A0A096M0W3_POEFO Loading...

Leucine rich repeat transmembrane neuronal 4

AlphaFold DB , UniProt , Accession A0A096M0W3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 566 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	40.9	Very low	248 Å²	248	141.9 Å²	141.9	100%	1.222	82%	0.817	S	S	*	*				0	128.3	0	-68.5	168.3	170.9	0	0	107.4
2	G	37	Very low	41.5	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	81%	0.806	S	S	*	*			trans	-101.8	-156.5	162.3	0	0	0	0	0	109.4
3	P	59.9	Low	41.9	Very low	118 Å²	118	140 Å²	140	77%	0.766	80%	0.797	S	S	*	*			cis	-128.6	176.7	-17.1	40.7	-26.5	0	0	0	112.2
4	L	33.1	Very low	42.3	Very low	158 Å²	158	138.6 Å²	138.6	83%	0.827	79%	0.786	S	S	*	*			trans	174.5	111.7	150.9	-91.7	141.2	0	0	0	106.7
5	L	34.8	Very low	42.9	Very low	160 Å²	160	140.7 Å²	140.7	84%	0.838	78%	0.783	S	S	*	*				82.2	137.3	80.8	-98.9	148	0	0	0	114.3
6	C	36.6	Very low	43.3	Very low	118 Å²	118	136.1 Å²	136.1	80%	0.797	76%	0.761	S	S	*	*			trans	-64.7	153.1	-168.8	-51.8	0	0	0	0	114.1
7	D	34.8	Very low	43.5	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	75%	0.746	S	S	*	*				-142.9	114.3	126.3	-151.5	-16.4	0	0	0	111.7
8	G	46.6	Very low	43.8	Very low	68 Å²	68	133.8 Å²	133.8	70%	0.701	74%	0.743	S	S	*	*			trans	-107.3	91.4	177.8	0	0	0	0	0	109.7
9	R	44.4	Very low	44.1	Very low	193 Å²	193	133.3 Å²	133.3	73%	0.728	74%	0.738	S	S	*	*			trans	-144.4	3.2	-176.5	-109.2	167.2	-170.1	-148.5	0.6	118.6
10	L	42	Very low	44.5	Very low	159 Å²	159	132.9 Å²	132.9	83%	0.832	74%	0.735	S	S	*	*	S	Bend	trans	-112.1	-14.1	179.8	-112.6	74.8	0	0	0	116.5
11	T	45.6	Very low	44.6	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	74%	0.735	S	S	*	*	S	Bend	trans	-94.7	-13.6	-174.9	44	0	0	0	0	115.2
12	C	48.4	Very low	45.2	Very low	101 Å²	101	132.1 Å²	132.1	68%	0.682	72%	0.717	S	S	*	*	S	Bend	trans	-87.9	-7.4	-177.6	-73.1	0	0	0	0	115.8	P16	C12-P16 WeakPolarHBondContact O-CD 3.41Å
13	F	46.5	Very low	45.9	Very low	158 Å²	158	131.9 Å²	131.9	69%	0.693	71%	0.708	S	S	*	*	S	Bend	trans	-97.8	-7.1	-175.9	-73.3	-71.6	0	0	0	115.4
14	L	47.9	Very low	45.3	Very low	121 Å²	121	131.7 Å²	131.7	63%	0.634	71%	0.707	S	S	*	*	H	α-helix	trans	-91.3	-20.4	178.5	-77.5	165.5	0	0	0	114.2
15	F	50.6	Low	45.9	Very low	170 Å²	170	132.1 Å²	132.1	75%	0.746	71%	0.709	S	S	*	*	H	α-helix	trans	-74.2	-37.1	176.5	-121.1	-92.5	0	0	0	114.8	L17	F15-L17 VanDerWaalsContact C-N 3.34Å; F15-L17 PolarHBondContact O-N 3.26Å
16	P	50.2	Low	46.3	Very low	66 Å²	66	131.9 Å²	131.9	43%	0.429	71%	0.708	S	S	.	*	H	α-helix	trans	-67.9	-32.1	175.9	-20.3	32.9	0	0	0	113.2	C12 L19 L20	C12-P16 WeakPolarHBondContact O-CD 3.41Å; P16-L19 PolarHBondContact O-N 3.25Å; P16-L20 PolarHBondContact O-N 3.2Å
17	L	46.8	Very low	46.8	Very low	98 Å²	98	136.4 Å²	136.4	51%	0.513	71%	0.714	S	S	.	*	H	α-helix	trans	-73.8	-32.4	-174.8	-156.8	71.2	0	0	0	112.6	F15 L19 L20 L21	F15-L17 VanDerWaalsContact C-N 3.34Å; F15-L17 PolarHBondContact O-N 3.26Å; L17-L19 VanDerWaalsContact C-N 3.3Å; L17-L19 PolarHBondContact O-N 3.37Å; L17-L20 PolarHBondContact O-N 3.4Å; L17-L21 PolarHBondContact O-N 3.32Å
18	L	47.8	Very low	47.2	Very low	133 Å²	133	134.5 Å²	134.5	70%	0.696	71%	0.712	S	S	*	*	H	α-helix	trans	-72	-22.5	174.5	-118.3	109.7	0	0	0	113.4
19	L	49.2	Very low	46.9	Very low	124 Å²	124	138.9 Å²	138.9	65%	0.649	71%	0.712	S	S	*	*	H	α-helix	trans	-78.5	-35.4	172.1	-85.5	159.1	0	0	0	112	P16 L17 R22	P16-L19 PolarHBondContact O-N 3.25Å; L17-L19 VanDerWaalsContact C-N 3.3Å; L17-L19 PolarHBondContact O-N 3.37Å; L19-R22 PolarHBondContact O-N 3.03Å
20	L	52.6	Low	46.9	Very low	126 Å²	126	133.1 Å²	133.1	66%	0.66	71%	0.713	S	S	*	*	H	α-helix	trans	-73.1	-29.1	177	-79.4	160.4	0	0	0	113.5	P16 L17 R22 A23	P16-L20 PolarHBondContact O-N 3.2Å; L17-L20 PolarHBondContact O-N 3.4Å; L20-R22 VanDerWaalsContact C-N 3.27Å; L20-R22 PolarHBondContact O-N 2.92Å; L20-A23 PolarHBondContact O-N 3.29Å
21	L	47.2	Very low	47.2	Very low	143 Å²	143	133.4 Å²	133.4	75%	0.749	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-0.1	173.9	-79.4	162.3	0	0	0	114.4	L17	L17-L21 PolarHBondContact O-N 3.32Å
22	R	46.7	Very low	47.8	Very low	221 Å²	221	136.2 Å²	136.2	83%	0.834	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	5	169.6	-100.5	-174.1	174.4	-174.7	-0.2	114.4	L19 L20	L19-R22 PolarHBondContact O-N 3.03Å; L20-R22 VanDerWaalsContact C-N 3.27Å; L20-R22 PolarHBondContact O-N 2.92Å
23	A	52.2	Low	48.8	Very low	69 Å²	69	134.5 Å²	134.5	57%	0.57	69%	0.693	S	S	*	*			trans	-118.6	85.3	171.5	0	0	0	0	0	109.9	L20	L20-A23 PolarHBondContact O-N 3.29Å
24	P	48	Very low	50.6	Low	115 Å²	115	129.2 Å²	129.2	75%	0.747	68%	0.675	S	S	*	*	S	Bend		-144.5	67.3	110.6	38.2	-22.8	0	0	0	113.7
25	L	44.8	Very low	52.4	Low	166 Å²	166	124 Å²	124	87%	0.869	65%	0.648	S	S	*	*	S	Bend	trans	-132.6	7.8	165.4	-80.3	177.7	0	0	0	114.6
26	L	44.1	Very low	54.1	Low	156 Å²	156	122.8 Å²	122.8	82%	0.817	65%	0.65	S	S	*	*	S	Bend	trans	-105	12.3	178.5	-73.5	171.4	0	0	0	114.4
27	F	45.4	Very low	56	Low	213 Å²	213	124.2 Å²	124.2	93%	0.934	66%	0.661	S	S	*	*	S	Bend	trans	-128.4	52.5	175.8	-77.1	-72.9	0	0	0	112.9
28	S	44.4	Very low	58.2	Low	100 Å²	100	120.5 Å²	120.5	70%	0.699	64%	0.643	S	S	*	*	S	Bend	trans	-163.9	81.2	153.5	-169.4	0	0	0	0	111.3
29	F	40	Very low	60.4	Low	160 Å²	160	122.2 Å²	122.2	70%	0.702	64%	0.641	S	S	*	*			trans	-173.7	103.9	145.7	-90.9	-63.7	0	0	0	105.4	E31	F29-E31 PolarHBondContact O-N 2.88Å
30	G	44.1	Very low	62.4	Low	73 Å²	73	118.9 Å²	118.9	75%	0.753	63%	0.627	S	S	*	*			trans	-57.1	124.8	162.8	0	0	0	0	0	107.1	R32	G30-R32 PolarHBondContact O-N 3.41Å
31	E	49.7	Very low	64.3	Low	165 Å²	165	117.4 Å²	117.4	77%	0.771	62%	0.617	S	S	*	*			trans	-50.7	116.5	-167.5	-71.6	-178	131	0	0	109.9	F29 T33	F29-E31 PolarHBondContact O-N 2.88Å; E31-T33 HydrophobicContact CB-CG2 4.28Å; E31-T33 PolarHBondContact O-N 3.15Å
32	R	56.5	Low	66.3	Low	182 Å²	182	113.7 Å²	113.7	69%	0.687	61%	0.613	S	S	*	*			trans	-78.4	69.9	175.6	-67.7	-176.7	178.8	-178.5	0.4	107.6	G30 C34	G30-R32 PolarHBondContact O-N 3.41Å; R32-C34 PolarHBondContact O-N 2.91Å
33	T	69.7	Low	68.5	Low	65 Å²	65	108.9 Å²	108.9	40%	0.399	60%	0.598	S	S	.	*			trans	-62.9	90.1	168.9	48	0	0	0	0	107.9	E31	E31-T33 HydrophobicContact CB-CG2 4.28Å; E31-T33 PolarHBondContact O-N 3.15Å
34	C	84.1	Confident	70.6	Confident	47 Å²	47	107.1 Å²	107.1	32%	0.318	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-85	126.1	166.6	-163.1	0	0	0	0	106.7	R32 C38 C40	R32-C34 PolarHBondContact O-N 2.91Å; C34-C38 PolarHBondContact SG-O 3.04Å; C34-C38 VanDerWaalsContact SG-O 3.39Å; C34-C40 WeakPolarHBondContact CA-SG 3.39Å; C34-C40 HydrophobicContact CB-CB 3.87Å; C34-C40 WeakPolarHBondContact CB-SG 3.27Å; C34-C40 WeakPolarHBondContact SG-CB 3.45Å; C34-C40 PolarHBondContact SG-N 3.44Å; C34-C40 VanDerWaalsContact SG-N 3.43Å; C34-C40 CovalentContact SG-SG 2.03Å; C34-C40 PolarHBondContact SG-SG 2.91Å
35	P	87	Confident	72.8	Confident	11 Å²	11	102 Å²	102	7%	0.071	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-60.3	147.9	176.3	-15.2	24.9	0	0	0	110.6	C38 P56 I59	P35-C38 HydrophobicContact CB-CB 4.34Å; P35-C38 HydrophobicContact CG-CB 4.47Å; P35-C38 WeakPolarHBondContact O-CB 3.24Å; P35-C38 PolarHBondContact O-N 3.45Å; P35-P56 HydrophobicContact CB-CB 4.1Å; P35-P56 HydrophobicContact CG-CB 4.29Å; P35-I59 HydrophobicContact CG-CG1 4.06Å
36	N	86.4	Confident	75.3	Confident	145 Å²	145	96.5 Å²	96.5	78%	0.775	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	145.4	174.6	-68.1	-25.4	0	0	0	110.2	C38	N36-C38 PolarHBondContact O-N 3.39Å
37	S	88.9	Confident	77.7	Confident	97 Å²	97	89.1 Å²	89.1	68%	0.678	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-2.3	-172.1	-51.2	0	0	0	0	116.4	S50	S37-S50 PolarHBondContact O-OG 3.02Å
38	C	93.5	Very high	80.1	Confident	20 Å²	20	81.4 Å²	81.4	14%	0.135	45%	0.447	C	S	.	.			trans	-98.3	155.6	176.3	-54	0	0	0	0	113.4	C34 P35 N36 I45 H46 C47	C34-C38 PolarHBondContact SG-O 3.04Å; C34-C38 VanDerWaalsContact SG-O 3.39Å; P35-C38 HydrophobicContact CB-CB 4.34Å; P35-C38 HydrophobicContact CG-CB 4.47Å; P35-C38 WeakPolarHBondContact O-CB 3.24Å; P35-C38 PolarHBondContact O-N 3.45Å; N36-C38 PolarHBondContact O-N 3.39Å; C38-I45 HydrophobicContact CB-CG2 4.27Å; C38-H46 CarbonylContact C-O 3.47Å; C38-H46 WeakPolarHBondContact CA-O 3.4Å; C38-C47 HydrophobicContact CB-CB 4.07Å; C38-C47 WeakPolarHBondContact CB-SG 3.27Å; C38-C47 VanDerWaalsContact SG-CA 3.54Å; C38-C47 WeakPolarHBondContact SG-CB 3.45Å; C38-C47 CovalentContact SG-SG 2.03Å; C38-C47 PolarHBondContact SG-SG 3.45Å
39	R	93.1	Very high	82.4	Confident	168 Å²	168	81 Å²	81	63%	0.634	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	120.2	171.6	175	179.3	176.3	170.1	-3.4	109.6	E41 H46	R39-E41 HydrophobicContact CG-CG 4.24Å; R39-E41 IonicContact CZ-OE1 3.1Å; R39-E41 IonicContact NE-OE1 2.77Å; R39-E41 PolarHBondContact NE-OE1 2.97Å; R39-E41 IonicContact NH2-OE1 2.65Å; R39-E41 PolarHBondContact NH2-OE1 2.99Å; R39-H46 HydrophobicContact CB-CB 4.4Å; R39-H46 PolarHBondContact N-O 3.33Å; R39-H46 PolarHBondContact O-N 3.22Å
40	C	92.6	Very high	84.9	Confident	54 Å²	54	75.4 Å²	75.4	37%	0.365	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.5	-179	-59.3	0	0	0	0	111.9	C34 T44 I45	C34-C40 WeakPolarHBondContact CA-SG 3.39Å; C34-C40 HydrophobicContact CB-CB 3.87Å; C34-C40 WeakPolarHBondContact CB-SG 3.27Å; C34-C40 WeakPolarHBondContact SG-CB 3.45Å; C34-C40 PolarHBondContact SG-N 3.44Å; C34-C40 VanDerWaalsContact SG-N 3.43Å; C34-C40 CovalentContact SG-SG 2.03Å; C34-C40 PolarHBondContact SG-SG 2.91Å; C40-T44 CarbonylContact C-O 3.46Å; C40-T44 WeakPolarHBondContact CA-O 3.36Å; C40-I45 HydrophobicContact CB-CG1 4.33Å
41	E	91.3	Very high	87.2	Confident	95 Å²	95	74.2 Å²	74.2	44%	0.444	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	95.7	-177.5	-57.8	-156.8	148.6	0	0	110.9	R39 K43 T44	R39-E41 HydrophobicContact CG-CG 4.24Å; R39-E41 IonicContact CZ-OE1 3.1Å; R39-E41 IonicContact NE-OE1 2.77Å; R39-E41 PolarHBondContact NE-OE1 2.97Å; R39-E41 IonicContact NH2-OE1 2.65Å; R39-E41 PolarHBondContact NH2-OE1 2.99Å; E41-K43 PolarHBondContact O-N 3.48Å; E41-T44 PolarHBondContact N-O 3.41Å; E41-T44 PolarHBondContact O-N 3.08Å; E41-T44 PolarHBondContact O-OG1 3.22Å
42	G	89.6	Confident	89.3	Confident	66 Å²	66	68.3 Å²	68.3	68%	0.68	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-88.5	-179.2	0	0	0	0	0	112.8
43	K	93.2	Very high	91.1	Very high	119 Å²	119	65 Å²	65	52%	0.517	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	7.3	176.7	-64.2	-173.8	-180	-178	0	113.4	E41 C63 Q64	E41-K43 PolarHBondContact O-N 3.48Å; K43-C63 CarbonylContact O-C 3.07Å; K43-C63 WeakPolarHBondContact O-CA 3.37Å; K43-Q64 HydrophobicContact CB-CB 4.2Å; K43-Q64 HydrophobicContact CB-CG 4.07Å; K43-Q64 HydrophobicContact CD-CG 4.04Å; K43-Q64 PolarHBondContact O-N 3.49Å
44	T	95.5	Very high	92.2	Very high	33 Å²	33	68.6 Å²	68.6	20%	0.202	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	147.2	173.6	64.5	0	0	0	0	110.1	C40 E41 H46 G65 W89	C40-T44 CarbonylContact C-O 3.46Å; C40-T44 WeakPolarHBondContact CA-O 3.36Å; E41-T44 PolarHBondContact N-O 3.41Å; E41-T44 PolarHBondContact O-N 3.08Å; E41-T44 PolarHBondContact O-OG1 3.22Å; T44-H46 PolarHBondContact OG1-NE2 3.41Å; T44-G65 CarbonylContact C-O 3.44Å; T44-G65 VanDerWaalsContact CA-O 3.29Å; T44-G65 WeakPolarHBondContact CA-O 3Å; T44-W89 HydrophobicContact CG2-CH2 4.42Å; T44-W89 HydrophobicContact CG2-CZ2 3.57Å
45	I	95.4	Very high	92.7	Very high	7 Å²	7	66.9 Å²	66.9	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.9	-174.9	-62.1	178.7	0	0	0	107.6	C38 C40 I59 C63 G65 L66 S67	C38-I45 HydrophobicContact CB-CG2 4.27Å; C40-I45 HydrophobicContact CB-CG1 4.33Å; I45-I59 HydrophobicContact CD1-CG2 3.73Å; I45-C63 HydrophobicContact CD1-CB 4.18Å; I45-G65 PolarHBondContact N-O 3.11Å; I45-L66 HydrophobicContact CB-CD1 4.28Å; I45-L66 HydrophobicContact CG2-CD1 4.2Å; I45-S67 PolarHBondContact O-N 3.01Å
46	H	96.3	Very high	92.9	Very high	51 Å²	51	67.2 Å²	67.2	24%	0.236	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	104.3	-176.8	-64.8	-91.7	0	0	0	109.3	C38 R39 T44 D48 W89	C38-H46 CarbonylContact C-O 3.47Å; C38-H46 WeakPolarHBondContact CA-O 3.4Å; R39-H46 HydrophobicContact CB-CB 4.4Å; R39-H46 PolarHBondContact N-O 3.33Å; R39-H46 PolarHBondContact O-N 3.22Å; T44-H46 PolarHBondContact OG1-NE2 3.41Å; H46-D48 IonicContact ND1-OD2 2.72Å; H46-W89 AromaticContact CE1-CH2 3.7Å; H46-W89 AromaticContact NE2-CH2 3.97Å
47	C	95.4	Very high	92.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.383	C	S	.	.			trans	-110.6	39	-179.1	-66.7	0	0	0	0	110	C38 F52 S67 L68 N71	C38-C47 HydrophobicContact CB-CB 4.07Å; C38-C47 WeakPolarHBondContact CB-SG 3.27Å; C38-C47 VanDerWaalsContact SG-CA 3.54Å; C38-C47 WeakPolarHBondContact SG-CB 3.45Å; C38-C47 CovalentContact SG-SG 2.03Å; C38-C47 PolarHBondContact SG-SG 3.45Å; C47-F52 HydrophobicContact CB-CD2 4.15Å; C47-F52 HydrophobicContact CB-CE2 3.75Å; C47-S67 WeakPolarHBondContact CA-O 3.33Å; C47-S67 WeakPolarHBondContact CB-O 3.23Å; C47-S67 PolarHBondContact N-O 3.09Å; C47-L68 HydrophobicContact CB-CD2 3.48Å; C47-L68 VanDerWaalsContact CB-CD2 3.48Å; C47-L68 HydrophobicContact CB-CG 4.23Å; C47-N71 PolarHBondContact O-ND2 3.27Å
48	D	94.7	Very high	92.4	Very high	52 Å²	52	69.6 Å²	69.6	28%	0.278	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	148.9	-171.8	-53.3	-50.5	0	0	0	111.2	H46 S50 S67 R69	H46-D48 IonicContact ND1-OD2 2.72Å; D48-S50 PolarHBondContact O-N 3.49Å; D48-S50 VanDerWaalsContact O-N 3.08Å; D48-S50 PolarHBondContact O-OG 2.81Å; D48-S67 VanDerWaalsContact OD1-CB 3.23Å; D48-S67 WeakPolarHBondContact OD1-CB 3.46Å; D48-S67 PolarHBondContact OD1-OG 2.77Å; D48-S67 PolarHBondContact OD2-OG 2.7Å; D48-R69 CarbonylContact C-O 3.21Å; D48-R69 VanDerWaalsContact CA-O 3.28Å; D48-R69 WeakPolarHBondContact CA-O 3.44Å; D48-R69 HydrophobicContact CB-CB 4.44Å; D48-R69 WeakPolarHBondContact OD1-CB 3.43Å; D48-R69 PolarHBondContact OD1-N 2.88Å
49	S	93.8	Very high	92.2	Very high	92 Å²	92	69 Å²	69	64%	0.643	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	34.2	173	-59.3	0	0	0	0	115.3	R69 Y70	S49-R69 PolarHBondContact N-O 3.36Å; S49-Y70 VanDerWaalsContact CA-O 3.3Å; S49-Y70 WeakPolarHBondContact CA-O 3.31Å; S49-Y70 WeakPolarHBondContact OG-CB 3.47Å
50	S	91.3	Very high	92	Very high	41 Å²	41	63 Å²	63	29%	0.287	36%	0.36	S	S	.	.	S	Bend	trans	-106.8	-1.3	-172.4	-65.9	0	0	0	0	113.7	S37 D48 N71	S37-S50 PolarHBondContact O-OG 3.02Å; D48-S50 PolarHBondContact O-N 3.49Å; D48-S50 VanDerWaalsContact O-N 3.08Å; D48-S50 PolarHBondContact O-OG 2.81Å; S50-N71 PolarHBondContact N-OD1 2.9Å
51	G	92.4	Very high	91.8	Very high	48 Å²	48	65.1 Å²	65.1	50%	0.495	37%	0.372	S	S	.	.			trans	73.8	23.7	178.9	0	0	0	0	0	114.2	L53 N71	G51-L53 PolarHBondContact O-N 3.37Å; G51-N71 PolarHBondContact N-OD1 3.03Å
52	F	94.1	Very high	91.7	Very high	42 Å²	42	62 Å²	62	18%	0.184	37%	0.365	C	S	.	.			trans	-65.6	124.8	178.8	-73	-65.9	0	0	0	111.6	C47 P56 L68 N71 E72 L73	C47-F52 HydrophobicContact CB-CD2 4.15Å; C47-F52 HydrophobicContact CB-CE2 3.75Å; F52-P56 HydrophobicContact CD1-CG 3.82Å; F52-P56 HydrophobicContact CD2-CG 4.37Å; F52-P56 HydrophobicContact CE1-CG 3.63Å; F52-P56 HydrophobicContact CE2-CG 4.2Å; F52-P56 HydrophobicContact CG-CG 4.2Å; F52-P56 HydrophobicContact CZ-CG 3.84Å; F52-L68 HydrophobicContact CD2-CD2 4.15Å; F52-N71 HydrophobicContact CB-CB 4.19Å; F52-N71 PolarHBondContact N-OD1 3.46Å; F52-E72 CarbonylContact O-C 3.6Å; F52-E72 VanDerWaalsContact O-C 3.26Å; F52-E72 WeakPolarHBondContact O-CA 3.26Å; F52-E72 PolarHBondContact O-N 2.65Å; F52-L73 HydrophobicContact CB-CD2 4.29Å; F52-L73 PolarHBondContact O-N 2.94Å
53	L	94.4	Very high	91.9	Very high	112 Å²	112	59 Å²	59	59%	0.586	33%	0.334	S	S	*	.	S	Bend	trans	-84.9	-26.1	172	-64.6	168.7	0	0	0	112.3	G51 E72	G51-L53 PolarHBondContact O-N 3.37Å; L53-E72 HydrophobicContact CD2-CB 3.83Å
54	E	93.8	Very high	92.1	Very high	141 Å²	141	56.2 Å²	56.2	66%	0.659	32%	0.322	S	S	*	.	S	Bend	trans	-137.5	161.2	179.9	-63.1	-174.8	175.3	0	0	110.7	L73	E54-L73 VanDerWaalsContact CA-CD2 3.48Å; E54-L73 WeakPolarHBondContact O-CD2 3.41Å
55	V	93.8	Very high	92.2	Very high	10 Å²	10	54.7 Å²	54.7	6%	0.061	31%	0.313	C	S	.	.			trans	-70.2	125.1	178.4	176.1	0	0	0	0	109.7	I59 L68 L73 L76 Q80 F81	V55-I59 HydrophobicContact CG1-CD1 4.09Å; V55-L68 HydrophobicContact CB-CD1 4.49Å; V55-L68 HydrophobicContact CG1-CD1 4.05Å; V55-L68 HydrophobicContact CG2-CD1 4.13Å; V55-L73 HydrophobicContact CG2-CD1 4.43Å; V55-L76 HydrophobicContact CG2-CD2 4.46Å; V55-Q80 HydrophobicContact CB-CG 4.06Å; V55-Q80 HydrophobicContact CG1-CG 4.33Å; V55-Q80 HydrophobicContact CG2-CG 4Å; V55-F81 HydrophobicContact CG1-CE1 3.92Å; V55-F81 HydrophobicContact CG2-CE1 4.08Å; V55-F81 HydrophobicContact CG2-CZ 4.08Å
56	P	90.9	Very high	92.3	Very high	18 Å²	18	54.3 Å²	54.3	12%	0.117	31%	0.311	C	S	.	.			trans	-58.9	140	-178.8	-25.7	34.7	0	0	0	113.6	P35 F52 I59 L68	P35-P56 HydrophobicContact CB-CB 4.1Å; P35-P56 HydrophobicContact CG-CB 4.29Å; F52-P56 HydrophobicContact CD1-CG 3.82Å; F52-P56 HydrophobicContact CD2-CG 4.37Å; F52-P56 HydrophobicContact CE1-CG 3.63Å; F52-P56 HydrophobicContact CE2-CG 4.2Å; F52-P56 HydrophobicContact CG-CG 4.2Å; F52-P56 HydrophobicContact CZ-CG 3.84Å; P56-I59 HydrophobicContact CB-CD1 4.46Å; P56-I59 HydrophobicContact CB-CG1 4.38Å; P56-I59 WeakPolarHBondContact O-CD1 3.38Å; P56-I59 VanDerWaalsContact O-CG1 3.29Å; P56-I59 WeakPolarHBondContact O-CG1 3.24Å; P56-L68 HydrophobicContact CG-CD2 4.39Å
57	E	82.8	Confident	92.4	Very high	174 Å²	174	52 Å²	52	81%	0.813	30%	0.301	S	S	*	.	S	Bend	trans	-78.5	-33.7	-178.9	-60.3	-171	145.7	0	0	113.5	I59	E57-I59 PolarHBondContact O-N 3Å
58	N	83.3	Confident	92.4	Very high	118 Å²	118	52 Å²	52	63%	0.631	30%	0.301	S	S	*	.			trans	-80.5	43.5	-173.2	-74.7	-16.5	0	0	0	113.8
59	I	88.9	Confident	92.6	Very high	7 Å²	7	53 Å²	53	4%	0.036	30%	0.3	C	S	.	.			trans	-92.5	125.5	179.6	-59.2	174.2	0	0	0	109.7	P35 I45 V55 P56 E57 V61 C63 L66 L84	P35-I59 HydrophobicContact CG-CG1 4.06Å; I45-I59 HydrophobicContact CD1-CG2 3.73Å; V55-I59 HydrophobicContact CG1-CD1 4.09Å; P56-I59 HydrophobicContact CB-CD1 4.46Å; P56-I59 HydrophobicContact CB-CG1 4.38Å; P56-I59 WeakPolarHBondContact O-CD1 3.38Å; P56-I59 VanDerWaalsContact O-CG1 3.29Å; P56-I59 WeakPolarHBondContact O-CG1 3.24Å; E57-I59 PolarHBondContact O-N 3Å; I59-V61 PolarHBondContact O-N 2.96Å; I59-C63 HydrophobicContact CG2-CB 4.19Å; I59-L66 HydrophobicContact CD1-CD1 3.92Å; I59-L66 HydrophobicContact CD1-CD2 3.87Å; I59-L84 HydrophobicContact CB-CD1 4.28Å; I59-L84 HydrophobicContact CB-CD2 4.07Å; I59-L84 HydrophobicContact CD1-CD1 4.32Å; I59-L84 HydrophobicContact CG2-CD1 3.76Å; I59-L84 HydrophobicContact CG2-CD2 3.6Å; I59-L84 HydrophobicContact CG2-CG 4.35Å
60	S	87.9	Confident	92.8	Very high	42 Å²	42	54.7 Å²	54.7	29%	0.294	29%	0.294	S	S	.	.			trans	-58.4	128.6	-179.8	-173.7	0	0	0	0	112.8	G62 C63	S60-G62 PolarHBondContact O-N 3.16Å; S60-C63 WeakPolarHBondContact O-CB 3.48Å; S60-C63 PolarHBondContact O-N 3.4Å
61	V	88.8	Confident	93	Very high	100 Å²	100	52.9 Å²	52.9	61%	0.606	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.1	178.4	-62.6	0	0	0	0	114.5	I59 C63	I59-V61 PolarHBondContact O-N 2.96Å; V61-C63 VanDerWaalsContact C-N 3.26Å; V61-C63 PolarHBondContact O-N 3.06Å
62	G	90.3	Very high	93.3	Very high	30 Å²	30	54.5 Å²	54.5	31%	0.309	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.7	174.1	0	0	0	0	0	114.7	S60 Q64	S60-G62 PolarHBondContact O-N 3.16Å; G62-Q64 PolarHBondContact O-N 3.15Å
63	C	93.7	Very high	93.4	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.014	27%	0.266	C	S	.	.			trans	-60.6	130.8	-177.3	-173	0	0	0	0	112	K43 I45 I59 S60 V61 G65 L84 Q86 L87	K43-C63 CarbonylContact O-C 3.07Å; K43-C63 WeakPolarHBondContact O-CA 3.37Å; I45-C63 HydrophobicContact CD1-CB 4.18Å; I59-C63 HydrophobicContact CG2-CB 4.19Å; S60-C63 WeakPolarHBondContact O-CB 3.48Å; S60-C63 PolarHBondContact O-N 3.4Å; V61-C63 VanDerWaalsContact C-N 3.26Å; V61-C63 PolarHBondContact O-N 3.06Å; C63-G65 PolarHBondContact SG-O 3.28Å; C63-L84 HydrophobicContact CB-CD2 4.4Å; C63-Q86 CarbonylContact O-C 3.53Å; C63-Q86 VanDerWaalsContact O-C 3.28Å; C63-Q86 WeakPolarHBondContact O-CB 3.5Å; C63-L87 HydrophobicContact CB-CD2 4.37Å; C63-L87 PolarHBondContact O-N 2.9Å
64	Q	96.8	Very high	93.6	Very high	61 Å²	61	50.8 Å²	50.8	29%	0.285	26%	0.255	S	S	.	.	S	Bend	trans	-108.4	-13.3	177.1	-67.8	-175.1	-13.7	0	0	112.7	K43 G62 L88 W89	K43-Q64 HydrophobicContact CB-CB 4.2Å; K43-Q64 HydrophobicContact CB-CG 4.07Å; K43-Q64 HydrophobicContact CD-CG 4.04Å; K43-Q64 PolarHBondContact O-N 3.49Å; G62-Q64 PolarHBondContact O-N 3.15Å; Q64-L88 HydrophobicContact CB-CD1 4.34Å; Q64-L88 HydrophobicContact CB-CG 4.39Å; Q64-L88 WeakPolarHBondContact O-CB 3.4Å; Q64-L88 PolarHBondContact O-N 3.37Å; Q64-W89 PolarHBondContact O-N 3.25Å
65	G	97.4	Very high	93.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	124.2	-178.1	0	0	0	0	0	111.8	T44 I45 C63 W89	T44-G65 CarbonylContact C-O 3.44Å; T44-G65 VanDerWaalsContact CA-O 3.29Å; T44-G65 WeakPolarHBondContact CA-O 3Å; I45-G65 PolarHBondContact N-O 3.11Å; C63-G65 PolarHBondContact SG-O 3.28Å; G65-W89 VanDerWaalsContact CA-CD2 3.45Å; G65-W89 WeakPolarHBondContact CA-O 3.3Å
66	L	97.2	Very high	93.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.2	-177.8	178.1	61	0	0	0	109.9	I45 I59 L68 F81 L84 L87 W89 I90 Y91	I45-L66 HydrophobicContact CB-CD1 4.28Å; I45-L66 HydrophobicContact CG2-CD1 4.2Å; I59-L66 HydrophobicContact CD1-CD1 3.92Å; I59-L66 HydrophobicContact CD1-CD2 3.87Å; L66-L68 HydrophobicContact CD1-CD1 4.18Å; L66-L68 HydrophobicContact CD1-CG 4.21Å; L66-L68 HydrophobicContact CD2-CD1 3.83Å; L66-L68 HydrophobicContact CG-CD1 3.92Å; L66-L68 HydrophobicContact CG-CG 4.26Å; L66-F81 HydrophobicContact CD2-CD1 4.19Å; L66-F81 HydrophobicContact CD2-CE1 4Å; L66-L84 HydrophobicContact CD2-CD1 4.13Å; L66-L87 HydrophobicContact CB-CD2 3.96Å; L66-W89 VanDerWaalsContact C-CZ3 3.4Å; L66-W89 PolarHBondContact N-O 2.96Å; L66-W89 WeakPolarHBondContact O-CZ3 3.3Å; L66-I90 WeakPolarHBondContact O-CA 3.36Å; L66-Y91 PolarHBondContact O-N 3.32Å
