarHBondContact O-N 3.38Å; G351-N353 VanDerWaalsContact C-N 3.28Å; G351-N353 PolarHBondContact O-N 2.8Å
352	S	32.7	Very low	46.8	Very low	117 Å²	117	116.7 Å²	116.7	82%	0.818	69%	0.688	S	S	*	*			trans	-68	90.4	167.2	171.3	0	0	0	0	108.4	Q350 S354	Q350-S352 PolarHBondContact O-N 3.08Å; S352-S354 VanDerWaalsContact C-N 3.31Å; S352-S354 PolarHBondContact O-N 3.03Å
353	N	33.3	Very low	43.5	Very low	154 Å²	154	122.4 Å²	122.4	82%	0.824	73%	0.728	S	S	*	*			trans	-63.7	89.9	174.1	-76.6	-12.4	0	0	0	110	G351 V355	G351-N353 VanDerWaalsContact C-N 3.28Å; G351-N353 PolarHBondContact O-N 2.8Å; N353-V355 PolarHBondContact O-N 3.1Å
354	S	31.7	Very low	40.5	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-61.6	123.9	162.1	50.9	0	0	0	0	108.7	S352	S352-S354 VanDerWaalsContact C-N 3.31Å; S352-S354 PolarHBondContact O-N 3.03Å
355	V	35.1	Very low	37.6	Very low	131 Å²	131	133 Å²	133	79%	0.794	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-58.4	142.3	-173.6	179.6	0	0	0	0	111.4	N353 D357	N353-V355 PolarHBondContact O-N 3.1Å; V355-D357 PolarHBondContact O-N 3.19Å
356	P	33.8	Very low	35.2	Very low	115 Å²	115	137 Å²	137	75%	0.747	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67	127.9	171.2	-13.4	28.2	0	0	0	110.4
357	D	25.7	Very low	33	Very low	156 Å²	156	135 Å²	135	83%	0.834	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75	125.5	173.7	-168.8	6.8	0	0	0	110.2	V355	V355-D357 PolarHBondContact O-N 3.19Å
358	S	30.7	Very low	31.5	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	81%	0.807	S	S	*	*			trans	-117.2	101.8	-178.9	62.7	0	0	0	0	109.8	L360	S358-L360 PolarHBondContact O-N 2.9Å; S358-L360 VanDerWaalsContact O-N 3.13Å
359	T	28.1	Very low	30.1	Very low	139 Å²	139	142 Å²	142	85%	0.853	81%	0.805	S	S	*	*			trans	-62.9	111.6	177.4	52.7	0	0	0	0	111.1
360	L	29.5	Very low	29.3	Very low	169 Å²	169	139.4 Å²	139.4	89%	0.885	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-94.8	129	170.7	-158.8	83.2	0	0	0	110	S358	S358-L360 PolarHBondContact O-N 2.9Å; S358-L360 VanDerWaalsContact O-N 3.13Å
361	D	26.9	Very low	28.5	Very low	144 Å²	144	135 Å²	135	77%	0.77	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-83.6	164.4	173.7	-151.8	-7.8	0	0	0	112
362	K	26.4	Very low	28.1	Very low	190 Å²	190	139.4 Å²	139.4	83%	0.826	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-86.5	150.9	-156.9	-63.6	160.6	-176.2	159.5	0	114.7
363	S	24.6	Very low	28.5	Very low	120 Å²	120	139.1 Å²	139.1	84%	0.839	79%	0.791	S	S	*	*			trans	-150.9	164.5	148.8	31.2	0	0	0	0	111.5
364	H	25.7	Very low	28	Very low	178 Å²	178	141.5 Å²	141.5	82%	0.824	79%	0.794	S	S	*	*			trans	-67.8	145.5	-165.8	-76	-48.3	0	0	0	114.6
365	V	26.5	Very low	27.6	Very low	120 Å²	120	142.7 Å²	142.7	73%	0.727	80%	0.796	S	S	*	*			cis	73.6	137.8	49.2	173.6	0	0	0	0	112.4
366	P	32	Very low	27.2	Very low	125 Å²	125	142 Å²	142	81%	0.812	79%	0.793	S	S	*	*			cis	-129.1	176.5	-13.3	37.5	-20.3	0	0	0	115.6
367	G	24.3	Very low	26.9	Very low	80 Å²	80	145.2 Å²	145.2	83%	0.825	80%	0.795	S	S	*	*			trans	-175.9	103.5	169.1	0	0	0	0	0	118.3
368	K	26	Very low	26.9	Very low	204 Å²	204	145.2 Å²	145.2	89%	0.887	80%	0.795	S	S	*	*			trans	-65.5	132.1	-171.3	-71.6	168.9	173.4	171.5	0	118.8
369	K	23.3	Very low	26.6	Very low	170 Å²	170	146.6 Å²	146.6	74%	0.739	79%	0.794	S	S	*	*				63.8	123.2	125.5	-76.2	-173.3	153.3	-141.9	0	125.4
370	H	25.3	Very low	26.4	Very low	149 Å²	149	146.4 Å²	146.4	69%	0.69	79%	0.793	S	S	*	*				91	150.4	129.5	-73.7	-51	0	0	0	124.1
371	S	23	Very low	26.2	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	78%	0.78	S	S	*	*			trans	64.5	144.7	172.1	61	0	0	0	0	117.8
372	D	25.7	Very low	25.9	Very low	154 Å²	154	143.9 Å²	143.9	82%	0.824	78%	0.778	S	S	*	*			cis	-159.3	166.3	-18.6	-108.1	-24.5	0	0	0	110.2
373	P	40.7	Very low	25.8	Very low	111 Å²	111	144.4 Å²	144.4	72%	0.721	78%	0.777	S	S	*	*			trans	-93.3	143.8	-172.4	35.1	-34.5	0	0	0	115
374	K	23.4	Very low	25.7	Very low	204 Å²	204	143.6 Å²	143.6	89%	0.887	77%	0.771	S	S	*	*			trans	-170	155.8	161.6	-119.1	165.4	-171.4	170.8	0	117.6
375	V	23.6	Very low	25.6	Very low	134 Å²	134	142.3 Å²	142.3	81%	0.812	77%	0.77	S	S	*	*			trans	81.2	154.5	155.3	174.3	0	0	0	0	119
376	T	25.4	Very low	25.5	Very low	117 Å²	117	145.3 Å²	145.3	72%	0.718	77%	0.774	S	S	*	*			trans	-138.6	-178.1	-165.3	50.6	0	0	0	0	112
377	K	27.7	Very low	25.2	Very low	181 Å²	181	145.6 Å²	145.6	79%	0.787	77%	0.768	S	S	*	*			trans	86	144.3	174	-55	-177	177.5	-179.7	0	114.3
378	N	25.7	Very low	25.3	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	76%	0.755	S	S	*	*				-138.8	172	52.7	-89.2	-31.5	0	0	0	117.4
379	N	25.2	Very low	25.1	Very low	131 Å²	131	147.2 Å²	147.2	70%	0.701	76%	0.758	S	S	*	*			trans	-100.9	168.2	179.9	-64.4	-11.4	0	0	0	113	I381	N379-I381 HydrophobicContact CB-CD1 4.18Å; N379-I381 HydrophobicContact CB-CG1 4.49Å
380	V	23.3	Very low	25.1	Very low	135 Å²	135	146.8 Å²	146.8	82%	0.818	76%	0.756	S	S	*	*				174.8	116.1	127.1	153.8	0	0	0	0	105.7
381	I	25.6	Very low	25	Very low	121 Å²	121	146.2 Å²	146.2	62%	0.621	76%	0.763	S	S	*	*			cis	83.4	105.3	46.9	-61.7	171.9	0	0	0	113.8	N379	N379-I381 HydrophobicContact CB-CD1 4.18Å; N379-I381 HydrophobicContact CB-CG1 4.49Å
382	N	21.5	Very low	25.1	Very low	138 Å²	138	149.9 Å²	149.9	74%	0.738	77%	0.766	S	S	*	*				-168.6	169	117.6	-114.5	-12.4	0	0	0	115.6
383	Y	23.2	Very low	24.9	Very low	201 Å²	201	148.3 Å²	148.3	79%	0.788	75%	0.754	S	S	*	*			trans	-55	156.7	-171.2	-59.8	-82.4	0	0	0	116.9
384	S	23	Very low	24	Very low	104 Å²	104	152 Å²	152	73%	0.727	75%	0.753	S	S	*	*			cis	96.8	129.3	19.2	-52.6	0	0	0	0	117.8
385	N	23.6	Very low	24	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	74%	0.742	S	S	*	*			trans	-157.1	119.5	147.7	-92.6	-34.7	0	0	0	106.2
386	K	24.1	Very low	24	Very low	183 Å²	183	147.6 Å²	147.6	80%	0.796	74%	0.739	S	S	*	*				64.2	112.7	84.6	-80.4	-169.8	174.6	-175.2	0	112.1
387	N	25.2	Very low	23.9	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	74%	0.741	S	S	*	*			cis	56.6	136.6	34.7	-65.5	43	0	0	0	112.4
388	E	26.6	Very low	23.7	Very low	118 Å²	118	144.1 Å²	144.1	55%	0.551	73%	0.731	S	S	*	*			cis	-167.8	166.8	12.2	-130.3	165	-116.3	0	0	109.4	K390	E388-K390 VanDerWaalsContact OE2-CD 3.31Å; E388-K390 WeakPolarHBondContact OE2-CD 3.41Å; E388-K390 WeakPolarHBondContact OE2-CE 3.31Å; E388-K390 IonicContact OE2-NZ 2.62Å; E388-K390 PolarHBondContact OE2-NZ 2.72Å
389	E	22.1	Very low	23.6	Very low	201 Å²	201	140.1 Å²	140.1	94%	0.939	72%	0.715	S	S	*	*			trans	-142.4	154.9	147.6	-155.4	158.3	-129.9	0	0	110.6
390	K	24.1	Very low	23.6	Very low	160 Å²	160	141.9 Å²	141.9	70%	0.696	72%	0.717	S	S	*	*			trans	-148	132	-147.9	-116.2	178.5	176.4	142	0	115.5	E388	E388-K390 VanDerWaalsContact OE2-CD 3.31Å; E388-K390 WeakPolarHBondContact OE2-CD 3.41Å; E388-K390 WeakPolarHBondContact OE2-CE 3.31Å; E388-K390 IonicContact OE2-NZ 2.62Å; E388-K390 PolarHBondContact OE2-NZ 2.72Å
391	T	22.9	Very low	23.8	Very low	137 Å²	137	141.5 Å²	141.5	84%	0.84	71%	0.706	S	S	*	*			trans	-159.5	130	144	13.9	0	0	0	0	107.9
392	K	24.3	Very low	23.7	Very low	179 Å²	179	143.3 Å²	143.3	78%	0.778	71%	0.709	S	S	*	*				62.4	131.4	51.9	-89.4	-160.8	168.5	-161.3	0	112.8
393	E	21.8	Very low	23.7	Very low	122 Å²	122	142.2 Å²	142.2	57%	0.57	71%	0.708	S	S	*	*			cis	-146.1	174.9	5.1	-66.1	-154.5	59.1	0	0	109.3
394	R	22.3	Very low	23.7	Very low	187 Å²	187	138.3 Å²	138.3	71%	0.706	71%	0.71	S	S	*	*			cis	-142.8	160.3	2.6	-103.7	132.6	-154.1	-168	16.5	107
395	T	22.5	Very low	23.7	Very low	105 Å²	105	137 Å²	137	64%	0.644	71%	0.713	S	S	*	*				65.4	143.6	66	84.4	0	0	0	0	118.8
396	D	23.3	Very low	23.7	Very low	141 Å²	141	135 Å²	135	75%	0.754	71%	0.71	S	S	*	*			trans	77.9	138	159.6	-46.8	-42.9	0	0	0	118.7
397	D	23.5	Very low	23.7	Very low	142 Å²	142	135.7 Å²	135.7	76%	0.759	72%	0.717	S	S	*	*			cis	-145.9	170	-6	-160.8	-0.4	0	0	0	112.4
398	S	23.2	Very low	23.7	Very low	84 Å²	84	138.9 Å²	138.9	59%	0.587	72%	0.724	S	S	*	*			trans	-64.9	-174.5	165.6	87.7	0	0	0	0	113.2
399	S	24.3	Very low	23.5	Very low	72 Å²	72	138.2 Å²	138.2	50%	0.503	74%	0.739	S	S	.	*			cis	-179.1	176.3	-31.6	55.8	0	0	0	0	110.1
400	K	26.1	Very low	23.6	Very low	168 Å²	168	132.5 Å²	132.5	73%	0.73	73%	0.734	S	S	*	*			trans	71.8	164.6	154.3	-67.6	164	-164.3	146.4	0	116
401	H	25.9	Very low	23.7	Very low	127 Å²	127	128.6 Å²	128.6	59%	0.588	74%	0.739	S	S	*	*			cis	-157.4	151.3	1.1	-126.7	1.1	0	0	0	113
402	K	23.9	Very low	23.7	Very low	159 Å²	159	131.6 Å²	131.6	69%	0.691	74%	0.741	S	S	*	*			trans	50.2	163.4	132.7	-73.4	177.3	-178.6	155.4	0	120.7
403	T	22.6	Very low	23.8	Very low	116 Å²	116	134.7 Å²	134.7	71%	0.712	75%	0.749	S	S	*	*			cis	-153.1	136.3	-0.7	4.4	0	0	0	0	107.5
404	S	22	Very low	23.9	Very low	118 Å²	118	138 Å²	138	83%	0.825	76%	0.761	S	S	*	*				66.7	120.5	93.1	-167.7	0	0	0	0	117.3
405	G	23.3	Very low	24	Very low	77 Å²	77	135.9 Å²	135.9	79%	0.794	76%	0.764	S	S	*	*			trans	-160.3	138.8	161.6	0	0	0	0	0	108
406	S	22.7	Very low	24.3	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	76%	0.764	S	S	*	*			trans	-152.6	135.2	-165.9	173.7	0	0	0	0	112.1
407	E	24.8	Very low	24.6	Very low	199 Å²	199	134.3 Å²	134.3	93%	0.93	77%	0.767	S	S	*	*			trans	-151.5	159.3	160.7	-125.7	164.9	-145.1	0	0	110.9
408	K	24.6	Very low	25	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.857	76%	0.764	S	S	*	*			trans	-135.1	137.3	-173.1	-69.6	179.6	176.4	179.3	0	111.3
409	A	23.9	Very low	25.5	Very low	105 Å²	105	133.9 Å²	133.9	87%	0.868	76%	0.762	S	S	*	*			trans	174.8	163.2	133.6	0	0	0	0	0	111.5
410	G	23.3	Very low	26.4	Very low	81 Å²	81	136 Å²	136	84%	0.835	78%	0.777	S	S	*	*			trans	92.6	96.1	164.2	0	0	0	0	0	115
411	G	25.8	Very low	27.5	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	76%	0.756	S	S	*	*			trans	-85.8	128.3	175.9	0	0	0	0	0	113
412	F	23.7	Very low	28.6	Very low	200 Å²	200	126 Å²	126	88%	0.877	74%	0.735	S	S	*	*			trans	-129.3	146.1	153.2	-101.8	-96.3	0	0	0	107.4	K414	F412-K414 PolarHBondContact O-N 3.42Å
413	Y	25.7	Very low	29.5	Very low	245 Å²	245	121 Å²	121	96%	0.961	73%	0.728	S	S	*	*			trans	-64.9	102.6	172.6	-83.6	-95	0	0	0	109.4
414	K	24.2	Very low	30.4	Very low	190 Å²	190	118.8 Å²	118.8	83%	0.826	71%	0.714	S	S	*	*			trans	-104	138.1	157	-72.6	-175.3	174.9	-179	0	107.4	F412	F412-K414 PolarHBondContact O-N 3.42Å
415	D	25.6	Very low	31.6	Very low	144 Å²	144	123.2 Å²	123.2	77%	0.77	71%	0.713	S	S	*	*			trans	-51.4	153.6	164.8	-76.1	-65.2	0	0	0	111.2	S417	D415-S417 PolarHBondContact O-N 3.11Å
416	P	28.3	Very low	32.3	Very low	97 Å²	97	129.9 Å²	129.9	63%	0.63	72%	0.723	S	S	*	*			trans	-54.7	112.6	168.9	24.9	-33.9	0	0	0	108.4	F418	P416-F418 HydrophobicContact CG-CE2 4.29Å; P416-F418 WeakPolarHBondContact O-CD2 3.44Å; P416-F418 PolarHBondContact O-N 2.95Å
417	S	29.2	Very low	33.1	Very low	116 Å²	116	128.4 Å²	128.4	81%	0.811	73%	0.725	S	S	*	*			trans	-66.1	106.2	-171.9	54.2	0	0	0	0	110.2	D415 G419	D415-S417 PolarHBondContact O-N 3.11Å; S417-G419 PolarHBondContact O-N 2.84Å
418	F	32.9	Very low	33.8	Very low	163 Å²	163	121.1 Å²	121.1	72%	0.715	70%	0.696	S	S	*	*			trans	-69.3	58.3	174.9	-78.8	-91.7	0	0	0	111.9	P416 K421	P416-F418 HydrophobicContact CG-CE2 4.29Å; P416-F418 WeakPolarHBondContact O-CD2 3.44Å; P416-F418 PolarHBondContact O-N 2.95Å; F418-K421 HydrophobicContact CD1-CG 4.49Å
419	G	32.3	Very low	34.3	Very low	53 Å²	53	118.4 Å²	118.4	55%	0.546	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	134.8	173.4	0	0	0	0	0	111	S417 K421	S417-G419 PolarHBondContact O-N 2.84Å; G419-K421 PolarHBondContact O-N 3.37Å
420	S	44.1	Very low	35	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.8	53.6	170.8	61.3	0	0	0	0	116.8
421	K	49.4	Very low	35.8	Very low	68 Å²	68	119.5 Å²	119.5	30%	0.296	65%	0.648	S	S	.	*			trans	-87.9	-18.3	161.6	-85.7	-87.5	175.4	-170.2	0	114	F418 G419 G423 G553 Q554 D555	F418-K421 HydrophobicContact CD1-CG 4.49Å; G419-K421 PolarHBondContact O-N 3.37Å; K421-G423 VanDerWaalsContact C-N 3.29Å; K421-G423 PolarHBondContact O-N 3.49Å; K421-G553 PolarHBondContact NZ-O 2.8Å; K421-Q554 PolarHBondContact NZ-O 3Å; K421-D555 IonicContact NZ-OD1 2.66Å; K421-D555 PolarHBondContact NZ-OD1 2.93Å
422	C	48	Very low	36.3	Very low	19 Å²	19	119.3 Å²	119.3	13%	0.128	64%	0.635	C	S	.	*	S	Bend	trans	-88.6	57.8	170.5	-51	0	0	0	0	110.7	C512 H519	C422-C512 HydrophobicContact CB-CB 3.84Å; C422-C512 WeakPolarHBondContact CB-SG 3.11Å; C422-C512 WeakPolarHBondContact SG-CB 2.95Å; C422-C512 CovalentContact SG-SG 2.05Å; C422-C512 PolarHBondContact SG-SG 3.26Å; C422-H519 HydrophobicContact CB-CB 3.36Å; C422-H519 WeakPolarHBondContact O-CB 3.33Å