67	S	97.9	Very high	94.2	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.014	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.6	173.7	-160.3	0	0	0	0	109.5	I45 C47 D48	I45-S67 PolarHBondContact O-N 3.01Å; C47-S67 WeakPolarHBondContact CA-O 3.33Å; C47-S67 WeakPolarHBondContact CB-O 3.23Å; C47-S67 PolarHBondContact N-O 3.09Å; D48-S67 VanDerWaalsContact OD1-CB 3.23Å; D48-S67 WeakPolarHBondContact OD1-CB 3.46Å; D48-S67 PolarHBondContact OD1-OG 2.77Å; D48-S67 PolarHBondContact OD2-OG 2.7Å
68	L	97.3	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.			trans	-131.6	37	178.6	-79.3	160.9	0	0	0	109.4	C47 F52 V55 P56 L66 N71 L73 Y91 L92 N95	C47-L68 HydrophobicContact CB-CD2 3.48Å; C47-L68 VanDerWaalsContact CB-CD2 3.48Å; C47-L68 HydrophobicContact CB-CG 4.23Å; F52-L68 HydrophobicContact CD2-CD2 4.15Å; V55-L68 HydrophobicContact CB-CD1 4.49Å; V55-L68 HydrophobicContact CG1-CD1 4.05Å; V55-L68 HydrophobicContact CG2-CD1 4.13Å; P56-L68 HydrophobicContact CG-CD2 4.39Å; L66-L68 HydrophobicContact CD1-CD1 4.18Å; L66-L68 HydrophobicContact CD1-CG 4.21Å; L66-L68 HydrophobicContact CD2-CD1 3.83Å; L66-L68 HydrophobicContact CG-CD1 3.92Å; L66-L68 HydrophobicContact CG-CG 4.26Å; L68-N71 PolarHBondContact O-ND2 3.12Å; L68-L73 HydrophobicContact CB-CD1 4.11Å; L68-L73 HydrophobicContact CD1-CD1 4.43Å; L68-Y91 PolarHBondContact N-O 2.85Å; L68-L92 HydrophobicContact CB-CD2 3.93Å; L68-L92 HydrophobicContact CD1-CD2 4.06Å; L68-N95 PolarHBondContact O-ND2 2.83Å
69	R	97.6	Very high	95.5	Very high	72 Å²	72	43.8 Å²	43.8	27%	0.272	22%	0.224	S	C	.	.			trans	-72.8	153.6	-174.3	-61.5	177.7	144.4	159.7	3.1	111.8	D48 S49 N71 Y91 D93	D48-R69 CarbonylContact C-O 3.21Å; D48-R69 VanDerWaalsContact CA-O 3.28Å; D48-R69 WeakPolarHBondContact CA-O 3.44Å; D48-R69 HydrophobicContact CB-CB 4.44Å; D48-R69 WeakPolarHBondContact OD1-CB 3.43Å; D48-R69 PolarHBondContact OD1-N 2.88Å; S49-R69 PolarHBondContact N-O 3.36Å; R69-N71 VanDerWaalsContact C-N 3.26Å; R69-N71 PolarHBondContact O-N 2.87Å; R69-N71 PolarHBondContact O-ND2 3.35Å; R69-Y91 VanDerWaalsContact CZ-CD2 3.47Å; R69-D93 WeakPolarHBondContact CA-O 3.37Å; R69-D93 IonicContact CZ-OD1 3.9Å; R69-D93 VanDerWaalsContact CZ-OD1 3.26Å; R69-D93 IonicContact CZ-OD2 3.25Å; R69-D93 VanDerWaalsContact NE-CG 3.27Å; R69-D93 IonicContact NE-OD1 3.62Å; R69-D93 PolarHBondContact NE-OD1 3.33Å; R69-D93 IonicContact NE-OD2 3.85Å; R69-D93 PolarHBondContact NE-OD2 3.36Å; R69-D93 VanDerWaalsContact NE-OD2 3.1Å; R69-D93 IonicContact NH2-OD1 3.72Å; R69-D93 PolarHBondContact NH2-OD1 3.32Å; R69-D93 IonicContact NH2-OD2 2.91Å
70	Y	97.6	Very high	95.9	Very high	129 Å²	129	45.4 Å²	45.4	51%	0.506	23%	0.231	S	C	.	.	S	Bend	trans	55.5	41.7	174.5	-58.3	-82.5	0	0	0	112.6	S49 D93 H94	S49-Y70 VanDerWaalsContact CA-O 3.3Å; S49-Y70 WeakPolarHBondContact CA-O 3.31Å; S49-Y70 WeakPolarHBondContact OG-CB 3.47Å; Y70-D93 PolarHBondContact N-O 3.07Å; Y70-H94 WeakPolarHBondContact CA-O 3.38Å; Y70-H94 HydrophobicContact CD1-CB 3.44Å; Y70-H94 VanDerWaalsContact CD1-CB 3.44Å; Y70-H94 AromaticContact CD1-CG 3.84Å; Y70-H94 HydrophobicContact CD2-CB 4.46Å; Y70-H94 HydrophobicContact CE1-CB 3.54Å; Y70-H94 AromaticContact CE1-CD2 3.66Å; Y70-H94 AromaticContact CE1-CG 3.35Å; Y70-H94 AromaticContact CE1-ND1 3.8Å; Y70-H94 HydrophobicContact CG-CB 3.93Å; Y70-H94 AromaticContact CZ-CE1 3.99Å; Y70-H94 AromaticContact CZ-CG 3.64Å; Y70-H94 AromaticContact CZ-ND1 3.56Å; Y70-H94 PolarHBondContact N-O 3.19Å
71	N	97.3	Very high	96.3	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	22%	0.217	C	C	.	.	S	Bend	trans	-114.3	-172.4	174.3	-73.1	-60	0	0	0	109.6	C47 S50 G51 F52 L68 R69 L73 H94 N95	C47-N71 PolarHBondContact O-ND2 3.27Å; S50-N71 PolarHBondContact N-OD1 2.9Å; G51-N71 PolarHBondContact N-OD1 3.03Å; F52-N71 HydrophobicContact CB-CB 4.19Å; F52-N71 PolarHBondContact N-OD1 3.46Å; L68-N71 PolarHBondContact O-ND2 3.12Å; R69-N71 VanDerWaalsContact C-N 3.26Å; R69-N71 PolarHBondContact O-N 2.87Å; R69-N71 PolarHBondContact O-ND2 3.35Å; N71-L73 HydrophobicContact CB-CG 4.37Å; N71-H94 PolarHBondContact N-O 3.15Å; N71-N95 WeakPolarHBondContact CA-OD1 3.39Å; N71-N95 VanDerWaalsContact CB-OD1 3.22Å; N71-N95 WeakPolarHBondContact CB-OD1 3.3Å; N71-N95 WeakPolarHBondContact O-CA 3.45Å; N71-N95 PolarHBondContact O-OD1 3.35Å; N71-N95 VanDerWaalsContact O-OD1 3.09Å
72	E	97.4	Very high	96.5	Very high	81 Å²	81	40.5 Å²	40.5	38%	0.379	20%	0.204	S	C	.	.			trans	-113.4	31.9	-174.7	-56.2	-64.2	-177.8	0	0	111.3	F52 L53 H74 Q96	F52-E72 CarbonylContact O-C 3.6Å; F52-E72 VanDerWaalsContact O-C 3.26Å; F52-E72 WeakPolarHBondContact O-CA 3.26Å; F52-E72 PolarHBondContact O-N 2.65Å; L53-E72 HydrophobicContact CD2-CB 3.83Å; E72-H74 PolarHBondContact O-CD2 3.48Å; E72-H74 PolarHBondContact O-N 2.9Å; E72-Q96 WeakPolarHBondContact OE2-CG 3.41Å; E72-Q96 PolarHBondContact OE2-NE2 3.46Å
73	L	97.5	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.			trans	-63.9	128	-179.6	-59.8	176.9	0	0	0	110.3	F52 E54 V55 L68 N71 L92 N95 Q96 I97	F52-L73 HydrophobicContact CB-CD2 4.29Å; F52-L73 PolarHBondContact O-N 2.94Å; E54-L73 VanDerWaalsContact CA-CD2 3.48Å; E54-L73 WeakPolarHBondContact O-CD2 3.41Å; V55-L73 HydrophobicContact CG2-CD1 4.43Å; L68-L73 HydrophobicContact CB-CD1 4.11Å; L68-L73 HydrophobicContact CD1-CD1 4.43Å; N71-L73 HydrophobicContact CB-CG 4.37Å; L73-L92 HydrophobicContact CD1-CD2 3.46Å; L73-L92 VanDerWaalsContact CD1-CD2 3.46Å; L73-N95 HydrophobicContact CB-CB 4.19Å; L73-N95 VanDerWaalsContact CB-OD1 3.25Å; L73-N95 WeakPolarHBondContact CB-OD1 3.5Å; L73-N95 WeakPolarHBondContact CG-OD1 3.29Å; L73-N95 PolarHBondContact N-OD1 2.04Å; L73-N95 VanDerWaalsContact N-OD1 3.07Å; L73-Q96 CarbonylContact O-C 3.16Å; L73-Q96 VanDerWaalsContact O-CA 3.31Å; L73-Q96 WeakPolarHBondContact O-CA 3.47Å; L73-Q96 PolarHBondContact O-N 3.02Å; L73-I97 HydrophobicContact CB-CD1 4.29Å; L73-I97 HydrophobicContact CB-CG1 3.93Å; L73-I97 WeakPolarHBondContact O-CA 3.34Å; L73-I97 VanDerWaalsContact O-CG1 3.29Å; L73-I97 WeakPolarHBondContact O-CG1 3.42Å; L73-I97 PolarHBondContact O-N 2.97Å
74	H	96.9	Very high	96.7	Very high	76 Å²	76	43 Å²	43	35%	0.352	21%	0.207	S	C	.	.			trans	-104	-32.6	-178.2	-75.2	-71.9	0	0	0	114.5	E72 Q96 I97 S98	E72-H74 PolarHBondContact O-CD2 3.48Å; E72-H74 PolarHBondContact O-N 2.9Å; H74-Q96 PolarHBondContact CE1-OE1 3.23Å; H74-Q96 VanDerWaalsContact CE1-OE1 3.27Å; H74-I97 WeakPolarHBondContact O-CA 3.14Å; H74-S98 PolarHBondContact O-N 2.86Å
75	T	97.2	Very high	96.5	Very high	57 Å²	57	41.4 Å²	41.4	35%	0.35	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.9	-173	62	0	0	0	0	111.2	V99	T75-V99 WeakPolarHBondContact CA-O 3.33Å; T75-V99 HydrophobicContact CG2-CB 4.19Å
76	L	97.7	Very high	96.5	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.5	167.9	-60.6	179.1	0	0	0	108.9	V55 F81 L92 I97 V99 V100 D101 A104 F105 L116	V55-L76 HydrophobicContact CG2-CD2 4.46Å; L76-F81 HydrophobicContact CD2-CE2 4.32Å; L76-F81 HydrophobicContact CD2-CZ 4.14Å; L76-L92 HydrophobicContact CD1-CD1 3.99Å; L76-L92 HydrophobicContact CD2-CD1 4.25Å; L76-I97 HydrophobicContact CD1-CD1 4.33Å; L76-I97 HydrophobicContact CD2-CD1 4.22Å; L76-I97 HydrophobicContact CG-CD1 4.24Å; L76-I97 HydrophobicContact CG-CG2 4.22Å; L76-V99 PolarHBondContact N-O 3.33Å; L76-V100 HydrophobicContact CB-CG1 4.32Å; L76-V100 HydrophobicContact CD1-CG1 4.12Å; L76-V100 HydrophobicContact CD1-CG2 4.04Å; L76-V100 HydrophobicContact CG-CG2 4.46Å; L76-D101 WeakPolarHBondContact O-CB 3.48Å; L76-D101 PolarHBondContact O-N 3.1Å; L76-A104 HydrophobicContact CB-CB 3.91Å; L76-F105 HydrophobicContact CD1-CE1 4.15Å; L76-F105 HydrophobicContact CD1-CZ 3.68Å; L76-L116 HydrophobicContact CD1-CD2 4.08Å
77	L	96.9	Very high	96.5	Very high	85 Å²	85	45.2 Å²	45.2	45%	0.445	22%	0.224	S	C	.	.			trans	-76.8	162.6	-174.5	-49.6	177.6	0	0	0	111.9	Y79 Q80 A104	L77-Y79 PolarHBondContact O-N 2.88Å; L77-Q80 VanDerWaalsContact CB-OE1 3.25Å; L77-Q80 PolarHBondContact O-N 3.43Å; L77-A104 VanDerWaalsContact O-CA 3.3Å; L77-A104 WeakPolarHBondContact O-CA 3.44Å; L77-A104 WeakPolarHBondContact O-CB 3.42Å
78	P	97.4	Very high	96.5	Very high	55 Å²	55	46.8 Å²	46.8	36%	0.357	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	135.2	174.2	-18.5	27.5	0	0	0	111.5	Q80 D101 R103	P78-Q80 PolarHBondContact O-N 3.27Å; P78-Q80 VanDerWaalsContact O-N 3.12Å; P78-D101 WeakPolarHBondContact CB-OD1 3.38Å; P78-D101 HydrophobicContact CG-CB 4.06Å; P78-D101 WeakPolarHBondContact CG-OD1 3.25Å; P78-R103 HydrophobicContact CB-CB 4.44Å
79	Y	96.6	Very high	96.6	Very high	115 Å²	115	49.1 Å²	49.1	45%	0.451	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	16.1	176.3	-49.6	-89.6	0	0	0	116	L77 F81 A82 R103 Q106	L77-Y79 PolarHBondContact O-N 2.88Å; Y79-F81 PolarHBondContact O-N 2.82Å; Y79-A82 WeakPolarHBondContact O-CB 3.22Å; Y79-A82 PolarHBondContact O-N 3.2Å; Y79-R103 HydrophobicContact CE2-CB 4.34Å; Y79-R103 PolarHBondContact N-O 3.25Å; Y79-Q106 HydrophobicContact CD1-CB 3.83Å; Y79-Q106 HydrophobicContact CD1-CG 3.89Å; Y79-Q106 HydrophobicContact CE1-CB 3.99Å; Y79-Q106 HydrophobicContact CE1-CG 3.64Å
80	Q	95.9	Very high	96.6	Very high	41 Å²	41	45.7 Å²	45.7	19%	0.192	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-43	-175.2	-168.8	72.1	45.9	0	0	113.9	V55 L77 P78 H83	V55-Q80 HydrophobicContact CB-CG 4.06Å; V55-Q80 HydrophobicContact CG1-CG 4.33Å; V55-Q80 HydrophobicContact CG2-CG 4Å; L77-Q80 VanDerWaalsContact CB-OE1 3.25Å; L77-Q80 PolarHBondContact O-N 3.43Å; P78-Q80 PolarHBondContact O-N 3.27Å; P78-Q80 VanDerWaalsContact O-N 3.12Å; Q80-H83 PolarHBondContact O-CE1 3.23Å; Q80-H83 PolarHBondContact O-ND1 3.43Å
81	F	96.1	Very high	96.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	6.9	-176.2	-51.2	-73.3	0	0	0	113.9	V55 L66 L76 Y79 H83 L84 L87 I90 L92 F105 V108	V55-F81 HydrophobicContact CG1-CE1 3.92Å; V55-F81 HydrophobicContact CG2-CE1 4.08Å; V55-F81 HydrophobicContact CG2-CZ 4.08Å; L66-F81 HydrophobicContact CD2-CD1 4.19Å; L66-F81 HydrophobicContact CD2-CE1 4Å; L76-F81 HydrophobicContact CD2-CE2 4.32Å; L76-F81 HydrophobicContact CD2-CZ 4.14Å; Y79-F81 PolarHBondContact O-N 2.82Å; F81-H83 PolarHBondContact O-N 3.37Å; F81-L84 HydrophobicContact CD1-CD1 4.42Å; F81-L84 WeakPolarHBondContact O-CB 3.38Å; F81-L84 PolarHBondContact O-N 3.49Å; F81-L87 HydrophobicContact CB-CD1 4.45Å; F81-I90 HydrophobicContact CD1-CD1 4.39Å; F81-I90 HydrophobicContact CD2-CD1 4.28Å; F81-I90 HydrophobicContact CG-CD1 4.14Å; F81-L92 HydrophobicContact CE2-CD1 4.46Å; F81-L92 HydrophobicContact CZ-CD1 4.06Å; F81-F105 AromaticContact CD2-CD1 3.98Å; F81-F105 HydrophobicContact CD2-CD1 3.98Å; F81-F105 HydrophobicContact CD2-CE1 4.19Å; F81-F105 HydrophobicContact CE2-CD1 4.11Å; F81-F105 AromaticContact CE2-CE1 3.84Å; F81-F105 HydrophobicContact CE2-CE1 3.84Å; F81-V108 HydrophobicContact CB-CG1 3.66Å; F81-V108 WeakPolarHBondContact O-CG1 3.29Å
82	A	94.8	Very high	96.7	Very high	39 Å²	39	41.4 Å²	41.4	32%	0.322	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.4	-169.2	0	0	0	0	0	113.9	Y79 L84 Q106	Y79-A82 WeakPolarHBondContact O-CB 3.22Å; Y79-A82 PolarHBondContact O-N 3.2Å; A82-L84 PolarHBondContact O-N 3.38Å; A82-Q106 WeakPolarHBondContact CB-O 3.03Å
83	H	92.5	Very high	96.8	Very high	85 Å²	85	38 Å²	38	39%	0.394	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.8	175	65.6	-82.6	0	0	0	113.1	Q80 F81 G85	Q80-H83 PolarHBondContact O-CE1 3.23Å; Q80-H83 PolarHBondContact O-ND1 3.43Å; F81-H83 PolarHBondContact O-N 3.37Å; H83-G85 PolarHBondContact O-N 3.37Å
84	L	94.3	Very high	96.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.			trans	-98.5	46.2	-176.7	-54.6	176.6	0	0	0	112.1	I59 C63 L66 F81 A82 Q86 L87	I59-L84 HydrophobicContact CB-CD1 4.28Å; I59-L84 HydrophobicContact CB-CD2 4.07Å; I59-L84 HydrophobicContact CD1-CD1 4.32Å; I59-L84 HydrophobicContact CG2-CD1 3.76Å; I59-L84 HydrophobicContact CG2-CD2 3.6Å; I59-L84 HydrophobicContact CG2-CG 4.35Å; C63-L84 HydrophobicContact CB-CD2 4.4Å; L66-L84 HydrophobicContact CD2-CD1 4.13Å; F81-L84 HydrophobicContact CD1-CD1 4.42Å; F81-L84 WeakPolarHBondContact O-CB 3.38Å; F81-L84 PolarHBondContact O-N 3.49Å; A82-L84 PolarHBondContact O-N 3.38Å; L84-Q86 PolarHBondContact O-N 3.47Å; L84-L87 HydrophobicContact CB-CD1 3.43Å; L84-L87 VanDerWaalsContact CB-CD1 3.43Å; L84-L87 HydrophobicContact CB-CG 3.75Å; L84-L87 HydrophobicContact CD1-CD1 3.81Å; L84-L87 HydrophobicContact CG-CD1 4.27Å; L84-L87 WeakPolarHBondContact O-CB 3.22Å; L84-L87 WeakPolarHBondContact O-CG 3.32Å; L84-L87 PolarHBondContact O-N 3.19Å
85	G	93.8	Very high	96.9	Very high	27 Å²	27	38.2 Å²	38.2	28%	0.278	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-6	-174.5	0	0	0	0	0	116.3	H83 R110	H83-G85 PolarHBondContact O-N 3.37Å; G85-R110 WeakPolarHBondContact O-CD 3.22Å
86	Q	96.4	Very high	97	Very high	79 Å²	79	37.7 Å²	37.7	37%	0.369	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.3	175.5	-56.8	-53.8	-37.2	0	0	114.5	C63 L84 L88	C63-Q86 CarbonylContact O-C 3.53Å; C63-Q86 VanDerWaalsContact O-C 3.28Å; C63-Q86 WeakPolarHBondContact O-CB 3.5Å; L84-Q86 PolarHBondContact O-N 3.47Å; Q86-L88 PolarHBondContact O-N 3.22Å
87	L	97.7	Very high	97	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.19	C	C	.	.			trans	-57.8	135.1	-178.1	-75.8	171.9	0	0	0	113	C63 L66 F81 L84 I90 V108 R110 L111	C63-L87 HydrophobicContact CB-CD2 4.37Å; C63-L87 PolarHBondContact O-N 2.9Å; L66-L87 HydrophobicContact CB-CD2 3.96Å; F81-L87 HydrophobicContact CB-CD1 4.45Å; L84-L87 HydrophobicContact CB-CD1 3.43Å; L84-L87 VanDerWaalsContact CB-CD1 3.43Å; L84-L87 HydrophobicContact CB-CG 3.75Å; L84-L87 HydrophobicContact CD1-CD1 3.81Å; L84-L87 HydrophobicContact CG-CD1 4.27Å; L84-L87 WeakPolarHBondContact O-CB 3.22Å; L84-L87 WeakPolarHBondContact O-CG 3.32Å; L84-L87 PolarHBondContact O-N 3.19Å; L87-I90 HydrophobicContact CD1-CD1 3.83Å; L87-I90 HydrophobicContact CD1-CG1 3.85Å; L87-V108 HydrophobicContact CB-CG1 4.43Å; L87-V108 HydrophobicContact CD1-CG1 4.07Å; L87-R110 CarbonylContact O-C 3.12Å; L87-R110 WeakPolarHBondContact O-CB 3.45Å; L87-L111 HydrophobicContact CB-CD1 4.3Å; L87-L111 PolarHBondContact O-N 3.15Å
88	L	98.5	Very high	97	Very high	36 Å²	36	36 Å²	36	19%	0.188	19%	0.187	C	C	.	.	S	Bend	trans	-110.9	-31.2	174.8	-57.3	178.8	0	0	0	111.1	Q64 Q86 R110 K112 E113	Q64-L88 HydrophobicContact CB-CD1 4.34Å; Q64-L88 HydrophobicContact CB-CG 4.39Å; Q64-L88 WeakPolarHBondContact O-CB 3.4Å; Q64-L88 PolarHBondContact O-N 3.37Å; Q86-L88 PolarHBondContact O-N 3.22Å; L88-R110 HydrophobicContact CD2-CB 4.24Å; L88-K112 WeakPolarHBondContact O-CA 3.4Å; L88-K112 WeakPolarHBondContact O-CB 3.32Å; L88-K112 PolarHBondContact O-N 3.48Å; L88-E113 PolarHBondContact O-N 3.4Å
89	W	98.7	Very high	97	Very high	48 Å²	48	37.5 Å²	37.5	18%	0.182	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148	174.9	55.7	-99.8	0	0	0	112.4	T44 H46 Q64 G65 L66 Y91 E113	T44-W89 HydrophobicContact CG2-CH2 4.42Å; T44-W89 HydrophobicContact CG2-CZ2 3.57Å; H46-W89 AromaticContact CE1-CH2 3.7Å; H46-W89 AromaticContact NE2-CH2 3.97Å; Q64-W89 PolarHBondContact O-N 3.25Å; G65-W89 VanDerWaalsContact CA-CD2 3.45Å; G65-W89 WeakPolarHBondContact CA-O 3.3Å; L66-W89 VanDerWaalsContact C-CZ3 3.4Å; L66-W89 PolarHBondContact N-O 2.96Å; L66-W89 WeakPolarHBondContact O-CZ3 3.3Å; W89-Y91 HydrophobicContact CB-CE1 4.45Å; W89-Y91 HydrophobicContact CD2-CE2 4.38Å; W89-Y91 HydrophobicContact CE3-CD1 4.25Å; W89-Y91 AromaticContact CE3-CD2 3.79Å; W89-Y91 HydrophobicContact CE3-CD2 3.79Å; W89-Y91 HydrophobicContact CE3-CE1 4.25Å; W89-Y91 AromaticContact CE3-CE2 3.78Å; W89-Y91 HydrophobicContact CE3-CE2 3.78Å; W89-Y91 HydrophobicContact CE3-CG 4.03Å; W89-Y91 HydrophobicContact CH2-CE2 4.47Å; W89-Y91 AromaticContact CZ3-CD2 3.65Å; W89-Y91 HydrophobicContact CZ3-CD2 3.65Å; W89-Y91 AromaticContact CZ3-CE2 3.84Å; W89-Y91 HydrophobicContact CZ3-CE2 3.84Å; W89-Y91 HydrophobicContact CZ3-CG 4.21Å; W89-E113 VanDerWaalsContact CA-O 3.29Å; W89-E113 WeakPolarHBondContact CA-O 3.34Å; W89-E113 HydrophobicContact CB-CB 3.92Å; W89-E113 HydrophobicContact CB-CG 4.44Å
90	I	98.3	Very high	97.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	125.4	174.4	-65.9	167.2	0	0	0	108.1	L66 F81 L87 L92 L111 E113 L114 I115	L66-I90 WeakPolarHBondContact O-CA 3.36Å; F81-I90 HydrophobicContact CD1-CD1 4.39Å; F81-I90 HydrophobicContact CD2-CD1 4.28Å; F81-I90 HydrophobicContact CG-CD1 4.14Å; L87-I90 HydrophobicContact CD1-CD1 3.83Å; L87-I90 HydrophobicContact CD1-CG1 3.85Å; I90-L92 HydrophobicContact CG2-CD1 3.55Å; I90-L92 HydrophobicContact CG2-CG 3.71Å; I90-L111 HydrophobicContact CB-CD1 4.25Å; I90-L111 HydrophobicContact CD1-CD1 3.76Å; I90-L111 HydrophobicContact CD1-CD2 4.02Å; I90-L111 HydrophobicContact CG1-CD1 3.66Å; I90-E113 PolarHBondContact N-O 3.34Å; I90-L114 HydrophobicContact CB-CD1 4.03Å; I90-L114 HydrophobicContact CG2-CD1 4.1Å; I90-I115 PolarHBondContact O-N 3.46Å
91	Y	98.8	Very high	97.2	Very high	43 Å²	43	32.6 Å²	32.6	17%	0.169	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.2	174.1	-58	-28	0	0	0	110.6	L66 L68 R69 W89 E113 I115	L66-Y91 PolarHBondContact O-N 3.32Å; L68-Y91 PolarHBondContact N-O 2.85Å; R69-Y91 VanDerWaalsContact CZ-CD2 3.47Å; W89-Y91 HydrophobicContact CB-CE1 4.45Å; W89-Y91 HydrophobicContact CD2-CE2 4.38Å; W89-Y91 HydrophobicContact CE3-CD1 4.25Å; W89-Y91 AromaticContact CE3-CD2 3.79Å; W89-Y91 HydrophobicContact CE3-CD2 3.79Å; W89-Y91 HydrophobicContact CE3-CE1 4.25Å; W89-Y91 AromaticContact CE3-CE2 3.78Å; W89-Y91 HydrophobicContact CE3-CE2 3.78Å; W89-Y91 HydrophobicContact CE3-CG 4.03Å; W89-Y91 HydrophobicContact CH2-CE2 4.47Å; W89-Y91 AromaticContact CZ3-CD2 3.65Å; W89-Y91 HydrophobicContact CZ3-CD2 3.65Å; W89-Y91 AromaticContact CZ3-CE2 3.84Å; W89-Y91 HydrophobicContact CZ3-CE2 3.84Å; W89-Y91 HydrophobicContact CZ3-CG 4.21Å; Y91-E113 HydrophobicContact CE1-CG 4.04Å; Y91-E113 PolarHBondContact OH-OE1 3.27Å; Y91-I115 HydrophobicContact CD1-CB 3.8Å; Y91-I115 HydrophobicContact CD1-CG1 3.4Å; Y91-I115 VanDerWaalsContact CD1-CG1 3.4Å; Y91-I115 HydrophobicContact CE1-CB 4.44Å; Y91-I115 HydrophobicContact CE1-CG1 3.54Å
92	L	98.4	Very high	97.3	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.			trans	-128.7	16.2	-177.8	-70.6	162.4	0	0	0	111.2	L68 L73 L76 F81 I90 N95 I97 I115 L116 N119	L68-L92 HydrophobicContact CB-CD2 3.93Å; L68-L92 HydrophobicContact CD1-CD2 4.06Å; L73-L92 HydrophobicContact CD1-CD2 3.46Å; L73-L92 VanDerWaalsContact CD1-CD2 3.46Å; L76-L92 HydrophobicContact CD1-CD1 3.99Å; L76-L92 HydrophobicContact CD2-CD1 4.25Å; F81-L92 HydrophobicContact CE2-CD1 4.46Å; F81-L92 HydrophobicContact CZ-CD1 4.06Å; I90-L92 HydrophobicContact CG2-CD1 3.55Å; I90-L92 HydrophobicContact CG2-CG 3.71Å; L92-N95 PolarHBondContact O-ND2 3.37Å; L92-I97 HydrophobicContact CB-CD1 4.08Å; L92-I97 HydrophobicContact CD2-CD1 4.47Å; L92-I115 PolarHBondContact N-O 3.43Å; L92-L116 HydrophobicContact CB-CD2 3.9Å; L92-L116 HydrophobicContact CD1-CD2 3.81Å; L92-N119 PolarHBondContact O-ND2 2.95Å
93	D	98.5	Very high	97.4	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.043	19%	0.193	C	C	.	.			trans	-69.7	158.1	179.8	53.4	-85.5	0	0	0	113.7	R69 Y70 N95 I115 S117	R69-D93 WeakPolarHBondContact CA-O 3.37Å; R69-D93 IonicContact CZ-OD1 3.9Å; R69-D93 VanDerWaalsContact CZ-OD1 3.26Å; R69-D93 IonicContact CZ-OD2 3.25Å; R69-D93 VanDerWaalsContact NE-CG 3.27Å; R69-D93 IonicContact NE-OD1 3.62Å; R69-D93 PolarHBondContact NE-OD1 3.33Å; R69-D93 IonicContact NE-OD2 3.85Å; R69-D93 PolarHBondContact NE-OD2 3.36Å; R69-D93 VanDerWaalsContact NE-OD2 3.1Å; R69-D93 IonicContact NH2-OD1 3.72Å; R69-D93 PolarHBondContact NH2-OD1 3.32Å; R69-D93 IonicContact NH2-OD2 2.91Å; Y70-D93 PolarHBondContact N-O 3.07Å; D93-N95 PolarHBondContact O-ND2 2.92Å; D93-N95 VanDerWaalsContact O-ND2 3.09Å; D93-I115 HydrophobicContact CB-CG2 3.93Å; D93-I115 VanDerWaalsContact OD1-CG2 3.3Å; D93-I115 WeakPolarHBondContact OD1-CG2 3.48Å; D93-S117 WeakPolarHBondContact CA-O 3.24Å; D93-S117 WeakPolarHBondContact CB-O 3.33Å
94	H	98.5	Very high	97.7	Very high	71 Å²	71	33.5 Å²	33.5	33%	0.329	17%	0.174	S	C	.	.	S	Bend	trans	57.1	54.5	-177.2	-56.5	87.9	0	0	0	111.5	Y70 N71 S117 S118	Y70-H94 WeakPolarHBondContact CA-O 3.38Å; Y70-H94 HydrophobicContact CD1-CB 3.44Å; Y70-H94 VanDerWaalsContact CD1-CB 3.44Å; Y70-H94 AromaticContact CD1-CG 3.84Å; Y70-H94 HydrophobicContact CD2-CB 4.46Å; Y70-H94 HydrophobicContact CE1-CB 3.54Å; Y70-H94 AromaticContact CE1-CD2 3.66Å; Y70-H94 AromaticContact CE1-CG 3.35Å; Y70-H94 AromaticContact CE1-ND1 3.8Å; Y70-H94 HydrophobicContact CG-CB 3.93Å; Y70-H94 AromaticContact CZ-CE1 3.99Å; Y70-H94 AromaticContact CZ-CG 3.64Å; Y70-H94 AromaticContact CZ-ND1 3.56Å; Y70-H94 PolarHBondContact N-O 3.19Å; N71-H94 PolarHBondContact N-O 3.15Å; H94-S117 PolarHBondContact N-O 3Å; H94-S117 VanDerWaalsContact N-O 3.17Å; H94-S118 VanDerWaalsContact CA-O 3.27Å; H94-S118 WeakPolarHBondContact CA-O 3.17Å; H94-S118 VanDerWaalsContact CD2-CB 3.41Å; H94-S118 WeakPolarHBondContact CD2-CB 3.49Å; H94-S118 PolarHBondContact N-O 3.21Å; H94-S118 PolarHBondContact NE2-OG 2.73Å; H94-S118 VanDerWaalsContact NE2-OG 3.09Å
95	N	98.4	Very high	97.8	Very high	11 Å²	11	33.5 Å²	33.5	6%	0.059	17%	0.174	C	C	.	.	S	Bend	trans	-127.5	-176.4	176	-84.4	-90.6	0	0	0	110	L68 N71 L73 L92 D93 I97 S118 N119	L68-N95 PolarHBondContact O-ND2 2.83Å; N71-N95 WeakPolarHBondContact CA-OD1 3.39Å; N71-N95 VanDerWaalsContact CB-OD1 3.22Å; N71-N95 WeakPolarHBondContact CB-OD1 3.3Å; N71-N95 WeakPolarHBondContact O-CA 3.45Å; N71-N95 PolarHBondContact O-OD1 3.35Å; N71-N95 VanDerWaalsContact O-OD1 3.09Å; L73-N95 HydrophobicContact CB-CB 4.19Å; L73-N95 VanDerWaalsContact CB-OD1 3.25Å; L73-N95 WeakPolarHBondContact CB-OD1 3.5Å; L73-N95 WeakPolarHBondContact CG-OD1 3.29Å; L73-N95 PolarHBondContact N-OD1 2.04Å; L73-N95 VanDerWaalsContact N-OD1 3.07Å; L92-N95 PolarHBondContact O-ND2 3.37Å; D93-N95 PolarHBondContact O-ND2 2.92Å; D93-N95 VanDerWaalsContact O-ND2 3.09Å; N95-I97 HydrophobicContact CB-CD1 4.23Å; N95-I97 HydrophobicContact CB-CG1 4.01Å; N95-S118 PolarHBondContact N-O 3.03Å; N95-N119 WeakPolarHBondContact CA-OD1 3.29Å; N95-N119 WeakPolarHBondContact CB-OD1 3.16Å; N95-N119 PolarHBondContact O-OD1 3.14Å
96	Q	98.1	Very high	98	Very high	45 Å²	45	35.6 Å²	35.6	21%	0.21	18%	0.177	C	C	.	.			trans	-102.6	20.4	177.7	-56.4	-155.8	27.6	0	0	113.3	E72 L73 H74 S98 R120	E72-Q96 WeakPolarHBondContact OE2-CG 3.41Å; E72-Q96 PolarHBondContact OE2-NE2 3.46Å; L73-Q96 CarbonylContact O-C 3.16Å; L73-Q96 VanDerWaalsContact O-CA 3.31Å; L73-Q96 WeakPolarHBondContact O-CA 3.47Å; L73-Q96 PolarHBondContact O-N 3.02Å; H74-Q96 PolarHBondContact CE1-OE1 3.23Å; H74-Q96 VanDerWaalsContact CE1-OE1 3.27Å; Q96-S98 PolarHBondContact O-N 3.18Å; Q96-S98 VanDerWaalsContact O-N 3.12Å; Q96-R120 VanDerWaalsContact CD-NH2 3.26Å
97	I	98.5	Very high	97.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.			trans	-64.1	117	-168.1	-57.3	169.3	0	0	0	109.5	L73 H74 L76 L92 N95 V100 L116 N119 R120 I121	L73-I97 HydrophobicContact CB-CD1 4.29Å; L73-I97 HydrophobicContact CB-CG1 3.93Å; L73-I97 WeakPolarHBondContact O-CA 3.34Å; L73-I97 VanDerWaalsContact O-CG1 3.29Å; L73-I97 WeakPolarHBondContact O-CG1 3.42Å; L73-I97 PolarHBondContact O-N 2.97Å; H74-I97 WeakPolarHBondContact O-CA 3.14Å; L76-I97 HydrophobicContact CD1-CD1 4.33Å; L76-I97 HydrophobicContact CD2-CD1 4.22Å; L76-I97 HydrophobicContact CG-CD1 4.24Å; L76-I97 HydrophobicContact CG-CG2 4.22Å; L92-I97 HydrophobicContact CB-CD1 4.08Å; L92-I97 HydrophobicContact CD2-CD1 4.47Å; N95-I97 HydrophobicContact CB-CD1 4.23Å; N95-I97 HydrophobicContact CB-CG1 4.01Å; I97-V100 HydrophobicContact CG2-CG2 3.8Å; I97-L116 HydrophobicContact CD1-CD2 4.36Å; I97-N119 HydrophobicContact CB-CB 4.4Å; I97-N119 WeakPolarHBondContact CB-OD1 3.47Å; I97-N119 VanDerWaalsContact CG1-OD1 3.31Å; I97-N119 WeakPolarHBondContact CG1-OD1 3.44Å; I97-N119 PolarHBondContact N-OD1 2.75Å; I97-R120 CarbonylContact O-C 3.6Å; I97-R120 VanDerWaalsContact O-CA 3.29Å; I97-R120 WeakPolarHBondContact O-CA 3.4Å; I97-R120 PolarHBondContact O-N 3.33Å; I97-I121 HydrophobicContact CG2-CG1 4.26Å; I97-I121 WeakPolarHBondContact O-CG1 3.28Å; I97-I121 PolarHBondContact O-N 3.15Å
98	S	97.8	Very high	97.8	Very high	54 Å²	54	33.4 Å²	33.4	38%	0.378	18%	0.175	S	C	.	.			trans	-111.4	-26.2	178.3	60.6	0	0	0	0	112.9	H74 Q96	H74-S98 PolarHBondContact O-N 2.86Å; Q96-S98 PolarHBondContact O-N 3.18Å; Q96-S98 VanDerWaalsContact O-N 3.12Å
99	V	97.6	Very high	97.8	Very high	86 Å²	86	39.7 Å²	39.7	52%	0.521	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.1	-179	-175.9	0	0	0	0	110.4	T75 L76	T75-V99 WeakPolarHBondContact CA-O 3.33Å; T75-V99 HydrophobicContact CG2-CB 4.19Å; L76-V99 PolarHBondContact N-O 3.33Å
100	V	98.1	Very high	97.7	Very high	12 Å²	12	43.1 Å²	43.1	7%	0.073	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.5	173.7	-179.8	0	0	0	0	108.4	L76 I97 A104 F105 I121 L124 T128	L76-V100 HydrophobicContact CB-CG1 4.32Å; L76-V100 HydrophobicContact CD1-CG1 4.12Å; L76-V100 HydrophobicContact CD1-CG2 4.04Å; L76-V100 HydrophobicContact CG-CG2 4.46Å; I97-V100 HydrophobicContact CG2-CG2 3.8Å; V100-A104 HydrophobicContact CG1-CB 4.13Å; V100-F105 HydrophobicContact CG1-CE2 3.79Å; V100-F105 HydrophobicContact CG1-CZ 4.25Å; V100-I121 HydrophobicContact CG2-CD1 3.96Å; V100-I121 HydrophobicContact CG2-CG1 4.26Å; V100-L124 HydrophobicContact CB-CD2 4.03Å; V100-L124 HydrophobicContact CG1-CD2 4.43Å; V100-L124 HydrophobicContact CG2-CD2 4.29Å; V100-T128 HydrophobicContact CG1-CG2 3.77Å
101	D	97.8	Very high	97.7	Very high	41 Å²	41	43.1 Å²	43.1	22%	0.219	21%	0.209	C	C	.	.			trans	-63.2	144.7	177.6	-176.5	-100.9	0	0	0	111.7	L76 P78 R103 A104	L76-D101 WeakPolarHBondContact O-CB 3.48Å; L76-D101 PolarHBondContact O-N 3.1Å; P78-D101 WeakPolarHBondContact CB-OD1 3.38Å; P78-D101 HydrophobicContact CG-CB 4.06Å; P78-D101 WeakPolarHBondContact CG-OD1 3.25Å; D101-R103 PolarHBondContact O-N 3.47Å; D101-R103 WeakPolarHBondContact OD1-CA 3.01Å; D101-R103 WeakPolarHBondContact OD1-CB 3.42Å; D101-R103 PolarHBondContact OD1-N 2.85Å; D101-R103 IonicContact OD1-NE 3.26Å; D101-A104 HydrophobicContact CB-CB 4.47Å; D101-A104 WeakPolarHBondContact O-CB 3.27Å; D101-A104 PolarHBondContact O-N 3.05Å
102	S	97.1	Very high	97.7	Very high	30 Å²	30	45.1 Å²	45.1	21%	0.21	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-19.9	174.8	64.5	0	0	0	0	115.7	S127	S102-S127 PolarHBondContact O-OG 2.78Å
103	R	97.8	Very high	97.8	Very high	112 Å²	112	48 Å²	48	42%	0.423	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	11.4	-178.5	-60.7	167.3	-69.3	179	-4.9	113.1	P78 Y79 D101 F105 Q106	P78-R103 HydrophobicContact CB-CB 4.44Å; Y79-R103 HydrophobicContact CE2-CB 4.34Å; Y79-R103 PolarHBondContact N-O 3.25Å; D101-R103 PolarHBondContact O-N 3.47Å; D101-R103 WeakPolarHBondContact OD1-CA 3.01Å; D101-R103 WeakPolarHBondContact OD1-CB 3.42Å; D101-R103 PolarHBondContact OD1-N 2.85Å; D101-R103 IonicContact OD1-NE 3.26Å; R103-F105 VanDerWaalsContact C-N 3.27Å; R103-F105 PolarHBondContact O-N 3.5Å; R103-Q106 HydrophobicContact CB-CB 4.25Å; R103-Q106 WeakPolarHBondContact O-CB 3.25Å; R103-Q106 PolarHBondContact O-N 2.83Å
104	A	98.1	Very high	97.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-39.3	-177.3	0	0	0	0	0	113.5	L76 L77 V100 D101	L76-A104 HydrophobicContact CB-CB 3.91Å; L77-A104 VanDerWaalsContact O-CA 3.3Å; L77-A104 WeakPolarHBondContact O-CA 3.44Å; L77-A104 WeakPolarHBondContact O-CB 3.42Å; V100-A104 HydrophobicContact CG1-CB 4.13Å; D101-A104 HydrophobicContact CB-CB 4.47Å; D101-A104 WeakPolarHBondContact O-CB 3.27Å; D101-A104 PolarHBondContact O-N 3.05Å
105	F	97.7	Very high	97.8	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	16.7	178.5	-50.2	-67.1	0	0	0	113.8	L76 F81 V100 R103 V108 L114 L116 T128 F129 V132	L76-F105 HydrophobicContact CD1-CE1 4.15Å; L76-F105 HydrophobicContact CD1-CZ 3.68Å; F81-F105 AromaticContact CD2-CD1 3.98Å; F81-F105 HydrophobicContact CD2-CD1 3.98Å; F81-F105 HydrophobicContact CD2-CE1 4.19Å; F81-F105 HydrophobicContact CE2-CD1 4.11Å; F81-F105 AromaticContact CE2-CE1 3.84Å; F81-F105 HydrophobicContact CE2-CE1 3.84Å; V100-F105 HydrophobicContact CG1-CE2 3.79Å; V100-F105 HydrophobicContact CG1-CZ 4.25Å; R103-F105 VanDerWaalsContact C-N 3.27Å; R103-F105 PolarHBondContact O-N 3.5Å; F105-V108 HydrophobicContact CB-CG2 4.14Å; F105-V108 WeakPolarHBondContact O-CG2 3.02Å; F105-L114 HydrophobicContact CD1-CD1 4.42Å; F105-L114 HydrophobicContact CD1-CD2 4.19Å; F105-L114 HydrophobicContact CD2-CD2 4.19Å; F105-L114 HydrophobicContact CE1-CD1 3.77Å; F105-L114 HydrophobicContact CE1-CD2 3.93Å; F105-L114 HydrophobicContact CE2-CD2 3.92Å; F105-L114 HydrophobicContact CG-CD2 4.32Å; F105-L114 HydrophobicContact CZ-CD1 4.1Å; F105-L114 HydrophobicContact CZ-CD2 3.8Å; F105-L116 HydrophobicContact CE2-CD1 4.33Å; F105-L116 HydrophobicContact CZ-CD1 3.97Å; F105-L116 HydrophobicContact CZ-CD2 4.43Å; F105-T128 HydrophobicContact CD2-CG2 3.97Å; F105-T128 HydrophobicContact CE2-CG2 3.94Å; F105-F129 HydrophobicContact CD2-CD1 4.4Å; F105-F129 HydrophobicContact CD2-CE1 4.46Å; F105-F129 HydrophobicContact CE2-CE1 4.24Å; F105-V132 HydrophobicContact CB-CG1 3.88Å
106	Q	96.8	Very high	97.8	Very high	71 Å²	71	44.3 Å²	44.3	33%	0.332	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	130.8	177.3	-170.3	66.7	-6.6	0	0	110.3	Y79 A82 R103 G131	Y79-Q106 HydrophobicContact CD1-CB 3.83Å; Y79-Q106 HydrophobicContact CD1-CG 3.89Å; Y79-Q106 HydrophobicContact CE1-CB 3.99Å; Y79-Q106 HydrophobicContact CE1-CG 3.64Å; A82-Q106 WeakPolarHBondContact CB-O 3.03Å; R103-Q106 HydrophobicContact CB-CB 4.25Å; R103-Q106 WeakPolarHBondContact O-CB 3.25Å; R103-Q106 PolarHBondContact O-N 2.83Å; Q106-G131 VanDerWaalsContact OE1-CA 3.23Å
107	G	94.5	Very high	97.8	Very high	33 Å²	33	42.6 Å²	42.6	34%	0.34	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.9	-31.7	-179.2	0	0	0	0	0	114.2	R109	G107-R109 PolarHBondContact O-N 3.24Å
108	V	96.9	Very high	97.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-81.8	49.2	179.9	-67.8	0	0	0	0	113.5	F81 L87 F105 R110 L111 V132	F81-V108 HydrophobicContact CB-CG1 3.66Å; F81-V108 WeakPolarHBondContact O-CG1 3.29Å; L87-V108 HydrophobicContact CB-CG1 4.43Å; L87-V108 HydrophobicContact CD1-CG1 4.07Å; F105-V108 HydrophobicContact CB-CG2 4.14Å; F105-V108 WeakPolarHBondContact O-CG2 3.02Å; V108-R110 PolarHBondContact O-N 3.37Å; V108-L111 HydrophobicContact CG2-CD2 4.44Å; V108-L111 VanDerWaalsContact O-CB 3.26Å; V108-L111 WeakPolarHBondContact O-CB 3.35Å; V108-L111 PolarHBondContact O-N 3.11Å; V108-V132 HydrophobicContact CG2-CG1 3.85Å
109	R	96.9	Very high	97.9	Very high	168 Å²	168	42.1 Å²	42.1	63%	0.634	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.7	-175.4	-69.8	-176.8	175.1	-177	-0.1	114.9	G107 N134	G107-R109 PolarHBondContact O-N 3.24Å; R109-N134 PolarHBondContact O-ND2 3.19Å
110	R	98.1	Very high	97.9	Very high	119 Å²	119	43.3 Å²	43.3	45%	0.449	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-10.1	178.4	-69.1	-169.1	64.6	158.2	8.2	114.1	G85 L87 L88 V108 K112	G85-R110 WeakPolarHBondContact O-CD 3.22Å; L87-R110 CarbonylContact O-C 3.12Å; L87-R110 WeakPolarHBondContact O-CB 3.45Å; L88-R110 HydrophobicContact CD2-CB 4.24Å; V108-R110 PolarHBondContact O-N 3.37Å; R110-K112 PolarHBondContact O-N 3.19Å
111	L	98.6	Very high	97.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.196	C	C	.	.			trans	-58.3	131.9	-176.1	-162.5	71.3	0	0	0	111.1	L87 I90 V108 L114 V132 N134 L135	L87-L111 HydrophobicContact CB-CD1 4.3Å; L87-L111 PolarHBondContact O-N 3.15Å; I90-L111 HydrophobicContact CB-CD1 4.25Å; I90-L111 HydrophobicContact CD1-CD1 3.76Å; I90-L111 HydrophobicContact CD1-CD2 4.02Å; I90-L111 HydrophobicContact CG1-CD1 3.66Å; V108-L111 HydrophobicContact CG2-CD2 4.44Å; V108-L111 VanDerWaalsContact O-CB 3.26Å; V108-L111 WeakPolarHBondContact O-CB 3.35Å; V108-L111 PolarHBondContact O-N 3.11Å; L111-L114 HydrophobicContact CD2-CB 4.02Å; L111-L114 HydrophobicContact CD2-CD1 4.44Å; L111-L114 HydrophobicContact CD2-CD2 4.41Å; L111-V132 HydrophobicContact CB-CB 4.43Å; L111-V132 HydrophobicContact CB-CG1 3.94Å; L111-V132 HydrophobicContact CD2-CB 4.49Å; L111-V132 HydrophobicContact CD2-CG1 3.78Å; L111-N134 CarbonylContact O-C 3.04Å; L111-L135 HydrophobicContact CB-CD1 4.48Å; L111-L135 HydrophobicContact CD2-CD1 3.99Å; L111-L135 HydrophobicContact CG-CD1 3.98Å; L111-L135 PolarHBondContact O-N 3.32Å
112	K	98.7	Very high	97.9	Very high	86 Å²	86	43.4 Å²	43.4	37%	0.374	21%	0.206	S	C	.	.			trans	-113.8	-26.2	178	-62.5	178.3	-177.2	173.1	0	111.9	L88 R110 R136 S137	L88-K112 WeakPolarHBondContact O-CA 3.4Å; L88-K112 WeakPolarHBondContact O-CB 3.32Å; L88-K112 PolarHBondContact O-N 3.48Å; R110-K112 PolarHBondContact O-N 3.19Å; K112-R136 HydrophobicContact CB-CG 4.44Å; K112-R136 WeakPolarHBondContact O-CA 3.47Å; K112-R136 WeakPolarHBondContact O-CB 3.34Å; K112-R136 PolarHBondContact O-N 2.66Å; K112-S137 PolarHBondContact O-N 2.91Å
113	E	98.9	Very high	97.9	Very high	59 Å²	59	45.7 Å²	45.7	28%	0.276	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	129.5	-174.4	-179.5	167.7	179.4	0	0	110.3	L88 W89 I90 Y91 I115 S137	L88-E113 PolarHBondContact O-N 3.4Å; W89-E113 VanDerWaalsContact CA-O 3.29Å; W89-E113 WeakPolarHBondContact CA-O 3.34Å; W89-E113 HydrophobicContact CB-CB 3.92Å; W89-E113 HydrophobicContact CB-CG 4.44Å; I90-E113 PolarHBondContact N-O 3.34Å; Y91-E113 HydrophobicContact CE1-CG 4.04Å; Y91-E113 PolarHBondContact OH-OE1 3.27Å; E113-I115 HydrophobicContact CG-CD1 4.04Å; E113-I115 HydrophobicContact CG-CG1 4.17Å; E113-S137 WeakPolarHBondContact CA-O 3.25Å
114	L	98.8	Very high	97.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	113.6	179.8	177.4	57.9	0	0	0	108.4	I90 F105 L111 L116 F129 L135 S137 L138 D139	I90-L114 HydrophobicContact CB-CD1 4.03Å; I90-L114 HydrophobicContact CG2-CD1 4.1Å; F105-L114 HydrophobicContact CD1-CD1 4.42Å; F105-L114 HydrophobicContact CD1-CD2 4.19Å; F105-L114 HydrophobicContact CD2-CD2 4.19Å; F105-L114 HydrophobicContact CE1-CD1 3.77Å; F105-L114 HydrophobicContact CE1-CD2 3.93Å; F105-L114 HydrophobicContact CE2-CD2 3.92Å; F105-L114 HydrophobicContact CG-CD2 4.32Å; F105-L114 HydrophobicContact CZ-CD1 4.1Å; F105-L114 HydrophobicContact CZ-CD2 3.8Å; L111-L114 HydrophobicContact CD2-CB 4.02Å; L111-L114 HydrophobicContact CD2-CD1 4.44Å; L111-L114 HydrophobicContact CD2-CD2 4.41Å; L114-L116 HydrophobicContact CD1-CD1 4.21Å; L114-L116 HydrophobicContact CD1-CG 4.09Å; L114-L116 HydrophobicContact CD2-CD1 3.92Å; L114-L116 HydrophobicContact CG-CD1 3.91Å; L114-L116 HydrophobicContact CG-CG 4.13Å; L114-F129 HydrophobicContact CD2-CD1 4.28Å; L114-F129 HydrophobicContact CD2-CE1 3.96Å; L114-L135 HydrophobicContact CB-CD1 3.85Å; L114-L135 HydrophobicContact CB-CD2 4.42Å; L114-S137 PolarHBondContact N-O 2.85Å; L114-S137 VanDerWaalsContact N-O 3.08Å; L114-L138 HydrophobicContact CB-CD1 4.16Å; L114-L138 HydrophobicContact CD2-CD1 4.08Å; L114-L138 HydrophobicContact CG-CD1 4.13Å; L114-L138 WeakPolarHBondContact O-CA 3.46Å; L114-D139 PolarHBondContact O-N 2.81Å
115	I	98.8	Very high	97.8	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.6	-179.7	-50.1	-60.5	0	0	0	108.1	I90 Y91 L92 D93 E113 S117 D139	I90-I115 PolarHBondContact O-N 3.46Å; Y91-I115 HydrophobicContact CD1-CB 3.8Å; Y91-I115 HydrophobicContact CD1-CG1 3.4Å; Y91-I115 VanDerWaalsContact CD1-CG1 3.4Å; Y91-I115 HydrophobicContact CE1-CB 4.44Å; Y91-I115 HydrophobicContact CE1-CG1 3.54Å; L92-I115 PolarHBondContact N-O 3.43Å; D93-I115 HydrophobicContact CB-CG2 3.93Å; D93-I115 VanDerWaalsContact OD1-CG2 3.3Å; D93-I115 WeakPolarHBondContact OD1-CG2 3.48Å; E113-I115 HydrophobicContact CG-CD1 4.04Å; E113-I115 HydrophobicContact CG-CG1 4.17Å; I115-S117 WeakPolarHBondContact CG2-OG 3.32Å; I115-D139 HydrophobicContact CD1-CB 3.63Å; I115-D139 HydrophobicContact CG2-CB 4.12Å
116	L	98.6	Very high	97.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.			trans	-123.7	17.8	-179.1	-74.4	163.9	0	0	0	111	L76 L92 I97 F105 L114 N119 I121 D139 L140 N143	L76-L116 HydrophobicContact CD1-CD2 4.08Å; L92-L116 HydrophobicContact CB-CD2 3.9Å; L92-L116 HydrophobicContact CD1-CD2 3.81Å; I97-L116 HydrophobicContact CD1-CD2 4.36Å; F105-L116 HydrophobicContact CE2-CD1 4.33Å; F105-L116 HydrophobicContact CZ-CD1 3.97Å; F105-L116 HydrophobicContact CZ-CD2 4.43Å; L114-L116 HydrophobicContact CD1-CD1 4.21Å; L114-L116 HydrophobicContact CD1-CG 4.09Å; L114-L116 HydrophobicContact CD2-CD1 3.92Å; L114-L116 HydrophobicContact CG-CD1 3.91Å; L114-L116 HydrophobicContact CG-CG 4.13Å; L116-N119 PolarHBondContact O-ND2 2.79Å; L116-N119 VanDerWaalsContact O-ND2 3.15Å; L116-I121 HydrophobicContact CB-CD1 4.25Å; L116-I121 HydrophobicContact CD2-CD1 4.47Å; L116-D139 CarbonylContact C-O 3.42Å; L116-D139 WeakPolarHBondContact CA-O 3.28Å; L116-D139 PolarHBondContact N-O 2.83Å; L116-L140 HydrophobicContact CB-CD2 3.96Å; L116-L140 HydrophobicContact CD1-CD2 3.93Å; L116-N143 PolarHBondContact O-ND2 3.39Å
117	S	98.7	Very high	97.5	Very high	10 Å²	10	46.7 Å²	46.7	7%	0.07	24%	0.237	C	C	.	.			trans	-70.4	164	-177.1	40	0	0	0	0	113.6	D93 H94 I115 N119 D139 S141	D93-S117 WeakPolarHBondContact CA-O 3.24Å; D93-S117 WeakPolarHBondContact CB-O 3.33Å; H94-S117 PolarHBondContact N-O 3Å; H94-S117 VanDerWaalsContact N-O 3.17Å; I115-S117 WeakPolarHBondContact CG2-OG 3.32Å; S117-N119 PolarHBondContact O-N 3.48Å; S117-N119 PolarHBondContact O-ND2 3.33Å; S117-D139 VanDerWaalsContact CB-CG 3.49Å; S117-D139 WeakPolarHBondContact CB-OD2 3.44Å; S117-D139 PolarHBondContact N-O 3.16Å; S117-D139 PolarHBondContact OG-OD2 3.29Å; S117-S141 CarbonylContact C-O 3.44Å; S117-S141 WeakPolarHBondContact CA-O 3.4Å; S117-S141 WeakPolarHBondContact CB-O 3.1Å
118	S	98.6	Very high	97.7	Very high	34 Å²	34	45.2 Å²	45.2	24%	0.238	22%	0.222	C	C	.	.	S	Bend	trans	53	53.8	-178.6	-61.2	0	0	0	0	112.1	H94 N95 S141 Y142	H94-S118 VanDerWaalsContact CA-O 3.27Å; H94-S118 WeakPolarHBondContact CA-O 3.17Å; H94-S118 VanDerWaalsContact CD2-CB 3.41Å; H94-S118 WeakPolarHBondContact CD2-CB 3.49Å; H94-S118 PolarHBondContact N-O 3.21Å; H94-S118 PolarHBondContact NE2-OG 2.73Å; H94-S118 VanDerWaalsContact NE2-OG 3.09Å; N95-S118 PolarHBondContact N-O 3.03Å; S118-S141 PolarHBondContact N-O 2.95Å; S118-Y142 VanDerWaalsContact CA-O 3.31Å; S118-Y142 WeakPolarHBondContact CA-O 3.43Å; S118-Y142 PolarHBondContact N-O 3.48Å
119	N	98.8	Very high	97.7	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.053	22%	0.222	C	C	.	.	S	Bend	trans	-130.9	-168.8	-179.7	-90.5	-76.5	0	0	0	110	L92 N95 I97 L116 S117 I121 Y142 N143	L92-N119 PolarHBondContact O-ND2 2.95Å; N95-N119 WeakPolarHBondContact CA-OD1 3.29Å; N95-N119 WeakPolarHBondContact CB-OD1 3.16Å; N95-N119 PolarHBondContact O-OD1 3.14Å; I97-N119 HydrophobicContact CB-CB 4.4Å; I97-N119 WeakPolarHBondContact CB-OD1 3.47Å; I97-N119 VanDerWaalsContact CG1-OD1 3.31Å; I97-N119 WeakPolarHBondContact CG1-OD1 3.44Å; I97-N119 PolarHBondContact N-OD1 2.75Å; L116-N119 PolarHBondContact O-ND2 2.79Å; L116-N119 VanDerWaalsContact O-ND2 3.15Å; S117-N119 PolarHBondContact O-N 3.48Å; S117-N119 PolarHBondContact O-ND2 3.33Å; N119-I121 HydrophobicContact CB-CD1 4.47Å; N119-I121 HydrophobicContact CB-CG1 4.26Å; N119-Y142 PolarHBondContact N-O 3.36Å; N119-Y142 VanDerWaalsContact N-O 3.17Å; N119-N143 WeakPolarHBondContact CA-OD1 3.5Å; N119-N143 WeakPolarHBondContact CB-OD1 3.46Å; N119-N143 PolarHBondContact O-OD1 3.25Å
120	R	98.4	Very high	97.6	Very high	111 Å²	111	41.7 Å²	41.7	42%	0.419	21%	0.212	S	C	.	.			trans	-118.7	21.1	-176	-59.7	-177.3	-177.7	165.1	11.4	112.8	Q96 I97 A122 N143	Q96-R120 VanDerWaalsContact CD-NH2 3.26Å; I97-R120 CarbonylContact O-C 3.6Å; I97-R120 VanDerWaalsContact O-CA 3.29Å; I97-R120 WeakPolarHBondContact O-CA 3.4Å; I97-R120 PolarHBondContact O-N 3.33Å; R120-A122 PolarHBondContact O-N 3.38Å; R120-N143 PolarHBondContact N-OD1 2.86Å
121	I	98.5	Very high	97.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.			trans	-66.7	114.4	-174.3	-54.7	171.5	0	0	0	109	I97 V100 L116 N119 S123 L124 N143 K144 L145	I97-I121 HydrophobicContact CG2-CG1 4.26Å; I97-I121 WeakPolarHBondContact O-CG1 3.28Å; I97-I121 PolarHBondContact O-N 3.15Å; V100-I121 HydrophobicContact CG2-CD1 3.96Å; V100-I121 HydrophobicContact CG2-CG1 4.26Å; L116-I121 HydrophobicContact CB-CD1 4.25Å; L116-I121 HydrophobicContact CD2-CD1 4.47Å; N119-I121 HydrophobicContact CB-CD1 4.47Å; N119-I121 HydrophobicContact CB-CG1 4.26Å; I121-S123 WeakPolarHBondContact CG2-O 3.48Å; I121-L124 HydrophobicContact CG2-CD2 3.77Å; I121-L124 HydrophobicContact CG2-CG 3.96Å; I121-N143 HydrophobicContact CB-CB 4.44Å; I121-N143 VanDerWaalsContact CB-OD1 3.3Å; I121-N143 WeakPolarHBondContact CB-OD1 3.05Å; I121-N143 WeakPolarHBondContact CG1-OD1 3.27Å; I121-N143 PolarHBondContact N-OD1 3.21Å; I121-K144 CarbonylContact O-C 3.57Å; I121-K144 VanDerWaalsContact O-C 3.25Å; I121-K144 WeakPolarHBondContact O-CA 3.22Å; I121-K144 PolarHBondContact O-N 2.83Å; I121-L145 HydrophobicContact CG2-CD2 3.88Å; I121-L145 PolarHBondContact O-N 3.15Å
122	A	97.3	Very high	97.4	Very high	54 Å²	54	36.2 Å²	36.2	45%	0.446	19%	0.193	S	C	.	.			trans	-92.3	-29.4	180	0	0	0	0	0	113.1	R120 K144	R120-A122 PolarHBondContact O-N 3.38Å; A122-K144 WeakPolarHBondContact CA-O 3.48Å; A122-K144 HydrophobicContact CB-CB 4.38Å
123	S	96.3	Very high	97.3	Very high	79 Å²	79	34.6 Å²	34.6	55%	0.552	19%	0.191	S	C	*	.			trans	-150	158.9	179	63.2	0	0	0	0	111.2	I121	I121-S123 WeakPolarHBondContact CG2-O 3.48Å
124	L	97.1	Very high	97.3	Very high	9 Å²	9	34.3 Å²	34.3	5%	0.047	19%	0.191	C	C	.	.			trans	-131.5	146.8	173.6	-69.1	170	0	0	0	108.6	V100 I121 T128 F129 L140 L145 Q149 Q152	V100-L124 HydrophobicContact CB-CD2 4.03Å; V100-L124 HydrophobicContact CG1-CD2 4.43Å; V100-L124 HydrophobicContact CG2-CD2 4.29Å; I121-L124 HydrophobicContact CG2-CD2 3.77Å; I121-L124 HydrophobicContact CG2-CG 3.96Å; L124-T128 HydrophobicContact CD2-CG2 4.31Å; L124-F129 HydrophobicContact CD1-CE2 3.92Å; L124-F129 HydrophobicContact CD1-CZ 3.83Å; L124-L140 HydrophobicContact CD1-CD1 3.97Å; L124-L140 HydrophobicContact CD1-CD2 4.07Å; L124-L145 HydrophobicContact CD1-CD1 4.42Å; L124-L145 HydrophobicContact CD1-CD2 4.23Å; L124-L145 HydrophobicContact CG-CD2 4.11Å; L124-Q149 WeakPolarHBondContact O-CG 3.39Å; L124-Q152 PolarHBondContact O-OE1 3.22Å
125	H	96.1	Very high	97.3	Very high	102 Å²	102	34.3 Å²	34.3	47%	0.472	19%	0.191	S	C	.	.			trans	-76.1	147.4	171.2	-165.8	-102.9	0	0	0	109.4	S127 T128 Q152	H125-S127 PolarHBondContact ND1-N 3.28Å; H125-S127 PolarHBondContact ND1-OG 2.9Å; H125-S127 PolarHBondContact O-N 2.9Å; H125-S127 VanDerWaalsContact O-N 3.12Å; H125-T128 PolarHBondContact N-OG1 3.36Å; H125-T128 WeakPolarHBondContact O-CB 3.45Å; H125-T128 PolarHBondContact O-N 3.01Å; H125-T128 VanDerWaalsContact O-N 3.09Å; H125-T128 PolarHBondContact O-OG1 2.03Å; H125-Q152 PolarHBondContact O-NE2 3.09Å
126	N	94.2	Very high	97.3	Very high	67 Å²	67	39.2 Å²	39.2	36%	0.358	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-32.9	-177.1	64.9	-2.8	0	0	0	112.8	Q149	N126-Q149 HydrophobicContact CB-CB 3.84Å; N126-Q149 HydrophobicContact CB-CG 4.47Å
127	S	95.7	Very high	97.3	Very high	27 Å²	27	40 Å²	40	19%	0.189	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-5.5	-178.7	72.2	0	0	0	0	115.6	S102 H125 F129 H130	S102-S127 PolarHBondContact O-OG 2.78Å; H125-S127 PolarHBondContact ND1-N 3.28Å; H125-S127 PolarHBondContact ND1-OG 2.9Å; H125-S127 PolarHBondContact O-N 2.9Å; H125-S127 VanDerWaalsContact O-N 3.12Å; S127-F129 PolarHBondContact O-N 2.79Å; S127-H130 WeakPolarHBondContact O-CB 3.12Å; S127-H130 PolarHBondContact O-N 3.13Å
128	T	97.4	Very high	97.3	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-32.7	-169.6	-62.7	0	0	0	0	113.1	V100 F105 L124 H125	V100-T128 HydrophobicContact CG1-CG2 3.77Å; F105-T128 HydrophobicContact CD2-CG2 3.97Å; F105-T128 HydrophobicContact CE2-CG2 3.94Å; L124-T128 HydrophobicContact CD2-CG2 4.31Å; H125-T128 PolarHBondContact N-OG1 3.36Å; H125-T128 WeakPolarHBondContact O-CB 3.45Å; H125-T128 PolarHBondContact O-N 3.01Å; H125-T128 VanDerWaalsContact O-N 3.09Å; H125-T128 PolarHBondContact O-OG1 2.03Å