423	G	43	Very low	37.1	Very low	54 Å²	54	111.2 Å²	111.2	56%	0.557	60%	0.601	S	S	*	*			trans	-111.3	98.7	-173	0	0	0	0	0	113.5	K421	K421-G423 VanDerWaalsContact C-N 3.29Å; K421-G423 PolarHBondContact O-N 3.49Å
424	V	42.6	Very low	37.5	Very low	69 Å²	69	107.7 Å²	107.7	42%	0.418	59%	0.593	S	S	.	*			trans	-65.5	137.8	177.3	-176.3	0	0	0	0	110.8
425	R	46.4	Very low	38	Very low	210 Å²	210	99.9 Å²	99.9	79%	0.792	56%	0.564	S	S	*	*			trans	-134.4	163	171.8	-67.3	-170.5	-179.6	-162.8	2.7	109.8	G427 S428	R425-G427 PolarHBondContact O-N 2.98Å; R425-S428 PolarHBondContact O-N 2.96Å; R425-S428 PolarHBondContact O-OG 3.18Å; R425-S428 VanDerWaalsContact O-OG 3.12Å
426	E	37.7	Very low	38.5	Very low	217 Å²	217	97.9 Å²	97.9	100%	1.014	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	8	-167.7	-60.9	173.9	126.2	0	0	116.8
427	G	39	Very low	38.7	Very low	76 Å²	76	100.9 Å²	100.9	78%	0.784	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	14	176.7	0	0	0	0	0	115	R425	R425-G427 PolarHBondContact O-N 2.98Å
428	S	39.7	Very low	39.1	Very low	47 Å²	47	100.8 Å²	100.8	33%	0.329	55%	0.547	S	S	.	.			trans	-92.2	119.3	176.2	58.6	0	0	0	0	111.8	R425	R425-S428 PolarHBondContact O-N 2.96Å; R425-S428 PolarHBondContact O-OG 3.18Å; R425-S428 VanDerWaalsContact O-OG 3.12Å
429	E	36.4	Very low	39.4	Very low	140 Å²	140	97.8 Å²	97.8	65%	0.654	54%	0.543	S	S	*	.			trans	-70.1	141.3	178.4	-64.6	-172.5	146	0	0	112.4	F450	E429-F450 WeakPolarHBondContact OE2-CE2 3.5Å
430	Y	37.6	Very low	39.6	Very low	135 Å²	135	101.7 Å²	101.7	53%	0.529	55%	0.55	S	S	.	*			trans	-108.4	89.9	-164.1	-121.6	-87	0	0	0	112	S432	Y430-S432 PolarHBondContact O-N 3.46Å
431	I	40.9	Very low	39.4	Very low	73 Å²	73	100.7 Å²	100.7	37%	0.374	54%	0.536	S	S	.	.	B	Isolated β-bridge	trans	-79.6	104.7	174	-53.6	-179.9	0	0	0	108.9	F450 V558	I431-F450 HydrophobicContact CD1-CB 3.89Å; I431-F450 HydrophobicContact CD1-CD2 4.04Å; I431-F450 HydrophobicContact CD1-CG 4.28Å; I431-V558 HydrophobicContact CD1-CG1 4.44Å
432	S	35.6	Very low	38.7	Very low	74 Å²	74	98.9 Å²	98.9	52%	0.517	53%	0.529	S	S	.	.			trans	-97.5	140.5	-169.9	-172.3	0	0	0	0	113	Y430 H434	Y430-S432 PolarHBondContact O-N 3.46Å; S432-H434 PolarHBondContact O-N 2.93Å
433	N	39.6	Very low	38.2	Very low	30 Å²	30	100.5 Å²	100.5	16%	0.16	54%	0.536	C	S	.	.	G	3₁₀ helix	trans	-71.8	15.1	-170.2	-154	56.3	0	0	0	115.9	A435 F436 V561 T563	N433-A435 PolarHBondContact O-N 3.06Å; N433-F436 WeakPolarHBondContact OD1-CD2 3.42Å; N433-F436 WeakPolarHBondContact OD1-CE2 3.38Å; N433-V561 VanDerWaalsContact CB-O 3.29Å; N433-V561 WeakPolarHBondContact CB-O 3.42Å; N433-V561 VanDerWaalsContact CG-O 3.28Å; N433-V561 PolarHBondContact OD1-O 3.3Å; N433-T563 PolarHBondContact ND2-OG1 2.97Å
434	H	35	Very low	37.9	Very low	170 Å²	170	103.7 Å²	103.7	79%	0.787	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-72.2	-12.8	-179.6	-90.3	-81.4	0	0	0	114.1	S432 F436	S432-H434 PolarHBondContact O-N 2.93Å; H434-F436 VanDerWaalsContact C-N 3.27Å; H434-F436 PolarHBondContact O-N 3.35Å
435	A	34.9	Very low	37.6	Very low	26 Å²	26	107.2 Å²	107.2	22%	0.215	55%	0.547	C	S	.	.	G	3₁₀ helix	trans	-66.8	-21.6	174.8	0	0	0	0	0	114.1	N433 N437 M438	N433-A435 PolarHBondContact O-N 3.06Å; A435-N437 PolarHBondContact O-N 2.82Å; A435-M438 PolarHBondContact O-N 2.84Å
436	F	36.7	Very low	37	Very low	103 Å²	103	106 Å²	106	45%	0.452	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-80.5	24.8	-171.5	-73.9	-93.3	0	0	0	115.2	N433 H434 A454	N433-F436 WeakPolarHBondContact OD1-CD2 3.42Å; N433-F436 WeakPolarHBondContact OD1-CE2 3.38Å; H434-F436 VanDerWaalsContact C-N 3.27Å; H434-F436 PolarHBondContact O-N 3.35Å; F436-A454 HydrophobicContact CE1-CB 4.45Å; F436-A454 HydrophobicContact CZ-CB 4.18Å
437	N	31.5	Very low	36.9	Very low	159 Å²	159	96.8 Å²	96.8	85%	0.85	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-132.3	22.5	167	-160.4	77.8	0	0	0	111.7	A435	A435-N437 PolarHBondContact O-N 2.82Å
438	M	36.9	Very low	36.7	Very low	114 Å²	114	100.2 Å²	100.2	56%	0.562	50%	0.496	S	S	*	.	S	Bend	trans	-111.4	172.9	175.4	-61.8	-169.7	74.9	0	0	111.2	A435 D442	A435-M438 PolarHBondContact O-N 2.84Å; M438-D442 HydrophobicContact CB-CB 3.83Å; M438-D442 HydrophobicContact CE-CB 3.91Å; M438-D442 HydrophobicContact SD-CB 4.27Å
439	T	40.7	Very low	36.6	Very low	101 Å²	101	104.9 Å²	104.9	62%	0.62	52%	0.517	S	S	*	.			trans	-76.1	162.2	-177.8	8.9	0	0	0	0	112.1	D441 D442	T439-D441 PolarHBondContact O-N 2.82Å; T439-D441 VanDerWaalsContact O-N 3.12Å; T439-D442 WeakPolarHBondContact CA-OD2 3.24Å; T439-D442 VanDerWaalsContact CB-OD2 3.27Å; T439-D442 WeakPolarHBondContact CB-OD2 3.2Å; T439-D442 PolarHBondContact N-OD2 2.84Å; T439-D442 PolarHBondContact O-N 3.2Å; T439-D442 VanDerWaalsContact O-N 3.13Å; T439-D442 PolarHBondContact OG1-OD2 3.12Å
440	L	36.6	Very low	36.6	Very low	134 Å²	134	102.4 Å²	102.4	70%	0.702	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-27.6	-171.9	-171.7	64.3	0	0	0	113.5	L443	L440-L443 WeakPolarHBondContact O-CB 3.28Å
441	D	38.5	Very low	36.8	Very low	96 Å²	96	96.7 Å²	96.7	51%	0.513	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-30.7	179	-64	-70.7	0	0	0	113.5	T439 L443 K444	T439-D441 PolarHBondContact O-N 2.82Å; T439-D441 VanDerWaalsContact O-N 3.12Å; D441-L443 PolarHBondContact O-N 3.08Å; D441-K444 VanDerWaalsContact O-CB 3.29Å; D441-K444 WeakPolarHBondContact O-CB 3.5Å; D441-K444 PolarHBondContact O-N 3.09Å; D441-K444 VanDerWaalsContact OD1-CE 3.32Å; D441-K444 WeakPolarHBondContact OD1-CE 3.45Å; D441-K444 IonicContact OD1-NZ 2.78Å; D441-K444 PolarHBondContact OD1-NZ 2.96Å
442	D	35.1	Very low	37.1	Very low	30 Å²	30	94.4 Å²	94.4	16%	0.16	48%	0.476	C	S	.	.	H	α-helix	trans	-62.6	-32.3	173	-53.8	-75.5	0	0	0	111.1	M438 T439 K444 Q445	M438-D442 HydrophobicContact CB-CB 3.83Å; M438-D442 HydrophobicContact CE-CB 3.91Å; M438-D442 HydrophobicContact SD-CB 4.27Å; T439-D442 WeakPolarHBondContact CA-OD2 3.24Å; T439-D442 VanDerWaalsContact CB-OD2 3.27Å; T439-D442 WeakPolarHBondContact CB-OD2 3.2Å; T439-D442 PolarHBondContact N-OD2 2.84Å; T439-D442 PolarHBondContact O-N 3.2Å; T439-D442 VanDerWaalsContact O-N 3.13Å; T439-D442 PolarHBondContact OG1-OD2 3.12Å; D442-K444 PolarHBondContact O-N 2.77Å; D442-Q445 PolarHBondContact O-N 3.2Å
443	L	37.2	Very low	37.8	Very low	52 Å²	52	92.9 Å²	92.9	27%	0.272	46%	0.462	S	S	.	.	H	α-helix	trans	-63.1	-26.6	175.8	-149.6	82.6	0	0	0	112.7	L440 D441 Q445 T447 I453	L440-L443 WeakPolarHBondContact O-CB 3.28Å; D441-L443 PolarHBondContact O-N 3.08Å; L443-Q445 VanDerWaalsContact C-N 3.32Å; L443-T447 PolarHBondContact O-OG1 3.09Å; L443-I453 HydrophobicContact CD2-CG2 4.36Å
444	K	37	Very low	38.4	Very low	122 Å²	122	92 Å²	92	53%	0.53	46%	0.458	S	S	.	.	H	α-helix	trans	-72.1	-25.4	178	-61.4	174.8	179.4	167.2	0	112.8	D441 D442 T447	D441-K444 VanDerWaalsContact O-CB 3.29Å; D441-K444 WeakPolarHBondContact O-CB 3.5Å; D441-K444 PolarHBondContact O-N 3.09Å; D441-K444 VanDerWaalsContact OD1-CE 3.32Å; D441-K444 WeakPolarHBondContact OD1-CE 3.45Å; D441-K444 IonicContact OD1-NZ 2.78Å; D441-K444 PolarHBondContact OD1-NZ 2.96Å; D442-K444 PolarHBondContact O-N 2.77Å; K444-T447 VanDerWaalsContact C-OG1 3.27Å; K444-T447 WeakPolarHBondContact CA-OG1 3.38Å; K444-T447 PolarHBondContact O-OG1 2.99Å; K444-T447 VanDerWaalsContact O-OG1 3.07Å
445	Q	37.2	Very low	39.2	Very low	142 Å²	142	87.6 Å²	87.6	66%	0.664	44%	0.44	S	S	*	.	H	α-helix	trans	-83.6	-26.3	-175.1	-159.3	162.7	3.3	0	0	112.4	D442 L443	D442-Q445 PolarHBondContact O-N 3.2Å; L443-Q445 VanDerWaalsContact C-N 3.32Å
446	Y	34.1	Very low	40.3	Very low	185 Å²	185	91.9 Å²	91.9	73%	0.725	46%	0.456	S	S	*	.	S	Bend	trans	-89.9	-3.8	173.5	-75	-83.8	0	0	0	114.4	F448	Y446-F448 VanDerWaalsContact C-N 3.34Å; Y446-F448 PolarHBondContact O-N 3.12Å
447	T	34.7	Very low	41.4	Very low	24 Å²	24	88.2 Å²	88.2	15%	0.147	44%	0.442	C	S	.	.	S	Bend	trans	-80.6	-11.4	-173.8	-7.1	0	0	0	0	114.6	L443 K444 G451 I453	L443-T447 PolarHBondContact O-OG1 3.09Å; K444-T447 VanDerWaalsContact C-OG1 3.27Å; K444-T447 WeakPolarHBondContact CA-OG1 3.38Å; K444-T447 PolarHBondContact O-OG1 2.99Å; K444-T447 VanDerWaalsContact O-OG1 3.07Å; T447-G451 PolarHBondContact O-N 3Å; T447-I453 HydrophobicContact CG2-CD1 3.72Å; T447-I453 HydrophobicContact CG2-CG1 3.58Å
448	F	35.3	Very low	42.9	Very low	148 Å²	148	83.3 Å²	83.3	65%	0.649	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-28.1	-158.3	-104.3	-84.7	0	0	0	116.3	Y446	Y446-F448 VanDerWaalsContact C-N 3.34Å; Y446-F448 PolarHBondContact O-N 3.12Å
449	D	36	Very low	44.1	Very low	144 Å²	144	80.6 Å²	80.6	77%	0.77	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-31.3	-173.6	-64.6	-49.9	0	0	0	114.5
450	F	37.8	Very low	45.3	Very low	88 Å²	88	78.9 Å²	78.9	39%	0.386	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	2.1	-175.4	-72.3	-69.6	0	0	0	116.5	E429 I431 V452 V558	E429-F450 WeakPolarHBondContact OE2-CE2 3.5Å; I431-F450 HydrophobicContact CD1-CB 3.89Å; I431-F450 HydrophobicContact CD1-CD2 4.04Å; I431-F450 HydrophobicContact CD1-CG 4.28Å; F450-V452 WeakPolarHBondContact O-CG2 3.24Å; F450-V452 PolarHBondContact O-N 2.99Å; F450-V558 HydrophobicContact CB-CG1 4.01Å; F450-V558 HydrophobicContact CD1-CG1 4.43Å; F450-V558 HydrophobicContact CD1-CG2 3.59Å; F450-V558 HydrophobicContact CE1-CG2 4.15Å; F450-V558 HydrophobicContact CG-CG1 4.35Å; F450-V558 HydrophobicContact CG-CG2 4.31Å
451	G	41.6	Very low	46.8	Very low	15 Å²	15	75.3 Å²	75.3	16%	0.155	38%	0.375	C	S	.	.			trans	56.8	39.7	156.4	0	0	0	0	0	117.7	T447 L466 N467	T447-G451 PolarHBondContact O-N 3Å; G451-L466 CarbonylContact O-C 3.52Å; G451-L466 VanDerWaalsContact O-CA 3.28Å; G451-L466 WeakPolarHBondContact O-CA 3.42Å; G451-N467 PolarHBondContact O-N 3.17Å
452	V	47.2	Very low	48.2	Very low	26 Å²	26	70.9 Å²	70.9	16%	0.158	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.9	172.8	-173.3	0	0	0	0	110.2	F450 V464 L466 L547 L549 V558 V560	F450-V452 WeakPolarHBondContact O-CG2 3.24Å; F450-V452 PolarHBondContact O-N 2.99Å; V452-V464 HydrophobicContact CG1-CG1 3.52Å; V452-L466 HydrophobicContact CB-CD2 4.3Å; V452-L466 HydrophobicContact CG1-CD2 3.96Å; V452-L466 HydrophobicContact CG2-CD2 3.91Å; V452-L547 HydrophobicContact CG1-CD2 3.76Å; V452-L549 HydrophobicContact CG2-CD1 3.87Å; V452-V558 HydrophobicContact CG2-CG1 4.37Å; V452-V560 HydrophobicContact CB-CG2 3.83Å; V452-V560 HydrophobicContact CG1-CB 4.44Å; V452-V560 HydrophobicContact CG1-CG1 4.43Å; V452-V560 HydrophobicContact CG1-CG2 3.96Å; V452-V560 HydrophobicContact CG2-CG2 3.94Å
453	I	50.5	Low	49.8	Very low	42 Å²	42	71.8 Å²	71.8	22%	0.215	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	115.1	179.2	-47.7	177	0	0	0	109.4	L443 T447 L455 V464 Q465	L443-I453 HydrophobicContact CD2-CG2 4.36Å; T447-I453 HydrophobicContact CG2-CD1 3.72Å; T447-I453 HydrophobicContact CG2-CG1 3.58Å; I453-L455 HydrophobicContact CB-CD2 4.4Å; I453-L455 HydrophobicContact CG2-CD2 3.9Å; I453-L455 PolarHBondContact O-N 3.45Å; I453-V464 CarbonylContact O-C 3.21Å; I453-V464 VanDerWaalsContact O-CA 3.31Å; I453-V464 WeakPolarHBondContact O-CA 3.31Å; I453-Q465 PolarHBondContact N-O 3.22Å; I453-Q465 PolarHBondContact O-N 2.85Å
454	A	52.4	Low	51.2	Low	11 Å²	11	69.3 Å²	69.3	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	89.5	164.8	0	0	0	0	0	108.9	F436 E456 V457 K463 V464	F436-A454 HydrophobicContact CE1-CB 4.45Å; F436-A454 HydrophobicContact CZ-CB 4.18Å; A454-E456 VanDerWaalsContact C-N 3.35Å; A454-E456 PolarHBondContact O-N 3.1Å; A454-V457 HydrophobicContact CB-CG2 4.04Å; A454-K463 CarbonylContact C-O 3.6Å; A454-V464 HydrophobicContact CB-CG2 4.5Å
455	L	52.1	Low	52.3	Low	78 Å²	78	66.8 Å²	66.8	41%	0.408	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	-44.6	-176.9	-66.7	178.3	0	0	0	112.3	I453 K463 Q465	I453-L455 HydrophobicContact CB-CD2 4.4Å; I453-L455 HydrophobicContact CG2-CD2 3.9Å; I453-L455 PolarHBondContact O-N 3.45Å; L455-K463 HydrophobicContact CD1-CD 4.49Å; L455-K463 HydrophobicContact CD1-CG 4.36Å; L455-K463 PolarHBondContact N-O 3.4Å; L455-Q465 HydrophobicContact CD1-CB 3.77Å; L455-Q465 HydrophobicContact CD2-CB 4.36Å; L455-Q465 HydrophobicContact CG-CB 3.93Å
456	E	57.8	Low	53.4	Low	115 Å²	115	61.1 Å²	61.1	54%	0.537	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	130.1	-175.6	-59.6	-179.4	149.9	0	0	109.7	A454 A462 K463	A454-E456 VanDerWaalsContact C-N 3.35Å; A454-E456 PolarHBondContact O-N 3.1Å; E456-A462 CarbonylContact O-C 3.54Å; E456-A462 VanDerWaalsContact O-CA 3.29Å; E456-A462 WeakPolarHBondContact O-CA 3.35Å; E456-K463 HydrophobicContact CB-CB 4.19Å; E456-K463 PolarHBondContact N-O 3.19Å; E456-K463 PolarHBondContact O-N 2.77Å