129	F	97.6	Very high	97.3	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	2.4	-179.6	-53	-58.3	0	0	0	115	F105 L114 L124 S127 G131 V132 L138 L140 F153 L156	F105-F129 HydrophobicContact CD2-CD1 4.4Å; F105-F129 HydrophobicContact CD2-CE1 4.46Å; F105-F129 HydrophobicContact CE2-CE1 4.24Å; L114-F129 HydrophobicContact CD2-CD1 4.28Å; L114-F129 HydrophobicContact CD2-CE1 3.96Å; L124-F129 HydrophobicContact CD1-CE2 3.92Å; L124-F129 HydrophobicContact CD1-CZ 3.83Å; S127-F129 PolarHBondContact O-N 2.79Å; F129-G131 PolarHBondContact O-N 3.12Å; F129-V132 HydrophobicContact CB-CG2 4.06Å; F129-V132 HydrophobicContact CD1-CG2 4.41Å; F129-V132 WeakPolarHBondContact O-CG2 3.45Å; F129-V132 PolarHBondContact O-N 3.12Å; F129-V132 VanDerWaalsContact O-N 3.12Å; F129-L138 HydrophobicContact CD1-CD2 4.47Å; F129-L138 HydrophobicContact CD2-CD2 4.17Å; F129-L138 HydrophobicContact CE1-CD1 4.05Å; F129-L138 HydrophobicContact CE1-CD2 4.22Å; F129-L138 HydrophobicContact CE2-CD2 3.9Å; F129-L138 HydrophobicContact CG-CD2 4.46Å; F129-L138 HydrophobicContact CZ-CD1 4.19Å; F129-L138 HydrophobicContact CZ-CD2 3.93Å; F129-L140 HydrophobicContact CE2-CD1 4.23Å; F129-L140 HydrophobicContact CZ-CD1 4.03Å; F129-L140 HydrophobicContact CZ-CD2 4.39Å; F129-F153 HydrophobicContact CD2-CD1 4.33Å; F129-F153 HydrophobicContact CD2-CE1 4.48Å; F129-F153 HydrophobicContact CE2-CE1 4.26Å; F129-L156 HydrophobicContact CB-CD1 3.98Å; F129-L156 HydrophobicContact CB-CD2 4.15Å; F129-L156 HydrophobicContact CB-CG 4.4Å; F129-L156 HydrophobicContact CG-CD1 4.44Å
130	H	94.9	Very high	97.3	Very high	93 Å²	93	38.6 Å²	38.6	43%	0.431	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.4	178.7	-69.9	-178.1	0	0	0	113	S127 V132	S127-H130 WeakPolarHBondContact O-CB 3.12Å; S127-H130 PolarHBondContact O-N 3.13Å; H130-V132 VanDerWaalsContact C-N 3.27Å; H130-V132 PolarHBondContact O-N 3.04Å
131	G	94.9	Very high	97.3	Very high	4 Å²	4	33.6 Å²	33.6	4%	0.041	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-15.6	177.2	0	0	0	0	0	115.1	Q106 F129 P133	Q106-G131 VanDerWaalsContact OE1-CA 3.23Å; F129-G131 PolarHBondContact O-N 3.12Å; G131-P133 VanDerWaalsContact O-CD 3.27Å; G131-P133 WeakPolarHBondContact O-CD 3.47Å
132	V	97.7	Very high	97.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.			trans	-121.8	56.7	-170.1	-67.3	0	0	0	0	113.6	F105 V108 L111 F129 H130 N134 L135 L156	F105-V132 HydrophobicContact CB-CG1 3.88Å; V108-V132 HydrophobicContact CG2-CG1 3.85Å; L111-V132 HydrophobicContact CB-CB 4.43Å; L111-V132 HydrophobicContact CB-CG1 3.94Å; L111-V132 HydrophobicContact CD2-CB 4.49Å; L111-V132 HydrophobicContact CD2-CG1 3.78Å; F129-V132 HydrophobicContact CB-CG2 4.06Å; F129-V132 HydrophobicContact CD1-CG2 4.41Å; F129-V132 WeakPolarHBondContact O-CG2 3.45Å; F129-V132 PolarHBondContact O-N 3.12Å; F129-V132 VanDerWaalsContact O-N 3.12Å; H130-V132 VanDerWaalsContact C-N 3.27Å; H130-V132 PolarHBondContact O-N 3.04Å; V132-N134 PolarHBondContact O-N 3.15Å; V132-L135 HydrophobicContact CG2-CB 4.5Å; V132-L135 HydrophobicContact CG2-CD2 4.27Å; V132-L135 WeakPolarHBondContact O-CB 3.28Å; V132-L135 PolarHBondContact O-N 2.93Å; V132-L135 VanDerWaalsContact O-N 3.13Å; V132-L156 HydrophobicContact CG2-CD2 4.48Å
133	P	96.9	Very high	97.4	Very high	52 Å²	52	36.7 Å²	36.7	34%	0.338	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.2	-174.5	31	-38.5	0	0	0	115	G131	G131-P133 VanDerWaalsContact O-CD 3.27Å; G131-P133 WeakPolarHBondContact O-CD 3.47Å
134	N	98.2	Very high	97.5	Very high	52 Å²	52	38.7 Å²	38.7	28%	0.278	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	4.9	176.9	-70.8	-63.4	0	0	0	114.1	R109 L111 V132 K158	R109-N134 PolarHBondContact O-ND2 3.19Å; L111-N134 CarbonylContact O-C 3.04Å; V132-N134 PolarHBondContact O-N 3.15Å; N134-K158 PolarHBondContact OD1-NZ 3.06Å
135	L	98.6	Very high	97.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.184	C	C	.	.			trans	-59.4	137.1	179.9	-153.7	71.3	0	0	0	111.1	L111 L114 V132 L138 L156 K158 L159	L111-L135 HydrophobicContact CB-CD1 4.48Å; L111-L135 HydrophobicContact CD2-CD1 3.99Å; L111-L135 HydrophobicContact CG-CD1 3.98Å; L111-L135 PolarHBondContact O-N 3.32Å; L114-L135 HydrophobicContact CB-CD1 3.85Å; L114-L135 HydrophobicContact CB-CD2 4.42Å; V132-L135 HydrophobicContact CG2-CB 4.5Å; V132-L135 HydrophobicContact CG2-CD2 4.27Å; V132-L135 WeakPolarHBondContact O-CB 3.28Å; V132-L135 PolarHBondContact O-N 2.93Å; V132-L135 VanDerWaalsContact O-N 3.13Å; L135-L138 HydrophobicContact CD2-CB 3.8Å; L135-L138 HydrophobicContact CD2-CD1 4.19Å; L135-L138 HydrophobicContact CD2-CD2 4.24Å; L135-L138 HydrophobicContact CD2-CG 4.3Å; L135-L156 HydrophobicContact CB-CD2 4.29Å; L135-K158 CarbonylContact O-C 3.13Å; L135-L159 HydrophobicContact CB-CD1 4.39Å; L135-L159 HydrophobicContact CD2-CD1 4.18Å; L135-L159 HydrophobicContact CG-CD1 4.2Å; L135-L159 WeakPolarHBondContact O-CA 3.46Å; L135-L159 PolarHBondContact O-N 3.07Å; L135-L159 VanDerWaalsContact O-N 3.09Å
136	R	98.8	Very high	97.6	Very high	117 Å²	117	38.7 Å²	38.7	44%	0.442	19%	0.186	S	C	.	.			trans	-120.2	-34.7	-179.2	-63.2	-174.5	177.8	-162.9	-5.1	112	K112 Q160 N161	K112-R136 HydrophobicContact CB-CG 4.44Å; K112-R136 WeakPolarHBondContact O-CA 3.47Å; K112-R136 WeakPolarHBondContact O-CB 3.34Å; K112-R136 PolarHBondContact O-N 2.66Å; R136-Q160 WeakPolarHBondContact O-CA 3.34Å; R136-Q160 PolarHBondContact O-N 3.35Å; R136-N161 PolarHBondContact O-N 3.46Å
137	S	98.8	Very high	97.6	Very high	15 Å²	15	40.6 Å²	40.6	11%	0.105	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.3	174.3	-169.2	0	0	0	0	109.8	K112 E113 L114 N161	K112-S137 PolarHBondContact O-N 2.91Å; E113-S137 WeakPolarHBondContact CA-O 3.25Å; L114-S137 PolarHBondContact N-O 2.85Å; L114-S137 VanDerWaalsContact N-O 3.08Å; S137-N161 WeakPolarHBondContact CA-O 3.12Å
138	L	98.9	Very high	97.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119.1	172.9	177.8	55.8	0	0	0	108.6	L114 F129 L135 L140 F153 L156 L159 N161 L162 H163	L114-L138 HydrophobicContact CB-CD1 4.16Å; L114-L138 HydrophobicContact CD2-CD1 4.08Å; L114-L138 HydrophobicContact CG-CD1 4.13Å; L114-L138 WeakPolarHBondContact O-CA 3.46Å; F129-L138 HydrophobicContact CD1-CD2 4.47Å; F129-L138 HydrophobicContact CD2-CD2 4.17Å; F129-L138 HydrophobicContact CE1-CD1 4.05Å; F129-L138 HydrophobicContact CE1-CD2 4.22Å; F129-L138 HydrophobicContact CE2-CD2 3.9Å; F129-L138 HydrophobicContact CG-CD2 4.46Å; F129-L138 HydrophobicContact CZ-CD1 4.19Å; F129-L138 HydrophobicContact CZ-CD2 3.93Å; L135-L138 HydrophobicContact CD2-CB 3.8Å; L135-L138 HydrophobicContact CD2-CD1 4.19Å; L135-L138 HydrophobicContact CD2-CD2 4.24Å; L135-L138 HydrophobicContact CD2-CG 4.3Å; L138-L140 HydrophobicContact CD1-CD1 4.36Å; L138-L140 HydrophobicContact CD1-CG 4.11Å; L138-L140 HydrophobicContact CD2-CD1 4.01Å; L138-L140 HydrophobicContact CG-CD1 4.11Å; L138-L140 HydrophobicContact CG-CG 4.18Å; L138-F153 HydrophobicContact CD2-CD1 4.19Å; L138-F153 HydrophobicContact CD2-CE1 3.93Å; L138-L156 HydrophobicContact CD2-CD1 4.45Å; L138-L159 HydrophobicContact CB-CD1 3.88Å; L138-N161 PolarHBondContact N-O 3.46Å; L138-L162 HydrophobicContact CB-CD1 4.07Å; L138-L162 HydrophobicContact CD2-CD1 3.99Å; L138-L162 HydrophobicContact CG-CD1 4.04Å; L138-L162 WeakPolarHBondContact O-CA 3.4Å; L138-H163 PolarHBondContact O-N 3.5Å
139	D	98.9	Very high	97.4	Very high	26 Å²	26	42.9 Å²	42.9	14%	0.139	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	117.5	174.3	-176.6	13.6	0	0	0	110.7	L114 I115 L116 S117 S141 H163	L114-D139 PolarHBondContact O-N 2.81Å; I115-D139 HydrophobicContact CD1-CB 3.63Å; I115-D139 HydrophobicContact CG2-CB 4.12Å; L116-D139 CarbonylContact C-O 3.42Å; L116-D139 WeakPolarHBondContact CA-O 3.28Å; L116-D139 PolarHBondContact N-O 2.83Å; S117-D139 VanDerWaalsContact CB-CG 3.49Å; S117-D139 WeakPolarHBondContact CB-OD2 3.44Å; S117-D139 PolarHBondContact N-O 3.16Å; S117-D139 PolarHBondContact OG-OD2 3.29Å; D139-S141 WeakPolarHBondContact OD1-CB 3.47Å; D139-S141 PolarHBondContact OD1-N 3.46Å; D139-S141 PolarHBondContact OD1-OG 3.41Å; D139-H163 HydrophobicContact CB-CB 4.28Å; D139-H163 WeakPolarHBondContact OD1-CB 3.27Å
140	L	98.8	Very high	97	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.			trans	-120.9	18	176.4	-70.9	166.6	0	0	0	110.8	L116 L124 F129 L138 N143 L145 F153 H163 L164 N167	L116-L140 HydrophobicContact CB-CD2 3.96Å; L116-L140 HydrophobicContact CD1-CD2 3.93Å; L124-L140 HydrophobicContact CD1-CD1 3.97Å; L124-L140 HydrophobicContact CD1-CD2 4.07Å; F129-L140 HydrophobicContact CE2-CD1 4.23Å; F129-L140 HydrophobicContact CZ-CD1 4.03Å; F129-L140 HydrophobicContact CZ-CD2 4.39Å; L138-L140 HydrophobicContact CD1-CD1 4.36Å; L138-L140 HydrophobicContact CD1-CG 4.11Å; L138-L140 HydrophobicContact CD2-CD1 4.01Å; L138-L140 HydrophobicContact CG-CD1 4.11Å; L138-L140 HydrophobicContact CG-CG 4.18Å; L140-N143 WeakPolarHBondContact O-CB 3.24Å; L140-N143 PolarHBondContact O-ND2 2.99Å; L140-N143 VanDerWaalsContact O-ND2 3.13Å; L140-L145 HydrophobicContact CB-CD1 4.22Å; L140-L145 HydrophobicContact CD1-CD1 4.39Å; L140-F153 HydrophobicContact CD1-CE1 4.44Å; L140-H163 PolarHBondContact N-O 2.83Å; L140-L164 HydrophobicContact CB-CD2 3.95Å; L140-L164 HydrophobicContact CD1-CD2 3.98Å; L140-N167 PolarHBondContact O-ND2 3.17Å
141	S	98.8	Very high	96.7	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.042	22%	0.223	C	C	.	.			trans	-66.8	157	-176.5	-54.5	0	0	0	0	112.9	S117 S118 D139 N143 H163 R165	S117-S141 CarbonylContact C-O 3.44Å; S117-S141 WeakPolarHBondContact CA-O 3.4Å; S117-S141 WeakPolarHBondContact CB-O 3.1Å; S118-S141 PolarHBondContact N-O 2.95Å; D139-S141 WeakPolarHBondContact OD1-CB 3.47Å; D139-S141 PolarHBondContact OD1-N 3.46Å; D139-S141 PolarHBondContact OD1-OG 3.41Å; S141-N143 VanDerWaalsContact C-N 3.3Å; S141-N143 PolarHBondContact O-N 3.22Å; S141-N143 PolarHBondContact O-ND2 3.41Å; S141-H163 WeakPolarHBondContact OG-CB 3.04Å; S141-R165 CarbonylContact C-O 3.26Å; S141-R165 WeakPolarHBondContact CA-O 3.36Å
142	Y	98.7	Very high	96.7	Very high	106 Å²	106	43.8 Å²	43.8	42%	0.416	22%	0.221	S	C	.	.	S	Bend	trans	54	48.8	178.3	-56.5	-85.5	0	0	0	111.9	S118 N119 R165 S166	S118-Y142 VanDerWaalsContact CA-O 3.31Å; S118-Y142 WeakPolarHBondContact CA-O 3.43Å; S118-Y142 PolarHBondContact N-O 3.48Å; N119-Y142 PolarHBondContact N-O 3.36Å; N119-Y142 VanDerWaalsContact N-O 3.17Å; Y142-R165 PolarHBondContact N-O 3.16Å; Y142-S166 WeakPolarHBondContact CA-O 3.34Å; Y142-S166 VanDerWaalsContact CD1-CB 3.42Å; Y142-S166 WeakPolarHBondContact CE1-OG 3.14Å; Y142-S166 PolarHBondContact N-O 2.92Å
143	N	98.8	Very high	96.6	Very high	12 Å²	12	43.9 Å²	43.9	6%	0.064	22%	0.222	C	C	.	.	S	Bend	trans	-120.3	-167.6	173.7	-88.3	-77.6	0	0	0	109.5	L116 N119 R120 I121 L140 S141 L145 S166 N167	L116-N143 PolarHBondContact O-ND2 3.39Å; N119-N143 WeakPolarHBondContact CA-OD1 3.5Å; N119-N143 WeakPolarHBondContact CB-OD1 3.46Å; N119-N143 PolarHBondContact O-OD1 3.25Å; R120-N143 PolarHBondContact N-OD1 2.86Å; I121-N143 HydrophobicContact CB-CB 4.44Å; I121-N143 VanDerWaalsContact CB-OD1 3.3Å; I121-N143 WeakPolarHBondContact CB-OD1 3.05Å; I121-N143 WeakPolarHBondContact CG1-OD1 3.27Å; I121-N143 PolarHBondContact N-OD1 3.21Å; L140-N143 WeakPolarHBondContact O-CB 3.24Å; L140-N143 PolarHBondContact O-ND2 2.99Å; L140-N143 VanDerWaalsContact O-ND2 3.13Å; S141-N143 VanDerWaalsContact C-N 3.3Å; S141-N143 PolarHBondContact O-N 3.22Å; S141-N143 PolarHBondContact O-ND2 3.41Å; N143-L145 HydrophobicContact CB-CG 4.43Å; N143-S166 PolarHBondContact N-O 3.12Å; N143-N167 WeakPolarHBondContact CA-OD1 3.39Å; N143-N167 WeakPolarHBondContact CB-OD1 3.4Å; N143-N167 PolarHBondContact O-OD1 3.35Å
144	K	98.3	Very high	96.5	Very high	121 Å²	121	45.7 Å²	45.7	53%	0.526	23%	0.225	S	C	.	.			trans	-116.2	24	-177	-59.5	-175.3	179.4	-174.4	0	112.4	I121 A122 E146 N167	I121-K144 CarbonylContact O-C 3.57Å; I121-K144 VanDerWaalsContact O-C 3.25Å; I121-K144 WeakPolarHBondContact O-CA 3.22Å; I121-K144 PolarHBondContact O-N 2.83Å; A122-K144 WeakPolarHBondContact CA-O 3.48Å; A122-K144 HydrophobicContact CB-CB 4.38Å; K144-E146 PolarHBondContact O-N 3.28Å; K144-N167 PolarHBondContact N-OD1 3.5Å
145	L	98.1	Very high	96.3	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.224	C	C	.	.			trans	-66.2	114.5	-176.6	-61	173.2	0	0	0	110.5	I121 L124 L140 N143 L164 N167 G168 L169	I121-L145 HydrophobicContact CG2-CD2 3.88Å; I121-L145 PolarHBondContact O-N 3.15Å; L124-L145 HydrophobicContact CD1-CD1 4.42Å; L124-L145 HydrophobicContact CD1-CD2 4.23Å; L124-L145 HydrophobicContact CG-CD2 4.11Å; L140-L145 HydrophobicContact CB-CD1 4.22Å; L140-L145 HydrophobicContact CD1-CD1 4.39Å; N143-L145 HydrophobicContact CB-CG 4.43Å; L145-L164 HydrophobicContact CD1-CD2 4.13Å; L145-N167 HydrophobicContact CB-CB 4.27Å; L145-N167 VanDerWaalsContact CB-OD1 3.29Å; L145-N167 WeakPolarHBondContact CB-OD1 3.49Å; L145-N167 WeakPolarHBondContact CG-OD1 3.3Å; L145-N167 PolarHBondContact N-OD1 2.91Å; L145-G168 CarbonylContact O-C 3.58Å; L145-G168 VanDerWaalsContact O-C 3.31Å; L145-G168 VanDerWaalsContact O-CA 3.25Å; L145-G168 WeakPolarHBondContact O-CA 3.37Å; L145-G168 PolarHBondContact O-N 3.09Å; L145-L169 HydrophobicContact CB-CD2 4.07Å; L145-L169 WeakPolarHBondContact O-CD2 3.12Å; L145-L169 PolarHBondContact O-N 3.41Å; L145-L169 VanDerWaalsContact O-N 3.16Å
146	E	96.2	Very high	96.2	Very high	110 Å²	110	44.3 Å²	44.3	51%	0.514	22%	0.224	S	C	.	.			trans	-95.1	-26.1	176.7	-57.8	-161.2	146.1	0	0	113.1	K144 S170 R192	K144-E146 PolarHBondContact O-N 3.28Å; E146-S170 PolarHBondContact O-N 3.04Å; E146-R192 IonicContact OE1-NH1 3.85Å
147	I	94.6	Very high	96.1	Very high	107 Å²	107	44.9 Å²	44.9	55%	0.549	23%	0.226	S	C	.	.			trans	-140.4	133.9	-175.4	-58.2	176.6	0	0	0	109
148	L	95.2	Very high	96.1	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-91.2	142.3	163.7	-62.5	173.3	0	0	0	109.3	Q152 F153 L164 L169 P173	L148-Q152 HydrophobicContact CD2-CG 4.49Å; L148-F153 HydrophobicContact CD1-CE2 4.14Å; L148-F153 HydrophobicContact CD2-CE2 4.41Å; L148-F153 HydrophobicContact CD2-CZ 4.15Å; L148-L164 HydrophobicContact CD1-CD1 4.19Å; L148-L164 HydrophobicContact CD2-CD2 4.25Å; L148-L169 HydrophobicContact CD1-CD1 4.11Å; L148-L169 HydrophobicContact CD2-CD1 4.44Å; L148-L169 HydrophobicContact CD2-CD2 4.21Å; L148-L169 HydrophobicContact CG-CD1 4.15Å; L148-L169 HydrophobicContact CG-CD2 3.84Å; L148-P173 HydrophobicContact CB-CG 3.99Å; L148-P173 WeakPolarHBondContact O-CG 3.26Å
149	Q	93.2	Very high	96.1	Very high	75 Å²	75	49.1 Å²	49.1	35%	0.35	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-76.7	151	174.7	-62	-59.4	-29.2	0	0	112	L124 N126 G151 Q152	L124-Q149 WeakPolarHBondContact O-CG 3.39Å; N126-Q149 HydrophobicContact CB-CB 3.84Å; N126-Q149 HydrophobicContact CB-CG 4.47Å; Q149-G151 PolarHBondContact O-N 3.1Å; Q149-Q152 VanDerWaalsContact O-CB 3.32Å; Q149-Q152 WeakPolarHBondContact O-CB 3.39Å; Q149-Q152 PolarHBondContact O-N 2.78Å
150	P	90.6	Very high	96.1	Very high	87 Å²	87	50.7 Å²	50.7	57%	0.565	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	123.4	166.9	-23.5	34.4	0	0	0	110.3
151	G	88.9	Confident	96.1	Very high	28 Å²	28	53.6 Å²	53.6	29%	0.289	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	17.6	-176.8	0	0	0	0	0	115.5	Q149 F153 H154	Q149-G151 PolarHBondContact O-N 3.1Å; G151-F153 PolarHBondContact O-N 3.13Å; G151-H154 WeakPolarHBondContact O-CB 3.34Å; G151-H154 PolarHBondContact O-N 3.38Å
152	Q	94.1	Very high	96.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-30.3	178.7	-170.7	61.6	73	0	0	114.7	L124 H125 L148 Q149	L124-Q152 PolarHBondContact O-OE1 3.22Å; H125-Q152 PolarHBondContact O-NE2 3.09Å; L148-Q152 HydrophobicContact CD2-CG 4.49Å; Q149-Q152 VanDerWaalsContact O-CB 3.32Å; Q149-Q152 WeakPolarHBondContact O-CB 3.39Å; Q149-Q152 PolarHBondContact O-N 2.78Å
153	F	96.1	Very high	96.1	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	24	179.6	-50.3	-62	0	0	0	112.7	F129 L138 L140 L148 G151 L156 L162 L164 F177	F129-F153 HydrophobicContact CD2-CD1 4.33Å; F129-F153 HydrophobicContact CD2-CE1 4.48Å; F129-F153 HydrophobicContact CE2-CE1 4.26Å; L138-F153 HydrophobicContact CD2-CD1 4.19Å; L138-F153 HydrophobicContact CD2-CE1 3.93Å; L140-F153 HydrophobicContact CD1-CE1 4.44Å; L148-F153 HydrophobicContact CD1-CE2 4.14Å; L148-F153 HydrophobicContact CD2-CE2 4.41Å; L148-F153 HydrophobicContact CD2-CZ 4.15Å; G151-F153 PolarHBondContact O-N 3.13Å; F153-L156 HydrophobicContact CB-CD1 4.1Å; F153-L156 HydrophobicContact CD1-CD1 4.04Å; F153-L156 WeakPolarHBondContact O-CB 3.29Å; F153-L156 PolarHBondContact O-N 2.93Å; F153-L162 HydrophobicContact CD1-CD2 4.43Å; F153-L162 HydrophobicContact CD2-CD2 4.09Å; F153-L162 HydrophobicContact CE1-CD1 4Å; F153-L162 HydrophobicContact CE1-CD2 4.19Å; F153-L162 HydrophobicContact CE2-CD2 3.83Å; F153-L162 HydrophobicContact CG-CD2 4.39Å; F153-L162 HydrophobicContact CZ-CD1 4.16Å; F153-L162 HydrophobicContact CZ-CD2 3.89Å; F153-L164 HydrophobicContact CE2-CD1 4.29Å; F153-L164 HydrophobicContact CZ-CD1 4.07Å; F153-L164 HydrophobicContact CZ-CD2 4.35Å; F153-F177 AromaticContact CD2-CD1 3.87Å; F153-F177 HydrophobicContact CD2-CD1 3.87Å; F153-F177 AromaticContact CD2-CE1 3.88Å; F153-F177 HydrophobicContact CD2-CE1 3.88Å; F153-F177 HydrophobicContact CE2-CD1 4.21Å; F153-F177 AromaticContact CE2-CE1 3.72Å; F153-F177 HydrophobicContact CE2-CE1 3.72Å
154	H	94.3	Very high	96.1	Very high	89 Å²	89	49.9 Å²	49.9	41%	0.412	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	139.7	178.3	-176.8	75	0	0	0	111.3	G151 L156 E179	G151-H154 WeakPolarHBondContact O-CB 3.34Å; G151-H154 PolarHBondContact O-N 3.38Å; H154-L156 PolarHBondContact O-N 3.45Å; H154-E179 IonicContact CE1-OE1 3.57Å; H154-E179 PolarHBondContact CE1-OE1 2.59Å; H154-E179 IonicContact ND1-OE1 3.99Å
155	G	93.2	Very high	96.1	Very high	24 Å²	24	45.6 Å²	45.6	25%	0.247	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-10.4	-177.3	0	0	0	0	0	116	R157 E179	G155-R157 PolarHBondContact O-N 2.95Å; G155-E179 PolarHBondContact N-OE2 3.33Å
156	L	97	Very high	96.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.			trans	-77	51.1	179.8	-58.4	-171.9	0	0	0	113	F129 V132 L135 L138 F153 H154 K158 L159	F129-L156 HydrophobicContact CB-CD1 3.98Å; F129-L156 HydrophobicContact CB-CD2 4.15Å; F129-L156 HydrophobicContact CB-CG 4.4Å; F129-L156 HydrophobicContact CG-CD1 4.44Å; V132-L156 HydrophobicContact CG2-CD2 4.48Å; L135-L156 HydrophobicContact CB-CD2 4.29Å; L138-L156 HydrophobicContact CD2-CD1 4.45Å; F153-L156 HydrophobicContact CB-CD1 4.1Å; F153-L156 HydrophobicContact CD1-CD1 4.04Å; F153-L156 WeakPolarHBondContact O-CB 3.29Å; F153-L156 PolarHBondContact O-N 2.93Å; H154-L156 PolarHBondContact O-N 3.45Å; L156-K158 PolarHBondContact O-N 3.37Å; L156-K158 VanDerWaalsContact O-N 3.16Å; L156-L159 HydrophobicContact CB-CB 4.15Å; L156-L159 HydrophobicContact CB-CD2 4.42Å; L156-L159 HydrophobicContact CD1-CD2 4.19Å; L156-L159 VanDerWaalsContact O-CB 3.28Å; L156-L159 WeakPolarHBondContact O-CB 3.33Å; L156-L159 PolarHBondContact O-N 3.13Å; L156-L159 VanDerWaalsContact O-N 3.14Å
157	R	97	Very high	96.2	Very high	129 Å²	129	42.1 Å²	42.1	49%	0.487	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.2	-173	-63.8	177.6	-176.5	178.6	0.9	114.4	G155 E179 S182	G155-R157 PolarHBondContact O-N 2.95Å; R157-E179 WeakPolarHBondContact CA-O 3.25Å; R157-E179 IonicContact CZ-OE1 2.7Å; R157-E179 IonicContact CZ-OE2 3.93Å; R157-E179 VanDerWaalsContact CZ-OE2 3.25Å; R157-E179 IonicContact NE-OE2 3.33Å; R157-E179 PolarHBondContact NE-OE2 3.25Å; R157-E179 IonicContact NH2-OE1 3.1Å; R157-E179 PolarHBondContact NH2-OE1 2.81Å; R157-E179 IonicContact NH2-OE2 3.69Å; R157-E179 PolarHBondContact NH2-OE2 3.38Å; R157-S182 VanDerWaalsContact O-CB 3.26Å; R157-S182 WeakPolarHBondContact O-CB 3.12Å; R157-S182 PolarHBondContact O-OG 2.79Å
158	K	98.2	Very high	96.4	Very high	103 Å²	103	37.4 Å²	37.4	45%	0.448	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	1.9	179.2	-63.4	-176.1	-174.9	173.4	0	113.5	N134 L135 L156 Q160	N134-K158 PolarHBondContact OD1-NZ 3.06Å; L135-K158 CarbonylContact O-C 3.13Å; L156-K158 PolarHBondContact O-N 3.37Å; L156-K158 VanDerWaalsContact O-N 3.16Å; K158-Q160 PolarHBondContact O-N 3.37Å
159	L	98.6	Very high	96.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.			trans	-65.3	128.1	178.8	-162.5	69.3	0	0	0	109.2	L135 L138 L156 L162 S182 L183	L135-L159 HydrophobicContact CB-CD1 4.39Å; L135-L159 HydrophobicContact CD2-CD1 4.18Å; L135-L159 HydrophobicContact CG-CD1 4.2Å; L135-L159 WeakPolarHBondContact O-CA 3.46Å; L135-L159 PolarHBondContact O-N 3.07Å; L135-L159 VanDerWaalsContact O-N 3.09Å; L138-L159 HydrophobicContact CB-CD1 3.88Å; L156-L159 HydrophobicContact CB-CB 4.15Å; L156-L159 HydrophobicContact CB-CD2 4.42Å; L156-L159 HydrophobicContact CD1-CD2 4.19Å; L156-L159 VanDerWaalsContact O-CB 3.28Å; L156-L159 WeakPolarHBondContact O-CB 3.33Å; L156-L159 PolarHBondContact O-N 3.13Å; L156-L159 VanDerWaalsContact O-N 3.14Å; L159-L162 HydrophobicContact CD2-CB 4.05Å; L159-L162 HydrophobicContact CD2-CD1 4.4Å; L159-L162 HydrophobicContact CD2-CD2 4.28Å; L159-L162 HydrophobicContact CD2-CG 4.48Å; L159-S182 CarbonylContact O-C 3.52Å; L159-S182 WeakPolarHBondContact O-CB 3.45Å; L159-L183 HydrophobicContact CB-CD1 4.28Å; L159-L183 HydrophobicContact CD2-CD1 4.01Å; L159-L183 HydrophobicContact CG-CD1 3.87Å; L159-L183 WeakPolarHBondContact O-CA 3.37Å; L159-L183 PolarHBondContact O-N 3.49Å
160	Q	98.7	Very high	96.6	Very high	60 Å²	60	36 Å²	36	28%	0.28	19%	0.193	S	C	.	.			trans	-110.6	-41.6	-179.8	-62.1	-176.2	-96.7	0	0	110.7	R136 K158 L183 E184 F185	R136-Q160 WeakPolarHBondContact O-CA 3.34Å; R136-Q160 PolarHBondContact O-N 3.35Å; K158-Q160 PolarHBondContact O-N 3.37Å; Q160-L183 WeakPolarHBondContact O-CD1 3.22Å; Q160-E184 PolarHBondContact NE2-OE2 2.98Å; Q160-E184 PolarHBondContact O-N 3.23Å; Q160-F185 PolarHBondContact O-N 3.4Å
161	N	98.8	Very high	96.8	Very high	61 Å²	61	36.6 Å²	36.6	33%	0.326	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.9	179.7	-54	-22.2	0	0	0	109.9	R136 S137 L138	R136-N161 PolarHBondContact O-N 3.46Å; S137-N161 WeakPolarHBondContact CA-O 3.12Å; L138-N161 PolarHBondContact N-O 3.46Å
162	L	98.8	Very high	97	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	116.9	172.5	177.2	56.7	0	0	0	109.7	L138 F153 L159 L164 F177 L183 F185 L186 D187	L138-L162 HydrophobicContact CB-CD1 4.07Å; L138-L162 HydrophobicContact CD2-CD1 3.99Å; L138-L162 HydrophobicContact CG-CD1 4.04Å; L138-L162 WeakPolarHBondContact O-CA 3.4Å; F153-L162 HydrophobicContact CD1-CD2 4.43Å; F153-L162 HydrophobicContact CD2-CD2 4.09Å; F153-L162 HydrophobicContact CE1-CD1 4Å; F153-L162 HydrophobicContact CE1-CD2 4.19Å; F153-L162 HydrophobicContact CE2-CD2 3.83Å; F153-L162 HydrophobicContact CG-CD2 4.39Å; F153-L162 HydrophobicContact CZ-CD1 4.16Å; F153-L162 HydrophobicContact CZ-CD2 3.89Å; L159-L162 HydrophobicContact CD2-CB 4.05Å; L159-L162 HydrophobicContact CD2-CD1 4.4Å; L159-L162 HydrophobicContact CD2-CD2 4.28Å; L159-L162 HydrophobicContact CD2-CG 4.48Å; L162-L164 HydrophobicContact CD1-CD1 4.4Å; L162-L164 HydrophobicContact CD1-CG 4.21Å; L162-L164 HydrophobicContact CD2-CD1 4.08Å; L162-L164 HydrophobicContact CG-CD1 4.11Å; L162-L164 HydrophobicContact CG-CG 4.26Å; L162-F177 HydrophobicContact CD2-CD1 4.13Å; L162-F177 HydrophobicContact CD2-CE1 3.74Å; L162-L183 HydrophobicContact CB-CD1 3.78Å; L162-L183 HydrophobicContact CB-CD2 4.39Å; L162-F185 PolarHBondContact N-O 3.25Å; L162-F185 VanDerWaalsContact N-O 3.08Å; L162-L186 HydrophobicContact CB-CD1 4.1Å; L162-L186 HydrophobicContact CD2-CD1 3.96Å; L162-L186 HydrophobicContact CG-CD1 4.01Å; L162-L186 WeakPolarHBondContact O-CA 3.28Å; L162-D187 PolarHBondContact O-N 2.79Å
163	H	98.9	Very high	96.9	Very high	46 Å²	46	37.3 Å²	37.3	21%	0.213	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.4	177.9	-51.5	-104.5	0	0	0	110	L138 D139 L140 S141 F185	L138-H163 PolarHBondContact O-N 3.5Å; D139-H163 HydrophobicContact CB-CB 4.28Å; D139-H163 WeakPolarHBondContact OD1-CB 3.27Å; L140-H163 PolarHBondContact N-O 2.83Å; S141-H163 WeakPolarHBondContact OG-CB 3.04Å; H163-F185 AromaticContact CE1-CD1 3.76Å; H163-F185 AromaticContact CE1-CE1 3.29Å; H163-F185 WeakPolarHBondContact CE1-CE1 3.41Å; H163-F185 AromaticContact ND1-CE1 3.4Å; H163-F185 WeakPolarHBondContact ND1-CE1 3.25Å
164	L	98.7	Very high	96.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.			trans	-126.3	18	177.1	-70.4	163.4	0	0	0	111	L140 L145 L148 F153 L162 N167 L169 D187 L188 N191	L140-L164 HydrophobicContact CB-CD2 3.95Å; L140-L164 HydrophobicContact CD1-CD2 3.98Å; L145-L164 HydrophobicContact CD1-CD2 4.13Å; L148-L164 HydrophobicContact CD1-CD1 4.19Å; L148-L164 HydrophobicContact CD2-CD2 4.25Å; F153-L164 HydrophobicContact CE2-CD1 4.29Å; F153-L164 HydrophobicContact CZ-CD1 4.07Å; F153-L164 HydrophobicContact CZ-CD2 4.35Å; L162-L164 HydrophobicContact CD1-CD1 4.4Å; L162-L164 HydrophobicContact CD1-CG 4.21Å; L162-L164 HydrophobicContact CD2-CD1 4.08Å; L162-L164 HydrophobicContact CG-CD1 4.11Å; L162-L164 HydrophobicContact CG-CG 4.26Å; L164-N167 PolarHBondContact O-ND2 3.36Å; L164-L169 HydrophobicContact CB-CD1 4.32Å; L164-L169 HydrophobicContact CD1-CD1 4.49Å; L164-D187 CarbonylContact C-O 3.53Å; L164-D187 WeakPolarHBondContact CA-O 3.36Å; L164-D187 WeakPolarHBondContact CB-O 3.43Å; L164-D187 PolarHBondContact N-O 2.97Å; L164-L188 HydrophobicContact CB-CD2 4.05Å; L164-L188 HydrophobicContact CD1-CD2 3.81Å; L164-N191 PolarHBondContact O-ND2 3.35Å
165	R	98.6	Very high	96.3	Very high	31 Å²	31	45.9 Å²	45.9	12%	0.117	23%	0.227	C	C	.	.			trans	-55.5	147.5	-178	-165.8	-173.6	-169.8	70.9	1.1	112.1	S141 Y142 N167 D187 G189 Y190 E213	S141-R165 CarbonylContact C-O 3.26Å; S141-R165 WeakPolarHBondContact CA-O 3.36Å; Y142-R165 PolarHBondContact N-O 3.16Å; R165-N167 PolarHBondContact O-N 3.1Å; R165-N167 PolarHBondContact O-ND2 3.04Å; R165-D187 WeakPolarHBondContact CB-OD2 3.4Å; R165-D187 WeakPolarHBondContact CD-OD2 3.21Å; R165-D187 IonicContact CZ-OD2 3.89Å; R165-D187 IonicContact NH1-OD1 3.41Å; R165-D187 PolarHBondContact NH1-OD1 3.25Å; R165-D187 IonicContact NH1-OD2 2.96Å; R165-D187 PolarHBondContact NH1-OD2 3.4Å; R165-G189 CarbonylContact C-O 3.25Å; R165-G189 VanDerWaalsContact CA-O 3.3Å; R165-G189 WeakPolarHBondContact CA-O 3.47Å; R165-Y190 HydrophobicContact CG-CD2 4.47Å; R165-E213 IonicContact CZ-OE1 3.3Å; R165-E213 VanDerWaalsContact CZ-OE1 3.3Å; R165-E213 IonicContact NH1-OE1 2.71Å; R165-E213 PolarHBondContact NH1-OE1 2.84Å; R165-E213 IonicContact NH2-OE1 2.99Å; R165-E213 PolarHBondContact NH2-OE1 3.15Å
166	S	98.6	Very high	96.2	Very high	26 Å²	26	44.9 Å²	44.9	18%	0.182	22%	0.216	C	C	.	.	S	Bend	trans	55.4	54.5	170.9	-59	0	0	0	0	112.2	Y142 N143 G189 Y190	Y142-S166 WeakPolarHBondContact CA-O 3.34Å; Y142-S166 VanDerWaalsContact CD1-CB 3.42Å; Y142-S166 WeakPolarHBondContact CE1-OG 3.14Å; Y142-S166 PolarHBondContact N-O 2.92Å; N143-S166 PolarHBondContact N-O 3.12Å; S166-G189 PolarHBondContact N-O 2.61Å; S166-Y190 VanDerWaalsContact CA-O 3.25Å; S166-Y190 WeakPolarHBondContact CA-O 3.5Å; S166-Y190 PolarHBondContact N-O 2.9Å
167	N	98.7	Very high	96.1	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.064	22%	0.216	C	C	.	.	S	Bend	trans	-123.2	-178.2	174	-86.7	-79.1	0	0	0	109.6	L140 N143 K144 L145 L164 R165 L169 Y190 N191	L140-N167 PolarHBondContact O-ND2 3.17Å; N143-N167 WeakPolarHBondContact CA-OD1 3.39Å; N143-N167 WeakPolarHBondContact CB-OD1 3.4Å; N143-N167 PolarHBondContact O-OD1 3.35Å; K144-N167 PolarHBondContact N-OD1 3.5Å; L145-N167 HydrophobicContact CB-CB 4.27Å; L145-N167 VanDerWaalsContact CB-OD1 3.29Å; L145-N167 WeakPolarHBondContact CB-OD1 3.49Å; L145-N167 WeakPolarHBondContact CG-OD1 3.3Å; L145-N167 PolarHBondContact N-OD1 2.91Å; L164-N167 PolarHBondContact O-ND2 3.36Å; R165-N167 PolarHBondContact O-N 3.1Å; R165-N167 PolarHBondContact O-ND2 3.04Å; N167-L169 HydrophobicContact CB-CG 4.23Å; N167-Y190 PolarHBondContact N-O 2.86Å; N167-N191 WeakPolarHBondContact CA-OD1 3.43Å; N167-N191 WeakPolarHBondContact CB-OD1 3.39Å; N167-N191 PolarHBondContact O-OD1 3.25Å
168	G	97.9	Very high	96	Very high	8 Å²	8	42.5 Å²	42.5	8%	0.082	21%	0.212	C	C	.	.			trans	-91.2	8.3	179.2	0	0	0	0	0	114.9	L145 S170	L145-G168 CarbonylContact O-C 3.58Å; L145-G168 VanDerWaalsContact O-C 3.31Å; L145-G168 VanDerWaalsContact O-CA 3.25Å; L145-G168 WeakPolarHBondContact O-CA 3.37Å; L145-G168 PolarHBondContact O-N 3.09Å; G168-S170 PolarHBondContact O-N 2.89Å; G168-S170 VanDerWaalsContact O-N 3.13Å
169	L	97.9	Very high	95.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.			trans	-60.8	116.5	-163.3	-60.8	176.5	0	0	0	111.9	L145 L148 L164 N167 L188 N191 R192 I193	L145-L169 HydrophobicContact CB-CD2 4.07Å; L145-L169 WeakPolarHBondContact O-CD2 3.12Å; L145-L169 PolarHBondContact O-N 3.41Å; L145-L169 VanDerWaalsContact O-N 3.16Å; L148-L169 HydrophobicContact CD1-CD1 4.11Å; L148-L169 HydrophobicContact CD2-CD1 4.44Å; L148-L169 HydrophobicContact CD2-CD2 4.21Å; L148-L169 HydrophobicContact CG-CD1 4.15Å; L148-L169 HydrophobicContact CG-CD2 3.84Å; L164-L169 HydrophobicContact CB-CD1 4.32Å; L164-L169 HydrophobicContact CD1-CD1 4.49Å; N167-L169 HydrophobicContact CB-CG 4.23Å; L169-L188 HydrophobicContact CD1-CD2 4.23Å; L169-N191 HydrophobicContact CB-CB 4.24Å; L169-N191 WeakPolarHBondContact CB-OD1 3.24Å; L169-N191 WeakPolarHBondContact CG-OD1 3.15Å; L169-N191 PolarHBondContact N-OD1 3.17Å; L169-R192 CarbonylContact O-C 3.31Å; L169-R192 VanDerWaalsContact O-CA 3.32Å; L169-R192 WeakPolarHBondContact O-CA 3.25Å; L169-R192 PolarHBondContact O-N 2.98Å; L169-I193 WeakPolarHBondContact O-CG1 3.35Å; L169-I193 PolarHBondContact O-N 2.97Å
170	S	95.7	Very high	95.6	Very high	47 Å²	47	39.1 Å²	39.1	33%	0.329	20%	0.198	S	C	.	.			trans	-89.4	-29	-179.7	61.3	0	0	0	0	113.5	E146 G168 I193	E146-S170 PolarHBondContact O-N 3.04Å; G168-S170 PolarHBondContact O-N 2.89Å; G168-S170 VanDerWaalsContact O-N 3.13Å; S170-I193 WeakPolarHBondContact O-CA 3.08Å
171	N	93.3	Very high	95.5	Very high	100 Å²	100	43 Å²	43	54%	0.535	21%	0.21	S	C	.	.			trans	-149.9	155.6	-177.8	-65.9	-73.3	0	0	0	109.8
172	I	94.3	Very high	95.4	Very high	19 Å²	19	41.9 Å²	41.9	10%	0.097	21%	0.208	C	C	.	.			trans	-107.4	126.1	172.1	-58.9	171.5	0	0	0	108.6	A176 F177 L188 I193 L196 T200	I172-A176 HydrophobicContact CG2-CB 3.85Å; I172-F177 HydrophobicContact CD1-CE2 4.39Å; I172-F177 HydrophobicContact CG2-CE2 3.79Å; I172-F177 HydrophobicContact CG2-CZ 4.18Å; I172-L188 HydrophobicContact CD1-CD1 3.63Å; I172-L188 HydrophobicContact CD1-CD2 4.19Å; I172-I193 HydrophobicContact CD1-CD1 3.96Å; I172-I193 HydrophobicContact CG1-CD1 4.16Å; I172-L196 HydrophobicContact CD1-CD2 4.42Å; I172-T200 HydrophobicContact CB-CG2 3.87Å; I172-T200 HydrophobicContact CD1-CG2 3.75Å; I172-T200 HydrophobicContact CG1-CG2 4.4Å; I172-T200 HydrophobicContact CG2-CG2 3.88Å
173	P	92.8	Very high	95.4	Very high	27 Å²	27	41.9 Å²	41.9	18%	0.175	21%	0.208	C	C	.	.			trans	-58.5	150	178	-22.7	30.8	0	0	0	113.4	L148 R175 A176	L148-P173 HydrophobicContact CB-CG 3.99Å; L148-P173 WeakPolarHBondContact O-CG 3.26Å; P173-R175 PolarHBondContact O-N 3.2Å; P173-A176 HydrophobicContact CB-CB 4.31Å; P173-A176 WeakPolarHBondContact O-CB 3.25Å; P173-A176 PolarHBondContact O-N 3.1Å
174	I	88.9	Confident	95.4	Very high	116 Å²	116	41.6 Å²	41.6	60%	0.595	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	131.1	170.6	-63.7	171.8	0	0	0	108.9	A176	I174-A176 PolarHBondContact O-N 2.93Å
175	R	87.7	Confident	95.4	Very high	155 Å²	155	43.5 Å²	43.5	59%	0.585	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	18.7	178.1	-63.4	164.9	179.1	-175.9	1.6	115.2	P173 F177 L178	P173-R175 PolarHBondContact O-N 3.2Å; R175-F177 PolarHBondContact O-N 2.86Å; R175-L178 HydrophobicContact CB-CB 3.95Å; R175-L178 HydrophobicContact CB-CD2 4.12Å; R175-L178 HydrophobicContact CG-CD2 4.07Å; R175-L178 WeakPolarHBondContact O-CB 3.41Å; R175-L178 PolarHBondContact O-N 2.84Å
176	A	92.2	Very high	95.4	Very high	3 Å²	3	42 Å²	42	3%	0.025	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-36.6	179.1	0	0	0	0	0	113.8	I172 P173 I174	I172-A176 HydrophobicContact CG2-CB 3.85Å; P173-A176 HydrophobicContact CB-CB 4.31Å; P173-A176 WeakPolarHBondContact O-CB 3.25Å; P173-A176 PolarHBondContact O-N 3.1Å; I174-A176 PolarHBondContact O-N 2.93Å
177	F	94.6	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	12.5	-177.8	-48.6	-62.5	0	0	0	114.9	F153 L162 I172 R175 E179 C180 L186 L188 T200 F201 L202 L204	F153-F177 AromaticContact CD2-CD1 3.87Å; F153-F177 HydrophobicContact CD2-CD1 3.87Å; F153-F177 AromaticContact CD2-CE1 3.88Å; F153-F177 HydrophobicContact CD2-CE1 3.88Å; F153-F177 HydrophobicContact CE2-CD1 4.21Å; F153-F177 AromaticContact CE2-CE1 3.72Å; F153-F177 HydrophobicContact CE2-CE1 3.72Å; L162-F177 HydrophobicContact CD2-CD1 4.13Å; L162-F177 HydrophobicContact CD2-CE1 3.74Å; I172-F177 HydrophobicContact CD1-CE2 4.39Å; I172-F177 HydrophobicContact CG2-CE2 3.79Å; I172-F177 HydrophobicContact CG2-CZ 4.18Å; R175-F177 PolarHBondContact O-N 2.86Å; F177-E179 PolarHBondContact O-N 3.39Å; F177-E179 VanDerWaalsContact O-N 3.09Å; F177-C180 HydrophobicContact CB-CB 4.36Å; F177-C180 WeakPolarHBondContact O-CB 3.26Å; F177-C180 PolarHBondContact O-N 3.03Å; F177-L186 HydrophobicContact CD2-CD2 4.37Å; F177-L186 HydrophobicContact CE1-CD1 4.28Å; F177-L186 HydrophobicContact CE2-CD2 3.98Å; F177-L186 HydrophobicContact CZ-CD1 4.25Å; F177-L186 HydrophobicContact CZ-CD2 4.06Å; F177-L188 HydrophobicContact CZ-CD1 4.4Å; F177-T200 WeakPolarHBondContact CD2-O 3.48Å; F177-F201 HydrophobicContact CD2-CD1 4.46Å; F177-F201 HydrophobicContact CE2-CD1 4.48Å; F177-L202 CarbonylContact C-O 3.07Å; F177-L204 HydrophobicContact CB-CD1 4.13Å; F177-L204 HydrophobicContact CB-CD2 3.68Å; F177-L204 HydrophobicContact CB-CG 3.91Å; F177-L204 HydrophobicContact CD2-CD1 4.04Å; F177-L204 HydrophobicContact CG-CD1 4.24Å; F177-L204 HydrophobicContact CG-CD2 4.4Å
178	L	93.3	Very high	95.4	Very high	78 Å²	78	40.7 Å²	40.7	41%	0.408	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.1	-169.5	-177.6	65.6	0	0	0	114.6	R175 L202	R175-L178 HydrophobicContact CB-CB 3.95Å; R175-L178 HydrophobicContact CB-CD2 4.12Å; R175-L178 HydrophobicContact CG-CD2 4.07Å; R175-L178 WeakPolarHBondContact O-CB 3.41Å; R175-L178 PolarHBondContact O-N 2.84Å; L178-L202 WeakPolarHBondContact CA-O 3.3Å; L178-L202 HydrophobicContact CD1-CB 4.15Å; L178-L202 PolarHBondContact N-O 2.89Å
179	E	94.2	Very high	95.4	Very high	33 Å²	33	40.3 Å²	40.3	15%	0.154	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-9.9	179	-68.1	-118.4	162.1	0	0	113.7	H154 G155 R157 F177 R181	H154-E179 IonicContact CE1-OE1 3.57Å; H154-E179 PolarHBondContact CE1-OE1 2.59Å; H154-E179 IonicContact ND1-OE1 3.99Å; G155-E179 PolarHBondContact N-OE2 3.33Å; R157-E179 WeakPolarHBondContact CA-O 3.25Å; R157-E179 IonicContact CZ-OE1 2.7Å; R157-E179 IonicContact CZ-OE2 3.93Å; R157-E179 VanDerWaalsContact CZ-OE2 3.25Å; R157-E179 IonicContact NE-OE2 3.33Å; R157-E179 PolarHBondContact NE-OE2 3.25Å; R157-E179 IonicContact NH2-OE1 3.1Å; R157-E179 PolarHBondContact NH2-OE1 2.81Å; R157-E179 IonicContact NH2-OE2 3.69Å; R157-E179 PolarHBondContact NH2-OE2 3.38Å; F177-E179 PolarHBondContact O-N 3.39Å; F177-E179 VanDerWaalsContact O-N 3.09Å; E179-R181 PolarHBondContact O-N 2.98Å
180	C	95.9	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.			trans	-78.6	52.3	-176.2	-62.6	0	0	0	0	112.3	F177 S182 L183 L204	F177-C180 HydrophobicContact CB-CB 4.36Å; F177-C180 WeakPolarHBondContact O-CB 3.26Å; F177-C180 PolarHBondContact O-N 3.03Å; C180-S182 VanDerWaalsContact C-N 3.25Å; C180-S182 PolarHBondContact O-N 3.38Å; C180-L183 HydrophobicContact CB-CB 4.18Å; C180-L183 VanDerWaalsContact O-CB 3.31Å; C180-L183 WeakPolarHBondContact O-CB 3.29Å; C180-L183 PolarHBondContact O-N 3.28Å; C180-L183 VanDerWaalsContact O-N 3.14Å; C180-L204 HydrophobicContact CB-CD2 4.02Å
181	R	95.1	Very high	95.6	Very high	140 Å²	140	43.2 Å²	43.2	53%	0.528	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.9	-171.1	-59.4	-177.7	-171.1	-178.9	2.9	114.3	E179 R206	E179-R181 PolarHBondContact O-N 2.98Å; R181-R206 WeakPolarHBondContact O-CD 3.27Å
182	S	97.6	Very high	95.8	Very high	39 Å²	39	44.6 Å²	44.6	27%	0.273	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.3	176.4	-71	0	0	0	0	114.3	R157 L159 C180 E184	R157-S182 VanDerWaalsContact O-CB 3.26Å; R157-S182 WeakPolarHBondContact O-CB 3.12Å; R157-S182 PolarHBondContact O-OG 2.79Å; L159-S182 CarbonylContact O-C 3.52Å; L159-S182 WeakPolarHBondContact O-CB 3.45Å; C180-S182 VanDerWaalsContact C-N 3.25Å; C180-S182 PolarHBondContact O-N 3.38Å; S182-E184 PolarHBondContact O-N 3.03Å
183	L	98.4	Very high	96	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	19%	0.194	C	C	.	.			trans	-70.2	126.2	-172.6	-160.1	77.1	0	0	0	110.4	L159 Q160 L162 C180 L186 L204 R206 L207	L159-L183 HydrophobicContact CB-CD1 4.28Å; L159-L183 HydrophobicContact CD2-CD1 4.01Å; L159-L183 HydrophobicContact CG-CD1 3.87Å; L159-L183 WeakPolarHBondContact O-CA 3.37Å; L159-L183 PolarHBondContact O-N 3.49Å; Q160-L183 WeakPolarHBondContact O-CD1 3.22Å; L162-L183 HydrophobicContact CB-CD1 3.78Å; L162-L183 HydrophobicContact CB-CD2 4.39Å; C180-L183 HydrophobicContact CB-CB 4.18Å; C180-L183 VanDerWaalsContact O-CB 3.31Å; C180-L183 WeakPolarHBondContact O-CB 3.29Å; C180-L183 PolarHBondContact O-N 3.28Å; C180-L183 VanDerWaalsContact O-N 3.14Å; L183-L186 HydrophobicContact CD2-CB 3.96Å; L183-L186 HydrophobicContact CD2-CD1 4.32Å; L183-L186 HydrophobicContact CD2-CD2 4.34Å; L183-L186 HydrophobicContact CD2-CG 4.44Å; L183-L204 HydrophobicContact CB-CD2 3.88Å; L183-L204 HydrophobicContact CD2-CD1 4.47Å; L183-L204 HydrophobicContact CD2-CD2 3.6Å; L183-L204 HydrophobicContact CG-CD2 4.38Å; L183-R206 CarbonylContact O-C 3.57Å; L183-L207 HydrophobicContact CD2-CD1 4.19Å; L183-L207 HydrophobicContact CG-CD1 4.3Å; L183-L207 VanDerWaalsContact O-CA 3.23Å; L183-L207 WeakPolarHBondContact O-CA 3.24Å; L183-L207 PolarHBondContact O-N 3.27Å
184	E	98.6	Very high	96.1	Very high	40 Å²	40	48.7 Å²	48.7	19%	0.187	21%	0.213	C	C	.	.			trans	-114	-29.9	-175.5	-74.3	165.7	173.9	0	0	110.5	Q160 S182 R206 M208 E209	Q160-E184 PolarHBondContact NE2-OE2 2.98Å; Q160-E184 PolarHBondContact O-N 3.23Å; S182-E184 PolarHBondContact O-N 3.03Å; E184-R206 HydrophobicContact CG-CB 4.2Å; E184-R206 IonicContact OE1-CZ 3.47Å; E184-R206 IonicContact OE1-NE 3.23Å; E184-R206 PolarHBondContact OE1-NE 3.06Å; E184-R206 IonicContact OE1-NH2 2.8Å; E184-R206 PolarHBondContact OE1-NH2 2.96Å; E184-M208 HydrophobicContact CG-CE 4.08Å; E184-M208 PolarHBondContact O-N 3.06Å; E184-E209 PolarHBondContact O-N 3.36Å
185	F	98.9	Very high	96.4	Very high	40 Å²	40	46.1 Å²	46.1	18%	0.175	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.8	176.4	-179.5	-83.1	0	0	0	111.8	Q160 L162 H163 D187 E209 H211	Q160-F185 PolarHBondContact O-N 3.4Å; L162-F185 PolarHBondContact N-O 3.25Å; L162-F185 VanDerWaalsContact N-O 3.08Å; H163-F185 AromaticContact CE1-CD1 3.76Å; H163-F185 AromaticContact CE1-CE1 3.29Å; H163-F185 WeakPolarHBondContact CE1-CE1 3.41Å; H163-F185 AromaticContact ND1-CE1 3.4Å; H163-F185 WeakPolarHBondContact ND1-CE1 3.25Å; F185-D187 HydrophobicContact CE1-CB 3.57Å; F185-D187 HydrophobicContact CZ-CB 3.91Å; F185-E209 HydrophobicContact CD2-CB 3.99Å; F185-E209 HydrophobicContact CD2-CG 3.97Å; F185-E209 HydrophobicContact CE2-CG 4.02Å; F185-H211 AromaticContact CE2-CD2 3.57Å; F185-H211 AromaticContact CE2-NE2 3.53Å; F185-H211 AromaticContact CZ-CD2 3.61Å; F185-H211 AromaticContact CZ-NE2 3.87Å
186	L	98.8	Very high	96.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	118.3	174.8	178.1	55.8	0	0	0	110.9	L162 F177 L183 L188 F201 L204 L207 E209 L210 H211	L162-L186 HydrophobicContact CB-CD1 4.1Å; L162-L186 HydrophobicContact CD2-CD1 3.96Å; L162-L186 HydrophobicContact CG-CD1 4.01Å; L162-L186 WeakPolarHBondContact O-CA 3.28Å; F177-L186 HydrophobicContact CD2-CD2 4.37Å; F177-L186 HydrophobicContact CE1-CD1 4.28Å; F177-L186 HydrophobicContact CE2-CD2 3.98Å; F177-L186 HydrophobicContact CZ-CD1 4.25Å; F177-L186 HydrophobicContact CZ-CD2 4.06Å; L183-L186 HydrophobicContact CD2-CB 3.96Å; L183-L186 HydrophobicContact CD2-CD1 4.32Å; L183-L186 HydrophobicContact CD2-CD2 4.34Å; L183-L186 HydrophobicContact CD2-CG 4.44Å; L186-L188 HydrophobicContact CD1-CD1 4.21Å; L186-L188 HydrophobicContact CD1-CG 4.1Å; L186-L188 HydrophobicContact CD2-CD1 3.81Å; L186-L188 HydrophobicContact CG-CD1 3.89Å; L186-L188 HydrophobicContact CG-CG 4.15Å; L186-F201 HydrophobicContact CD2-CD1 4.35Å; L186-F201 HydrophobicContact CD2-CE1 4.22Å; L186-L204 HydrophobicContact CD2-CD1 3.77Å; L186-L207 HydrophobicContact CB-CD1 3.67Å; L186-L207 HydrophobicContact CB-CD2 4.48Å; L186-E209 PolarHBondContact N-O 3.06Å; L186-E209 VanDerWaalsContact N-O 3.09Å; L186-L210 HydrophobicContact CB-CD1 4.16Å; L186-L210 HydrophobicContact CD2-CD1 4Å; L186-L210 HydrophobicContact CG-CD1 4.04Å; L186-H211 PolarHBondContact O-N 2.96Å
187	D	98.8	Very high	96.6	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115	173.4	-174.8	-6.7	0	0	0	112.2	L162 L164 R165 F185 G189 H211	L162-D187 PolarHBondContact O-N 2.79Å; L164-D187 CarbonylContact C-O 3.53Å; L164-D187 WeakPolarHBondContact CA-O 3.36Å; L164-D187 WeakPolarHBondContact CB-O 3.43Å; L164-D187 PolarHBondContact N-O 2.97Å; R165-D187 WeakPolarHBondContact CB-OD2 3.4Å; R165-D187 WeakPolarHBondContact CD-OD2 3.21Å; R165-D187 IonicContact CZ-OD2 3.89Å; R165-D187 IonicContact NH1-OD1 3.41Å; R165-D187 PolarHBondContact NH1-OD1 3.25Å; R165-D187 IonicContact NH1-OD2 2.96Å; R165-D187 PolarHBondContact NH1-OD2 3.4Å; F185-D187 HydrophobicContact CE1-CB 3.57Å; F185-D187 HydrophobicContact CZ-CB 3.91Å; D187-G189 WeakPolarHBondContact OD1-CA 3.29Å; D187-G189 PolarHBondContact OD1-N 3.06Å; D187-H211 HydrophobicContact CB-CB 4.13Å
188	L	98.6	Very high	96.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.234	C	C	.	.			trans	-121.1	14.7	174.8	-70.2	158.6	0	0	0	111.1	L164 L169 I172 F177 L186 N191 I193 F201 L210 H211 L212 N215	L164-L188 HydrophobicContact CB-CD2 4.05Å; L164-L188 HydrophobicContact CD1-CD2 3.81Å; L169-L188 HydrophobicContact CD1-CD2 4.23Å; I172-L188 HydrophobicContact CD1-CD1 3.63Å; I172-L188 HydrophobicContact CD1-CD2 4.19Å; F177-L188 HydrophobicContact CZ-CD1 4.4Å; L186-L188 HydrophobicContact CD1-CD1 4.21Å; L186-L188 HydrophobicContact CD1-CG 4.1Å; L186-L188 HydrophobicContact CD2-CD1 3.81Å; L186-L188 HydrophobicContact CG-CD1 3.89Å; L186-L188 HydrophobicContact CG-CG 4.15Å; L188-N191 PolarHBondContact O-ND2 3.05Å; L188-I193 HydrophobicContact CB-CD1 4.24Å; L188-I193 HydrophobicContact CD2-CD1 4.44Å; L188-F201 HydrophobicContact CD1-CE1 4.24Å; L188-L210 HydrophobicContact CD1-CD1 4.49Å; L188-H211 CarbonylContact C-O 3.28Å; L188-H211 WeakPolarHBondContact CA-O 3.35Å; L188-H211 WeakPolarHBondContact CB-O 3.21Å; L188-H211 PolarHBondContact N-O 3.34Å; L188-L212 HydrophobicContact CB-CD2 4.02Å; L188-L212 HydrophobicContact CD1-CD2 4.16Å; L188-N215 PolarHBondContact O-ND2 3.25Å
189	G	98.6	Very high	96.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.228	C	C	.	.			trans	-63.4	157.4	179.6	0	0	0	0	0	112.6	R165 S166 D187 N191 H211 E213	R165-G189 CarbonylContact C-O 3.25Å; R165-G189 VanDerWaalsContact CA-O 3.3Å; R165-G189 WeakPolarHBondContact CA-O 3.47Å; S166-G189 PolarHBondContact N-O 2.61Å; D187-G189 WeakPolarHBondContact OD1-CA 3.29Å; D187-G189 PolarHBondContact OD1-N 3.06Å; G189-N191 VanDerWaalsContact C-N 3.31Å; G189-N191 PolarHBondContact O-N 3.09Å; G189-N191 PolarHBondContact O-ND2 3.16Å; G189-H211 PolarHBondContact N-O 3.36Å; G189-E213 CarbonylContact C-O 3.59Å; G189-E213 VanDerWaalsContact CA-O 3.24Å; G189-E213 WeakPolarHBondContact CA-O 3.48Å
190	Y	98.6	Very high	95.9	Very high	100 Å²	100	47.6 Å²	47.6	39%	0.392	22%	0.221	S	C	.	.	S	Bend	trans	55.5	44.5	178.8	-65.6	-107.3	0	0	0	112.8	R165 S166 N167 E213 H214	R165-Y190 HydrophobicContact CG-CD2 4.47Å; S166-Y190 VanDerWaalsContact CA-O 3.25Å; S166-Y190 WeakPolarHBondContact CA-O 3.5Å; S166-Y190 PolarHBondContact N-O 2.9Å; N167-Y190 PolarHBondContact N-O 2.86Å; Y190-E213 HydrophobicContact CD2-CG 4.31Å; Y190-E213 HydrophobicContact CE2-CG 4.01Å; Y190-E213 PolarHBondContact N-O 3.47Å; Y190-H214 WeakPolarHBondContact CA-O 3.43Å; Y190-H214 HydrophobicContact CD1-CB 3.83Å; Y190-H214 AromaticContact CD1-CG 3.98Å; Y190-H214 HydrophobicContact CD2-CB 3.8Å; Y190-H214 AromaticContact CD2-CD2 4Å; Y190-H214 HydrophobicContact CE1-CB 4.04Å; Y190-H214 AromaticContact CE1-CD2 3.72Å; Y190-H214 AromaticContact CE1-CG 3.66Å; Y190-H214 AromaticContact CE1-ND1 3.96Å; Y190-H214 HydrophobicContact CE2-CB 3.97Å; Y190-H214 AromaticContact CE2-CD2 3.24Å; Y190-H214 WeakPolarHBondContact CE2-CD2 3.23Å; Y190-H214 AromaticContact CE2-CG 3.76Å; Y190-H214 HydrophobicContact CG-CB 3.72Å; Y190-H214 AromaticContact CZ-CD2 3.12Å; Y190-H214 AromaticContact CZ-CG 3.56Å; Y190-H214 AromaticContact CZ-NE2 3.47Å; Y190-H214 PolarHBondContact OH-CD2 3.28Å; Y190-H214 VanDerWaalsContact OH-CD2 3.25Å; Y190-H214 PolarHBondContact OH-NE2 3.4Å; Y190-H214 VanDerWaalsContact OH-NE2 3.1Å