457	V	59.3	Low	53.9	Low	27 Å²	27	55.4 Å²	55.4	16%	0.164	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.9	172.7	-175.7	0	0	0	0	109.4	A454 A462 F562 T564 R565	A454-V457 HydrophobicContact CB-CG2 4.04Å; V457-A462 HydrophobicContact CG2-CB 4.39Å; V457-F562 HydrophobicContact CG1-CD2 4.14Å; V457-F562 HydrophobicContact CG2-CD2 4.15Å; V457-T564 HydrophobicContact CG1-CG2 4.45Å; V457-R565 PolarHBondContact O-NE 3.24Å
458	S	62.3	Low	54.2	Low	55 Å²	55	58.4 Å²	58.4	39%	0.385	31%	0.307	S	S	.	.			trans	-98	-164.1	-177.4	-171.1	0	0	0	0	111.1	E461 R565	S458-E461 WeakPolarHBondContact CB-O 3.2Å; S458-E461 PolarHBondContact N-O 2.92Å; S458-R565 PolarHBondContact O-N 3.05Å
459	E	63.1	Low	54.1	Low	57 Å²	57	57 Å²	57	27%	0.266	31%	0.306	S	S	.	.	S	Bend	trans	-71.2	-39.7	167	-65.8	-166.1	-179	0	0	111.5	P541 R565 K567	E459-P541 HydrophobicContact CB-CB 4.36Å; E459-P541 HydrophobicContact CB-CG 4.14Å; E459-P541 WeakPolarHBondContact O-CA 3.38Å; E459-P541 WeakPolarHBondContact O-CG 2.99Å; E459-R565 HydrophobicContact CG-CB 4.44Å; E459-K567 WeakPolarHBondContact OE1-CA 3.35Å; E459-K567 WeakPolarHBondContact OE2-CD 3.47Å; E459-K567 WeakPolarHBondContact OE2-CG 3.42Å
460	T	66.1	Low	53.9	Low	66 Å²	66	59 Å²	59	41%	0.405	31%	0.31	S	S	.	.	S	Bend	trans	-131.7	0.9	-170.5	59.4	0	0	0	0	115.3	H537 D538 L539 P541	T460-H537 CarbonylContact O-C 3.35Å; T460-D538 PolarHBondContact O-N 2.9Å; T460-D538 VanDerWaalsContact O-N 3.09Å; T460-L539 WeakPolarHBondContact CA-O 3.29Å; T460-L539 PolarHBondContact O-N 3.09Å; T460-P541 HydrophobicContact CG2-CG 4.19Å
461	E	67.6	Low	53.6	Low	59 Å²	59	60 Å²	60	28%	0.276	32%	0.32	S	S	.	.			trans	-133.3	152.5	179.7	-62.4	-172.5	134	0	0	110.4	S458 R535 F536 H537	S458-E461 WeakPolarHBondContact CB-O 3.2Å; S458-E461 PolarHBondContact N-O 2.92Å; E461-R535 IonicContact OE1-CZ 3.24Å; E461-R535 IonicContact OE1-NH1 2.75Å; E461-R535 PolarHBondContact OE1-NH1 3.32Å; E461-R535 IonicContact OE1-NH2 3.2Å; E461-R535 IonicContact OE2-CZ 3.4Å; E461-R535 IonicContact OE2-NH1 2.72Å; E461-R535 PolarHBondContact OE2-NH1 3.29Å; E461-R535 IonicContact OE2-NH2 3.44Å; E461-R535 PolarHBondContact OE2-NH2 3.14Å; E461-F536 WeakPolarHBondContact CA-O 3.39Å; E461-H537 IonicContact OE1-CD2 2.73Å; E461-H537 PolarHBondContact OE1-CD2 3.13Å; E461-H537 IonicContact OE1-NE2 3.52Å
462	A	68.6	Low	52.9	Low	2 Å²	2	64.2 Å²	64.2	2%	0.017	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	138.4	169.1	0	0	0	0	0	111.4	E456 V457 F536 L539 F562	E456-A462 CarbonylContact O-C 3.54Å; E456-A462 VanDerWaalsContact O-CA 3.29Å; E456-A462 WeakPolarHBondContact O-CA 3.35Å; V457-A462 HydrophobicContact CG2-CB 4.39Å; A462-F536 PolarHBondContact N-O 3.24Å; A462-F536 PolarHBondContact O-N 3.5Å; A462-L539 HydrophobicContact CB-CD1 3.62Å; A462-F562 HydrophobicContact CB-CE2 3.66Å; A462-F562 HydrophobicContact CB-CZ 3.89Å
463	K	67.7	Low	51.9	Low	49 Å²	49	67.7 Å²	67.7	21%	0.213	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.2	173.8	-175	168.2	175.1	159.9	0	109.5	A454 L455 E456 E528 Y534 R535	A454-K463 CarbonylContact C-O 3.6Å; L455-K463 HydrophobicContact CD1-CD 4.49Å; L455-K463 HydrophobicContact CD1-CG 4.36Å; L455-K463 PolarHBondContact N-O 3.4Å; E456-K463 HydrophobicContact CB-CB 4.19Å; E456-K463 PolarHBondContact N-O 3.19Å; E456-K463 PolarHBondContact O-N 2.77Å; K463-E528 WeakPolarHBondContact CE-OE2 3.49Å; K463-E528 IonicContact NZ-OE2 3.88Å; K463-E528 PolarHBondContact NZ-OE2 2.88Å; K463-Y534 WeakPolarHBondContact CA-O 3.33Å; K463-R535 HydrophobicContact CB-CG 4.4Å
464	V	67.8	Low	50.8	Low	1 Å²	1	71.2 Å²	71.2	1%	0.006	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.2	-176.1	-176.5	0	0	0	0	109.3	V452 I453 A454 L466 Y534 F536 L547	V452-V464 HydrophobicContact CG1-CG1 3.52Å; I453-V464 CarbonylContact O-C 3.21Å; I453-V464 VanDerWaalsContact O-CA 3.31Å; I453-V464 WeakPolarHBondContact O-CA 3.31Å; A454-V464 HydrophobicContact CB-CG2 4.5Å; V464-L466 HydrophobicContact CG1-CD2 4.4Å; V464-Y534 PolarHBondContact N-O 2.66Å; V464-Y534 PolarHBondContact O-N 3.07Å; V464-F536 HydrophobicContact CB-CE2 4.44Å; V464-F536 HydrophobicContact CG2-CD2 4.3Å; V464-F536 HydrophobicContact CG2-CE2 4.03Å; V464-L547 HydrophobicContact CG1-CD2 3.98Å
465	Q	60.1	Low	49.8	Very low	69 Å²	69	75.8 Å²	75.8	32%	0.322	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137.7	173.1	-176.4	177.3	6.6	0	0	110.2	I453 L455 N532	I453-Q465 PolarHBondContact N-O 3.22Å; I453-Q465 PolarHBondContact O-N 2.85Å; L455-Q465 HydrophobicContact CD1-CB 3.77Å; L455-Q465 HydrophobicContact CD2-CB 4.36Å; L455-Q465 HydrophobicContact CG-CB 3.93Å; Q465-N532 VanDerWaalsContact CA-O 3.31Å; Q465-N532 WeakPolarHBondContact CA-O 3.44Å
466	L	58.8	Low	48.8	Very low	23 Å²	23	76.3 Å²	76.3	12%	0.12	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136	170.8	-42.3	177.8	0	0	0	110.4	G451 V452 V464 N532 Y534 L549	G451-L466 CarbonylContact O-C 3.52Å; G451-L466 VanDerWaalsContact O-CA 3.28Å; G451-L466 WeakPolarHBondContact O-CA 3.42Å; V452-L466 HydrophobicContact CB-CD2 4.3Å; V452-L466 HydrophobicContact CG1-CD2 3.96Å; V452-L466 HydrophobicContact CG2-CD2 3.91Å; V464-L466 HydrophobicContact CG1-CD2 4.4Å; L466-N532 HydrophobicContact CB-CB 3.93Å; L466-N532 PolarHBondContact N-O 2.99Å; L466-N532 WeakPolarHBondContact O-CB 3.49Å; L466-N532 PolarHBondContact O-ND2 2.99Å; L466-Y534 HydrophobicContact CD1-CD2 4.35Å; L466-Y534 HydrophobicContact CD1-CE2 3.62Å; L466-Y534 HydrophobicContact CG-CD2 4.17Å; L466-Y534 HydrophobicContact CG-CE2 3.82Å; L466-L549 HydrophobicContact CD1-CD2 4.05Å; L466-L549 HydrophobicContact CD2-CD1 4.34Å
467	N	45.5	Very low	47.4	Very low	65 Å²	65	77.8 Å²	77.8	35%	0.348	44%	0.438	S	S	.	.			trans	-81.1	127.2	-179.2	-158.6	18	0	0	0	109.4	G451 L469	G451-N467 PolarHBondContact O-N 3.17Å; N467-L469 VanDerWaalsContact C-N 3.27Å; N467-L469 PolarHBondContact O-N 3.41Å
468	P	40.2	Very low	45.9	Very low	87 Å²	87	82.8 Å²	82.8	57%	0.565	46%	0.463	S	S	*	.			trans	-77.3	69.3	-173.3	31.3	-36.5	0	0	0	113.4
469	L	33	Very low	44.2	Very low	118 Å²	118	87.6 Å²	87.6	62%	0.618	48%	0.479	S	S	*	.	S	Bend	trans	-121.7	118	164.1	-75.5	171.6	0	0	0	109.4	N467	N467-L469 VanDerWaalsContact C-N 3.27Å; N467-L469 PolarHBondContact O-N 3.41Å
470	Q	33.3	Very low	42.4	Very low	185 Å²	185	91.7 Å²	91.7	86%	0.864	50%	0.502	S	S	*	.			trans	56.4	77.3	180	-56.1	-169.3	29	0	0	116.5
471	L	31.5	Very low	40.4	Very low	111 Å²	111	92 Å²	92	58%	0.581	51%	0.506	S	S	*	.			trans	-72.9	135.7	136.8	-84.2	83.3	0	0	0	108.2	S473	L471-S473 PolarHBondContact O-N 2.93Å; L471-S473 VanDerWaalsContact O-N 3.11Å
472	P	26	Very low	38.5	Very low	102 Å²	102	97.8 Å²	97.8	66%	0.662	53%	0.533	S	S	*	.			trans	-68.3	108.4	172.4	27.8	-32.8	0	0	0	109.6	S474	P472-S474 PolarHBondContact O-N 3.3Å
473	S	26.8	Very low	36.5	Very low	100 Å²	100	102.1 Å²	102.1	70%	0.699	57%	0.569	S	S	*	*			trans	-76.7	95.3	-167.6	50.8	0	0	0	0	113.7	L471 K475	L471-S473 PolarHBondContact O-N 2.93Å; L471-S473 VanDerWaalsContact O-N 3.11Å; S473-K475 PolarHBondContact O-N 2.95Å
474	S	27.4	Very low	34.7	Very low	116 Å²	116	108.4 Å²	108.4	81%	0.811	60%	0.599	S	S	*	*			trans	-62.6	101.4	157.9	53.9	0	0	0	0	109.7	P472	P472-S474 PolarHBondContact O-N 3.3Å
475	K	31.2	Very low	32.7	Very low	107 Å²	107	115.8 Å²	115.8	47%	0.465	64%	0.639	S	S	.	*			trans	-55.2	145.4	167.4	-64.6	-176	173.6	-178	0	108.5	S473	S473-K475 PolarHBondContact O-N 2.95Å
476	S	30.4	Very low	31	Very low	89 Å²	89	120.6 Å²	120.6	62%	0.622	66%	0.661	S	S	*	*				-175.4	149.6	63.3	-54.7	0	0	0	0	112.3
477	N	27.9	Very low	29.3	Very low	146 Å²	146	127 Å²	127	78%	0.781	69%	0.691	S	S	*	*			trans	60.6	150.7	133.5	-61.6	1.8	0	0	0	119.9
478	L	27.8	Very low	28.3	Very low	132 Å²	132	131.3 Å²	131.3	69%	0.691	71%	0.71	S	S	*	*			cis	-155.1	159.5	1	-148.2	74	0	0	0	109.2
479	H	27.6	Very low	27.5	Very low	156 Å²	156	132.9 Å²	132.9	72%	0.722	72%	0.719	S	S	*	*			trans	27.9	154.3	142.6	-87.1	-111	0	0	0	122.2
480	L	24.4	Very low	27.1	Very low	142 Å²	142	133 Å²	133	74%	0.743	72%	0.724	S	S	*	*			cis	-165.8	126.8	48.2	-158	100	0	0	0	112.6
481	S	26	Very low	26.6	Very low	72 Å²	72	133 Å²	133	50%	0.503	72%	0.721	S	S	.	*			trans	44	150.2	138.8	71	0	0	0	0	125.8
482	Q	27.6	Very low	26.1	Very low	181 Å²	181	136.2 Å²	136.2	85%	0.846	73%	0.733	S	S	*	*			trans	82.3	149.2	137.6	-86	162.9	2.1	0	0	119
483	A	25.7	Very low	26.5	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	73%	0.732	S	S	*	*			cis	-148.5	-175.7	-3.7	0	0	0	0	0	111.5
484	E	29.8	Very low	26.3	Very low	181 Å²	181	141.4 Å²	141.4	85%	0.846	74%	0.743	S	S	*	*			trans	-81.2	156.7	173.6	-61.7	174.6	118	0	0	113.6
485	N	26	Very low	26.1	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	74%	0.744	S	S	*	*			trans	80.4	148.4	156.4	-86.9	-35.9	0	0	0	122.9
486	Q	24.2	Very low	25.8	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	76%	0.76	S	S	*	*			trans	80	97.8	159.8	-74.5	174.9	-20.2	0	0	122.2
487	E	23.6	Very low	25.5	Very low	158 Å²	158	150.7 Å²	150.7	74%	0.738	78%	0.776	S	S	*	*				51.5	120.8	127	-60.1	-166.7	136.3	0	0	124
488	M	23.6	Very low	25.4	Very low	154 Å²	154	152.8 Å²	152.8	76%	0.759	78%	0.781	S	S	*	*			trans	77.5	126.4	131.1	-80	-163.7	-80.8	0	0	124.2
489	V	23.3	Very low	25.1	Very low	121 Å²	121	151.6 Å²	151.6	73%	0.733	78%	0.784	S	S	*	*			trans	92.4	97	131.5	171.2	0	0	0	0	121.3
490	V	24.2	Very low	25	Very low	120 Å²	120	149.4 Å²	149.4	73%	0.727	79%	0.786	S	S	*	*				79.1	116.2	126	175.8	0	0	0	0	122.8
491	K	23.4	Very low	25.1	Very low	185 Å²	185	147.5 Å²	147.5	80%	0.804	79%	0.785	S	S	*	*			trans	60.5	115.9	146.4	-73.3	176.8	178.5	-177.1	0	122.9
492	E	20.7	Very low	25.1	Very low	179 Å²	179	149.6 Å²	149.6	84%	0.836	80%	0.799	S	S	*	*				42.6	158.3	112.2	-88.4	-171.3	-173.5	0	0	123.4
493	P	34.2	Very low	25.1	Very low	99 Å²	99	150.1 Å²	150.1	64%	0.643	80%	0.799	S	S	*	*			cis	-139.2	176.5	-13.2	36.8	-17.1	0	0	0	116.5
494	F	23.3	Very low	25.4	Very low	212 Å²	212	153.2 Å²	153.2	93%	0.93	80%	0.803	S	S	*	*			trans	60.8	123.9	153.6	-103.4	-93.3	0	0	0	121.7
495	G	23.2	Very low	25.4	Very low	80 Å²	80	150.9 Å²	150.9	83%	0.825	80%	0.801	S	S	*	*			trans	-176.9	123.9	165.4	0	0	0	0	0	113.3
496	Q	25.2	Very low	25.9	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	79%	0.794	S	S	*	*			trans	-125	130.3	-168	-176.3	-175.2	16.3	0	0	112.3
497	R	24.3	Very low	27	Very low	252 Å²	252	146.3 Å²	146.3	95%	0.951	78%	0.781	S	S	*	*			trans	-166.1	148.9	159.8	-108.9	157.7	-155	-135	2.1	112.8
498	Q	26	Very low	28.3	Very low	191 Å²	191	143.1 Å²	143.1	89%	0.893	77%	0.767	S	S	*	*			trans	-130.5	143.6	179.9	-68.2	175.1	-34.8	0	0	111.2
499	S	21.8	Very low	29.7	Very low	107 Å²	107	136 Å²	136	75%	0.748	73%	0.732	S	S	*	*			trans	-175.6	105.3	153.6	52.3	0	0	0	0	107.7
500	S	24.3	Very low	31.4	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	71%	0.711	S	S	*	*				72.5	134.9	69.7	74.3	0	0	0	0	114.7
501	S	27	Very low	32.8	Very low	103 Å²	103	128 Å²	128	72%	0.72	68%	0.676	S	S	*	*			cis	-174.6	140.3	-23.9	41.9	0	0	0	0	108.9
502	S	26	Very low	34.6	Very low	116 Å²	116	119.4 Å²	119.4	81%	0.811	64%	0.639	S	S	*	*			trans	-116.9	119.5	158	50.8	0	0	0	0	107.5	D504	S502-D504 PolarHBondContact O-N 3.48Å
503	K	28	Very low	36.3	Very low	191 Å²	191	111.8 Å²	111.8	83%	0.83	61%	0.605	S	S	*	*			trans	-85.9	109.7	-171.9	-66.4	179.7	178.3	-179.2	0	111.1
504	D	30.9	Very low	36.9	Very low	159 Å²	159	114 Å²	114	85%	0.85	61%	0.605	S	S	*	*			trans	-67.6	142.6	147.6	-68.1	-52.3	0	0	0	109	S502 L506	S502-D504 PolarHBondContact O-N 3.48Å; D504-L506 PolarHBondContact O-N 3.33Å
505	T	30.2	Very low	38.2	Very low	132 Å²	132	106.9 Å²	106.9	81%	0.81	58%	0.579	S	S	*	*			trans	-82.2	111.6	179.4	49.4	0	0	0	0	109.9
506	L	37	Very low	39.1	Very low	132 Å²	132	107 Å²	107	69%	0.691	58%	0.58	S	S	*	*			trans	-47.3	138.5	172.8	-70.7	157.3	0	0	0	112	D504 M508	D504-L506 PolarHBondContact O-N 3.33Å; L506-M508 PolarHBondContact O-N 3.28Å
507	D	46.2	Very low	39.8	Very low	98 Å²	98	106.9 Å²	106.9	52%	0.524	59%	0.585	S	S	.	*			trans	-63	123.8	169.4	-72.6	-62.2	0	0	0	110.3
508	M	50.9	Low	41.1	Very low	91 Å²	91	96.4 Å²	96.4	45%	0.448	56%	0.556	S	S	.	*			trans	-110.8	133.8	-172.9	-73.6	-75.1	-166.4	0	0	111.4	L506 Y510	L506-M508 PolarHBondContact O-N 3.28Å; M508-Y510 HydrophobicContact CB-CE1 4.2Å; M508-Y510 HydrophobicContact CB-CE2 3.76Å; M508-Y510 WeakPolarHBondContact CB-OH 3.35Å