191	N	98.8	Very high	95.8	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.043	22%	0.223	C	C	.	.	S	Bend	trans	-116	-168.3	173.8	-83.9	-82.3	0	0	0	110.2	L164 N167 L169 L188 G189 I193 H214 N215	L164-N191 PolarHBondContact O-ND2 3.35Å; N167-N191 WeakPolarHBondContact CA-OD1 3.43Å; N167-N191 WeakPolarHBondContact CB-OD1 3.39Å; N167-N191 PolarHBondContact O-OD1 3.25Å; L169-N191 HydrophobicContact CB-CB 4.24Å; L169-N191 WeakPolarHBondContact CB-OD1 3.24Å; L169-N191 WeakPolarHBondContact CG-OD1 3.15Å; L169-N191 PolarHBondContact N-OD1 3.17Å; L188-N191 PolarHBondContact O-ND2 3.05Å; G189-N191 VanDerWaalsContact C-N 3.31Å; G189-N191 PolarHBondContact O-N 3.09Å; G189-N191 PolarHBondContact O-ND2 3.16Å; N191-I193 HydrophobicContact CB-CD1 4.22Å; N191-I193 HydrophobicContact CB-CG1 4.06Å; N191-H214 PolarHBondContact N-O 3.09Å; N191-N215 WeakPolarHBondContact CA-OD1 3.25Å; N191-N215 VanDerWaalsContact CB-OD1 3.24Å; N191-N215 WeakPolarHBondContact CB-OD1 3.38Å; N191-N215 PolarHBondContact O-OD1 2.8Å
192	R	98	Very high	95.6	Very high	130 Å²	130	43.4 Å²	43.4	49%	0.491	21%	0.209	S	C	.	.			trans	-115	24.9	-177.1	-59.6	178.3	-179.1	166.8	0.1	111.9	E146 L169 K194	E146-R192 IonicContact OE1-NH1 3.85Å; L169-R192 CarbonylContact O-C 3.31Å; L169-R192 VanDerWaalsContact O-CA 3.32Å; L169-R192 WeakPolarHBondContact O-CA 3.25Å; L169-R192 PolarHBondContact O-N 2.98Å; R192-K194 PolarHBondContact O-N 2.63Å
193	I	97.6	Very high	95.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.204	C	C	.	.			trans	-72.6	124.5	-171.4	-50.4	167.3	0	0	0	109.6	L169 S170 I172 L188 N191 A195 L196 N215 Q216 F217	L169-I193 WeakPolarHBondContact O-CG1 3.35Å; L169-I193 PolarHBondContact O-N 2.97Å; S170-I193 WeakPolarHBondContact O-CA 3.08Å; I172-I193 HydrophobicContact CD1-CD1 3.96Å; I172-I193 HydrophobicContact CG1-CD1 4.16Å; L188-I193 HydrophobicContact CB-CD1 4.24Å; L188-I193 HydrophobicContact CD2-CD1 4.44Å; N191-I193 HydrophobicContact CB-CD1 4.22Å; N191-I193 HydrophobicContact CB-CG1 4.06Å; I193-A195 WeakPolarHBondContact CG2-O 3.12Å; I193-L196 HydrophobicContact CG2-CD2 4.45Å; I193-N215 VanDerWaalsContact CB-OD1 3.26Å; I193-N215 WeakPolarHBondContact CB-OD1 3.26Å; I193-N215 VanDerWaalsContact CG1-OD1 3.27Å; I193-N215 WeakPolarHBondContact CG1-OD1 3.39Å; I193-N215 PolarHBondContact N-OD1 3.3Å; I193-Q216 CarbonylContact O-C 3.05Å; I193-Q216 WeakPolarHBondContact O-CA 3.1Å; I193-Q216 PolarHBondContact O-N 3.04Å; I193-F217 HydrophobicContact CB-CE1 4.11Å; I193-F217 HydrophobicContact CB-CZ 3.8Å; I193-F217 HydrophobicContact CG2-CE1 3.62Å; I193-F217 HydrophobicContact CG2-CZ 3.63Å
194	K	95.7	Very high	95.1	Very high	131 Å²	131	42.4 Å²	42.4	57%	0.57	21%	0.205	S	C	*	.			trans	-96.4	-30.3	-176.6	-65	177.9	-178.5	178	0	113.9	R192 Q216	R192-K194 PolarHBondContact O-N 2.63Å; K194-Q216 HydrophobicContact CG-CB 3.92Å
195	A	94.3	Very high	94.8	Very high	62 Å²	62	46.6 Å²	46.6	51%	0.512	22%	0.224	S	C	.	.			trans	-151.4	157.2	-174.9	0	0	0	0	0	111.6	I193	I193-A195 WeakPolarHBondContact CG2-O 3.12Å
196	L	93.7	Very high	94.7	Very high	20 Å²	20	50.5 Å²	50.5	11%	0.105	24%	0.238	C	C	.	.			trans	-119.8	149.4	175	-64.1	166.2	0	0	0	108.8	I172 I193 T200 F201 L212 F217 I220 L224 F225	I172-L196 HydrophobicContact CD1-CD2 4.42Å; I193-L196 HydrophobicContact CG2-CD2 4.45Å; L196-T200 HydrophobicContact CD2-CG2 3.99Å; L196-F201 HydrophobicContact CD1-CE2 4.02Å; L196-F201 HydrophobicContact CD1-CZ 4.28Å; L196-F201 HydrophobicContact CD2-CE2 3.91Å; L196-F201 HydrophobicContact CD2-CZ 3.74Å; L196-F201 HydrophobicContact CG-CE2 4.39Å; L196-L212 HydrophobicContact CD1-CD1 3.92Å; L196-F217 HydrophobicContact CD1-CE1 4.02Å; L196-F217 HydrophobicContact CD1-CZ 3.98Å; L196-F217 HydrophobicContact CD2-CE1 4.16Å; L196-F217 HydrophobicContact CD2-CZ 4.06Å; L196-F217 HydrophobicContact CG-CE1 3.63Å; L196-F217 HydrophobicContact CG-CZ 3.87Å; L196-I220 HydrophobicContact CD1-CD1 4.4Å; L196-L224 HydrophobicContact CB-CD1 3.93Å; L196-F225 HydrophobicContact CD1-CE1 4.28Å; L196-F225 HydrophobicContact CD1-CZ 4.05Å
197	T	91.2	Very high	94.7	Very high	66 Å²	66	50.5 Å²	50.5	41%	0.405	24%	0.238	S	C	.	.			trans	-114.4	159.4	177.3	77.1	0	0	0	0	110.6	T199 T200	T197-T199 PolarHBondContact O-N 2.86Å; T197-T199 PolarHBondContact OG1-N 2.98Å; T197-T199 PolarHBondContact OG1-OG1 3.41Å; T197-T200 PolarHBondContact N-OG1 3.36Å; T197-T200 WeakPolarHBondContact O-CB 3.3Å; T197-T200 PolarHBondContact O-N 2.88Å; T197-T200 PolarHBondContact O-OG1 3.02Å; T197-T200 PolarHBondContact OG1-N 3.11Å; T197-T200 PolarHBondContact OG1-OG1 3.35Å
198	R	87.8	Confident	94.7	Very high	166 Å²	166	53.2 Å²	53.2	63%	0.626	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.4	172	-65.8	178.3	-179.7	178.8	-5	113.5	L224	R198-L224 HydrophobicContact CG-CD2 3.74Å
199	T	88.3	Confident	94.7	Very high	45 Å²	45	55.7 Å²	55.7	28%	0.276	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-9.3	-179.7	69	0	0	0	0	114.4	T197 L202	T197-T199 PolarHBondContact O-N 2.86Å; T197-T199 PolarHBondContact OG1-N 2.98Å; T197-T199 PolarHBondContact OG1-OG1 3.41Å; T199-L202 HydrophobicContact CG2-CD1 4.1Å
200	T	91.7	Very high	94.7	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.018	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-44.9	-171.4	-64.5	0	0	0	0	112.1	I172 F177 L196 T197	I172-T200 HydrophobicContact CB-CG2 3.87Å; I172-T200 HydrophobicContact CD1-CG2 3.75Å; I172-T200 HydrophobicContact CG1-CG2 4.4Å; I172-T200 HydrophobicContact CG2-CG2 3.88Å; F177-T200 WeakPolarHBondContact CD2-O 3.48Å; L196-T200 HydrophobicContact CD2-CG2 3.99Å; T197-T200 PolarHBondContact N-OG1 3.36Å; T197-T200 WeakPolarHBondContact O-CB 3.3Å; T197-T200 PolarHBondContact O-N 2.88Å; T197-T200 PolarHBondContact O-OG1 3.02Å; T197-T200 PolarHBondContact OG1-N 3.11Å; T197-T200 PolarHBondContact OG1-OG1 3.35Å
201	F	92.6	Very high	94.7	Very high	7 Å²	7	52 Å²	52	3%	0.031	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	23	-177.5	-54.7	-64.8	0	0	0	114.2	F177 L186 L188 L196 G203 L204 L210 L212 F225 L228	F177-F201 HydrophobicContact CD2-CD1 4.46Å; F177-F201 HydrophobicContact CE2-CD1 4.48Å; L186-F201 HydrophobicContact CD2-CD1 4.35Å; L186-F201 HydrophobicContact CD2-CE1 4.22Å; L188-F201 HydrophobicContact CD1-CE1 4.24Å; L196-F201 HydrophobicContact CD1-CE2 4.02Å; L196-F201 HydrophobicContact CD1-CZ 4.28Å; L196-F201 HydrophobicContact CD2-CE2 3.91Å; L196-F201 HydrophobicContact CD2-CZ 3.74Å; L196-F201 HydrophobicContact CG-CE2 4.39Å; F201-G203 PolarHBondContact O-N 3.14Å; F201-L204 HydrophobicContact CB-CD1 4.07Å; F201-L204 HydrophobicContact CD1-CD1 3.79Å; F201-L204 HydrophobicContact CG-CD1 4.4Å; F201-L204 PolarHBondContact O-N 2.94Å; F201-L210 HydrophobicContact CE1-CD1 4.13Å; F201-L210 HydrophobicContact CE1-CD2 4.16Å; F201-L210 HydrophobicContact CE2-CD2 4.34Å; F201-L210 HydrophobicContact CZ-CD1 4.47Å; F201-L210 HydrophobicContact CZ-CD2 3.99Å; F201-L212 HydrophobicContact CZ-CD1 4.23Å; F201-L212 HydrophobicContact CZ-CD2 4.5Å; F201-F225 HydrophobicContact CD2-CD1 4.02Å; F201-F225 HydrophobicContact CD2-CE1 4.02Å; F201-F225 HydrophobicContact CE2-CD1 4.06Å; F201-F225 AromaticContact CE2-CE1 3.57Å; F201-F225 HydrophobicContact CE2-CE1 3.57Å; F201-F225 HydrophobicContact CZ-CE1 4.46Å; F201-L228 HydrophobicContact CB-CD2 3.93Å; F201-L228 HydrophobicContact CB-CG 4.38Å; F201-L228 HydrophobicContact CD2-CD1 4.49Å; F201-L228 HydrophobicContact CG-CD1 4.48Å
202	L	91	Very high	94.7	Very high	45 Å²	45	51.6 Å²	51.6	24%	0.236	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	136.7	174.1	-69.4	174	0	0	0	110.5	F177 L178 T199 R227	F177-L202 CarbonylContact C-O 3.07Å; L178-L202 WeakPolarHBondContact CA-O 3.3Å; L178-L202 HydrophobicContact CD1-CB 4.15Å; L178-L202 PolarHBondContact N-O 2.89Å; T199-L202 HydrophobicContact CG2-CD1 4.1Å; L202-R227 HydrophobicContact CD2-CG 4.3Å
203	G	90.3	Very high	94.7	Very high	17 Å²	17	45.7 Å²	45.7	18%	0.175	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-20.5	-178.5	0	0	0	0	0	114.8	F201 Q205	F201-G203 PolarHBondContact O-N 3.14Å; G203-Q205 PolarHBondContact O-N 2.84Å
204	L	95.4	Very high	94.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.238	C	C	.	.			trans	-80	55.3	-173.4	-62.2	-171	0	0	0	113.9	F177 C180 L183 L186 F201 R206 L207 L228	F177-L204 HydrophobicContact CB-CD1 4.13Å; F177-L204 HydrophobicContact CB-CD2 3.68Å; F177-L204 HydrophobicContact CB-CG 3.91Å; F177-L204 HydrophobicContact CD2-CD1 4.04Å; F177-L204 HydrophobicContact CG-CD1 4.24Å; F177-L204 HydrophobicContact CG-CD2 4.4Å; C180-L204 HydrophobicContact CB-CD2 4.02Å; L183-L204 HydrophobicContact CB-CD2 3.88Å; L183-L204 HydrophobicContact CD2-CD1 4.47Å; L183-L204 HydrophobicContact CD2-CD2 3.6Å; L183-L204 HydrophobicContact CG-CD2 4.38Å; L186-L204 HydrophobicContact CD2-CD1 3.77Å; F201-L204 HydrophobicContact CB-CD1 4.07Å; F201-L204 HydrophobicContact CD1-CD1 3.79Å; F201-L204 HydrophobicContact CG-CD1 4.4Å; F201-L204 PolarHBondContact O-N 2.94Å; L204-R206 VanDerWaalsContact C-N 3.32Å; L204-R206 PolarHBondContact O-N 2.98Å; L204-L207 HydrophobicContact CB-CB 4.14Å; L204-L207 HydrophobicContact CB-CD2 4.45Å; L204-L207 HydrophobicContact CD1-CD2 4Å; L204-L228 HydrophobicContact CB-CD2 3.7Å
205	Q	92	Very high	94.9	Very high	128 Å²	128	42.7 Å²	42.7	60%	0.598	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-25.1	-173.8	-67.1	177.7	-21.8	0	0	114.1	G203 N230	G203-Q205 PolarHBondContact O-N 2.84Å; Q205-N230 PolarHBondContact O-ND2 2.96Å
206	R	97.1	Very high	95.1	Very high	123 Å²	123	42.5 Å²	42.5	46%	0.464	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2.6	-177.2	-68	-179.6	63.5	112	1.7	113.9	R181 L183 E184 L204 M208	R181-R206 WeakPolarHBondContact O-CD 3.27Å; L183-R206 CarbonylContact O-C 3.57Å; E184-R206 HydrophobicContact CG-CB 4.2Å; E184-R206 IonicContact OE1-CZ 3.47Å; E184-R206 IonicContact OE1-NE 3.23Å; E184-R206 PolarHBondContact OE1-NE 3.06Å; E184-R206 IonicContact OE1-NH2 2.8Å; E184-R206 PolarHBondContact OE1-NH2 2.96Å; L204-R206 VanDerWaalsContact C-N 3.32Å; L204-R206 PolarHBondContact O-N 2.98Å; R206-M208 WeakPolarHBondContact O-CG 3.24Å; R206-M208 PolarHBondContact O-N 2.8Å
207	L	98.4	Very high	95.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.197	C	C	.	.			trans	-64.1	123.4	-175.1	-168.7	73.8	0	0	0	110	L183 L186 L204 L210 L228 N230 L231	L183-L207 HydrophobicContact CD2-CD1 4.19Å; L183-L207 HydrophobicContact CG-CD1 4.3Å; L183-L207 VanDerWaalsContact O-CA 3.23Å; L183-L207 WeakPolarHBondContact O-CA 3.24Å; L183-L207 PolarHBondContact O-N 3.27Å; L186-L207 HydrophobicContact CB-CD1 3.67Å; L186-L207 HydrophobicContact CB-CD2 4.48Å; L204-L207 HydrophobicContact CB-CB 4.14Å; L204-L207 HydrophobicContact CB-CD2 4.45Å; L204-L207 HydrophobicContact CD1-CD2 4Å; L207-L210 HydrophobicContact CD2-CB 4.08Å; L207-L210 HydrophobicContact CD2-CD1 4.39Å; L207-L210 HydrophobicContact CD2-CD2 4.36Å; L207-L228 HydrophobicContact CB-CD2 4.23Å; L207-L228 HydrophobicContact CD2-CD1 4.2Å; L207-L228 HydrophobicContact CD2-CD2 3.83Å; L207-N230 CarbonylContact O-C 3.14Å; L207-L231 HydrophobicContact CB-CD1 4.49Å; L207-L231 HydrophobicContact CD2-CD1 3.95Å; L207-L231 HydrophobicContact CG-CD1 3.92Å; L207-L231 VanDerWaalsContact O-CA 3.25Å; L207-L231 WeakPolarHBondContact O-CA 3.34Å; L207-L231 PolarHBondContact O-N 3.17Å; L207-L231 VanDerWaalsContact O-N 3.09Å
208	M	98.5	Very high	95.5	Very high	66 Å²	66	41.5 Å²	41.5	33%	0.325	20%	0.199	S	C	.	.			trans	-106.3	-30.6	-179.9	-53.4	-164.1	-161.4	0	0	111.8	E184 R206 R232 S233	E184-M208 HydrophobicContact CG-CE 4.08Å; E184-M208 PolarHBondContact O-N 3.06Å; R206-M208 WeakPolarHBondContact O-CG 3.24Å; R206-M208 PolarHBondContact O-N 2.8Å; M208-R232 PolarHBondContact O-N 2.83Å; M208-S233 PolarHBondContact O-N 3.26Å
209	E	98.8	Very high	95.9	Very high	51 Å²	51	42.8 Å²	42.8	24%	0.238	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.5	-177.1	-175.6	148.3	136	0	0	111.8	E184 F185 L186 H211 S233 Y235	E184-E209 PolarHBondContact O-N 3.36Å; F185-E209 HydrophobicContact CD2-CB 3.99Å; F185-E209 HydrophobicContact CD2-CG 3.97Å; F185-E209 HydrophobicContact CE2-CG 4.02Å; L186-E209 PolarHBondContact N-O 3.06Å; L186-E209 VanDerWaalsContact N-O 3.09Å; E209-H211 WeakPolarHBondContact CG-NE2 3.39Å; E209-H211 IonicContact OE1-CD2 3.82Å; E209-H211 IonicContact OE1-CE1 3.58Å; E209-H211 IonicContact OE1-NE2 2.77Å; E209-H211 PolarHBondContact OE1-NE2 2.8Å; E209-S233 WeakPolarHBondContact OE2-CB 3.35Å; E209-S233 PolarHBondContact OE2-OG 2.95Å; E209-S233 VanDerWaalsContact OE2-OG 3.1Å; E209-Y235 HydrophobicContact CG-CD2 4.45Å; E209-Y235 HydrophobicContact CG-CE2 3.94Å
210	L	98.8	Very high	96.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115.9	-177.7	177.7	55.3	0	0	0	110.7	L186 L188 F201 L207 L212 F225 L228 L231 S233 L234 Y235	L186-L210 HydrophobicContact CB-CD1 4.16Å; L186-L210 HydrophobicContact CD2-CD1 4Å; L186-L210 HydrophobicContact CG-CD1 4.04Å; L188-L210 HydrophobicContact CD1-CD1 4.49Å; F201-L210 HydrophobicContact CE1-CD1 4.13Å; F201-L210 HydrophobicContact CE1-CD2 4.16Å; F201-L210 HydrophobicContact CE2-CD2 4.34Å; F201-L210 HydrophobicContact CZ-CD1 4.47Å; F201-L210 HydrophobicContact CZ-CD2 3.99Å; L207-L210 HydrophobicContact CD2-CB 4.08Å; L207-L210 HydrophobicContact CD2-CD1 4.39Å; L207-L210 HydrophobicContact CD2-CD2 4.36Å; L210-L212 HydrophobicContact CD1-CD1 4.35Å; L210-L212 HydrophobicContact CD1-CG 4.08Å; L210-L212 HydrophobicContact CD2-CD1 3.85Å; L210-L212 HydrophobicContact CD2-CG 4.45Å; L210-L212 HydrophobicContact CG-CD1 3.93Å; L210-L212 HydrophobicContact CG-CG 4.01Å; L210-F225 HydrophobicContact CD2-CE1 4.25Å; L210-L228 HydrophobicContact CD2-CD1 3.87Å; L210-L231 HydrophobicContact CB-CD1 3.74Å; L210-L231 HydrophobicContact CB-CD2 4.29Å; L210-S233 PolarHBondContact N-O 3.16Å; L210-L234 HydrophobicContact CB-CD1 4.25Å; L210-L234 HydrophobicContact CD2-CD1 4.02Å; L210-L234 HydrophobicContact CG-CD1 4.1Å; L210-Y235 PolarHBondContact O-N 3.44Å
211	H	98.9	Very high	96.5	Very high	23 Å²	23	43.1 Å²	43.1	11%	0.106	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.4	175.5	-68.4	-94.9	0	0	0	110.7	F185 L186 D187 L188 G189 E209 E213 Y235	F185-H211 AromaticContact CE2-CD2 3.57Å; F185-H211 AromaticContact CE2-NE2 3.53Å; F185-H211 AromaticContact CZ-CD2 3.61Å; F185-H211 AromaticContact CZ-NE2 3.87Å; L186-H211 PolarHBondContact O-N 2.96Å; D187-H211 HydrophobicContact CB-CB 4.13Å; L188-H211 CarbonylContact C-O 3.28Å; L188-H211 WeakPolarHBondContact CA-O 3.35Å; L188-H211 WeakPolarHBondContact CB-O 3.21Å; L188-H211 PolarHBondContact N-O 3.34Å; G189-H211 PolarHBondContact N-O 3.36Å; E209-H211 WeakPolarHBondContact CG-NE2 3.39Å; E209-H211 IonicContact OE1-CD2 3.82Å; E209-H211 IonicContact OE1-CE1 3.58Å; E209-H211 IonicContact OE1-NE2 2.77Å; E209-H211 PolarHBondContact OE1-NE2 2.8Å; H211-E213 VanDerWaalsContact CB-OE2 3.25Å; H211-E213 WeakPolarHBondContact CB-OE2 3.26Å; H211-E213 IonicContact CG-OE2 3.17Å; H211-E213 IonicContact ND1-OE1 2.76Å; H211-E213 IonicContact ND1-OE2 2.94Å; H211-Y235 AromaticContact CE1-CD2 3.25Å; H211-Y235 WeakPolarHBondContact CE1-CD2 3.47Å; H211-Y235 AromaticContact CE1-CE2 3.29Å; H211-Y235 WeakPolarHBondContact CE1-CE2 3.35Å; H211-Y235 AromaticContact CE1-CG 3.84Å; H211-Y235 AromaticContact CE1-CZ 3.9Å; H211-Y235 AromaticContact CG-CD2 3.88Å; H211-Y235 AromaticContact ND1-CD2 3.38Å; H211-Y235 WeakPolarHBondContact ND1-CD2 3.43Å; H211-Y235 AromaticContact ND1-CE2 3.92Å; H211-Y235 AromaticContact ND1-CG 3.66Å; H211-Y235 AromaticContact NE2-CD2 3.66Å; H211-Y235 AromaticContact NE2-CE2 3.56Å
212	L	98.6	Very high	96.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.202	C	C	.	.			trans	-135.8	14.4	-178	-76.1	172	0	0	0	111.5	L188 L196 F201 L210 N215 F217 L234 Y235 L236 N239	L188-L212 HydrophobicContact CB-CD2 4.02Å; L188-L212 HydrophobicContact CD1-CD2 4.16Å; L196-L212 HydrophobicContact CD1-CD1 3.92Å; F201-L212 HydrophobicContact CZ-CD1 4.23Å; F201-L212 HydrophobicContact CZ-CD2 4.5Å; L210-L212 HydrophobicContact CD1-CD1 4.35Å; L210-L212 HydrophobicContact CD1-CG 4.08Å; L210-L212 HydrophobicContact CD2-CD1 3.85Å; L210-L212 HydrophobicContact CD2-CG 4.45Å; L210-L212 HydrophobicContact CG-CD1 3.93Å; L210-L212 HydrophobicContact CG-CG 4.01Å; L212-N215 PolarHBondContact O-ND2 3.14Å; L212-F217 HydrophobicContact CB-CE2 4.05Å; L212-F217 HydrophobicContact CD2-CE2 4.06Å; L212-F217 HydrophobicContact CD2-CZ 4.1Å; L212-F217 HydrophobicContact CG-CE2 4.48Å; L212-L234 HydrophobicContact CD1-CD1 4.24Å; L212-Y235 CarbonylContact C-O 3.21Å; L212-Y235 WeakPolarHBondContact CA-O 3.41Å; L212-Y235 WeakPolarHBondContact CB-O 3.19Å; L212-Y235 PolarHBondContact N-O 3.23Å; L212-L236 HydrophobicContact CB-CD2 3.77Å; L212-L236 HydrophobicContact CD1-CD2 4.08Å; L212-N239 PolarHBondContact O-ND2 3.16Å
213	E	98.7	Very high	96.5	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.023	20%	0.202	C	C	.	.			trans	-67.8	162.9	179.7	77.8	-83.4	-165.7	0	0	113.1	R165 G189 Y190 H211 N215 Y235 Q237	R165-E213 IonicContact CZ-OE1 3.3Å; R165-E213 VanDerWaalsContact CZ-OE1 3.3Å; R165-E213 IonicContact NH1-OE1 2.71Å; R165-E213 PolarHBondContact NH1-OE1 2.84Å; R165-E213 IonicContact NH2-OE1 2.99Å; R165-E213 PolarHBondContact NH2-OE1 3.15Å; G189-E213 CarbonylContact C-O 3.59Å; G189-E213 VanDerWaalsContact CA-O 3.24Å; G189-E213 WeakPolarHBondContact CA-O 3.48Å; Y190-E213 HydrophobicContact CD2-CG 4.31Å; Y190-E213 HydrophobicContact CE2-CG 4.01Å; Y190-E213 PolarHBondContact N-O 3.47Å; H211-E213 VanDerWaalsContact CB-OE2 3.25Å; H211-E213 WeakPolarHBondContact CB-OE2 3.26Å; H211-E213 IonicContact CG-OE2 3.17Å; H211-E213 IonicContact ND1-OE1 2.76Å; H211-E213 IonicContact ND1-OE2 2.94Å; E213-N215 PolarHBondContact O-N 2.71Å; E213-N215 VanDerWaalsContact O-N 3.16Å; E213-N215 PolarHBondContact O-ND2 3.31Å; E213-Y235 PolarHBondContact N-O 3.05Å; E213-Q237 CarbonylContact C-O 3.5Å; E213-Q237 WeakPolarHBondContact CA-O 3.48Å; E213-Q237 HydrophobicContact CB-CG 3.72Å; E213-Q237 VanDerWaalsContact CB-O 3.24Å; E213-Q237 WeakPolarHBondContact CB-O 3.34Å; E213-Q237 HydrophobicContact CG-CG 4.42Å
214	H	98.6	Very high	96.5	Very high	60 Å²	60	44.1 Å²	44.1	28%	0.278	20%	0.202	S	C	.	.	S	Bend	trans	50.2	42.4	178.1	-70.4	-85.8	0	0	0	113.2	Y190 N191 Q237 W238	Y190-H214 WeakPolarHBondContact CA-O 3.43Å; Y190-H214 HydrophobicContact CD1-CB 3.83Å; Y190-H214 AromaticContact CD1-CG 3.98Å; Y190-H214 HydrophobicContact CD2-CB 3.8Å; Y190-H214 AromaticContact CD2-CD2 4Å; Y190-H214 HydrophobicContact CE1-CB 4.04Å; Y190-H214 AromaticContact CE1-CD2 3.72Å; Y190-H214 AromaticContact CE1-CG 3.66Å; Y190-H214 AromaticContact CE1-ND1 3.96Å; Y190-H214 HydrophobicContact CE2-CB 3.97Å; Y190-H214 AromaticContact CE2-CD2 3.24Å; Y190-H214 WeakPolarHBondContact CE2-CD2 3.23Å; Y190-H214 AromaticContact CE2-CG 3.76Å; Y190-H214 HydrophobicContact CG-CB 3.72Å; Y190-H214 AromaticContact CZ-CD2 3.12Å; Y190-H214 AromaticContact CZ-CG 3.56Å; Y190-H214 AromaticContact CZ-NE2 3.47Å; Y190-H214 PolarHBondContact OH-CD2 3.28Å; Y190-H214 VanDerWaalsContact OH-CD2 3.25Å; Y190-H214 PolarHBondContact OH-NE2 3.4Å; Y190-H214 VanDerWaalsContact OH-NE2 3.1Å; N191-H214 PolarHBondContact N-O 3.09Å; H214-Q237 PolarHBondContact N-O 3.38Å; H214-W238 WeakPolarHBondContact CA-O 3.45Å; H214-W238 AromaticContact CD2-CD1 3.93Å; H214-W238 WeakPolarHBondContact CE1-CB 3.42Å; H214-W238 AromaticContact CE1-CD1 3.53Å; H214-W238 AromaticContact CE1-CG 3.37Å; H214-W238 WeakPolarHBondContact ND1-CB 3.3Å; H214-W238 AromaticContact NE2-CD1 3.13Å; H214-W238 AromaticContact NE2-CG 3.45Å
215	N	98.7	Very high	96.4	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.048	20%	0.202	C	C	.	.	S	Bend	trans	-110.1	-159	173	-88.1	-82.7	0	0	0	109.8	L188 N191 I193 L212 E213 F217 N239	L188-N215 PolarHBondContact O-ND2 3.25Å; N191-N215 WeakPolarHBondContact CA-OD1 3.25Å; N191-N215 VanDerWaalsContact CB-OD1 3.24Å; N191-N215 WeakPolarHBondContact CB-OD1 3.38Å; N191-N215 PolarHBondContact O-OD1 2.8Å; I193-N215 VanDerWaalsContact CB-OD1 3.26Å; I193-N215 WeakPolarHBondContact CB-OD1 3.26Å; I193-N215 VanDerWaalsContact CG1-OD1 3.27Å; I193-N215 WeakPolarHBondContact CG1-OD1 3.39Å; I193-N215 PolarHBondContact N-OD1 3.3Å; L212-N215 PolarHBondContact O-ND2 3.14Å; E213-N215 PolarHBondContact O-N 2.71Å; E213-N215 VanDerWaalsContact O-N 3.16Å; E213-N215 PolarHBondContact O-ND2 3.31Å; N215-F217 HydrophobicContact CB-CD2 3.91Å; N215-F217 HydrophobicContact CB-CE2 3.61Å; N215-F217 HydrophobicContact CB-CZ 4.27Å; N215-N239 WeakPolarHBondContact CA-OD1 3.14Å; N215-N239 WeakPolarHBondContact CB-OD1 3.15Å; N215-N239 PolarHBondContact N-OD1 3.07Å; N215-N239 PolarHBondContact O-OD1 3Å
216	Q	97.7	Very high	96.2	Very high	58 Å²	58	40.5 Å²	40.5	27%	0.271	19%	0.19	S	C	.	.			trans	-121.3	26	-174.9	-58.4	-175.4	5.3	0	0	112.7	I193 K194 S218 N239	I193-Q216 CarbonylContact O-C 3.05Å; I193-Q216 WeakPolarHBondContact O-CA 3.1Å; I193-Q216 PolarHBondContact O-N 3.04Å; K194-Q216 HydrophobicContact CG-CB 3.92Å; Q216-S218 PolarHBondContact O-N 2.65Å; Q216-N239 PolarHBondContact N-OD1 2.86Å