509	L	53.5	Low	42.4	Very low	4 Å²	4	89.3 Å²	89.3	2%	0.021	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.6	179.2	-172.5	66.4	0	0	0	110.6	Y534 F536 L547 L549	L509-Y534 HydrophobicContact CB-CD1 4.3Å; L509-Y534 HydrophobicContact CB-CE1 4.37Å; L509-Y534 HydrophobicContact CD2-CD1 4.02Å; L509-Y534 HydrophobicContact CD2-CD2 3.83Å; L509-Y534 HydrophobicContact CD2-CE2 4.35Å; L509-Y534 HydrophobicContact CD2-CG 3.64Å; L509-F536 HydrophobicContact CD2-CE2 4.28Å; L509-F536 HydrophobicContact CD2-CZ 3.94Å; L509-F536 HydrophobicContact CG-CZ 4.06Å; L509-L547 HydrophobicContact CD1-CD1 4.11Å; L509-L547 HydrophobicContact CD1-CD2 4.2Å; L509-L547 HydrophobicContact CD1-CG 4.09Å; L509-L547 HydrophobicContact CD2-CD1 4.04Å; L509-L547 HydrophobicContact CD2-CD2 4.35Å; L509-L547 HydrophobicContact CG-CD1 3.87Å; L509-L547 HydrophobicContact CG-CG 4.39Å; L509-L549 HydrophobicContact CD1-CD2 3.67Å; L509-L549 HydrophobicContact CD1-CG 3.78Å
510	Y	58.8	Low	43.6	Very low	74 Å²	74	86.8 Å²	86.8	29%	0.29	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.7	-167.5	-60.4	-69.4	0	0	0	113.6	M508 L521 C548	M508-Y510 HydrophobicContact CB-CE1 4.2Å; M508-Y510 HydrophobicContact CB-CE2 3.76Å; M508-Y510 WeakPolarHBondContact CB-OH 3.35Å; Y510-L521 HydrophobicContact CD1-CD1 3.86Å; Y510-L521 HydrophobicContact CG-CD1 3.98Å; Y510-C548 PolarHBondContact O-N 2.78Å
511	L	54.9	Low	45.1	Very low	0 Å²	0	86.9 Å²	86.9	0%	0	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.4	167.9	-70.1	174.5	0	0	0	111.5	V522 Q523 F536 L539 Y545 L547 F562	L511-V522 PolarHBondContact O-N 3.17Å; L511-Q523 HydrophobicContact CD1-CB 4.44Å; L511-Q523 PolarHBondContact N-O 2.96Å; L511-F536 HydrophobicContact CD1-CB 3.96Å; L511-F536 HydrophobicContact CD1-CD1 3.41Å; L511-F536 VanDerWaalsContact CD1-CD1 3.41Å; L511-F536 HydrophobicContact CD1-CD2 4.25Å; L511-F536 HydrophobicContact CD1-CE1 3.86Å; L511-F536 HydrophobicContact CD1-CG 3.63Å; L511-F536 HydrophobicContact CD1-CZ 4.45Å; L511-F536 HydrophobicContact CD2-CE1 4.49Å; L511-F536 HydrophobicContact CD2-CZ 4.43Å; L511-F536 HydrophobicContact CG-CD1 3.77Å; L511-F536 HydrophobicContact CG-CE1 3.64Å; L511-F536 HydrophobicContact CG-CG 4.25Å; L511-F536 HydrophobicContact CG-CZ 4.04Å; L511-L539 HydrophobicContact CD1-CD2 3.75Å; L511-Y545 HydrophobicContact CB-CD1 4.45Å; L511-Y545 HydrophobicContact CD1-CD1 4.16Å; L511-L547 HydrophobicContact CD2-CB 4.24Å; L511-L547 HydrophobicContact CD2-CD1 3.62Å; L511-L547 HydrophobicContact CG-CD1 4.32Å; L511-F562 HydrophobicContact CD1-CZ 4.36Å; L511-F562 HydrophobicContact CD2-CE1 3.55Å; L511-F562 HydrophobicContact CD2-CZ 3.69Å
512	C	60.8	Low	46.4	Very low	4 Å²	4	85.1 Å²	85.1	3%	0.027	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	148.8	163.6	-61.4	0	0	0	0	110.2	C422 H519 S520 T546	C422-C512 HydrophobicContact CB-CB 3.84Å; C422-C512 WeakPolarHBondContact CB-SG 3.11Å; C422-C512 WeakPolarHBondContact SG-CB 2.95Å; C422-C512 CovalentContact SG-SG 2.05Å; C422-C512 PolarHBondContact SG-SG 3.26Å; C512-H519 HydrophobicContact CB-CB 4.39Å; C512-S520 CarbonylContact C-O 3.41Å; C512-S520 VanDerWaalsContact CA-O 3.28Å; C512-S520 WeakPolarHBondContact CA-O 3.43Å; C512-T546 WeakPolarHBondContact CA-O 3.16Å; C512-T546 PolarHBondContact N-O 3.06Å; C512-T546 WeakPolarHBondContact O-CA 3.4Å; C512-T546 WeakPolarHBondContact O-CB 3.31Å; C512-T546 PolarHBondContact O-N 2.89Å; C512-T546 VanDerWaalsContact O-O 3.11Å
513	V	55.7	Low	47.8	Very low	20 Å²	20	81.6 Å²	81.6	12%	0.121	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.5	167.4	169.8	0	0	0	0	109.7	T515 H519 S520 V522 T543 Y545	V513-T515 PolarHBondContact O-N 3.02Å; V513-H519 CarbonylContact O-C 3.53Å; V513-H519 VanDerWaalsContact O-CA 3.27Å; V513-H519 WeakPolarHBondContact O-CA 3.48Å; V513-S520 PolarHBondContact N-O 2.96Å; V513-S520 PolarHBondContact O-N 3.11Å; V513-V522 HydrophobicContact CB-CG2 3.71Å; V513-V522 HydrophobicContact CG2-CB 4.32Å; V513-V522 HydrophobicContact CG2-CG2 3.54Å; V513-T543 HydrophobicContact CG1-CG2 4.31Å; V513-Y545 HydrophobicContact CG2-CD1 3.31Å; V513-Y545 HydrophobicContact CG2-CE1 3.32Å; V513-Y545 HydrophobicContact CG2-CG 4.04Å
514	K	47.6	Very low	49.2	Very low	146 Å²	146	79.5 Å²	79.5	64%	0.635	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	105.9	175.8	-172.9	173.2	-177.2	172.5	0	110.3
515	T	49.1	Very low	50.6	Low	62 Å²	62	72.5 Å²	72.5	38%	0.38	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	168.5	169.7	81.3	0	0	0	0	110.3	V513 N517 G518	V513-T515 PolarHBondContact O-N 3.02Å; T515-N517 PolarHBondContact O-N 2.62Å; T515-N517 VanDerWaalsContact O-N 3.13Å; T515-G518 CarbonylContact C-O 3.52Å; T515-G518 WeakPolarHBondContact CA-O 3.26Å; T515-G518 WeakPolarHBondContact CB-O 3.31Å; T515-G518 PolarHBondContact N-O 3.4Å; T515-G518 PolarHBondContact O-N 3.32Å; T515-G518 VanDerWaalsContact O-N 3.14Å; T515-G518 PolarHBondContact OG1-O 3.15Å
516	G	43.5	Very low	51.7	Low	83 Å²	83	70.5 Å²	70.5	86%	0.856	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.5	-179	0	0	0	0	0	114.8
517	N	39.4	Very low	52.5	Low	170 Å²	170	69.2 Å²	69.2	91%	0.909	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	19.3	-178.6	-65	3.5	0	0	0	112.7	T515	T515-N517 PolarHBondContact O-N 2.62Å; T515-N517 VanDerWaalsContact O-N 3.13Å
518	G	52.2	Low	52.7	Low	33 Å²	33	68 Å²	68	34%	0.34	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.2	177.7	-178.8	0	0	0	0	0	113.3	T515	T515-G518 CarbonylContact C-O 3.52Å; T515-G518 WeakPolarHBondContact CA-O 3.26Å; T515-G518 WeakPolarHBondContact CB-O 3.31Å; T515-G518 PolarHBondContact N-O 3.4Å; T515-G518 PolarHBondContact O-N 3.32Å; T515-G518 VanDerWaalsContact O-N 3.14Å; T515-G518 PolarHBondContact OG1-O 3.15Å
519	H	52.4	Low	52.3	Low	42 Å²	42	73.8 Å²	73.8	19%	0.194	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	136.9	178.6	-62.5	-118.6	0	0	0	110.4	C422 C512 V513	C422-H519 HydrophobicContact CB-CB 3.36Å; C422-H519 WeakPolarHBondContact O-CB 3.33Å; C512-H519 HydrophobicContact CB-CB 4.39Å; V513-H519 CarbonylContact O-C 3.53Å; V513-H519 VanDerWaalsContact O-CA 3.27Å; V513-H519 WeakPolarHBondContact O-CA 3.48Å
520	S	48.2	Very low	52.1	Low	54 Å²	54	75.4 Å²	75.4	38%	0.378	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.6	-179.9	-56.2	0	0	0	0	110.9	C512 V513	C512-S520 CarbonylContact C-O 3.41Å; C512-S520 VanDerWaalsContact CA-O 3.28Å; C512-S520 WeakPolarHBondContact CA-O 3.43Å; V513-S520 PolarHBondContact N-O 2.96Å; V513-S520 PolarHBondContact O-N 3.11Å
521	L	54.3	Low	51.7	Low	110 Å²	110	78.1 Å²	78.1	58%	0.576	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	137.6	171.1	-166.1	86.6	0	0	0	109.7	Y510	Y510-L521 HydrophobicContact CD1-CD1 3.86Å; Y510-L521 HydrophobicContact CG-CD1 3.98Å
522	V	54.5	Low	51.9	Low	67 Å²	67	79.4 Å²	79.4	41%	0.406	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	-48.3	179.3	-178.4	0	0	0	0	113.1	L511 V513 Y545	L511-V522 PolarHBondContact O-N 3.17Å; V513-V522 HydrophobicContact CB-CG2 3.71Å; V513-V522 HydrophobicContact CG2-CB 4.32Å; V513-V522 HydrophobicContact CG2-CG2 3.54Å; V522-Y545 HydrophobicContact CG1-CE1 4.16Å
523	Q	56.6	Low	51.7	Low	42 Å²	42	79.7 Å²	79.7	20%	0.196	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	158.9	-174.2	-150.6	139.3	-12.9	0	0	113.1	L511 H537 D538	L511-Q523 HydrophobicContact CD1-CB 4.44Å; L511-Q523 PolarHBondContact N-O 2.96Å; Q523-H537 VanDerWaalsContact CD-O 3.25Å; Q523-H537 PolarHBondContact NE2-O 2.76Å; Q523-H537 PolarHBondContact OE1-O 3.5Å; Q523-H537 VanDerWaalsContact OE1-O 3.11Å; Q523-D538 PolarHBondContact NE2-OD2 3.43Å
524	W	57.1	Low	52.2	Low	147 Å²	147	80.3 Å²	80.3	56%	0.557	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	158.8	172.2	61.8	-84.2	0	0	0	109.3	N526	W524-N526 WeakPolarHBondContact CZ3-OD1 3.49Å
525	S	60.6	Low	53.1	Low	11 Å²	11	75.6 Å²	75.6	8%	0.077	43%	0.426	C	S	.	.			trans	-105.9	147.8	-177	48.9	0	0	0	0	113.9	Y534 R535 F536	S525-Y534 WeakPolarHBondContact OG-CD1 3.46Å; S525-R535 VanDerWaalsContact CA-O 3.26Å; S525-R535 WeakPolarHBondContact CA-O 3.24Å; S525-R535 VanDerWaalsContact CB-O 3.31Å; S525-R535 WeakPolarHBondContact CB-O 3.29Å; S525-F536 VanDerWaalsContact CB-CE1 3.44Å
526	N	52.6	Low	54.1	Low	90 Å²	90	72.7 Å²	72.7	48%	0.481	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	150.6	159.6	-78.5	-54.5	0	0	0	111.1	W524 Y534 R535	W524-N526 WeakPolarHBondContact CZ3-OD1 3.49Å; N526-Y534 WeakPolarHBondContact O-CA 3.47Å; N526-R535 PolarHBondContact N-O 3.4Å; N526-R535 PolarHBondContact O-N 3.01Å
527	I	54.1	Low	55.3	Low	106 Å²	106	71.6 Å²	71.6	54%	0.544	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135	169.8	-60.1	169.2	0	0	0	108.1	A533 Y534	I527-A533 WeakPolarHBondContact CA-O 3.32Å; I527-Y534 HydrophobicContact CG1-CD1 4.23Å; I527-Y534 HydrophobicContact CG1-CE1 3.98Å
528	E	49.6	Very low	56.5	Low	71 Å²	71	69.6 Å²	69.6	33%	0.332	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-103.9	171.4	171.5	-66.4	-166.5	139.2	0	0	111.5	K463 G530 A533 R535	K463-E528 WeakPolarHBondContact CE-OE2 3.49Å; K463-E528 IonicContact NZ-OE2 3.88Å; K463-E528 PolarHBondContact NZ-OE2 2.88Å; E528-G530 VanDerWaalsContact C-N 3.29Å; E528-G530 PolarHBondContact O-N 2.95Å; E528-A533 PolarHBondContact N-O 3.2Å; E528-A533 VanDerWaalsContact N-O 3.09Å; E528-R535 VanDerWaalsContact CD-CD 3.46Å; E528-R535 HydrophobicContact CG-CB 4.24Å; E528-R535 WeakPolarHBondContact OE1-CD 3.5Å; E528-R535 IonicContact OE1-NE 3.42Å
529	E	43	Very low	57.5	Low	214 Å²	214	68.2 Å²	68.2	100%	1	35%	0.354	S	S	*	.	S	Bend	trans	-68.8	82.5	-178.7	-66.8	-170.7	152.7	0	0	112.2
530	G	48.3	Very low	58.1	Low	38 Å²	38	73.1 Å²	73.1	39%	0.392	38%	0.375	S	S	.	.	S	Bend	trans	171.2	128.2	177.3	0	0	0	0	0	109.3	E528 N532 A533	E528-G530 VanDerWaalsContact C-N 3.29Å; E528-G530 PolarHBondContact O-N 2.95Å; G530-N532 PolarHBondContact O-N 2.83Å; G530-A533 PolarHBondContact O-N 2.85Å; G530-A533 VanDerWaalsContact O-N 3.08Å
531	V	51.9	Low	58.8	Low	130 Å²	130	73.1 Å²	73.1	79%	0.788	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	125.8	179.9	-178.8	0	0	0	0	108.8
532	N	57.8	Low	59.1	Low	28 Å²	28	69.4 Å²	69.4	15%	0.15	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	15	-177	-52.9	-12.8	0	0	0	118.1	Q465 L466 G530 Y534	Q465-N532 VanDerWaalsContact CA-O 3.31Å; Q465-N532 WeakPolarHBondContact CA-O 3.44Å; L466-N532 HydrophobicContact CB-CB 3.93Å; L466-N532 PolarHBondContact N-O 2.99Å; L466-N532 WeakPolarHBondContact O-CB 3.49Å; L466-N532 PolarHBondContact O-ND2 2.99Å; G530-N532 PolarHBondContact O-N 2.83Å; N532-Y534 WeakPolarHBondContact O-CD2 3.37Å; N532-Y534 WeakPolarHBondContact O-CE2 3.44Å
533	A	57.9	Low	59.5	Low	10 Å²	10	68.1 Å²	68.1	8%	0.083	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.2	175.9	0	0	0	0	0	113.2	I527 E528 G530	I527-A533 WeakPolarHBondContact CA-O 3.32Å; E528-A533 PolarHBondContact N-O 3.2Å; E528-A533 VanDerWaalsContact N-O 3.09Å; G530-A533 PolarHBondContact O-N 2.85Å; G530-A533 VanDerWaalsContact O-N 3.08Å
534	Y	65.8	Low	59.7	Low	32 Å²	32	70.6 Å²	70.6	13%	0.125	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136	-176	-61.6	-88.4	0	0	0	111.5	K463 V464 L466 L509 S525 N526 I527 N532	K463-Y534 WeakPolarHBondContact CA-O 3.33Å; V464-Y534 PolarHBondContact N-O 2.66Å; V464-Y534 PolarHBondContact O-N 3.07Å; L466-Y534 HydrophobicContact CD1-CD2 4.35Å; L466-Y534 HydrophobicContact CD1-CE2 3.62Å; L466-Y534 HydrophobicContact CG-CD2 4.17Å; L466-Y534 HydrophobicContact CG-CE2 3.82Å; L509-Y534 HydrophobicContact CB-CD1 4.3Å; L509-Y534 HydrophobicContact CB-CE1 4.37Å; L509-Y534 HydrophobicContact CD2-CD1 4.02Å; L509-Y534 HydrophobicContact CD2-CD2 3.83Å; L509-Y534 HydrophobicContact CD2-CE2 4.35Å; L509-Y534 HydrophobicContact CD2-CG 3.64Å; S525-Y534 WeakPolarHBondContact OG-CD1 3.46Å; N526-Y534 WeakPolarHBondContact O-CA 3.47Å; I527-Y534 HydrophobicContact CG1-CD1 4.23Å; I527-Y534 HydrophobicContact CG1-CE1 3.98Å; N532-Y534 WeakPolarHBondContact O-CD2 3.37Å; N532-Y534 WeakPolarHBondContact O-CE2 3.44Å
535	R	66.4	Low	60	Low	48 Å²	48	63.8 Å²	63.8	18%	0.181	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136	180	-155.3	163.2	-165.9	-86.8	-0.9	112.4	E461 K463 S525 N526 E528 H537	E461-R535 IonicContact OE1-CZ 3.24Å; E461-R535 IonicContact OE1-NH1 2.75Å; E461-R535 PolarHBondContact OE1-NH1 3.32Å; E461-R535 IonicContact OE1-NH2 3.2Å; E461-R535 IonicContact OE2-CZ 3.4Å; E461-R535 IonicContact OE2-NH1 2.72Å; E461-R535 PolarHBondContact OE2-NH1 3.29Å; E461-R535 IonicContact OE2-NH2 3.44Å; E461-R535 PolarHBondContact OE2-NH2 3.14Å; K463-R535 HydrophobicContact CB-CG 4.4Å; S525-R535 VanDerWaalsContact CA-O 3.26Å; S525-R535 WeakPolarHBondContact CA-O 3.24Å; S525-R535 VanDerWaalsContact CB-O 3.31Å; S525-R535 WeakPolarHBondContact CB-O 3.29Å; N526-R535 PolarHBondContact N-O 3.4Å; N526-R535 PolarHBondContact O-N 3.01Å; E528-R535 VanDerWaalsContact CD-CD 3.46Å; E528-R535 HydrophobicContact CG-CB 4.24Å; E528-R535 WeakPolarHBondContact OE1-CD 3.5Å; E528-R535 IonicContact OE1-NE 3.42Å; R535-H537 PolarHBondContact NH1-NE2 2.79Å; R535-H537 VanDerWaalsContact NH1-NE2 3.19Å
536	F	70.7	Confident	60.1	Low	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.4	179.2	-59.2	-87.1	0	0	0	110.7	E461 A462 V464 L509 L511 S525 L539 L547	E461-F536 WeakPolarHBondContact CA-O 3.39Å; A462-F536 PolarHBondContact N-O 3.24Å; A462-F536 PolarHBondContact O-N 3.5Å; V464-F536 HydrophobicContact CB-CE2 4.44Å; V464-F536 HydrophobicContact CG2-CD2 4.3Å; V464-F536 HydrophobicContact CG2-CE2 4.03Å; L509-F536 HydrophobicContact CD2-CE2 4.28Å; L509-F536 HydrophobicContact CD2-CZ 3.94Å; L509-F536 HydrophobicContact CG-CZ 4.06Å; L511-F536 HydrophobicContact CD1-CB 3.96Å; L511-F536 HydrophobicContact CD1-CD1 3.41Å; L511-F536 VanDerWaalsContact CD1-CD1 3.41Å; L511-F536 HydrophobicContact CD1-CD2 4.25Å; L511-F536 HydrophobicContact CD1-CE1 3.86Å; L511-F536 HydrophobicContact CD1-CG 3.63Å; L511-F536 HydrophobicContact CD1-CZ 4.45Å; L511-F536 HydrophobicContact CD2-CE1 4.49Å; L511-F536 HydrophobicContact CD2-CZ 4.43Å; L511-F536 HydrophobicContact CG-CD1 3.77Å; L511-F536 HydrophobicContact CG-CE1 3.64Å; L511-F536 HydrophobicContact CG-CG 4.25Å; L511-F536 HydrophobicContact CG-CZ 4.04Å; S525-F536 VanDerWaalsContact CB-CE1 3.44Å; F536-L539 HydrophobicContact CB-CD2 4.5Å; F536-L547 HydrophobicContact CE2-CD1 3.79Å; F536-L547 HydrophobicContact CZ-CD1 3.53Å
537	H	68.3	Low	60.5	Low	61 Å²	61	59.4 Å²	59.4	28%	0.282	32%	0.319	S	S	.	.			trans	-121.9	-178.6	-175.5	-60.1	83.3	0	0	0	110.8	T460 E461 Q523 R535 L539	T460-H537 CarbonylContact O-C 3.35Å; E461-H537 IonicContact OE1-CD2 2.73Å; E461-H537 PolarHBondContact OE1-CD2 3.13Å; E461-H537 IonicContact OE1-NE2 3.52Å; Q523-H537 VanDerWaalsContact CD-O 3.25Å; Q523-H537 PolarHBondContact NE2-O 2.76Å; Q523-H537 PolarHBondContact OE1-O 3.5Å; Q523-H537 VanDerWaalsContact OE1-O 3.11Å; R535-H537 PolarHBondContact NH1-NE2 2.79Å; R535-H537 VanDerWaalsContact NH1-NE2 3.19Å; H537-L539 WeakPolarHBondContact O-CD2 3.33Å; H537-L539 WeakPolarHBondContact O-CG 3.41Å; H537-L539 PolarHBondContact O-N 3.02Å
538	D	64.6	Low	60.7	Low	128 Å²	128	54.8 Å²	54.8	68%	0.684	30%	0.296	S	S	*	.	S	Bend	trans	52	22.7	171.7	-51.9	-56.6	0	0	0	117.1	T460 Q523	T460-D538 PolarHBondContact O-N 2.9Å; T460-D538 VanDerWaalsContact O-N 3.09Å; Q523-D538 PolarHBondContact NE2-OD2 3.43Å
539	L	72.2	Confident	61	Low	3 Å²	3	52.8 Å²	52.8	2%	0.016	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-69.7	149.6	-179.8	-51.8	-176.9	0	0	0	111.1	T460 A462 L511 F536 H537 Y545 F562 T564	T460-L539 WeakPolarHBondContact CA-O 3.29Å; T460-L539 PolarHBondContact O-N 3.09Å; A462-L539 HydrophobicContact CB-CD1 3.62Å; L511-L539 HydrophobicContact CD1-CD2 3.75Å; F536-L539 HydrophobicContact CB-CD2 4.5Å; H537-L539 WeakPolarHBondContact O-CD2 3.33Å; H537-L539 WeakPolarHBondContact O-CG 3.41Å; H537-L539 PolarHBondContact O-N 3.02Å; L539-Y545 HydrophobicContact CB-CE2 3.96Å; L539-Y545 HydrophobicContact CD2-CD1 4.17Å; L539-Y545 HydrophobicContact CD2-CE1 3.71Å; L539-Y545 HydrophobicContact CD2-CE2 4.39Å; L539-F562 HydrophobicContact CD1-CE2 4.07Å; L539-F562 HydrophobicContact CD1-CZ 4.4Å; L539-T564 HydrophobicContact CB-CG2 3.78Å; L539-T564 HydrophobicContact CD1-CG2 3.94Å
540	K	64.6	Low	61.3	Low	145 Å²	145	43.8 Å²	43.8	63%	0.63	25%	0.248	S	C	*	.	P	Polyproline II helix	trans	-83.9	127.9	177.7	-67.7	-178.4	179.9	178	0	109.8	T543 Y545 T564	K540-T543 WeakPolarHBondContact CB-OG1 3.36Å; K540-T543 WeakPolarHBondContact O-CB 3.17Å; K540-T543 PolarHBondContact O-OG1 3.49Å; K540-Y545 PolarHBondContact N-OH 3.13Å; K540-T564 PolarHBondContact O-OG1 3.02Å
541	P	64.6	Low	61.2	Low	54 Å²	54	45.9 Å²	45.9	35%	0.351	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	145	178.7	-24.4	33.3	0	0	0	113	E459 T460 T543 K567	E459-P541 HydrophobicContact CB-CB 4.36Å; E459-P541 HydrophobicContact CB-CG 4.14Å; E459-P541 WeakPolarHBondContact O-CA 3.38Å; E459-P541 WeakPolarHBondContact O-CG 2.99Å; T460-P541 HydrophobicContact CG2-CG 4.19Å; P541-T543 PolarHBondContact O-N 3.23Å; P541-T543 PolarHBondContact O-OG1 3.33Å; P541-K567 HydrophobicContact CB-CB 4.32Å
542	G	60.4	Low	60.4	Low	32 Å²	32	43.6 Å²	43.6	33%	0.33	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	23.3	179.2	0	0	0	0	0	115.7	T564 R565	G542-T564 WeakPolarHBondContact CA-O 3.48Å; G542-T564 PolarHBondContact N-O 3.21Å; G542-T564 PolarHBondContact N-OG1 3.02Å; G542-R565 PolarHBondContact N-O 3.39Å; G542-R565 VanDerWaalsContact N-O 3.13Å
543	T	62.9	Low	59.7	Low	40 Å²	40	45.6 Å²	45.6	25%	0.245	27%	0.274	C	S	.	.			trans	-109.2	142.3	-177.9	-59.4	0	0	0	0	110.7	V513 K540 P541 Y545 T564	V513-T543 HydrophobicContact CG1-CG2 4.31Å; K540-T543 WeakPolarHBondContact CB-OG1 3.36Å; K540-T543 WeakPolarHBondContact O-CB 3.17Å; K540-T543 PolarHBondContact O-OG1 3.49Å; P541-T543 PolarHBondContact O-N 3.23Å; P541-T543 PolarHBondContact O-OG1 3.33Å; T543-Y545 HydrophobicContact CG2-CD2 4.32Å; T543-Y545 HydrophobicContact CG2-CE2 3.85Å; T543-Y545 WeakPolarHBondContact O-CD2 3.36Å; T543-Y545 PolarHBondContact O-N 3.23Å; T543-T564 PolarHBondContact N-OG1 2.99Å; T543-T564 PolarHBondContact O-N 2.88Å; T543-T564 VanDerWaalsContact O-N 3.15Å; T543-T564 PolarHBondContact O-OG1 3.21Å
544	N	59.8	Low	59	Low	95 Å²	95	50.9 Å²	50.9	51%	0.508	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	111.2	177.8	-63.7	23.5	0	0	0	109.7	T563	N544-T563 HydrophobicContact CB-CG2 4.32Å; N544-T563 WeakPolarHBondContact OD1-CG2 3.48Å
545	Y	64.7	Low	58.1	Low	4 Å²	4	54.6 Å²	54.6	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	159.3	174.3	-76.5	-90.5	0	0	0	110.9	L511 V513 V522 L539 K540 T543 V561 F562 T564	L511-Y545 HydrophobicContact CB-CD1 4.45Å; L511-Y545 HydrophobicContact CD1-CD1 4.16Å; V513-Y545 HydrophobicContact CG2-CD1 3.31Å; V513-Y545 HydrophobicContact CG2-CE1 3.32Å; V513-Y545 HydrophobicContact CG2-CG 4.04Å; V522-Y545 HydrophobicContact CG1-CE1 4.16Å; L539-Y545 HydrophobicContact CB-CE2 3.96Å; L539-Y545 HydrophobicContact CD2-CD1 4.17Å; L539-Y545 HydrophobicContact CD2-CE1 3.71Å; L539-Y545 HydrophobicContact CD2-CE2 4.39Å; K540-Y545 PolarHBondContact N-OH 3.13Å; T543-Y545 HydrophobicContact CG2-CD2 4.32Å; T543-Y545 HydrophobicContact CG2-CE2 3.85Å; T543-Y545 WeakPolarHBondContact O-CD2 3.36Å; T543-Y545 PolarHBondContact O-N 3.23Å; Y545-V561 WeakPolarHBondContact O-CA 3.38Å; Y545-F562 HydrophobicContact CG-CE2 4.3Å; Y545-F562 HydrophobicContact CG-CZ 4.35Å; Y545-F562 PolarHBondContact N-O 3.46Å; Y545-F562 PolarHBondContact O-N 3.39Å; Y545-T564 HydrophobicContact CD2-CG2 3.96Å; Y545-T564 HydrophobicContact CE2-CG2 3.93Å
546	T	60.9	Low	57.2	Low	6 Å²	6	54 Å²	54	4%	0.037	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	105.4	-179.3	-57.4	0	0	0	0	108.8	C512 Q559 V560 V561	C512-T546 WeakPolarHBondContact CA-O 3.16Å; C512-T546 PolarHBondContact N-O 3.06Å; C512-T546 WeakPolarHBondContact O-CA 3.4Å; C512-T546 WeakPolarHBondContact O-CB 3.31Å; C512-T546 PolarHBondContact O-N 2.89Å; C512-T546 VanDerWaalsContact O-O 3.11Å; T546-Q559 HydrophobicContact CG2-CG 3.28Å; T546-V560 CarbonylContact C-O 3.31Å; T546-V560 WeakPolarHBondContact CA-O 3.34Å; T546-V561 HydrophobicContact CG2-CG2 4.28Å
547	L	62.8	Low	56	Low	3 Å²	3	60.2 Å²	60.2	2%	0.016	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.3	172.3	-163.6	76.7	0	0	0	109.4	V452 V464 L509 L511 F536 Q559 V560	V452-L547 HydrophobicContact CG1-CD2 3.76Å; V464-L547 HydrophobicContact CG1-CD2 3.98Å; L509-L547 HydrophobicContact CD1-CD1 4.11Å; L509-L547 HydrophobicContact CD1-CD2 4.2Å; L509-L547 HydrophobicContact CD1-CG 4.09Å; L509-L547 HydrophobicContact CD2-CD1 4.04Å; L509-L547 HydrophobicContact CD2-CD2 4.35Å; L509-L547 HydrophobicContact CG-CD1 3.87Å; L509-L547 HydrophobicContact CG-CG 4.39Å; L511-L547 HydrophobicContact CD2-CB 4.24Å; L511-L547 HydrophobicContact CD2-CD1 3.62Å; L511-L547 HydrophobicContact CG-CD1 4.32Å; F536-L547 HydrophobicContact CE2-CD1 3.79Å; F536-L547 HydrophobicContact CZ-CD1 3.53Å; L547-Q559 WeakPolarHBondContact O-CA 3.34Å; L547-V560 HydrophobicContact CB-CB 4.17Å; L547-V560 PolarHBondContact N-O 2.71Å; L547-V560 PolarHBondContact O-N 3.26Å
548	C	57	Low	55.2	Low	8 Å²	8	58.1 Å²	58.1	5%	0.054	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.6	171.8	-101	0	0	0	0	109.9	Y510 C556	Y510-C548 PolarHBondContact O-N 2.78Å; C548-C556 WeakPolarHBondContact CA-SG 3.31Å; C548-C556 HydrophobicContact CB-CB 3.84Å; C548-C556 WeakPolarHBondContact CB-SG 3.44Å; C548-C556 WeakPolarHBondContact SG-CB 3.44Å; C548-C556 CovalentContact SG-SG 2.04Å; C548-C556 PolarHBondContact SG-SG 3.3Å
549	L	56	Low	54.5	Low	29 Å²	29	52.7 Å²	52.7	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	122.6	168.2	-88	153.3	0	0	0	109.6	V452 L466 L509 Q557 V558	V452-L549 HydrophobicContact CG2-CD1 3.87Å; L466-L549 HydrophobicContact CD1-CD2 4.05Å; L466-L549 HydrophobicContact CD2-CD1 4.34Å; L509-L549 HydrophobicContact CD1-CD2 3.67Å; L509-L549 HydrophobicContact CD1-CG 3.78Å; L549-Q557 PolarHBondContact O-N 3Å; L549-V558 HydrophobicContact CB-CB 4.3Å; L549-V558 HydrophobicContact CD1-CB 4.11Å; L549-V558 PolarHBondContact N-O 3.48Å
550	T	49.7	Very low	53.7	Low	26 Å²	26	53.3 Å²	53.3	16%	0.16	32%	0.317	C	S	.	.			trans	-138.4	117.2	177.6	57.9	0	0	0	0	110	C556	T550-C556 HydrophobicContact CG2-CB 4.2Å
551	Y	45.3	Very low	53.4	Low	82 Å²	82	47.6 Å²	47.6	32%	0.322	29%	0.294	S	S	.	.			trans	-74.4	156.8	166.6	-60.9	-73.3	0	0	0	110.7	G553 Q554	Y551-G553 PolarHBondContact O-N 3.19Å; Y551-Q554 PolarHBondContact O-N 3.44Å
552	G	36	Very low	53.2	Low	81 Å²	81	45.2 Å²	45.2	84%	0.835	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	109.4	-171.2	0	0	0	0	0	114.5
553	G	43.5	Very low	53.3	Low	70 Å²	70	46.3 Å²	46.3	72%	0.722	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-16.5	178.7	0	0	0	0	0	116.2	K421 Y551	K421-G553 PolarHBondContact NZ-O 2.8Å; Y551-G553 PolarHBondContact O-N 3.19Å
554	Q	42.8	Very low	53.4	Low	121 Å²	121	44.6 Å²	44.6	57%	0.565	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-87.1	168.7	-176.7	-60.9	-169.8	2.4	0	0	113.2	K421 Y551	K421-Q554 PolarHBondContact NZ-O 3Å; Y551-Q554 PolarHBondContact O-N 3.44Å
555	D	45.9	Very low	53.5	Low	110 Å²	110	48.4 Å²	48.4	59%	0.588	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-88.2	169.3	-178.7	-64.3	-25.9	0	0	0	111.9	K421 Q557	K421-D555 IonicContact NZ-OD1 2.66Å; K421-D555 PolarHBondContact NZ-OD1 2.93Å; D555-Q557 PolarHBondContact O-N 2.92Å
556	C	48.8	Very low	53.2	Low	37 Å²	37	56.3 Å²	56.3	25%	0.25	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-66.1	116.9	-173.1	178.8	0	0	0	0	111.8	C548 T550	C548-C556 WeakPolarHBondContact CA-SG 3.31Å; C548-C556 HydrophobicContact CB-CB 3.84Å; C548-C556 WeakPolarHBondContact CB-SG 3.44Å; C548-C556 WeakPolarHBondContact SG-CB 3.44Å; C548-C556 CovalentContact SG-SG 2.04Å; C548-C556 PolarHBondContact SG-SG 3.3Å; T550-C556 HydrophobicContact CG2-CB 4.2Å
557	Q	46.1	Very low	52.9	Low	129 Å²	129	63.4 Å²	63.4	60%	0.603	34%	0.34	S	S	*	.			trans	-95.5	-33.2	-174.2	-173.3	175.9	-4	0	0	113.1	L549 D555	L549-Q557 PolarHBondContact O-N 3Å; D555-Q557 PolarHBondContact O-N 2.92Å
558	V	49.7	Very low	52.8	Low	17 Å²	17	69.7 Å²	69.7	10%	0.103	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.1	178	-176.3	0	0	0	0	108.9	I431 F450 V452 L549 V560	I431-V558 HydrophobicContact CD1-CG1 4.44Å; F450-V558 HydrophobicContact CB-CG1 4.01Å; F450-V558 HydrophobicContact CD1-CG1 4.43Å; F450-V558 HydrophobicContact CD1-CG2 3.59Å; F450-V558 HydrophobicContact CE1-CG2 4.15Å; F450-V558 HydrophobicContact CG-CG1 4.35Å; F450-V558 HydrophobicContact CG-CG2 4.31Å; V452-V558 HydrophobicContact CG2-CG1 4.37Å; L549-V558 HydrophobicContact CB-CB 4.3Å; L549-V558 HydrophobicContact CD1-CB 4.11Å; L549-V558 PolarHBondContact N-O 3.48Å; V558-V560 HydrophobicContact CG1-CG2 4.13Å