217	F	97.9	Very high	95.8	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	20%	0.201	C	C	.	.			trans	-66.9	125.7	179.9	-59.4	-57.4	0	0	0	111.4	I193 L196 L212 N215 I220 L236 N239 R240 I241	I193-F217 HydrophobicContact CB-CE1 4.11Å; I193-F217 HydrophobicContact CB-CZ 3.8Å; I193-F217 HydrophobicContact CG2-CE1 3.62Å; I193-F217 HydrophobicContact CG2-CZ 3.63Å; L196-F217 HydrophobicContact CD1-CE1 4.02Å; L196-F217 HydrophobicContact CD1-CZ 3.98Å; L196-F217 HydrophobicContact CD2-CE1 4.16Å; L196-F217 HydrophobicContact CD2-CZ 4.06Å; L196-F217 HydrophobicContact CG-CE1 3.63Å; L196-F217 HydrophobicContact CG-CZ 3.87Å; L212-F217 HydrophobicContact CB-CE2 4.05Å; L212-F217 HydrophobicContact CD2-CE2 4.06Å; L212-F217 HydrophobicContact CD2-CZ 4.1Å; L212-F217 HydrophobicContact CG-CE2 4.48Å; N215-F217 HydrophobicContact CB-CD2 3.91Å; N215-F217 HydrophobicContact CB-CE2 3.61Å; N215-F217 HydrophobicContact CB-CZ 4.27Å; F217-I220 HydrophobicContact CB-CD1 4.06Å; F217-I220 HydrophobicContact CB-CG1 4.47Å; F217-I220 HydrophobicContact CD1-CD1 4.31Å; F217-I220 HydrophobicContact CD2-CD1 4.34Å; F217-I220 HydrophobicContact CG-CD1 3.97Å; F217-L236 HydrophobicContact CD2-CD2 4.18Å; F217-N239 HydrophobicContact CB-CB 4.28Å; F217-N239 WeakPolarHBondContact CD2-OD1 3.12Å; F217-N239 PolarHBondContact N-OD1 3.33Å; F217-N239 VanDerWaalsContact N-OD1 3.11Å; F217-R240 CarbonylContact O-C 3.46Å; F217-R240 VanDerWaalsContact O-CA 3.31Å; F217-R240 WeakPolarHBondContact O-CA 3.12Å; F217-R240 PolarHBondContact O-N 2.97Å; F217-I241 HydrophobicContact CB-CD1 4.46Å; F217-I241 HydrophobicContact CB-CG1 4.01Å; F217-I241 WeakPolarHBondContact O-CG1 3.47Å; F217-I241 PolarHBondContact O-N 2.94Å; F217-I241 VanDerWaalsContact O-N 3.11Å
218	S	96.7	Very high	95.6	Very high	64 Å²	64	43.5 Å²	43.5	45%	0.448	20%	0.202	S	C	.	.	S	Bend	trans	-97.6	-21.4	176.5	61.3	0	0	0	0	113.8	Q216 R240 I241 R242	Q216-S218 PolarHBondContact O-N 2.65Å; S218-R240 WeakPolarHBondContact CA-O 3.39Å; S218-I241 WeakPolarHBondContact O-CA 3.35Å; S218-R242 PolarHBondContact O-N 3.38Å
219	R	96.3	Very high	95.3	Very high	193 Å²	193	43.2 Å²	43.2	73%	0.728	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-149.9	148.2	178.4	-58.2	-178.1	-175	179.4	0	108.6	V243	R219-V243 WeakPolarHBondContact CA-O 3.41Å
220	I	96.1	Very high	95.2	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.2	171.8	-69.3	-66.3	0	0	0	109.5	L196 F217 F222 F225 L236 I241 V243 V244 N245	L196-I220 HydrophobicContact CD1-CD1 4.4Å; F217-I220 HydrophobicContact CB-CD1 4.06Å; F217-I220 HydrophobicContact CB-CG1 4.47Å; F217-I220 HydrophobicContact CD1-CD1 4.31Å; F217-I220 HydrophobicContact CD2-CD1 4.34Å; F217-I220 HydrophobicContact CG-CD1 3.97Å; I220-F222 HydrophobicContact CG2-CD1 3.68Å; I220-F222 HydrophobicContact CG2-CE1 3.68Å; I220-F225 HydrophobicContact CG2-CE2 4.1Å; I220-L236 HydrophobicContact CD1-CD2 4.02Å; I220-L236 HydrophobicContact CG1-CD1 4.2Å; I220-L236 HydrophobicContact CG1-CD2 4.25Å; I220-L236 HydrophobicContact CG2-CD1 4.24Å; I220-I241 HydrophobicContact CG1-CD1 3.58Å; I220-I241 HydrophobicContact CG1-CG1 4.01Å; I220-V243 PolarHBondContact N-O 2.96Å; I220-V243 VanDerWaalsContact N-O 3.11Å; I220-V244 WeakPolarHBondContact O-CA 3.29Å; I220-N245 PolarHBondContact O-N 3.08Å
221	N	94.9	Very high	95.2	Very high	50 Å²	50	44.3 Å²	44.3	27%	0.267	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119.4	173.5	-175.4	-34.2	0	0	0	108.6	F223 L224 N245 Q246	N221-F223 PolarHBondContact O-N 2.8Å; N221-F223 WeakPolarHBondContact OD1-CB 3.4Å; N221-F223 PolarHBondContact OD1-N 2.99Å; N221-L224 HydrophobicContact CB-CG 4.42Å; N221-L224 WeakPolarHBondContact O-CB 3Å; N221-L224 VanDerWaalsContact O-CG 3.27Å; N221-L224 WeakPolarHBondContact O-CG 3.4Å; N221-L224 PolarHBondContact O-N 3.37Å; N221-L224 VanDerWaalsContact O-N 3.15Å; N221-N245 CarbonylContact C-O 3.57Å; N221-N245 WeakPolarHBondContact CA-O 3.35Å; N221-N245 VanDerWaalsContact CA-OD1 3.26Å; N221-N245 WeakPolarHBondContact CA-OD1 3.5Å; N221-N245 WeakPolarHBondContact CB-OD1 3.39Å; N221-N245 PolarHBondContact ND2-OD1 3.09Å; N221-Q246 PolarHBondContact OD1-O 2.77Å
222	F	94.2	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-68.8	-20.1	-176	-72.2	-13.3	0	0	0	113.5	I220 L224 F225 L234 V244 N245 W250 W252 L258 V272 L276	I220-F222 HydrophobicContact CG2-CD1 3.68Å; I220-F222 HydrophobicContact CG2-CE1 3.68Å; F222-L224 PolarHBondContact O-N 3.41Å; F222-F225 HydrophobicContact CD1-CD2 4.14Å; F222-F225 HydrophobicContact CD1-CE2 4.03Å; F222-F225 PolarHBondContact O-N 3.1Å; F222-L234 HydrophobicContact CE1-CD2 4.42Å; F222-V244 HydrophobicContact CD1-CG1 4.22Å; F222-V244 HydrophobicContact CD2-CG1 4.45Å; F222-V244 HydrophobicContact CE1-CG1 3.74Å; F222-V244 HydrophobicContact CE2-CG1 3.99Å; F222-V244 HydrophobicContact CZ-CG1 3.61Å; F222-N245 PolarHBondContact N-O 2.84Å; F222-W250 HydrophobicContact CB-CZ2 4.01Å; F222-W250 WeakPolarHBondContact O-CZ2 3.37Å; F222-W252 HydrophobicContact CD1-CZ3 4.38Å; F222-W252 HydrophobicContact CG-CZ3 4.34Å; F222-L258 HydrophobicContact CE2-CD2 4.38Å; F222-L258 HydrophobicContact CZ-CD1 4.31Å; F222-L258 HydrophobicContact CZ-CD2 3.89Å; F222-V272 HydrophobicContact CD2-CG1 3.94Å; F222-V272 HydrophobicContact CE2-CG1 3.42Å; F222-V272 VanDerWaalsContact CE2-CG1 3.42Å; F222-V272 HydrophobicContact CZ-CG1 4.19Å; F222-L276 HydrophobicContact CE2-CD1 3.9Å; F222-L276 HydrophobicContact CE2-CD2 4.5Å; F222-L276 HydrophobicContact CE2-CG 4.45Å
223	F	90.2	Very high	95.1	Very high	53 Å²	53	49.9 Å²	49.9	23%	0.232	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.6	-6.1	169.5	-165.7	-93.5	0	0	0	114.3	N221 F225 P226 Q246 L248	N221-F223 PolarHBondContact O-N 2.8Å; N221-F223 WeakPolarHBondContact OD1-CB 3.4Å; N221-F223 PolarHBondContact OD1-N 2.99Å; F223-F225 VanDerWaalsContact C-N 3.35Å; F223-P226 HydrophobicContact CD2-CG 4.35Å; F223-P226 WeakPolarHBondContact O-CD 3.05Å; F223-Q246 PolarHBondContact N-O 3.17Å; F223-Q246 VanDerWaalsContact N-O 3.15Å; F223-L248 HydrophobicContact CD2-CB 3.88Å; F223-L248 HydrophobicContact CD2-CD1 4.36Å; F223-L248 HydrophobicContact CD2-CG 4.28Å; F223-L248 HydrophobicContact CE2-CB 3.9Å; F223-L248 HydrophobicContact CE2-CD1 3.74Å; F223-L248 HydrophobicContact CE2-CG 4.14Å; F223-L248 HydrophobicContact CZ-CD1 3.9Å
224	L	90.6	Very high	95.1	Very high	37 Å²	37	49.6 Å²	49.6	19%	0.194	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-77.7	-18.9	170.2	-59.6	177	0	0	0	113.3	L196 R198 N221 F222	L196-L224 HydrophobicContact CB-CD1 3.93Å; R198-L224 HydrophobicContact CG-CD2 3.74Å; N221-L224 HydrophobicContact CB-CG 4.42Å; N221-L224 WeakPolarHBondContact O-CB 3Å; N221-L224 VanDerWaalsContact O-CG 3.27Å; N221-L224 WeakPolarHBondContact O-CG 3.4Å; N221-L224 PolarHBondContact O-N 3.37Å; N221-L224 VanDerWaalsContact O-N 3.15Å; F222-L224 PolarHBondContact O-N 3.41Å
225	F	92.4	Very high	95.2	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	23%	0.231	C	C	.	.			trans	-106.1	2.9	-174.2	-49.3	-71.6	0	0	0	118.8	L196 F201 L210 I220 F222 F223 R227 L228 L234 W252	L196-F225 HydrophobicContact CD1-CE1 4.28Å; L196-F225 HydrophobicContact CD1-CZ 4.05Å; F201-F225 HydrophobicContact CD2-CD1 4.02Å; F201-F225 HydrophobicContact CD2-CE1 4.02Å; F201-F225 HydrophobicContact CE2-CD1 4.06Å; F201-F225 AromaticContact CE2-CE1 3.57Å; F201-F225 HydrophobicContact CE2-CE1 3.57Å; F201-F225 HydrophobicContact CZ-CE1 4.46Å; L210-F225 HydrophobicContact CD2-CE1 4.25Å; I220-F225 HydrophobicContact CG2-CE2 4.1Å; F222-F225 HydrophobicContact CD1-CD2 4.14Å; F222-F225 HydrophobicContact CD1-CE2 4.03Å; F222-F225 PolarHBondContact O-N 3.1Å; F223-F225 VanDerWaalsContact C-N 3.35Å; F225-R227 PolarHBondContact O-N 3.25Å; F225-L228 HydrophobicContact CB-CD1 4.22Å; F225-L228 HydrophobicContact CB-CG 4.49Å; F225-L228 HydrophobicContact CD1-CD1 3.65Å; F225-L228 HydrophobicContact CG-CD1 4.36Å; F225-L228 WeakPolarHBondContact O-CB 3.45Å; F225-L228 PolarHBondContact O-N 2.99Å; F225-L234 HydrophobicContact CE2-CD2 4.43Å; F225-W252 HydrophobicContact CB-CH2 3.27Å; F225-W252 HydrophobicContact CB-CZ2 3.72Å; F225-W252 HydrophobicContact CB-CZ3 3.8Å; F225-W252 HydrophobicContact CD1-CH2 4.36Å; F225-W252 AromaticContact CD2-CH2 3.7Å; F225-W252 HydrophobicContact CD2-CH2 3.7Å; F225-W252 AromaticContact CD2-CZ3 3.79Å; F225-W252 HydrophobicContact CD2-CZ3 3.79Å; F225-W252 AromaticContact CG-CH2 3.54Å; F225-W252 HydrophobicContact CG-CH2 3.54Å; F225-W252 HydrophobicContact CG-CZ2 4.37Å; F225-W252 HydrophobicContact CG-CZ3 4.06Å
226	P	87.9	Confident	95.2	Very high	53 Å²	53	47.8 Å²	47.8	34%	0.344	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-11.2	-178.7	-29.1	34.9	0	0	0	117.5	F223 W250	F223-P226 HydrophobicContact CD2-CG 4.35Å; F223-P226 WeakPolarHBondContact O-CD 3.05Å; P226-W250 HydrophobicContact CB-CE3 4.19Å; P226-W250 HydrophobicContact CB-CH2 4.49Å; P226-W250 HydrophobicContact CB-CZ3 4.06Å; P226-W250 HydrophobicContact CG-CD2 4.18Å; P226-W250 HydrophobicContact CG-CE3 4.09Å; P226-W250 HydrophobicContact CG-CH2 4.15Å; P226-W250 HydrophobicContact CG-CZ2 4.25Å; P226-W250 HydrophobicContact CG-CZ3 4.09Å
227	R	88.9	Confident	95.2	Very high	184 Å²	184	46.3 Å²	46.3	69%	0.694	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-13.7	174.4	-60.8	-57	-170.9	177.4	0.2	113.7	L202 F225 A229	L202-R227 HydrophobicContact CD2-CG 4.3Å; F225-R227 PolarHBondContact O-N 3.25Å; R227-A229 PolarHBondContact O-N 2.71Å
228	L	94.6	Very high	95.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	25%	0.246	C	C	.	.			trans	-83.3	55.6	176.6	-60.7	-172.6	0	0	0	110.9	F201 L204 L207 L210 F225 N230 L231 W252	F201-L228 HydrophobicContact CB-CD2 3.93Å; F201-L228 HydrophobicContact CB-CG 4.38Å; F201-L228 HydrophobicContact CD2-CD1 4.49Å; F201-L228 HydrophobicContact CG-CD1 4.48Å; L204-L228 HydrophobicContact CB-CD2 3.7Å; L207-L228 HydrophobicContact CB-CD2 4.23Å; L207-L228 HydrophobicContact CD2-CD1 4.2Å; L207-L228 HydrophobicContact CD2-CD2 3.83Å; L210-L228 HydrophobicContact CD2-CD1 3.87Å; F225-L228 HydrophobicContact CB-CD1 4.22Å; F225-L228 HydrophobicContact CB-CG 4.49Å; F225-L228 HydrophobicContact CD1-CD1 3.65Å; F225-L228 HydrophobicContact CG-CD1 4.36Å; F225-L228 WeakPolarHBondContact O-CB 3.45Å; F225-L228 PolarHBondContact O-N 2.99Å; L228-N230 PolarHBondContact O-N 3.41Å; L228-L231 HydrophobicContact CB-CB 4.03Å; L228-L231 HydrophobicContact CD1-CD2 4.1Å; L228-L231 WeakPolarHBondContact O-CB 3.23Å; L228-L231 PolarHBondContact O-N 2.77Å; L228-L231 VanDerWaalsContact O-N 3.07Å; L228-W252 HydrophobicContact CB-CZ2 4.36Å
229	A	92.1	Very high	95.3	Very high	61 Å²	61	50 Å²	50	50%	0.504	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.6	-169.4	0	0	0	0	0	114.1	R227 T254	R227-A229 PolarHBondContact O-N 2.71Å; A229-T254 WeakPolarHBondContact O-CB 3.24Å; A229-T254 WeakPolarHBondContact O-CG2 3.15Å; A229-T254 PolarHBondContact O-OG1 2.81Å
230	N	96.6	Very high	95.4	Very high	73 Å²	73	47.5 Å²	47.5	39%	0.39	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	5	-180	-74.7	-59.6	0	0	0	114.4	Q205 L207 L228 R232	Q205-N230 PolarHBondContact O-ND2 2.96Å; L207-N230 CarbonylContact O-C 3.14Å; L228-N230 PolarHBondContact O-N 3.41Å; N230-R232 PolarHBondContact O-N 3.32Å
231	L	97.9	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.217	C	C	.	.			trans	-68.6	126.7	-174.4	-162.5	78.2	0	0	0	111.3	L207 L210 L228 L234 W252 T254 L255	L207-L231 HydrophobicContact CB-CD1 4.49Å; L207-L231 HydrophobicContact CD2-CD1 3.95Å; L207-L231 HydrophobicContact CG-CD1 3.92Å; L207-L231 VanDerWaalsContact O-CA 3.25Å; L207-L231 WeakPolarHBondContact O-CA 3.34Å; L207-L231 PolarHBondContact O-N 3.17Å; L207-L231 VanDerWaalsContact O-N 3.09Å; L210-L231 HydrophobicContact CB-CD1 3.74Å; L210-L231 HydrophobicContact CB-CD2 4.29Å; L228-L231 HydrophobicContact CB-CB 4.03Å; L228-L231 HydrophobicContact CD1-CD2 4.1Å; L228-L231 WeakPolarHBondContact O-CB 3.23Å; L228-L231 PolarHBondContact O-N 2.77Å; L228-L231 VanDerWaalsContact O-N 3.07Å; L231-L234 HydrophobicContact CD2-CB 4.05Å; L231-L234 HydrophobicContact CD2-CD1 4.38Å; L231-W252 HydrophobicContact CB-CZ2 3.95Å; L231-W252 HydrophobicContact CD2-CH2 3.93Å; L231-W252 HydrophobicContact CD2-CZ2 3.51Å; L231-W252 HydrophobicContact CG-CZ2 4.33Å; L231-T254 CarbonylContact O-C 3.41Å; L231-T254 VanDerWaalsContact O-O 3.04Å; L231-L255 HydrophobicContact CD2-CD1 4.04Å; L231-L255 HydrophobicContact CG-CD1 4.29Å; L231-L255 WeakPolarHBondContact O-CA 3.22Å; L231-L255 PolarHBondContact O-N 3.36Å
232	R	98.4	Very high	95.6	Very high	122 Å²	122	51.6 Å²	51.6	46%	0.46	23%	0.229	S	C	.	.			trans	-107.8	-38.1	179.2	-55.8	-175	-175.3	-167.4	-0.5	112.2	M208 N230 T254 Q256 K257	M208-R232 PolarHBondContact O-N 2.83Å; N230-R232 PolarHBondContact O-N 3.32Å; R232-T254 WeakPolarHBondContact CA-O 3.35Å; R232-Q256 PolarHBondContact O-N 3.11Å; R232-K257 PolarHBondContact O-N 3.39Å
233	S	98.8	Very high	95.7	Very high	18 Å²	18	54.6 Å²	54.6	13%	0.126	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.2	-177	-57.4	0	0	0	0	111	M208 E209 L210	M208-S233 PolarHBondContact O-N 3.26Å; E209-S233 WeakPolarHBondContact OE2-CB 3.35Å; E209-S233 PolarHBondContact OE2-OG 2.95Å; E209-S233 VanDerWaalsContact OE2-OG 3.1Å; L210-S233 PolarHBondContact N-O 3.16Å
234	L	98.7	Very high	96	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120	171.8	179.9	58	0	0	0	110.4	L210 L212 F222 F225 L231 L236 W252 L255 K257 L258 D259	L210-L234 HydrophobicContact CB-CD1 4.25Å; L210-L234 HydrophobicContact CD2-CD1 4.02Å; L210-L234 HydrophobicContact CG-CD1 4.1Å; L212-L234 HydrophobicContact CD1-CD1 4.24Å; F222-L234 HydrophobicContact CE1-CD2 4.42Å; F225-L234 HydrophobicContact CE2-CD2 4.43Å; L231-L234 HydrophobicContact CD2-CB 4.05Å; L231-L234 HydrophobicContact CD2-CD1 4.38Å; L234-L236 HydrophobicContact CD1-CD1 4.37Å; L234-L236 HydrophobicContact CD1-CG 4.23Å; L234-L236 HydrophobicContact CD2-CD1 3.85Å; L234-L236 HydrophobicContact CG-CD1 3.94Å; L234-L236 HydrophobicContact CG-CG 4.13Å; L234-W252 HydrophobicContact CD2-CH2 4.07Å; L234-W252 HydrophobicContact CD2-CZ3 4.34Å; L234-L255 HydrophobicContact CB-CD1 3.91Å; L234-K257 PolarHBondContact N-O 3.19Å; L234-L258 HydrophobicContact CB-CD1 4.27Å; L234-L258 HydrophobicContact CD2-CD1 4.07Å; L234-L258 HydrophobicContact CG-CD1 4.19Å; L234-L258 WeakPolarHBondContact O-CA 3.09Å; L234-D259 PolarHBondContact O-N 3.14Å
235	Y	98.9	Very high	96.1	Very high	30 Å²	30	54 Å²	54	12%	0.118	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	116.1	-179.6	-63.4	-84.7	0	0	0	110.1	E209 L210 H211 L212 E213 Q237 K257 D259	E209-Y235 HydrophobicContact CG-CD2 4.45Å; E209-Y235 HydrophobicContact CG-CE2 3.94Å; L210-Y235 PolarHBondContact O-N 3.44Å; H211-Y235 AromaticContact CE1-CD2 3.25Å; H211-Y235 WeakPolarHBondContact CE1-CD2 3.47Å; H211-Y235 AromaticContact CE1-CE2 3.29Å; H211-Y235 WeakPolarHBondContact CE1-CE2 3.35Å; H211-Y235 AromaticContact CE1-CG 3.84Å; H211-Y235 AromaticContact CE1-CZ 3.9Å; H211-Y235 AromaticContact CG-CD2 3.88Å; H211-Y235 AromaticContact ND1-CD2 3.38Å; H211-Y235 WeakPolarHBondContact ND1-CD2 3.43Å; H211-Y235 AromaticContact ND1-CE2 3.92Å; H211-Y235 AromaticContact ND1-CG 3.66Å; H211-Y235 AromaticContact NE2-CD2 3.66Å; H211-Y235 AromaticContact NE2-CE2 3.56Å; L212-Y235 CarbonylContact C-O 3.21Å; L212-Y235 WeakPolarHBondContact CA-O 3.41Å; L212-Y235 WeakPolarHBondContact CB-O 3.19Å; L212-Y235 PolarHBondContact N-O 3.23Å; E213-Y235 PolarHBondContact N-O 3.05Å; Y235-Q237 VanDerWaalsContact CB-OE1 3.3Å; Y235-K257 HydrophobicContact CE1-CD 4.18Å; Y235-K257 VanDerWaalsContact CE1-CE 3.46Å; Y235-K257 VanDerWaalsContact CE1-NZ 3.32Å; Y235-K257 PolarHBondContact OH-NZ 2.98Å; Y235-D259 HydrophobicContact CD1-CB 3.96Å
236	L	98.6	Very high	96.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.255	C	S	.	.			trans	-128.7	12.9	-177.3	-76.5	166.4	0	0	0	112.1	L212 F217 I220 L234 N239 I241 L258 D259 L260 N263	L212-L236 HydrophobicContact CB-CD2 3.77Å; L212-L236 HydrophobicContact CD1-CD2 4.08Å; F217-L236 HydrophobicContact CD2-CD2 4.18Å; I220-L236 HydrophobicContact CD1-CD2 4.02Å; I220-L236 HydrophobicContact CG1-CD1 4.2Å; I220-L236 HydrophobicContact CG1-CD2 4.25Å; I220-L236 HydrophobicContact CG2-CD1 4.24Å; L234-L236 HydrophobicContact CD1-CD1 4.37Å; L234-L236 HydrophobicContact CD1-CG 4.23Å; L234-L236 HydrophobicContact CD2-CD1 3.85Å; L234-L236 HydrophobicContact CG-CD1 3.94Å; L234-L236 HydrophobicContact CG-CG 4.13Å; L236-N239 PolarHBondContact O-ND2 3.37Å; L236-I241 HydrophobicContact CB-CD1 4.05Å; L236-I241 HydrophobicContact CD2-CD1 4.39Å; L236-L258 HydrophobicContact CD1-CD1 4.46Å; L236-D259 CarbonylContact C-O 2.95Å; L236-D259 WeakPolarHBondContact CA-O 3.4Å; L236-D259 WeakPolarHBondContact CB-O 3.31Å; L236-D259 PolarHBondContact N-O 2.87Å; L236-L260 HydrophobicContact CB-CD2 3.88Å; L236-L260 HydrophobicContact CD1-CD2 3.99Å; L236-N263 PolarHBondContact O-ND2 3.23Å
237	Q	98.6	Very high	96.2	Very high	27 Å²	27	54.8 Å²	54.8	13%	0.126	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	156.8	-176.8	67.7	-77.9	6.7	0	0	113.6	E213 H214 Y235 N239 D259 S261	E213-Q237 CarbonylContact C-O 3.5Å; E213-Q237 WeakPolarHBondContact CA-O 3.48Å; E213-Q237 HydrophobicContact CB-CG 3.72Å; E213-Q237 VanDerWaalsContact CB-O 3.24Å; E213-Q237 WeakPolarHBondContact CB-O 3.34Å; E213-Q237 HydrophobicContact CG-CG 4.42Å; H214-Q237 PolarHBondContact N-O 3.38Å; Y235-Q237 VanDerWaalsContact CB-OE1 3.3Å; Q237-N239 PolarHBondContact O-N 3.38Å; Q237-N239 PolarHBondContact O-ND2 2.93Å; Q237-D259 PolarHBondContact N-O 3.37Å; Q237-S261 CarbonylContact C-O 3.09Å; Q237-S261 WeakPolarHBondContact CA-O 3.43Å; Q237-S261 VanDerWaalsContact CB-O 3.25Å; Q237-S261 WeakPolarHBondContact CB-O 3.29Å; Q237-S261 WeakPolarHBondContact CB-OG 3.49Å
238	W	98.5	Very high	96.2	Very high	134 Å²	134	50.9 Å²	50.9	51%	0.508	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	37.2	177.9	-58.4	109.7	0	0	0	114.5	H214 S261 G262	H214-W238 WeakPolarHBondContact CA-O 3.45Å; H214-W238 AromaticContact CD2-CD1 3.93Å; H214-W238 WeakPolarHBondContact CE1-CB 3.42Å; H214-W238 AromaticContact CE1-CD1 3.53Å; H214-W238 AromaticContact CE1-CG 3.37Å; H214-W238 WeakPolarHBondContact ND1-CB 3.3Å; H214-W238 AromaticContact NE2-CD1 3.13Å; H214-W238 AromaticContact NE2-CG 3.45Å; W238-S261 PolarHBondContact N-O 2.91Å; W238-G262 WeakPolarHBondContact CA-O 3.41Å
239	N	98.7	Very high	95.9	Very high	9 Å²	9	56.3 Å²	56.3	5%	0.048	28%	0.284	C	S	.	.	S	Bend	trans	-97.4	-159.6	166.5	-84.4	-84.3	0	0	0	109.5	L212 N215 Q216 F217 L236 Q237 I241 N263	L212-N239 PolarHBondContact O-ND2 3.16Å; N215-N239 WeakPolarHBondContact CA-OD1 3.14Å; N215-N239 WeakPolarHBondContact CB-OD1 3.15Å; N215-N239 PolarHBondContact N-OD1 3.07Å; N215-N239 PolarHBondContact O-OD1 3Å; Q216-N239 PolarHBondContact N-OD1 2.86Å; F217-N239 HydrophobicContact CB-CB 4.28Å; F217-N239 WeakPolarHBondContact CD2-OD1 3.12Å; F217-N239 PolarHBondContact N-OD1 3.33Å; F217-N239 VanDerWaalsContact N-OD1 3.11Å; L236-N239 PolarHBondContact O-ND2 3.37Å; Q237-N239 PolarHBondContact O-N 3.38Å; Q237-N239 PolarHBondContact O-ND2 2.93Å; N239-I241 HydrophobicContact CB-CD1 3.98Å; N239-I241 HydrophobicContact CB-CG1 3.88Å; N239-N263 VanDerWaalsContact CA-OD1 3.3Å; N239-N263 WeakPolarHBondContact CA-OD1 3.41Å; N239-N263 WeakPolarHBondContact CB-OD1 3.46Å; N239-N263 PolarHBondContact N-OD1 3.45Å; N239-N263 PolarHBondContact O-OD1 3.03Å
240	R	97.9	Very high	95.9	Very high	140 Å²	140	55.8 Å²	55.8	53%	0.528	27%	0.269	S	S	.	.			trans	-121.1	30	177	-58.4	-179.9	-171.3	171.9	0	111	F217 S218 R242 N263	F217-R240 CarbonylContact O-C 3.46Å; F217-R240 VanDerWaalsContact O-CA 3.31Å; F217-R240 WeakPolarHBondContact O-CA 3.12Å; F217-R240 PolarHBondContact O-N 2.97Å; S218-R240 WeakPolarHBondContact CA-O 3.39Å; R240-R242 PolarHBondContact O-N 3.05Å; R240-N263 PolarHBondContact N-OD1 3.39Å
241	I	98.4	Very high	95.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.268	C	S	.	.			trans	-69.1	119.7	-169.5	-60	164.7	0	0	0	108.5	F217 S218 I220 L236 N239 V244 L260 N263 E264 I265	F217-I241 HydrophobicContact CB-CD1 4.46Å; F217-I241 HydrophobicContact CB-CG1 4.01Å; F217-I241 WeakPolarHBondContact O-CG1 3.47Å; F217-I241 PolarHBondContact O-N 2.94Å; F217-I241 VanDerWaalsContact O-N 3.11Å; S218-I241 WeakPolarHBondContact O-CA 3.35Å; I220-I241 HydrophobicContact CG1-CD1 3.58Å; I220-I241 HydrophobicContact CG1-CG1 4.01Å; L236-I241 HydrophobicContact CB-CD1 4.05Å; L236-I241 HydrophobicContact CD2-CD1 4.39Å; N239-I241 HydrophobicContact CB-CD1 3.98Å; N239-I241 HydrophobicContact CB-CG1 3.88Å; I241-V244 HydrophobicContact CG2-CG2 3.79Å; I241-L260 HydrophobicContact CD1-CD2 4.14Å; I241-N263 HydrophobicContact CB-CB 4.24Å; I241-N263 VanDerWaalsContact CB-OD1 3.27Å; I241-N263 WeakPolarHBondContact CB-OD1 3.49Å; I241-N263 VanDerWaalsContact CG1-OD1 3.3Å; I241-N263 WeakPolarHBondContact CG1-OD1 3.47Å; I241-N263 PolarHBondContact N-OD1 2.8Å; I241-E264 CarbonylContact O-C 3.4Å; I241-E264 WeakPolarHBondContact O-CA 3.49Å; I241-E264 PolarHBondContact O-N 3.48Å; I241-I265 HydrophobicContact CB-CG1 4.49Å; I241-I265 HydrophobicContact CG2-CD1 4.45Å; I241-I265 HydrophobicContact CG2-CG1 4.23Å; I241-I265 VanDerWaalsContact O-CG1 3.24Å; I241-I265 WeakPolarHBondContact O-CG1 3.37Å; I241-I265 PolarHBondContact O-N 3.41Å
242	R	97.3	Very high	95.6	Very high	140 Å²	140	55.5 Å²	55.5	53%	0.528	27%	0.269	S	S	.	.			trans	-96.8	-30.2	174.9	-67.1	179.9	-178.2	-177.8	-0.8	113.2	S218 R240 E264	S218-R242 PolarHBondContact O-N 3.38Å; R240-R242 PolarHBondContact O-N 3.05Å; R242-E264 HydrophobicContact CG-CB 3.7Å; R242-E264 IonicContact CZ-OE2 2.72Å; R242-E264 IonicContact NE-OE2 3.05Å; R242-E264 PolarHBondContact NE-OE2 3.17Å; R242-E264 IonicContact NH2-OE2 4Å; R242-E264 PolarHBondContact NH2-OE2 3.38Å
243	V	95.3	Very high	95.5	Very high	64 Å²	64	56.6 Å²	56.6	39%	0.388	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	129.8	-175.2	-177.4	0	0	0	0	109	R219 I220	R219-V243 WeakPolarHBondContact CA-O 3.41Å; I220-V243 PolarHBondContact N-O 2.96Å; I220-V243 VanDerWaalsContact N-O 3.11Å
244	V	96.1	Very high	95.4	Very high	14 Å²	14	57.9 Å²	57.9	9%	0.085	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.9	163.7	-174.6	0	0	0	0	107	I220 F222 I241 L260 I265 V272	I220-V244 WeakPolarHBondContact O-CA 3.29Å; F222-V244 HydrophobicContact CD1-CG1 4.22Å; F222-V244 HydrophobicContact CD2-CG1 4.45Å; F222-V244 HydrophobicContact CE1-CG1 3.74Å; F222-V244 HydrophobicContact CE2-CG1 3.99Å; F222-V244 HydrophobicContact CZ-CG1 3.61Å; I241-V244 HydrophobicContact CG2-CG2 3.79Å; V244-L260 HydrophobicContact CG2-CD1 4.21Å; V244-L260 HydrophobicContact CG2-CD2 4.17Å; V244-I265 HydrophobicContact CG2-CD1 4.12Å; V244-V272 HydrophobicContact CB-CG1 4.43Å; V244-V272 HydrophobicContact CG1-CG1 3.7Å; V244-V272 HydrophobicContact CG1-CG2 4.19Å; V244-V272 WeakPolarHBondContact O-CG2 3.21Å