559	Q	50.8	Low	52.5	Low	14 Å²	14	73.4 Å²	73.4	7%	0.065	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.8	-177.8	-170.9	-175.3	-66.5	0	0	110.7	T546 L547	T546-Q559 HydrophobicContact CG2-CG 3.28Å; L547-Q559 WeakPolarHBondContact O-CA 3.34Å
560	V	56.2	Low	52.6	Low	17 Å²	17	75.4 Å²	75.4	10%	0.103	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	109.8	179.2	-175.3	0	0	0	0	110	V452 T546 L547 V558	V452-V560 HydrophobicContact CB-CG2 3.83Å; V452-V560 HydrophobicContact CG1-CB 4.44Å; V452-V560 HydrophobicContact CG1-CG1 4.43Å; V452-V560 HydrophobicContact CG1-CG2 3.96Å; V452-V560 HydrophobicContact CG2-CG2 3.94Å; T546-V560 CarbonylContact C-O 3.31Å; T546-V560 WeakPolarHBondContact CA-O 3.34Å; L547-V560 HydrophobicContact CB-CB 4.17Å; L547-V560 PolarHBondContact N-O 2.71Å; L547-V560 PolarHBondContact O-N 3.26Å; V558-V560 HydrophobicContact CG1-CG2 4.13Å
561	V	57.1	Low	53	Low	25 Å²	25	80.6 Å²	80.6	15%	0.152	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.1	177.3	-176.8	0	0	0	0	109	N433 Y545 T546	N433-V561 VanDerWaalsContact CB-O 3.29Å; N433-V561 WeakPolarHBondContact CB-O 3.42Å; N433-V561 VanDerWaalsContact CG-O 3.28Å; N433-V561 PolarHBondContact OD1-O 3.3Å; Y545-V561 WeakPolarHBondContact O-CA 3.38Å; T546-V561 HydrophobicContact CG2-CG2 4.28Å
562	F	61.5	Low	53.6	Low	3 Å²	3	82.3 Å²	82.3	1%	0.013	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.2	169.7	68	-93.3	0	0	0	111.7	V457 A462 L511 L539 Y545	V457-F562 HydrophobicContact CG1-CD2 4.14Å; V457-F562 HydrophobicContact CG2-CD2 4.15Å; A462-F562 HydrophobicContact CB-CE2 3.66Å; A462-F562 HydrophobicContact CB-CZ 3.89Å; L511-F562 HydrophobicContact CD1-CZ 4.36Å; L511-F562 HydrophobicContact CD2-CE1 3.55Å; L511-F562 HydrophobicContact CD2-CZ 3.69Å; L539-F562 HydrophobicContact CD1-CE2 4.07Å; L539-F562 HydrophobicContact CD1-CZ 4.4Å; Y545-F562 HydrophobicContact CG-CE2 4.3Å; Y545-F562 HydrophobicContact CG-CZ 4.35Å; Y545-F562 PolarHBondContact N-O 3.46Å; Y545-F562 PolarHBondContact O-N 3.39Å
563	T	62.6	Low	55.1	Low	56 Å²	56	82.7 Å²	82.7	34%	0.344	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.4	-175.1	60.4	0	0	0	0	111	N433 N544	N433-T563 PolarHBondContact ND2-OG1 2.97Å; N544-T563 HydrophobicContact CB-CG2 4.32Å; N544-T563 WeakPolarHBondContact OD1-CG2 3.48Å
564	T	63.9	Low	56.3	Low	4 Å²	4	84.5 Å²	84.5	3%	0.025	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-63.3	148.5	173.5	48.8	0	0	0	0	110.9	V457 L539 K540 G542 T543 Y545 K566	V457-T564 HydrophobicContact CG1-CG2 4.45Å; L539-T564 HydrophobicContact CB-CG2 3.78Å; L539-T564 HydrophobicContact CD1-CG2 3.94Å; K540-T564 PolarHBondContact O-OG1 3.02Å; G542-T564 WeakPolarHBondContact CA-O 3.48Å; G542-T564 PolarHBondContact N-O 3.21Å; G542-T564 PolarHBondContact N-OG1 3.02Å; T543-T564 PolarHBondContact N-OG1 2.99Å; T543-T564 PolarHBondContact O-N 2.88Å; T543-T564 VanDerWaalsContact O-N 3.15Å; T543-T564 PolarHBondContact O-OG1 3.21Å; Y545-T564 HydrophobicContact CD2-CG2 3.96Å; Y545-T564 HydrophobicContact CE2-CG2 3.93Å; T564-K566 PolarHBondContact O-N 3.01Å
565	R	61.8	Low	57.8	Low	174 Å²	174	82 Å²	82	66%	0.657	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-61.2	136.8	-179.5	-63.9	-173.1	-176.5	-139	-5.1	109.7	V457 S458 E459 G542 K567	V457-R565 PolarHBondContact O-NE 3.24Å; S458-R565 PolarHBondContact O-N 3.05Å; E459-R565 HydrophobicContact CG-CB 4.44Å; G542-R565 PolarHBondContact N-O 3.39Å; G542-R565 VanDerWaalsContact N-O 3.13Å; R565-K567 PolarHBondContact O-N 3.27Å
566	K	59.5	Low	59.4	Low	170 Å²	170	80.8 Å²	80.8	74%	0.739	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-66.9	133	169	-78.1	-177.7	177.4	176.7	0	108.3	T564 I568	T564-K566 PolarHBondContact O-N 3.01Å; K566-I568 PolarHBondContact O-N 3.01Å
567	K	54.3	Low	61	Low	155 Å²	155	82.5 Å²	82.5	67%	0.674	43%	0.425	S	S	*	.			trans	-60.6	106.1	179.1	-176.4	160	-168.6	162.1	0	111.2	E459 P541 R565	E459-K567 WeakPolarHBondContact OE1-CA 3.35Å; E459-K567 WeakPolarHBondContact OE2-CD 3.47Å; E459-K567 WeakPolarHBondContact OE2-CG 3.42Å; P541-K567 HydrophobicContact CB-CB 4.32Å; R565-K567 PolarHBondContact O-N 3.27Å
568	I	59.8	Low	62.6	Low	136 Å²	136	79.5 Å²	79.5	70%	0.697	42%	0.419	S	S	*	.			trans	-78.2	127.5	176.2	-60.4	178.7	0	0	0	107.2	K566 S570	K566-I568 PolarHBondContact O-N 3.01Å; I568-S570 VanDerWaalsContact C-N 3.3Å; I568-S570 PolarHBondContact O-N 2.82Å
569	P	51.3	Low	64.3	Low	86 Å²	86	84 Å²	84	56%	0.558	44%	0.441	S	S	*	.			trans	-78.3	79.4	-173.5	33.3	-37.2	0	0	0	111.9	I573	P569-I573 HydrophobicContact CB-CD1 3.82Å; P569-I573 HydrophobicContact CG-CD1 4.14Å; P569-I573 WeakPolarHBondContact O-CD1 3.36Å; P569-I573 WeakPolarHBondContact O-CG1 3.42Å
570	S	58.2	Low	65.9	Low	71 Å²	71	90.2 Å²	90.2	50%	0.497	47%	0.468	S	S	.	.			trans	51.2	139.4	162.7	-169.3	0	0	0	0	119.1	I568 L572 I573	I568-S570 VanDerWaalsContact C-N 3.3Å; I568-S570 PolarHBondContact O-N 2.82Å; S570-L572 PolarHBondContact O-N 2.94Å; S570-L572 WeakPolarHBondContact OG-CB 3.31Å; S570-L572 PolarHBondContact OG-N 2.91Å; S570-I573 PolarHBondContact O-N 2.87Å
571	L	58.1	Low	67.2	Low	135 Å²	135	94.4 Å²	94.4	71%	0.707	49%	0.489	S	S	*	.	H	α-helix	trans	-43.7	-33.4	165.4	-164.7	90.5	0	0	0	112.7	I573 I574 V575	L571-I573 VanDerWaalsContact C-N 3.32Å; L571-I573 PolarHBondContact O-N 3.26Å; L571-I574 PolarHBondContact O-N 2.97Å; L571-I574 VanDerWaalsContact O-N 3.13Å; L571-V575 HydrophobicContact CD2-CG2 4.48Å; L571-V575 HydrophobicContact CG-CG2 4.36Å; L571-V575 WeakPolarHBondContact O-CG2 3.46Å; L571-V575 PolarHBondContact O-N 2.91Å
572	L	58.5	Low	68.6	Low	117 Å²	117	98.8 Å²	98.8	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-56.3	-38.9	178.9	-152.2	164.1	0	0	0	112.7	S570 V576	S570-L572 PolarHBondContact O-N 2.94Å; S570-L572 WeakPolarHBondContact OG-CB 3.31Å; S570-L572 PolarHBondContact OG-N 2.91Å; L572-V576 HydrophobicContact CD2-CG2 3.89Å; L572-V576 WeakPolarHBondContact O-CB 3.46Å; L572-V576 VanDerWaalsContact O-CG2 3.3Å; L572-V576 WeakPolarHBondContact O-CG2 3.34Å; L572-V576 PolarHBondContact O-N 3.33Å
573	I	67	Low	69.6	Low	90 Å²	90	99.9 Å²	99.9	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-69.9	-41.7	176.4	-62	-168.9	0	0	0	110.9	P569 S570 L571 V575 V576 V577	P569-I573 HydrophobicContact CB-CD1 3.82Å; P569-I573 HydrophobicContact CG-CD1 4.14Å; P569-I573 WeakPolarHBondContact O-CD1 3.36Å; P569-I573 WeakPolarHBondContact O-CG1 3.42Å; S570-I573 PolarHBondContact O-N 2.87Å; L571-I573 VanDerWaalsContact C-N 3.32Å; L571-I573 PolarHBondContact O-N 3.26Å; I573-V575 VanDerWaalsContact C-N 3.31Å; I573-V575 PolarHBondContact O-N 3.44Å; I573-V576 PolarHBondContact O-N 3.34Å; I573-V577 HydrophobicContact CG2-CG2 4.18Å; I573-V577 WeakPolarHBondContact O-CB 3.3Å; I573-V577 WeakPolarHBondContact O-CG2 3.27Å; I573-V577 PolarHBondContact O-N 2.91Å
574	I	68.4	Low	70.6	Confident	107 Å²	107	102.1 Å²	102.1	55%	0.549	53%	0.533	S	S	.	.	H	α-helix	trans	-61.4	-43.6	177.4	-59.9	175.8	0	0	0	110	L571 S578	L571-I574 PolarHBondContact O-N 2.97Å; L571-I574 VanDerWaalsContact O-N 3.13Å; I574-S578 VanDerWaalsContact O-CB 3.27Å; I574-S578 WeakPolarHBondContact O-CB 3.39Å; I574-S578 PolarHBondContact O-N 3.13Å; I574-S578 PolarHBondContact O-OG 3.39Å
575	V	74.6	Confident	71.5	Confident	68 Å²	68	104.9 Å²	104.9	41%	0.412	56%	0.556	S	S	.	*	H	α-helix	trans	-61.8	-47.7	174.4	170.7	0	0	0	0	111.5	L571 I573 S578 I579	L571-V575 HydrophobicContact CD2-CG2 4.48Å; L571-V575 HydrophobicContact CG-CG2 4.36Å; L571-V575 WeakPolarHBondContact O-CG2 3.46Å; L571-V575 PolarHBondContact O-N 2.91Å; I573-V575 VanDerWaalsContact C-N 3.31Å; I573-V575 PolarHBondContact O-N 3.44Å; V575-S578 PolarHBondContact O-N 3.25Å; V575-I579 HydrophobicContact CG1-CD1 3.65Å; V575-I579 HydrophobicContact CG1-CG1 4.41Å; V575-I579 WeakPolarHBondContact O-CB 3.46Å; V575-I579 VanDerWaalsContact O-CG1 3.29Å; V575-I579 WeakPolarHBondContact O-CG1 3.41Å; V575-I579 PolarHBondContact O-N 3.33Å
576	V	79.2	Confident	72.5	Confident	85 Å²	85	99.4 Å²	99.4	52%	0.515	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-44.8	178.9	165.3	0	0	0	0	112	L572 I573 S578 I579 F580	L572-V576 HydrophobicContact CD2-CG2 3.89Å; L572-V576 WeakPolarHBondContact O-CB 3.46Å; L572-V576 VanDerWaalsContact O-CG2 3.3Å; L572-V576 WeakPolarHBondContact O-CG2 3.34Å; L572-V576 PolarHBondContact O-N 3.33Å; I573-V576 PolarHBondContact O-N 3.34Å; V576-S578 VanDerWaalsContact C-N 3.35Å; V576-I579 PolarHBondContact O-N 2.67Å; V576-F580 WeakPolarHBondContact O-CB 3.32Å; V576-F580 PolarHBondContact O-N 2.92Å
577	V	81.6	Confident	73.6	Confident	74 Å²	74	96 Å²	96	45%	0.448	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-40.5	176.4	171.4	0	0	0	0	110.9	I573 F580 L581	I573-V577 HydrophobicContact CG2-CG2 4.18Å; I573-V577 WeakPolarHBondContact O-CB 3.3Å; I573-V577 WeakPolarHBondContact O-CG2 3.27Å; I573-V577 PolarHBondContact O-N 2.91Å; V577-F580 PolarHBondContact O-N 3.28Å; V577-L581 HydrophobicContact CG1-CD1 3.88Å; V577-L581 HydrophobicContact CG1-CG 4.38Å; V577-L581 WeakPolarHBondContact O-CB 3.44Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.3Å; V577-L581 PolarHBondContact O-N 2.9Å
578	S	80.8	Confident	74.8	Confident	66 Å²	66	92.5 Å²	92.5	46%	0.462	53%	0.528	S	S	.	.	H	α-helix	trans	-65.7	-43.4	178.3	-57.6	0	0	0	0	112	I574 V575 V576 F580 L582	I574-S578 VanDerWaalsContact O-CB 3.27Å; I574-S578 WeakPolarHBondContact O-CB 3.39Å; I574-S578 PolarHBondContact O-N 3.13Å; I574-S578 PolarHBondContact O-OG 3.39Å; V575-S578 PolarHBondContact O-N 3.25Å; V576-S578 VanDerWaalsContact C-N 3.35Å; S578-F580 VanDerWaalsContact C-N 3.35Å; S578-L582 VanDerWaalsContact O-CB 3.3Å; S578-L582 WeakPolarHBondContact O-CB 3.29Å; S578-L582 PolarHBondContact O-N 3.37Å
579	I	84.6	Confident	75.6	Confident	110 Å²	110	91.9 Å²	91.9	56%	0.564	53%	0.526	S	S	*	.	H	α-helix	trans	-63	-41.8	174.2	-70.2	168.2	0	0	0	110.7	V575 V576 L582 G583	V575-I579 HydrophobicContact CG1-CD1 3.65Å; V575-I579 HydrophobicContact CG1-CG1 4.41Å; V575-I579 WeakPolarHBondContact O-CB 3.46Å; V575-I579 VanDerWaalsContact O-CG1 3.29Å; V575-I579 WeakPolarHBondContact O-CG1 3.41Å; V575-I579 PolarHBondContact O-N 3.33Å; V576-I579 PolarHBondContact O-N 2.67Å; I579-L582 PolarHBondContact O-N 3.41Å; I579-G583 PolarHBondContact O-N 2.94Å
580	F	84.8	Confident	76.9	Confident	145 Å²	145	93.4 Å²	93.4	64%	0.636	53%	0.529	S	S	*	.	H	α-helix	trans	-66	-43.9	179.5	-167.6	-103.5	0	0	0	112.2	V576 V577 S578 G583 L584	V576-F580 WeakPolarHBondContact O-CB 3.32Å; V576-F580 PolarHBondContact O-N 2.92Å; V577-F580 PolarHBondContact O-N 3.28Å; S578-F580 VanDerWaalsContact C-N 3.35Å; F580-G583 PolarHBondContact O-N 3.46Å; F580-L584 HydrophobicContact CD1-CD1 3.84Å; F580-L584 HydrophobicContact CD1-CG 4.4Å; F580-L584 HydrophobicContact CE1-CD1 3.63Å; F580-L584 HydrophobicContact CE1-CG 4.24Å; F580-L584 HydrophobicContact CZ-CD1 4.43Å; F580-L584 WeakPolarHBondContact O-CG 3.04Å; F580-L584 PolarHBondContact O-N 3Å
581	L	83.7	Confident	77.9	Confident	106 Å²	106	91.7 Å²	91.7	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-40.3	174.5	-70.2	171.2	0	0	0	112.1	V577 G583 L584 A585	V577-L581 HydrophobicContact CG1-CD1 3.88Å; V577-L581 HydrophobicContact CG1-CG 4.38Å; V577-L581 WeakPolarHBondContact O-CB 3.44Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.3Å; V577-L581 PolarHBondContact O-N 2.9Å; L581-G583 VanDerWaalsContact C-N 3.34Å; L581-L584 PolarHBondContact O-N 3.45Å; L581-A585 PolarHBondContact O-N 3.33Å
582	L	86.2	Confident	78.9	Confident	116 Å²	116	88.1 Å²	88.1	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-39.1	175	-171.1	67.3	0	0	0	111.7	S578 I579 A585 T586	S578-L582 VanDerWaalsContact O-CB 3.3Å; S578-L582 WeakPolarHBondContact O-CB 3.29Å; S578-L582 PolarHBondContact O-N 3.37Å; I579-L582 PolarHBondContact O-N 3.41Å; L582-A585 PolarHBondContact O-N 2.98Å; L582-T586 HydrophobicContact CD1-CG2 4.33Å; L582-T586 HydrophobicContact CG-CG2 4.43Å; L582-T586 WeakPolarHBondContact O-CB 3.32Å; L582-T586 VanDerWaalsContact O-CG2 3.32Å; L582-T586 WeakPolarHBondContact O-CG2 3.4Å; L582-T586 PolarHBondContact O-N 3.4Å; L582-T586 PolarHBondContact O-OG1 3.31Å
583	G	82.6	Confident	79.8	Confident	27 Å²	27	86.1 Å²	86.1	28%	0.278	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-47.7	172.1	0	0	0	0	0	112.6	I579 F580 L581 A585 T586 V587	I579-G583 PolarHBondContact O-N 2.94Å; F580-G583 PolarHBondContact O-N 3.46Å; L581-G583 VanDerWaalsContact C-N 3.34Å; G583-A585 VanDerWaalsContact C-N 3.26Å; G583-A585 PolarHBondContact O-N 2.94Å; G583-T586 PolarHBondContact O-N 2.88Å; G583-T586 PolarHBondContact O-OG1 2.88Å; G583-V587 WeakPolarHBondContact O-CB 3.46Å; G583-V587 VanDerWaalsContact O-CG2 3.32Å; G583-V587 WeakPolarHBondContact O-CG2 3.25Å; G583-V587 PolarHBondContact O-N 3.43Å
584	L	84	Confident	80.2	Confident	103 Å²	103	85 Å²	85	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-30.4	176.1	-74	175.1	0	0	0	113.4	F580 L581 P588	F580-L584 HydrophobicContact CD1-CD1 3.84Å; F580-L584 HydrophobicContact CD1-CG 4.4Å; F580-L584 HydrophobicContact CE1-CD1 3.63Å; F580-L584 HydrophobicContact CE1-CG 4.24Å; F580-L584 HydrophobicContact CZ-CD1 4.43Å; F580-L584 WeakPolarHBondContact O-CG 3.04Å; F580-L584 PolarHBondContact O-N 3Å; L581-L584 PolarHBondContact O-N 3.45Å; L584-P588 WeakPolarHBondContact O-CD 3.32Å; L584-P588 VanDerWaalsContact O-CG 3.25Å; L584-P588 WeakPolarHBondContact O-CG 3.44Å
585	A	81.9	Confident	80.4	Confident	62 Å²	62	83.9 Å²	83.9	51%	0.512	51%	0.505	S	S	.	.	H	α-helix	trans	-80.7	-38.2	175.8	0	0	0	0	0	113.3	L581 L582 G583	L581-A585 PolarHBondContact O-N 3.33Å; L582-A585 PolarHBondContact O-N 2.98Å; G583-A585 VanDerWaalsContact C-N 3.26Å; G583-A585 PolarHBondContact O-N 2.94Å
586	T	83.1	Confident	80.3	Confident	58 Å²	58	86.4 Å²	86.4	36%	0.356	51%	0.512	S	S	.	.	H	α-helix	trans	-84.6	-35.5	-173.3	50.8	0	0	0	0	113.8	L582 G583 L589 L590	L582-T586 HydrophobicContact CD1-CG2 4.33Å; L582-T586 HydrophobicContact CG-CG2 4.43Å; L582-T586 WeakPolarHBondContact O-CB 3.32Å; L582-T586 VanDerWaalsContact O-CG2 3.32Å; L582-T586 WeakPolarHBondContact O-CG2 3.4Å; L582-T586 PolarHBondContact O-N 3.4Å; L582-T586 PolarHBondContact O-OG1 3.31Å; G583-T586 PolarHBondContact O-N 2.88Å; G583-T586 PolarHBondContact O-OG1 2.88Å; T586-L589 WeakPolarHBondContact O-CB 3.39Å; T586-L589 PolarHBondContact O-N 2.86Å; T586-L589 VanDerWaalsContact O-N 3.15Å; T586-L590 PolarHBondContact O-N 3.43Å
587	V	82.5	Confident	79.6	Confident	99 Å²	99	86.7 Å²	86.7	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-61.3	-43.6	-179.4	169.8	0	0	0	0	112.8	G583 L589 L590 G591	G583-V587 WeakPolarHBondContact O-CB 3.46Å; G583-V587 VanDerWaalsContact O-CG2 3.32Å; G583-V587 WeakPolarHBondContact O-CG2 3.25Å; G583-V587 PolarHBondContact O-N 3.43Å; V587-L589 VanDerWaalsContact C-N 3.31Å; V587-L589 PolarHBondContact O-N 3.31Å; V587-L590 PolarHBondContact O-N 2.71Å; V587-G591 PolarHBondContact O-N 2.94Å
588	P	80.8	Confident	79	Confident	81 Å²	81	88.7 Å²	88.7	53%	0.526	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-34.6	173.4	-23.8	35.5	0	0	0	113.3	L584 G591 A592	L584-P588 WeakPolarHBondContact O-CD 3.32Å; L584-P588 VanDerWaalsContact O-CG 3.25Å; L584-P588 WeakPolarHBondContact O-CG 3.44Å; P588-G591 PolarHBondContact O-N 2.95Å; P588-A592 WeakPolarHBondContact O-CB 3.46Å; P588-A592 PolarHBondContact O-N 3.43Å
589	L	76.7	Confident	78.3	Confident	123 Å²	123	94.5 Å²	94.5	64%	0.644	53%	0.531	S	S	*	.	H	α-helix	trans	-68.9	-42.3	177.9	-130.3	74.7	0	0	0	111.8	T586 V587 A592 T593	T586-L589 WeakPolarHBondContact O-CB 3.39Å; T586-L589 PolarHBondContact O-N 2.86Å; T586-L589 VanDerWaalsContact O-N 3.15Å; V587-L589 VanDerWaalsContact C-N 3.31Å; V587-L589 PolarHBondContact O-N 3.31Å; L589-A592 PolarHBondContact O-N 2.92Å; L589-T593 WeakPolarHBondContact O-CG2 3.32Å; L589-T593 PolarHBondContact O-N 2.83Å; L589-T593 PolarHBondContact O-OG1 3.42Å
590	L	78.1	Confident	77.2	Confident	119 Å²	119	96.7 Å²	96.7	62%	0.623	54%	0.536	S	S	*	.	H	α-helix	trans	-66.4	-39.1	172.4	-81	160.9	0	0	0	111.9	T586 V587 T593 C594	T586-L590 PolarHBondContact O-N 3.43Å; V587-L590 PolarHBondContact O-N 2.71Å; L590-T593 WeakPolarHBondContact CA-OG1 3.38Å; L590-T593 PolarHBondContact O-OG1 3.16Å; L590-C594 WeakPolarHBondContact O-CB 3.3Å; L590-C594 PolarHBondContact O-N 3.46Å
591	G	79.4	Confident	75.8	Confident	34 Å²	34	98.4 Å²	98.4	35%	0.351	54%	0.54	S	S	.	.	H	α-helix	trans	-60.1	-48	171.6	0	0	0	0	0	112.4	V587 P588 C594 C595	V587-G591 PolarHBondContact O-N 2.94Å; P588-G591 PolarHBondContact O-N 2.95Å; G591-C594 PolarHBondContact O-N 3.44Å; G591-C595 WeakPolarHBondContact O-CB 3.47Å; G591-C595 PolarHBondContact O-N 2.86Å; G591-C595 PolarHBondContact O-SG 3.42Å
592	A	78.2	Confident	74.4	Confident	60 Å²	60	101.7 Å²	101.7	50%	0.496	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-45.6	178.9	0	0	0	0	0	112.4	P588 L589 C595 H596	P588-A592 WeakPolarHBondContact O-CB 3.46Å; P588-A592 PolarHBondContact O-N 3.43Å; L589-A592 PolarHBondContact O-N 2.92Å; A592-C595 PolarHBondContact O-N 2.89Å; A592-H596 VanDerWaalsContact O-CB 3.26Å; A592-H596 WeakPolarHBondContact O-CB 3.12Å; A592-H596 PolarHBondContact O-N 3.42Å
593	T	78.6	Confident	73.1	Confident	75 Å²	75	99 Å²	99	46%	0.46	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-38.3	177.5	47.8	0	0	0	0	112.5	L589 L590 H596 L597	L589-T593 WeakPolarHBondContact O-CG2 3.32Å; L589-T593 PolarHBondContact O-N 2.83Å; L589-T593 PolarHBondContact O-OG1 3.42Å; L590-T593 WeakPolarHBondContact CA-OG1 3.38Å; L590-T593 PolarHBondContact O-OG1 3.16Å; T593-H596 PolarHBondContact O-N 2.91Å; T593-L597 WeakPolarHBondContact O-CB 3.37Å; T593-L597 WeakPolarHBondContact O-CG 3.26Å; T593-L597 PolarHBondContact O-N 3.15Å
594	C	74.8	Confident	71.3	Confident	66 Å²	66	105.3 Å²	105.3	45%	0.446	57%	0.572	S	S	.	*	H	α-helix	trans	-63.8	-47	172.9	-173.9	0	0	0	0	111.9	L590 G591 H596 L597 L598	L590-C594 WeakPolarHBondContact O-CB 3.3Å; L590-C594 PolarHBondContact O-N 3.46Å; G591-C594 PolarHBondContact O-N 3.44Å; C594-H596 VanDerWaalsContact C-N 3.33Å; C594-H596 PolarHBondContact O-N 3.45Å; C594-L597 PolarHBondContact O-N 2.91Å; C594-L598 WeakPolarHBondContact O-CG 3.32Å; C594-L598 PolarHBondContact O-N 3.17Å
595	C	73	Confident	69.6	Low	85 Å²	85	107.3 Å²	107.3	57%	0.574	59%	0.589	S	S	*	*	H	α-helix	trans	-62	-39.9	175.4	-68.4	0	0	0	0	112.1	G591 A592 L598 Y599	G591-C595 WeakPolarHBondContact O-CB 3.47Å; G591-C595 PolarHBondContact O-N 2.86Å; G591-C595 PolarHBondContact O-SG 3.42Å; A592-C595 PolarHBondContact O-N 2.89Å; C595-L598 PolarHBondContact O-N 3.42Å; C595-Y599 VanDerWaalsContact O-CB 3.3Å; C595-Y599 WeakPolarHBondContact O-CB 3.37Å; C595-Y599 PolarHBondContact O-N 2.88Å
596	H	71.2	Confident	67.8	Low	120 Å²	120	113.2 Å²	113.2	56%	0.556	60%	0.6	S	S	*	*	H	α-helix	trans	-66.4	-36.9	176.2	-174.3	-96.3	0	0	0	112.4	A592 T593 C594 K600	A592-H596 VanDerWaalsContact O-CB 3.26Å; A592-H596 WeakPolarHBondContact O-CB 3.12Å; A592-H596 PolarHBondContact O-N 3.42Å; T593-H596 PolarHBondContact O-N 2.91Å; C594-H596 VanDerWaalsContact C-N 3.33Å; C594-H596 PolarHBondContact O-N 3.45Å; H596-K600 WeakPolarHBondContact O-CB 3.38Å; H596-K600 PolarHBondContact O-N 3.22Å
597	L	66.1	Low	65.7	Low	91 Å²	91	119.2 Å²	119.2	48%	0.476	62%	0.621	S	S	.	*	H	α-helix	trans	-65.5	-50.3	171.5	-77.8	164.7	0	0	0	111.4	T593 C594 Y599 K600 Y601	T593-L597 WeakPolarHBondContact O-CB 3.37Å; T593-L597 WeakPolarHBondContact O-CG 3.26Å; T593-L597 PolarHBondContact O-N 3.15Å; C594-L597 PolarHBondContact O-N 2.91Å; L597-Y599 VanDerWaalsContact C-N 3.3Å; L597-Y599 PolarHBondContact O-N 3.38Å; L597-K600 PolarHBondContact O-N 3.45Å; L597-K600 VanDerWaalsContact O-N 3.09Å; L597-Y601 HydrophobicContact CD2-CD2 4.41Å; L597-Y601 HydrophobicContact CD2-CE2 3.98Å; L597-Y601 VanDerWaalsContact O-CD2 3.32Å; L597-Y601 WeakPolarHBondContact O-CD2 3.19Å; L597-Y601 PolarHBondContact O-N 2.91Å
598	L	67	Low	63.6	Low	117 Å²	117	121.8 Å²	121.8	61%	0.613	63%	0.63	S	S	*	*	H	α-helix	trans	-58	-42.4	178.5	-71.7	169	0	0	0	111.8	C594 C595 Y601 Q602	C594-L598 WeakPolarHBondContact O-CG 3.32Å; C594-L598 PolarHBondContact O-N 3.17Å; C595-L598 PolarHBondContact O-N 3.42Å; L598-Y601 PolarHBondContact O-N 2.96Å; L598-Q602 PolarHBondContact O-N 3.09Å
599	Y	67.7	Low	61.7	Low	188 Å²	188	124.4 Å²	124.4	74%	0.737	64%	0.639	S	S	*	*	H	α-helix	trans	-61.4	-47	172.6	-177.1	-102.9	0	0	0	112.2	C595 L597 Y601 Q602	C595-Y599 VanDerWaalsContact O-CB 3.3Å; C595-Y599 WeakPolarHBondContact O-CB 3.37Å; C595-Y599 PolarHBondContact O-N 2.88Å; L597-Y599 VanDerWaalsContact C-N 3.3Å; L597-Y599 PolarHBondContact O-N 3.38Å; Y599-Y601 VanDerWaalsContact C-N 3.27Å; Y599-Y601 PolarHBondContact O-N 3.3Å; Y599-Q602 PolarHBondContact O-N 3.35Å
600	K	59.9	Low	59.8	Low	156 Å²	156	126.9 Å²	126.9	68%	0.678	65%	0.649	S	S	*	*	H	α-helix	trans	-66.8	-23.2	-179.2	-169.2	174.2	-176.6	-179.3	0	113.8	H596 L597	H596-K600 WeakPolarHBondContact O-CB 3.38Å; H596-K600 PolarHBondContact O-N 3.22Å; L597-K600 PolarHBondContact O-N 3.45Å; L597-K600 VanDerWaalsContact O-N 3.09Å
601	Y	56.7	Low	57.6	Low	180 Å²	180	129.8 Å²	129.8	71%	0.706	66%	0.657	S	S	*	*	H	α-helix	trans	-99.8	-5.2	179.3	-80.5	-76.5	0	0	0	115	L597 L598 Y599 G603	L597-Y601 HydrophobicContact CD2-CD2 4.41Å; L597-Y601 HydrophobicContact CD2-CE2 3.98Å; L597-Y601 VanDerWaalsContact O-CD2 3.32Å; L597-Y601 WeakPolarHBondContact O-CD2 3.19Å; L597-Y601 PolarHBondContact O-N 2.91Å; L598-Y601 PolarHBondContact O-N 2.96Å; Y599-Y601 VanDerWaalsContact C-N 3.27Å; Y599-Y601 PolarHBondContact O-N 3.3Å; Y601-G603 PolarHBondContact O-N 2.88Å
602	Q	53.2	Low	55.8	Low	176 Å²	176	133 Å²	133	82%	0.822	68%	0.68	S	S	*	*	S	Bend	trans	-73.8	15.9	-173.4	-133.5	-176.4	16.9	0	0	115.8	L598 Y599	L598-Q602 PolarHBondContact O-N 3.09Å; Y599-Q602 PolarHBondContact O-N 3.35Å
603	G	59.3	Low	53.8	Low	60 Å²	60	137.9 Å²	137.9	62%	0.619	69%	0.692	S	S	*	*	S	Bend	trans	-166	80.6	-178.7	0	0	0	0	0	115.3	Y601	Y601-G603 PolarHBondContact O-N 2.88Å
604	K	45.6	Very low	52.1	Low	158 Å²	158	141.1 Å²	141.1	69%	0.687	71%	0.707	S	S	*	*			trans	-168.5	108	151.2	-102.2	151.1	-161.9	178.1	0	111.6	Y606	K604-Y606 HydrophobicContact CB-CD2 4.32Å; K604-Y606 HydrophobicContact CB-CE1 4.04Å; K604-Y606 HydrophobicContact CB-CE2 3.71Å; K604-Y606 HydrophobicContact CD-CE1 4.16Å; K604-Y606 WeakPolarHBondContact CD-OH 3.34Å; K604-Y606 HydrophobicContact CG-CE1 4.22Å; K604-Y606 WeakPolarHBondContact O-CD2 3.48Å; K604-Y606 PolarHBondContact O-N 2.95Å
605	T	48.4	Very low	50.8	Low	146 Å²	146	145.4 Å²	145.4	90%	0.896	72%	0.724	S	S	*	*			trans	-79.5	99.5	166	48.6	0	0	0	0	109.7	K607	T605-K607 PolarHBondContact O-N 2.92Å
606	Y	43.7	Very low	49.6	Very low	185 Å²	185	148.7 Å²	148.7	73%	0.725	74%	0.736	S	S	*	*			trans	-78.7	106.5	176.9	-60.2	-76.6	0	0	0	110.7	K604 L608	K604-Y606 HydrophobicContact CB-CD2 4.32Å; K604-Y606 HydrophobicContact CB-CE1 4.04Å; K604-Y606 HydrophobicContact CB-CE2 3.71Å; K604-Y606 HydrophobicContact CD-CE1 4.16Å; K604-Y606 WeakPolarHBondContact CD-OH 3.34Å; K604-Y606 HydrophobicContact CG-CE1 4.22Å; K604-Y606 WeakPolarHBondContact O-CD2 3.48Å; K604-Y606 PolarHBondContact O-N 2.95Å; Y606-L608 PolarHBondContact O-N 3.23Å
607	K	39.7	Very low	48.2	Very low	185 Å²	185	152.3 Å²	152.3	80%	0.804	75%	0.754	S	S	*	*			trans	-76.4	106.6	172.5	-173.2	177.4	-176.5	178.7	0	109	T605 I609	T605-K607 PolarHBondContact O-N 2.92Å; K607-I609 PolarHBondContact O-N 3.32Å
608	L	36.6	Very low	47.1	Very low	153 Å²	153	153.1 Å²	153.1	80%	0.801	76%	0.762	S	S	*	*			trans	-65.4	116.4	179.5	-153.2	88.7	0	0	0	110	Y606 M610	Y606-L608 PolarHBondContact O-N 3.23Å; L608-M610 HydrophobicContact CD2-CG 4.2Å
609	I	42.2	Very low	46	Very low	136 Å²	136	155.9 Å²	155.9	70%	0.697	77%	0.772	S	S	*	*			trans	-120	101.7	171.2	-60.2	177.7	0	0	0	106.6	K607 K611	K607-I609 PolarHBondContact O-N 3.32Å; I609-K611 PolarHBondContact O-N 3.28Å
610	M	35.6	Very low	44.7	Very low	174 Å²	174	156 Å²	156	86%	0.857	78%	0.776	S	S	*	*			trans	-74	124	171.1	-63.6	-156.2	-60.7	0	0	109.1	L608	L608-M610 HydrophobicContact CD2-CG 4.2Å
611	K	32	Very low	43.9	Very low	181 Å²	181	157.1 Å²	157.1	79%	0.787	78%	0.784	S	S	*	*			trans	-122.7	107.9	168.5	-171.4	-178.1	-179.9	-170.8	0	107.7	I609	I609-K611 PolarHBondContact O-N 3.28Å
612	A	43.1	Very low	42.9	Very low	101 Å²	101	156 Å²	156	84%	0.835	79%	0.787	S	S	*	*			trans	-70.4	143.5	175.6	0	0	0	0	0	110.5
613	Q	36.3	Very low	42.1	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.762	78%	0.782	S	S	*	*			trans	-149.2	101.6	168.8	-166.4	159	-15.2	0	0	109
614	N	41.6	Very low	40.9	Very low	142 Å²	142	162.1 Å²	162.1	76%	0.759	80%	0.797	S	S	*	*			trans	29	117.4	162	-58.7	8	0	0	0	118.2
615	L	48.1	Very low	40.4	Very low	156 Å²	156	161.5 Å²	161.5	82%	0.817	80%	0.801	S	S	*	*				43.4	96.7	72.5	-76.3	84.7	0	0	0	113.3
616	D	47.1	Very low	39.6	Very low	155 Å²	155	164 Å²	164	83%	0.829	80%	0.8	S	S	*	*	S	Bend	trans	179.3	-11	143.2	-102.7	-5.5	0	0	0	113.5
617	Q	42.8	Very low	39.1	Very low	196 Å²	196	161.7 Å²	161.7	92%	0.916	80%	0.8	S	S	*	*	S	Bend	trans	-105	-0.5	-178	-73	-166.4	-21.1	0	0	116.4
618	V	42.3	Very low	39.1	Very low	108 Å²	108	157.9 Å²	157.9	66%	0.655	79%	0.794	S	S	*	*	S	Bend	trans	-94.2	-25	-178.7	-173.4	0	0	0	0	112.5	K620	V618-K620 PolarHBondContact O-N 3.28Å
619	E	44.3	Very low	39.3	Very low	175 Å²	175	162.9 Å²	162.9	82%	0.818	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	16.1	-169.4	-146.7	-178.3	147.2	0	0	115.4
620	K	41.3	Very low	38.6	Very low	189 Å²	189	161.1 Å²	161.1	82%	0.822	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-0.9	175.8	-88.7	-174	175	176.3	0	116	V618	V618-K620 PolarHBondContact O-N 3.28Å
621	Q	42	Very low	38.4	Very low	180 Å²	180	158 Å²	158	84%	0.841	80%	0.804	S	S	*	*	S	Bend	trans	-114.9	2.7	-179.2	-147.8	66.2	30.7	0	0	114.3
622	M	35	Very low	38.2	Very low	156 Å²	156	158.3 Å²	158.3	77%	0.768	81%	0.805	S	S	*	*	S	Bend	trans	-125.6	38.5	-175.3	-70.4	-174.8	169.3	0	0	113.7
623	T	36.4	Very low	37.6	Very low	118 Å²	118	158.3 Å²	158.3	72%	0.724	80%	0.795	S	S	*	*	S	Bend	trans	-134.6	53.8	175	39.5	0	0	0	0	113.2
624	R	34.7	Very low	37.2	Very low	247 Å²	247	158.2 Å²	158.2	93%	0.932	79%	0.794	S	S	*	*			trans	-174.3	71.2	146.6	-100.3	155.8	-164.9	-177	5.1	112.1
625	D	35.1	Very low	36.6	Very low	146 Å²	146	156.1 Å²	156.1	78%	0.781	79%	0.79	S	S	*	*			trans	-69.8	-176.6	141.9	-82.6	-53.5	0	0	0	110
626	F	31	Very low	35.7	Very low	199 Å²	199	155.2 Å²	155.2	87%	0.873	78%	0.782	S	S	*	*			trans	89	125.5	-172.7	-66.1	-83.4	0	0	0	115.2
627	D	34.1	Very low	34.9	Very low	136 Å²	136	154.9 Å²	154.9	73%	0.727	77%	0.773	S	S	*	*			cis	-154.6	-148.8	-14.5	-155.4	10.7	0	0	0	111.2
628	P	40.6	Very low	34.2	Very low	104 Å²	104	150.8 Å²	150.8	68%	0.675	76%	0.762	S	S	*	*				-118.9	-164.6	-126.7	40.8	-21.3	0	0	0	115.3	A630	P628-A630 PolarHBondContact O-N 3.2Å
629	R	39.5	Very low	33.5	Very low	258 Å²	258	154.8 Å²	154.8	97%	0.974	77%	0.771	S	S	*	*			trans	-84.4	88.9	-166.6	-148	-179.4	-171.9	170.7	0.7	114.4
630	A	28.2	Very low	32.8	Very low	99 Å²	99	152.6 Å²	152.6	82%	0.818	77%	0.765	S	S	*	*			trans	-164.9	150.6	156.6	0	0	0	0	0	107.4	P628	P628-A630 PolarHBondContact O-N 3.2Å
631	S	30.2	Very low	32.1	Very low	109 Å²	109	155 Å²	155	76%	0.762	77%	0.769	S	S	*	*			cis	-150.2	146.1	13.3	46.8	0	0	0	0	108.5
632	F	29.7	Very low	31.6	Very low	187 Å²	187	152.6 Å²	152.6	82%	0.82	76%	0.762	S	S	*	*				63.8	95.1	89.3	-128.1	-92.4	0	0	0	117
633	V	30.5	Very low	31.5	Very low	102 Å²	102	150.9 Å²	150.9	62%	0.618	76%	0.76	S	S	*	*			trans	72.8	152.3	137.6	179.9	0	0	0	0	121.4
634	E	26.7	Very low	31.4	Very low	161 Å²	161	151.6 Å²	151.6	75%	0.752	76%	0.759	S	S	*	*			trans	96.7	126.7	157	-130	80.8	-100.4	0	0	120.4
635	S	29.8	Very low	31.2	Very low	97 Å²	97	151.1 Å²	151.1	68%	0.678	76%	0.757	S	S	*	*			trans	64.4	145.3	142.5	-81.1	0	0	0	0	122.5
636	E	29.4	Very low	31.1	Very low	138 Å²	138	152 Å²	152	65%	0.645	76%	0.762	S	S	*	*			cis	-168.2	173.8	-13.9	-131.8	-164.8	138.9	0	0	112.4
637	K	29.9	Very low	31	Very low	147 Å²	147	146.1 Å²	146.1	64%	0.639	76%	0.758	S	S	*	*			trans	66.6	113.1	148.2	-79.8	173.8	171.7	74.5	0	122.4
638	T	27.3	Very low	30.9	Very low	111 Å²	111	147.5 Å²	147.5	68%	0.681	77%	0.765	S	S	*	*				42.2	147.4	120.4	61.9	0	0	0	0	121.6
639	F	27.5	Very low	30.5	Very low	191 Å²	191	147 Å²	147	84%	0.838	77%	0.77	S	S	*	*			cis	-162.5	163.2	49.2	-132.6	-79.7	0	0	0	113.3
640	N	29.4	Very low	30	Very low	130 Å²	130	142.8 Å²	142.8	70%	0.695	77%	0.767	S	S	*	*			trans	-68.5	166.2	175.3	-62.5	12.8	0	0	0	114.4
641	R	27.9	Very low	30.1	Very low	238 Å²	238	141.5 Å²	141.5	90%	0.898	76%	0.763	S	S	*	*				-166.3	152.1	118.6	-104.3	176.6	82.9	151.4	7.8	114.2
642	D	30.3	Very low	29.9	Very low	130 Å²	130	141.7 Å²	141.7	70%	0.695	76%	0.764	S	S	*	*			trans	-98.4	170.5	-174	-35.4	-99.8	0	0	0	113
643	V	32.8	Very low	29.9	Very low	120 Å²	120	138.7 Å²	138.7	73%	0.727	76%	0.761	S	S	*	*				162.1	122.6	124	160.5	0	0	0	0	113.4
644	D	34	Very low	29.8	Very low	133 Å²	133	139.2 Å²	139.2	71%	0.711	76%	0.764	S	S	*	*			trans	5.4	143	148.9	-33.7	-31.7	0	0	0	122.6
645	R	31.6	Very low	30	Very low	238 Å²	238	137.1 Å²	137.1	90%	0.898	76%	0.762	S	S	*	*				-179.8	151.7	96.4	-100.1	-176	178.8	-176.5	-1.8	116.5
646	D	32.4	Very low	29.9	Very low	164 Å²	164	140.5 Å²	140.5	88%	0.877	77%	0.768	S	S	*	*			trans	-87.1	173.4	173.8	-50.7	-77.8	0	0	0	114.5
647	G	29.6	Very low	29.8	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	77%	0.766	S	S	*	*			trans	-173.6	128.7	167.8	0	0	0	0	0	113.5
648	D	31.5	Very low	29.9	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	77%	0.774	S	S	*	*			trans	-100.1	172.1	-166.6	-74.2	-66.9	0	0	0	116.7
649	A	32.2	Very low	30.7	Very low	93 Å²	93	139 Å²	139	77%	0.769	78%	0.778	S	S	*	*			trans	89.1	111.6	139.5	0	0	0	0	0	122.3
650	D	29.5	Very low	30.7	Very low	170 Å²	170	133.5 Å²	133.5	91%	0.909	78%	0.775	S	S	*	*				61.6	147.5	122.1	-154	14.3	0	0	0	121.9
651	G	29.4	Very low	30.6	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	79%	0.785	S	S	*	*			trans	160.1	113.8	177.2	0	0	0	0	0	114.9
652	S	26.3	Very low	30.6	Very low	112 Å²	112	127 Å²	127	78%	0.783	78%	0.777	S	S	*	*			trans	-103	165.9	176.9	-178.8	0	0	0	0	112.3
653	V	29.8	Very low	30.5	Very low	124 Å²	124	126.1 Å²	126.1	75%	0.752	78%	0.781	S	S	*	*			trans	151.3	114.8	134.8	164.8	0	0	0	0	115.1
654	V	29	Very low	30.3	Very low	113 Å²	113	129.9 Å²	129.9	69%	0.685	79%	0.787	S	S	*	*			trans	37.2	125.3	134.5	-166.4	0	0	0	0	120.8
655	T	30.1	Very low	30	Very low	117 Å²	117	130.2 Å²	130.2	72%	0.718	79%	0.794	S	S	*	*				-170.7	131.1	101.3	20	0	0	0	0	110.4
656	E	27.5	Very low	29.9	Very low	169 Å²	169	126.3 Å²	126.3	79%	0.79	79%	0.791	S	S	*	*				61.8	144.5	94.5	-63.8	-156.6	112.4	0	0	116.9
657	S	28.6	Very low	30.2	Very low	87 Å²	87	123.2 Å²	123.2	61%	0.608	78%	0.78	S	S	*	*			cis	-168.6	141.5	-16.3	-94.1	0	0	0	0	112
658	I	30.3	Very low	30.2	Very low	157 Å²	157	128.3 Å²	128.3	81%	0.805	78%	0.783	S	S	*	*				20.1	150.9	128.2	-58.9	168.4	0	0	0	119.1
659	P	45.8	Very low	30	Very low	120 Å²	120	128.2 Å²	128.2	78%	0.779	78%	0.778	S	S	*	*			cis	-123.8	-166.5	0.9	26.5	-1.6	0	0	0	113
660	G	27.1	Very low	29.8	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	78%	0.78	S	S	*	*			cis	119.1	127.8	-2.2	0	0	0	0	0	114.8
661	S	26.7	Very low	29.7	Very low	130 Å²	130	132 Å²	132	91%	0.909	77%	0.771	S	S	*	*			trans	-162.9	168.6	168.7	-167.5	0	0	0	0	112.6
662	S	28	Very low	29.6	Very low	102 Å²	102	135.5 Å²	135.5	71%	0.713	78%	0.778	S	S	*	*			trans	-159.8	160.7	-173.2	70.2	0	0	0	0	115.3
663	S	28	Very low	29.6	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	78%	0.777	S	S	*	*			trans	137.7	133.7	130.4	70.1	0	0	0	0	119.1
664	K	29.1	Very low	29.4	Very low	199 Å²	199	132.7 Å²	132.7	87%	0.865	78%	0.776	S	S	*	*			trans	12.7	138.3	152.2	-61	176.5	175.3	179.5	0	122.8
665	T	28.1	Very low	29.4	Very low	141 Å²	141	134.9 Å²	134.9	87%	0.865	78%	0.778	S	S	*	*				-166.4	165.2	123.9	10.9	0	0	0	0	112.8
666	N	28.7	Very low	29.4	Very low	156 Å²	156	139.1 Å²	139.1	83%	0.834	78%	0.783	S	S	*	*			trans	-146.6	169	172.8	-105.5	27.2	0	0	0	106.3
667	P	39.3	Very low	29.3	Very low	99 Å²	99	134.8 Å²	134.8	64%	0.643	77%	0.771	S	S	*	*			cis	-138	-165.2	13.7	44.4	-25.6	0	0	0	116
668	E	29.1	Very low	29.2	Very low	182 Å²	182	137 Å²	137	85%	0.85	78%	0.776	S	S	*	*			trans	86.6	142.9	150.1	-81.5	161.1	-154.3	0	0	123.6
669	E	27.9	Very low	29.1	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	78%	0.779	S	S	*	*			trans	-9.3	130.2	179.2	-51.4	-176.8	149.7	0	0	122.9
670	F	28.1	Very low	28.2	Very low	183 Å²	183	143 Å²	143	80%	0.803	79%	0.785	S	S	*	*				-170.3	-178.2	96.9	-120	-93.4	0	0	0	114
671	E	26.8	Very low	28.4	Very low	158 Å²	158	144.5 Å²	144.5	74%	0.738	78%	0.781	S	S	*	*			trans	-80.3	161.1	-164	-65.2	-177	116.6	0	0	118.8
672	V	28	Very low	28.5	Very low	147 Å²	147	146.7 Å²	146.7	89%	0.891	78%	0.782	S	S	*	*			trans	64.9	128	149	166.7	0	0	0	0	120
673	G	25.7	Very low	28.4	Very low	73 Å²	73	145.6 Å²	145.6	75%	0.753	79%	0.786	S	S	*	*			trans	154.1	108.2	152.4	0	0	0	0	0	119.5
674	S	25.9	Very low	28.4	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	79%	0.791	S	S	*	*			trans	25	118.4	138.2	-127.5	0	0	0	0	123.1
675	E	29.8	Very low	28.3	Very low	159 Å²	159	144.3 Å²	144.3	74%	0.743	79%	0.789	S	S	*	*				64.7	154.3	129.9	-61.7	178.3	149.2	0	0	124.1
676	Y	28.3	Very low	28.1	Very low	207 Å²	207	142.2 Å²	142.2	81%	0.812	79%	0.786	S	S	*	*			trans	63.2	146.2	172.9	-68.7	-81.7	0	0	0	117.2
677	S	25.4	Very low	28	Very low	78 Å²	78	139.5 Å²	139.5	55%	0.545	78%	0.775	S	S	.	*			cis	-157.1	157.7	13	-134.3	0	0	0	0	112.1
678	D	26.5	Very low	27.3	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	78%	0.781	S	S	*	*			trans	38.3	147.5	147	-35.7	-47.3	0	0	0	121.8
679	R	28.5	Very low	27.3	Very low	233 Å²	233	139.3 Å²	139.3	88%	0.879	78%	0.778	S	S	*	*			cis	-159.8	148.5	40	-70.7	176.3	173.9	167.7	-0.3	113
680	L	26.9	Very low	27.3	Very low	172 Å²	172	136.4 Å²	136.4	90%	0.901	78%	0.775	S	S	*	*			trans	-132	150.5	140.6	-85.6	174.4	0	0	0	108.8
681	P	30.8	Very low	27.5	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	78%	0.778	S	S	*	*			trans	-91.5	154.9	-167.9	35.7	-36	0	0	0	114.8
682	L	29.9	Very low	27.7	Very low	177 Å²	177	138.2 Å²	138.2	93%	0.927	79%	0.787	S	S	*	*			trans	28.2	125.3	138.8	-52.7	170.6	0	0	0	118.4
683	G	26	Very low	28	Very low	78 Å²	78	137.7 Å²	137.7	80%	0.804	78%	0.777	S	S	*	*			cis	140.9	144.6	-0.6	0	0	0	0	0	112.2
684	A	27.9	Very low	28.3	Very low	108 Å²	108	142 Å²	142	89%	0.893	78%	0.783	S	S	*	*			trans	-165.5	141	164.8	0	0	0	0	0	109.7
685	E	26.8	Very low	28.6	Very low	175 Å²	175	140.9 Å²	140.9	82%	0.818	79%	0.787	S	S	*	*			trans	-91.6	156.2	177.9	-64.6	178.4	108.7	0	0	112.8	V687	E685-V687 HydrophobicContact CB-CG2 4.2Å
686	A	24.1	Very low	28.5	Very low	97 Å²	97	141.5 Å²	141.5	80%	0.802	80%	0.796	S	S	*	*			trans	-134.9	82.2	156.2	0	0	0	0	0	108.9	T688	A686-T688 PolarHBondContact O-N 3.45Å
687	V	26.4	Very low	28.5	Very low	100 Å²	100	142.7 Å²	142.7	61%	0.606	80%	0.8	S	S	*	*			trans	-71.3	121.7	-179	-177.4	0	0	0	0	110.1	E685 I689	E685-V687 HydrophobicContact CB-CG2 4.2Å; V687-I689 HydrophobicContact CG1-CG1 3.87Å
688	T	25.3	Very low	28.7	Very low	126 Å²	126	148.6 Å²	148.6	77%	0.773	82%	0.816	S	S	*	*			trans	-102.7	103.8	166.5	-53.9	0	0	0	0	108.7	A686 S690	A686-T688 PolarHBondContact O-N 3.45Å; T688-S690 PolarHBondContact O-N 3.26Å
689	I	27.5	Very low	28.9	Very low	151 Å²	151	151.4 Å²	151.4	77%	0.774	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-75.7	121.2	178.4	-55.8	178	0	0	0	108.7	V687	V687-I689 HydrophobicContact CG1-CG1 3.87Å
690	S	29.2	Very low	29.5	Very low	102 Å²	102	146 Å²	146	71%	0.713	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-99.2	141.2	166.7	-59.8	0	0	0	0	109.5	T688	T688-S690 PolarHBondContact O-N 3.26Å
691	E	31.2	Very low	29.8	Very low	184 Å²	184	147 Å²	147	86%	0.86	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-75.6	124.2	174.8	-62.1	177.6	113.9	0	0	110.7
692	E	32	Very low	29.7	Very low	196 Å²	196	149.1 Å²	149.1	92%	0.916	85%	0.85	S	S	*	*			trans	-129.7	144.3	155.5	-75	-156.3	143.4	0	0	110.8
693	I	34.2	Very low	29.7	Very low	136 Å²	136	147.6 Å²	147.6	70%	0.697	85%	0.845	S	S	*	*			trans	-123.1	136.3	-167.6	-67.7	172.7	0	0	0	109.1
694	N	31.4	Very low	29.9	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	85%	0.848	S	S	*	*			trans	70.9	121	177.9	-56.5	-36.1	0	0	0	117
695	G	31.9	Very low	30.1	Very low	78 Å²	78	154.1 Å²	154.1	80%	0.804	85%	0.845	S	S	*	*			trans	176	94.6	167.2	0	0	0	0	0	113.2
696	N	29	Very low	30.3	Very low	172 Å²	172	152.8 Å²	152.8	92%	0.92	85%	0.847	S	S	*	*			trans	-61.4	145.2	-176.2	-82.7	-34.4	0	0	0	114.3	K698	N696-K698 PolarHBondContact O-N 3Å
697	Y	26.8	Very low	30.7	Very low	232 Å²	232	156.5 Å²	156.5	91%	0.91	85%	0.85	S	S	*	*			trans	-53.6	129.8	165.2	-81.9	-102.5	0	0	0	112.9
698	K	29.7	Very low	31	Very low	203 Å²	203	160.5 Å²	160.5	88%	0.883	87%	0.867	S	S	*	*				-167	133.8	129.8	-112.7	178.7	-178.8	-175.3	0	112	N696	N696-K698 PolarHBondContact O-N 3Å
699	Q	32.4	Very low	31.4	Very low	191 Å²	191	163.2 Å²	163.2	89%	0.893	88%	0.875	S	S	*	*			trans	-74.8	146.2	162.1	-64.9	170.1	-71.7	0	0	110
700	P	40.5	Very low	31.8	Very low	119 Å²	119	164.2 Å²	164.2	77%	0.773	88%	0.883	S	S	*	*			trans	-104.6	169	150	37	-29.5	0	0	0	111.6
701	S	32.8	Very low	32	Very low	193 Å²	193	169.8 Å²	169.8	100%	1.35	90%	0.898	S	S	*	*			trans	-86.7	0	161.7	-51.9	0	0	0	0	111.2

Retrieved 701 of 701 residues in 884.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).