245	N	94.5	Very high	95.4	Very high	62 Å²	62	57.9 Å²	57.9	33%	0.332	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.8	173.2	62.1	22	0	0	0	112.1	I220 N221 F222 V272	I220-N245 PolarHBondContact O-N 3.08Å; N221-N245 CarbonylContact C-O 3.57Å; N221-N245 WeakPolarHBondContact CA-O 3.35Å; N221-N245 VanDerWaalsContact CA-OD1 3.26Å; N221-N245 WeakPolarHBondContact CA-OD1 3.5Å; N221-N245 WeakPolarHBondContact CB-OD1 3.39Å; N221-N245 PolarHBondContact ND2-OD1 3.09Å; F222-N245 PolarHBondContact N-O 2.84Å; N245-V272 VanDerWaalsContact CA-CG2 3.49Å
246	Q	91.4	Very high	95.3	Very high	35 Å²	35	59.8 Å²	59.8	16%	0.164	29%	0.291	C	S	.	.			trans	-73.8	-30	178.8	61.4	162.2	1.8	0	0	113.1	N221 F223 W250 A271	N221-Q246 PolarHBondContact OD1-O 2.77Å; F223-Q246 PolarHBondContact N-O 3.17Å; F223-Q246 VanDerWaalsContact N-O 3.15Å; Q246-W250 PolarHBondContact O-NE1 2.92Å; Q246-A271 HydrophobicContact CG-CB 3.97Å; Q246-A271 PolarHBondContact OE1-O 3.34Å
247	G	90.3	Very high	95.3	Very high	36 Å²	36	62.7 Å²	62.7	37%	0.371	30%	0.304	S	S	.	.			trans	83	-123.6	-168.4	0	0	0	0	0	111.7
248	L	88.1	Confident	95.3	Very high	103 Å²	103	61.4 Å²	61.4	54%	0.539	30%	0.298	S	S	.	.	S	Bend	trans	-77.1	151.7	171.8	-63.6	176.9	0	0	0	110.1	F223 W250	F223-L248 HydrophobicContact CD2-CB 3.88Å; F223-L248 HydrophobicContact CD2-CD1 4.36Å; F223-L248 HydrophobicContact CD2-CG 4.28Å; F223-L248 HydrophobicContact CE2-CB 3.9Å; F223-L248 HydrophobicContact CE2-CD1 3.74Å; F223-L248 HydrophobicContact CE2-CG 4.14Å; F223-L248 HydrophobicContact CZ-CD1 3.9Å; L248-W250 VanDerWaalsContact O-CD1 3.23Å; L248-W250 PolarHBondContact O-N 2.98Å
249	P	89.5	Confident	95.4	Very high	114 Å²	114	56 Å²	56	74%	0.74	28%	0.279	S	S	*	.	S	Bend	trans	-57.9	126.1	176.6	-24.5	34.7	0	0	0	112.2
250	W	92	Very high	95.4	Very high	51 Å²	51	55.7 Å²	55.7	19%	0.193	28%	0.277	C	S	.	.			trans	-160.5	177.3	176.1	74.8	-61.2	0	0	0	110	F222 P226 Q246 L248 W252 C275	F222-W250 HydrophobicContact CB-CZ2 4.01Å; F222-W250 WeakPolarHBondContact O-CZ2 3.37Å; P226-W250 HydrophobicContact CB-CE3 4.19Å; P226-W250 HydrophobicContact CB-CH2 4.49Å; P226-W250 HydrophobicContact CB-CZ3 4.06Å; P226-W250 HydrophobicContact CG-CD2 4.18Å; P226-W250 HydrophobicContact CG-CE3 4.09Å; P226-W250 HydrophobicContact CG-CH2 4.15Å; P226-W250 HydrophobicContact CG-CZ2 4.25Å; P226-W250 HydrophobicContact CG-CZ3 4.09Å; Q246-W250 PolarHBondContact O-NE1 2.92Å; L248-W250 VanDerWaalsContact O-CD1 3.23Å; L248-W250 PolarHBondContact O-N 2.98Å; W250-W252 HydrophobicContact CE3-CB 4.48Å; W250-W252 HydrophobicContact CH2-CB 3.82Å; W250-W252 AromaticContact CH2-CD2 3.48Å; W250-W252 HydrophobicContact CH2-CD2 3.48Å; W250-W252 VanDerWaalsContact CH2-CD2 3.48Å; W250-W252 AromaticContact CH2-CE3 3.54Å; W250-W252 HydrophobicContact CH2-CE3 3.54Å; W250-W252 AromaticContact CH2-CG 3.64Å; W250-W252 HydrophobicContact CH2-CG 3.64Å; W250-W252 HydrophobicContact CH2-CZ3 4.25Å; W250-W252 HydrophobicContact CZ2-CB 4.36Å; W250-W252 HydrophobicContact CZ2-CD2 4.14Å; W250-W252 AromaticContact CZ2-CE3 3.74Å; W250-W252 HydrophobicContact CZ2-CE3 3.74Å; W250-W252 HydrophobicContact CZ2-CG 4.45Å; W250-W252 HydrophobicContact CZ2-CZ3 4.34Å; W250-W252 HydrophobicContact CZ3-CB 3.87Å; W250-W252 HydrophobicContact CZ3-CD2 4.22Å; W250-W252 AromaticContact CZ3-CG 3.91Å; W250-W252 HydrophobicContact CZ3-CG 3.91Å; W250-C275 WeakPolarHBondContact O-CB 3.35Å
251	T	93.6	Very high	95.4	Very high	61 Å²	61	49.5 Å²	49.5	37%	0.374	26%	0.256	S	S	.	.			trans	-135.9	132.9	-178.6	38.6	0	0	0	0	111.3	Y253	T251-Y253 VanDerWaalsContact CB-CZ 3.46Å; T251-Y253 HydrophobicContact CG2-CE1 4.45Å; T251-Y253 WeakPolarHBondContact OG1-CE2 3.3Å; T251-Y253 PolarHBondContact OG1-OH 3.06Å
252	W	94.8	Very high	95.4	Very high	6 Å²	6	50 Å²	50	2%	0.023	26%	0.261	C	S	.	.			trans	-113.2	71.7	-176.8	-160.8	-9.2	0	0	0	110.4	F222 F225 L228 L231 L234 W250 T254 L255 C275 L276	F222-W252 HydrophobicContact CD1-CZ3 4.38Å; F222-W252 HydrophobicContact CG-CZ3 4.34Å; F225-W252 HydrophobicContact CB-CH2 3.27Å; F225-W252 HydrophobicContact CB-CZ2 3.72Å; F225-W252 HydrophobicContact CB-CZ3 3.8Å; F225-W252 HydrophobicContact CD1-CH2 4.36Å; F225-W252 AromaticContact CD2-CH2 3.7Å; F225-W252 HydrophobicContact CD2-CH2 3.7Å; F225-W252 AromaticContact CD2-CZ3 3.79Å; F225-W252 HydrophobicContact CD2-CZ3 3.79Å; F225-W252 AromaticContact CG-CH2 3.54Å; F225-W252 HydrophobicContact CG-CH2 3.54Å; F225-W252 HydrophobicContact CG-CZ2 4.37Å; F225-W252 HydrophobicContact CG-CZ3 4.06Å; L228-W252 HydrophobicContact CB-CZ2 4.36Å; L231-W252 HydrophobicContact CB-CZ2 3.95Å; L231-W252 HydrophobicContact CD2-CH2 3.93Å; L231-W252 HydrophobicContact CD2-CZ2 3.51Å; L231-W252 HydrophobicContact CG-CZ2 4.33Å; L234-W252 HydrophobicContact CD2-CH2 4.07Å; L234-W252 HydrophobicContact CD2-CZ3 4.34Å; W250-W252 HydrophobicContact CE3-CB 4.48Å; W250-W252 HydrophobicContact CH2-CB 3.82Å; W250-W252 AromaticContact CH2-CD2 3.48Å; W250-W252 HydrophobicContact CH2-CD2 3.48Å; W250-W252 VanDerWaalsContact CH2-CD2 3.48Å; W250-W252 AromaticContact CH2-CE3 3.54Å; W250-W252 HydrophobicContact CH2-CE3 3.54Å; W250-W252 AromaticContact CH2-CG 3.64Å; W250-W252 HydrophobicContact CH2-CG 3.64Å; W250-W252 HydrophobicContact CH2-CZ3 4.25Å; W250-W252 HydrophobicContact CZ2-CB 4.36Å; W250-W252 HydrophobicContact CZ2-CD2 4.14Å; W250-W252 AromaticContact CZ2-CE3 3.74Å; W250-W252 HydrophobicContact CZ2-CE3 3.74Å; W250-W252 HydrophobicContact CZ2-CG 4.45Å; W250-W252 HydrophobicContact CZ2-CZ3 4.34Å; W250-W252 HydrophobicContact CZ3-CB 3.87Å; W250-W252 HydrophobicContact CZ3-CD2 4.22Å; W250-W252 AromaticContact CZ3-CG 3.91Å; W250-W252 HydrophobicContact CZ3-CG 3.91Å; W252-T254 PolarHBondContact O-N 2.96Å; W252-L255 HydrophobicContact CD2-CB 4.13Å; W252-L255 HydrophobicContact CD2-CD2 4.4Å; W252-L255 HydrophobicContact CE3-CD2 4.15Å; W252-L255 HydrophobicContact CG-CB 4.12Å; W252-L255 HydrophobicContact CZ2-CD1 4.34Å; W252-L255 HydrophobicContact CZ3-CD2 4.27Å; W252-L255 PolarHBondContact O-N 3.01Å; W252-C275 PolarHBondContact N-O 2.81Å; W252-L276 HydrophobicContact CB-CD2 3.82Å; W252-L276 HydrophobicContact CD2-CD2 4.38Å; W252-L276 HydrophobicContact CE3-CD2 3.97Å; W252-L276 HydrophobicContact CG-CD2 4.37Å
253	Y	95.1	Very high	95.4	Very high	144 Å²	144	43.6 Å²	43.6	57%	0.565	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-14.8	-173.1	-59.2	-76.4	0	0	0	115.8	T251 P277 N278	T251-Y253 VanDerWaalsContact CB-CZ 3.46Å; T251-Y253 HydrophobicContact CG2-CE1 4.45Å; T251-Y253 WeakPolarHBondContact OG1-CE2 3.3Å; T251-Y253 PolarHBondContact OG1-OH 3.06Å; Y253-P277 HydrophobicContact CD1-CG 3.75Å; Y253-P277 HydrophobicContact CE1-CG 4.03Å; Y253-N278 WeakPolarHBondContact O-CB 3.31Å; Y253-N278 PolarHBondContact O-ND2 2.61Å
254	T	97	Very high	95.6	Very high	45 Å²	45	43.3 Å²	43.3	28%	0.276	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-16.8	-174.5	40	0	0	0	0	114.6	A229 L231 R232 W252 Q256	A229-T254 WeakPolarHBondContact O-CB 3.24Å; A229-T254 WeakPolarHBondContact O-CG2 3.15Å; A229-T254 PolarHBondContact O-OG1 2.81Å; L231-T254 CarbonylContact O-C 3.41Å; L231-T254 VanDerWaalsContact O-O 3.04Å; R232-T254 WeakPolarHBondContact CA-O 3.35Å; W252-T254 PolarHBondContact O-N 2.96Å; T254-Q256 PolarHBondContact O-N 3Å
255	L	98	Very high	95.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.			trans	-74.9	121.8	-177.5	-163.9	73.8	0	0	0	110.8	L231 L234 W252 L258 L276 N278 L279	L231-L255 HydrophobicContact CD2-CD1 4.04Å; L231-L255 HydrophobicContact CG-CD1 4.29Å; L231-L255 WeakPolarHBondContact O-CA 3.22Å; L231-L255 PolarHBondContact O-N 3.36Å; L234-L255 HydrophobicContact CB-CD1 3.91Å; W252-L255 HydrophobicContact CD2-CB 4.13Å; W252-L255 HydrophobicContact CD2-CD2 4.4Å; W252-L255 HydrophobicContact CE3-CD2 4.15Å; W252-L255 HydrophobicContact CG-CB 4.12Å; W252-L255 HydrophobicContact CZ2-CD1 4.34Å; W252-L255 HydrophobicContact CZ3-CD2 4.27Å; W252-L255 PolarHBondContact O-N 3.01Å; L255-L258 HydrophobicContact CD2-CB 4.41Å; L255-L276 HydrophobicContact CB-CD2 4.36Å; L255-L276 HydrophobicContact CD2-CD1 4.13Å; L255-L276 HydrophobicContact CD2-CD2 3.78Å; L255-N278 CarbonylContact O-C 3.56Å; L255-L279 PolarHBondContact O-N 3.45Å
256	Q	98.4	Very high	95.8	Very high	71 Å²	71	45.2 Å²	45.2	33%	0.332	24%	0.237	S	C	.	.			trans	-112.7	-29.5	-176.7	-69	174.6	-24.1	0	0	112.2	R232 T254 Q280 V281	R232-Q256 PolarHBondContact O-N 3.11Å; T254-Q256 PolarHBondContact O-N 3Å; Q256-Q280 WeakPolarHBondContact O-CA 3.37Å; Q256-Q280 PolarHBondContact O-N 2.8Å; Q256-V281 PolarHBondContact O-N 3.08Å
257	K	98.8	Very high	95.9	Very high	60 Å²	60	48.1 Å²	48.1	26%	0.261	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.4	-179.5	178.5	173.9	-177.3	-174.1	0	111.3	R232 L234 Y235 V281	R232-K257 PolarHBondContact O-N 3.39Å; L234-K257 PolarHBondContact N-O 3.19Å; Y235-K257 HydrophobicContact CE1-CD 4.18Å; Y235-K257 VanDerWaalsContact CE1-CE 3.46Å; Y235-K257 VanDerWaalsContact CE1-NZ 3.32Å; Y235-K257 PolarHBondContact OH-NZ 2.98Å; K257-V281 WeakPolarHBondContact CA-O 3.27Å; K257-V281 HydrophobicContact CB-CB 4.15Å; K257-V281 HydrophobicContact CD-CG1 4.42Å; K257-V281 HydrophobicContact CG-CB 3.99Å; K257-V281 HydrophobicContact CG-CG1 4.08Å
258	L	98.7	Very high	96.2	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.9	174.5	176.8	59.5	0	0	0	109.2	F222 L234 L236 L255 L260 L276 L279 V281 L282 N283	F222-L258 HydrophobicContact CE2-CD2 4.38Å; F222-L258 HydrophobicContact CZ-CD1 4.31Å; F222-L258 HydrophobicContact CZ-CD2 3.89Å; L234-L258 HydrophobicContact CB-CD1 4.27Å; L234-L258 HydrophobicContact CD2-CD1 4.07Å; L234-L258 HydrophobicContact CG-CD1 4.19Å; L234-L258 WeakPolarHBondContact O-CA 3.09Å; L236-L258 HydrophobicContact CD1-CD1 4.46Å; L255-L258 HydrophobicContact CD2-CB 4.41Å; L258-L260 HydrophobicContact CD1-CD1 4.34Å; L258-L260 HydrophobicContact CD1-CD2 4.49Å; L258-L260 HydrophobicContact CD1-CG 4.06Å; L258-L260 HydrophobicContact CD2-CD1 3.85Å; L258-L260 HydrophobicContact CD2-CG 4.43Å; L258-L260 HydrophobicContact CG-CD1 4.01Å; L258-L260 HydrophobicContact CG-CG 4.04Å; L258-L276 HydrophobicContact CD2-CD1 3.87Å; L258-L279 HydrophobicContact CB-CD1 3.74Å; L258-L279 HydrophobicContact CB-CD2 4.46Å; L258-V281 PolarHBondContact N-O 3.05Å; L258-L282 HydrophobicContact CB-CD1 4.44Å; L258-L282 HydrophobicContact CD2-CD1 4.19Å; L258-L282 HydrophobicContact CG-CD1 4.34Å; L258-N283 PolarHBondContact O-N 3.03Å
259	D	98.8	Very high	96.5	Very high	20 Å²	20	45.5 Å²	45.5	11%	0.107	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.7	173	-156.8	-38.6	0	0	0	110.7	L234 Y235 L236 Q237 S261 N283	L234-D259 PolarHBondContact O-N 3.14Å; Y235-D259 HydrophobicContact CD1-CB 3.96Å; L236-D259 CarbonylContact C-O 2.95Å; L236-D259 WeakPolarHBondContact CA-O 3.4Å; L236-D259 WeakPolarHBondContact CB-O 3.31Å; L236-D259 PolarHBondContact N-O 2.87Å; Q237-D259 PolarHBondContact N-O 3.37Å; D259-S261 WeakPolarHBondContact OD1-CB 3.48Å; D259-S261 PolarHBondContact OD1-N 2.84Å; D259-S261 PolarHBondContact OD1-OG 2.82Å; D259-N283 HydrophobicContact CB-CB 4.32Å; D259-N283 VanDerWaalsContact CG-ND2 3.35Å; D259-N283 WeakPolarHBondContact OD1-CB 3.13Å; D259-N283 PolarHBondContact OD1-ND2 2.78Å; D259-N283 VanDerWaalsContact OD1-ND2 3.12Å; D259-N283 PolarHBondContact OD2-ND2 2.8Å
260	L	98.5	Very high	96.7	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	21%	0.21	C	C	.	.			trans	-120.6	15.4	178.2	-73.3	168.1	0	0	0	111.3	L236 I241 V244 L258 N263 I265 N283 L284 N287	L236-L260 HydrophobicContact CB-CD2 3.88Å; L236-L260 HydrophobicContact CD1-CD2 3.99Å; I241-L260 HydrophobicContact CD1-CD2 4.14Å; V244-L260 HydrophobicContact CG2-CD1 4.21Å; V244-L260 HydrophobicContact CG2-CD2 4.17Å; L258-L260 HydrophobicContact CD1-CD1 4.34Å; L258-L260 HydrophobicContact CD1-CD2 4.49Å; L258-L260 HydrophobicContact CD1-CG 4.06Å; L258-L260 HydrophobicContact CD2-CD1 3.85Å; L258-L260 HydrophobicContact CD2-CG 4.43Å; L258-L260 HydrophobicContact CG-CD1 4.01Å; L258-L260 HydrophobicContact CG-CG 4.04Å; L260-N263 PolarHBondContact O-ND2 2.94Å; L260-I265 HydrophobicContact CB-CD1 4.06Å; L260-I265 HydrophobicContact CD1-CD1 4.18Å; L260-I265 HydrophobicContact CD2-CD1 4.33Å; L260-I265 HydrophobicContact CG-CD1 4.44Å; L260-N283 CarbonylContact C-O 3.28Å; L260-N283 WeakPolarHBondContact CA-O 3.35Å; L260-N283 PolarHBondContact N-O 2.71Å; L260-L284 HydrophobicContact CB-CD2 4.03Å; L260-L284 HydrophobicContact CD1-CD2 4.11Å; L260-N287 PolarHBondContact O-ND2 2.94Å
261	S	98.4	Very high	96.8	Very high	11 Å²	11	40.3 Å²	40.3	8%	0.077	21%	0.21	C	C	.	.			trans	-63	156.2	-176	55.7	0	0	0	0	113.7	Q237 W238 D259 N263 N283 E285	Q237-S261 CarbonylContact C-O 3.09Å; Q237-S261 WeakPolarHBondContact CA-O 3.43Å; Q237-S261 VanDerWaalsContact CB-O 3.25Å; Q237-S261 WeakPolarHBondContact CB-O 3.29Å; Q237-S261 WeakPolarHBondContact CB-OG 3.49Å; W238-S261 PolarHBondContact N-O 2.91Å; D259-S261 WeakPolarHBondContact OD1-CB 3.48Å; D259-S261 PolarHBondContact OD1-N 2.84Å; D259-S261 PolarHBondContact OD1-OG 2.82Å; S261-N263 VanDerWaalsContact C-N 3.33Å; S261-N263 PolarHBondContact O-N 3.29Å; S261-N263 PolarHBondContact O-ND2 3.02Å; S261-N263 VanDerWaalsContact O-ND2 3.16Å; S261-N283 WeakPolarHBondContact CB-ND2 3.02Å; S261-N283 PolarHBondContact N-O 2.87Å; S261-N283 PolarHBondContact OG-ND2 2.92Å; S261-E285 CarbonylContact C-O 3.5Å; S261-E285 WeakPolarHBondContact CA-O 3.38Å; S261-E285 WeakPolarHBondContact CB-O 3.28Å
262	G	98.3	Very high	96.9	Very high	10 Å²	10	37.5 Å²	37.5	10%	0.103	19%	0.193	C	C	.	.	S	Bend	trans	64.1	32.5	175.7	0	0	0	0	0	114.5	W238 E285 S286	W238-G262 WeakPolarHBondContact CA-O 3.41Å; G262-E285 PolarHBondContact N-O 3.15Å; G262-S286 VanDerWaalsContact CA-O 3.27Å; G262-S286 WeakPolarHBondContact CA-O 3.45Å; G262-S286 PolarHBondContact N-O 2.88Å
263	N	98.8	Very high	96.9	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.032	19%	0.193	C	C	.	.	S	Bend	trans	-110.6	-172.5	179.8	-85.8	-78	0	0	0	111.7	L236 N239 R240 I241 L260 S261 I265 N287	L236-N263 PolarHBondContact O-ND2 3.23Å; N239-N263 VanDerWaalsContact CA-OD1 3.3Å; N239-N263 WeakPolarHBondContact CA-OD1 3.41Å; N239-N263 WeakPolarHBondContact CB-OD1 3.46Å; N239-N263 PolarHBondContact N-OD1 3.45Å; N239-N263 PolarHBondContact O-OD1 3.03Å; R240-N263 PolarHBondContact N-OD1 3.39Å; I241-N263 HydrophobicContact CB-CB 4.24Å; I241-N263 VanDerWaalsContact CB-OD1 3.27Å; I241-N263 WeakPolarHBondContact CB-OD1 3.49Å; I241-N263 VanDerWaalsContact CG1-OD1 3.3Å; I241-N263 WeakPolarHBondContact CG1-OD1 3.47Å; I241-N263 PolarHBondContact N-OD1 2.8Å; L260-N263 PolarHBondContact O-ND2 2.94Å; S261-N263 VanDerWaalsContact C-N 3.33Å; S261-N263 PolarHBondContact O-N 3.29Å; S261-N263 PolarHBondContact O-ND2 3.02Å; S261-N263 VanDerWaalsContact O-ND2 3.16Å; N263-I265 HydrophobicContact CB-CD1 4.38Å; N263-I265 HydrophobicContact CB-CG1 4.13Å; N263-N287 WeakPolarHBondContact CA-OD1 3.35Å; N263-N287 WeakPolarHBondContact CB-OD1 3.27Å; N263-N287 PolarHBondContact O-OD1 2.95Å
264	E	98.3	Very high	96.9	Very high	58 Å²	58	35.8 Å²	35.8	27%	0.271	19%	0.19	S	C	.	.			trans	-107.3	24.2	-178.7	-64.1	-179.7	-150.7	0	0	112.3	I241 R242 Q266	I241-E264 CarbonylContact O-C 3.4Å; I241-E264 WeakPolarHBondContact O-CA 3.49Å; I241-E264 PolarHBondContact O-N 3.48Å; R242-E264 HydrophobicContact CG-CB 3.7Å; R242-E264 IonicContact CZ-OE2 2.72Å; R242-E264 IonicContact NE-OE2 3.05Å; R242-E264 PolarHBondContact NE-OE2 3.17Å; R242-E264 IonicContact NH2-OE2 4Å; R242-E264 PolarHBondContact NH2-OE2 3.38Å; E264-Q266 PolarHBondContact O-N 3.38Å
265	I	98.2	Very high	96.8	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	18%	0.177	C	C	.	.			trans	-70.9	124.4	-172.2	-55.5	173.1	0	0	0	110	I241 V244 L260 N263 T267 L268 L284 N287 K288 L289	I241-I265 HydrophobicContact CB-CG1 4.49Å; I241-I265 HydrophobicContact CG2-CD1 4.45Å; I241-I265 HydrophobicContact CG2-CG1 4.23Å; I241-I265 VanDerWaalsContact O-CG1 3.24Å; I241-I265 WeakPolarHBondContact O-CG1 3.37Å; I241-I265 PolarHBondContact O-N 3.41Å; V244-I265 HydrophobicContact CG2-CD1 4.12Å; L260-I265 HydrophobicContact CB-CD1 4.06Å; L260-I265 HydrophobicContact CD1-CD1 4.18Å; L260-I265 HydrophobicContact CD2-CD1 4.33Å; L260-I265 HydrophobicContact CG-CD1 4.44Å; N263-I265 HydrophobicContact CB-CD1 4.38Å; N263-I265 HydrophobicContact CB-CG1 4.13Å; I265-T267 VanDerWaalsContact CG2-O 3.3Å; I265-T267 WeakPolarHBondContact CG2-O 3.47Å; I265-L268 HydrophobicContact CG2-CD2 3.96Å; I265-L284 HydrophobicContact CD1-CD2 4.46Å; I265-N287 HydrophobicContact CB-CB 4.45Å; I265-N287 VanDerWaalsContact CB-OD1 3.27Å; I265-N287 WeakPolarHBondContact CB-OD1 3.21Å; I265-N287 VanDerWaalsContact CG1-OD1 3.28Å; I265-N287 WeakPolarHBondContact CG1-OD1 3.09Å; I265-N287 PolarHBondContact N-OD1 3.03Å; I265-N287 VanDerWaalsContact N-OD1 3.11Å; I265-K288 CarbonylContact O-C 3.07Å; I265-K288 WeakPolarHBondContact O-CA 3.31Å; I265-K288 WeakPolarHBondContact O-CB 3.47Å; I265-K288 PolarHBondContact O-N 3.27Å; I265-L289 HydrophobicContact CG2-CD2 3.96Å; I265-L289 PolarHBondContact O-N 3.16Å; I265-L289 VanDerWaalsContact O-N 3.14Å
266	Q	96	Very high	96.7	Very high	114 Å²	114	34 Å²	34	53%	0.533	18%	0.179	S	C	.	.			trans	-101.7	-35.6	-178.3	-66.1	175.6	12.9	0	0	113.4	E264 K288	E264-Q266 PolarHBondContact O-N 3.38Å; Q266-K288 WeakPolarHBondContact CA-O 3.41Å; Q266-K288 HydrophobicContact CG-CB 3.95Å
267	T	94.9	Very high	96.6	Very high	95 Å²	95	31.8 Å²	31.8	58%	0.583	17%	0.171	S	C	*	.			trans	-135.7	154.1	-179.6	56.3	0	0	0	0	110.3	I265	I265-T267 VanDerWaalsContact CG2-O 3.3Å; I265-T267 WeakPolarHBondContact CG2-O 3.47Å
268	L	95.9	Very high	96.5	Very high	24 Å²	24	32.4 Å²	32.4	13%	0.126	18%	0.177	C	C	.	.			trans	-108.4	124.4	176.1	-64	-174.1	0	0	0	109.2	I265 P270 F273 L284 L289 V292 A296 W300	I265-L268 HydrophobicContact CG2-CD2 3.96Å; L268-P270 WeakPolarHBondContact O-CD 3.46Å; L268-F273 HydrophobicContact CB-CE2 3.98Å; L268-F273 HydrophobicContact CD1-CE2 4.17Å; L268-F273 HydrophobicContact CD1-CZ 4.29Å; L268-F273 HydrophobicContact CD2-CE2 4.15Å; L268-F273 HydrophobicContact CD2-CZ 4.16Å; L268-F273 HydrophobicContact CG-CE2 4.33Å; L268-L284 HydrophobicContact CD1-CD1 3.82Å; L268-L284 HydrophobicContact CD2-CD1 4.41Å; L268-L284 HydrophobicContact CD2-CD2 4.21Å; L268-L289 HydrophobicContact CD1-CD1 4.28Å; L268-L289 HydrophobicContact CD2-CD2 3.99Å; L268-L289 HydrophobicContact CG-CD1 4.41Å; L268-L289 HydrophobicContact CG-CD2 3.89Å; L268-V292 HydrophobicContact CD1-CG1 4.11Å; L268-V292 HydrophobicContact CD1-CG2 4.02Å; L268-A296 HydrophobicContact CB-CB 4.42Å; L268-W300 HydrophobicContact CD1-CH2 4.39Å; L268-W300 HydrophobicContact CD1-CZ2 3.78Å
269	D	94.9	Very high	96.5	Very high	61 Å²	61	32.6 Å²	32.6	33%	0.326	18%	0.178	S	C	.	.			trans	-78.9	116.3	170.6	170.8	6.8	0	0	0	108.7	A271 V272	D269-A271 PolarHBondContact O-N 2.03Å; D269-A271 VanDerWaalsContact O-N 3.16Å; D269-A271 VanDerWaalsContact OD1-CB 3.26Å; D269-A271 WeakPolarHBondContact OD1-CB 3.48Å; D269-A271 PolarHBondContact OD1-N 2.86Å; D269-V272 HydrophobicContact CB-CG2 3.79Å; D269-V272 VanDerWaalsContact O-CB 3.26Å; D269-V272 WeakPolarHBondContact O-CB 3.49Å; D269-V272 PolarHBondContact O-N 3.43Å
270	P	94.6	Very high	96.5	Very high	32 Å²	32	35.6 Å²	35.6	21%	0.208	19%	0.191	C	C	.	.	H	α-helix	trans	-55.9	-32.5	179.9	-25.4	34.7	0	0	0	113.3	L268 V272 F273 H274 E295 A296	L268-P270 WeakPolarHBondContact O-CD 3.46Å; P270-V272 PolarHBondContact O-N 2.82Å; P270-F273 PolarHBondContact O-N 2.58Å; P270-H274 PolarHBondContact O-CD2 3.1Å; P270-H274 VanDerWaalsContact O-CD2 3.23Å; P270-H274 PolarHBondContact O-N 2.7Å; P270-E295 HydrophobicContact CB-CB 3.75Å; P270-E295 HydrophobicContact CG-CB 3.63Å; P270-A296 HydrophobicContact CG-CB 4.28Å
271	A	93.8	Very high	96.5	Very high	24 Å²	24	37.4 Å²	37.4	20%	0.198	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-26.9	-179.2	0	0	0	0	0	112.6	Q246 D269 F273 C275	Q246-A271 HydrophobicContact CG-CB 3.97Å; Q246-A271 PolarHBondContact OE1-O 3.34Å; D269-A271 PolarHBondContact O-N 2.03Å; D269-A271 VanDerWaalsContact O-N 3.16Å; D269-A271 VanDerWaalsContact OD1-CB 3.26Å; D269-A271 WeakPolarHBondContact OD1-CB 3.48Å; D269-A271 PolarHBondContact OD1-N 2.86Å; A271-F273 VanDerWaalsContact C-N 3.25Å; A271-F273 PolarHBondContact O-N 2.95Å; A271-C275 PolarHBondContact O-N 3.09Å
272	V	94.8	Very high	96.5	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-31.5	172.2	175.8	0	0	0	0	112	F222 V244 N245 D269 P270 C275 L276	F222-V272 HydrophobicContact CD2-CG1 3.94Å; F222-V272 HydrophobicContact CE2-CG1 3.42Å; F222-V272 VanDerWaalsContact CE2-CG1 3.42Å; F222-V272 HydrophobicContact CZ-CG1 4.19Å; V244-V272 HydrophobicContact CB-CG1 4.43Å; V244-V272 HydrophobicContact CG1-CG1 3.7Å; V244-V272 HydrophobicContact CG1-CG2 4.19Å; V244-V272 WeakPolarHBondContact O-CG2 3.21Å; N245-V272 VanDerWaalsContact CA-CG2 3.49Å; D269-V272 HydrophobicContact CB-CG2 3.79Å; D269-V272 VanDerWaalsContact O-CB 3.26Å; D269-V272 WeakPolarHBondContact O-CB 3.49Å; D269-V272 PolarHBondContact O-N 3.43Å; P270-V272 PolarHBondContact O-N 2.82Å; V272-C275 PolarHBondContact O-SG 2.86Å; V272-L276 WeakPolarHBondContact O-CG 3.41Å
273	F	95.1	Very high	96.5	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-93.2	-31.6	-178.4	-62.6	-78.4	0	0	0	111.8	L268 P270 A271 C275 L276 L282 A299 W300	L268-F273 HydrophobicContact CB-CE2 3.98Å; L268-F273 HydrophobicContact CD1-CE2 4.17Å; L268-F273 HydrophobicContact CD1-CZ 4.29Å; L268-F273 HydrophobicContact CD2-CE2 4.15Å; L268-F273 HydrophobicContact CD2-CZ 4.16Å; L268-F273 HydrophobicContact CG-CE2 4.33Å; P270-F273 PolarHBondContact O-N 2.58Å; A271-F273 VanDerWaalsContact C-N 3.25Å; A271-F273 PolarHBondContact O-N 2.95Å; F273-C275 PolarHBondContact O-N 3.48Å; F273-L276 PolarHBondContact O-N 3.23Å; F273-L282 HydrophobicContact CD1-CD2 4.21Å; F273-L282 HydrophobicContact CE1-CD1 4.03Å; F273-L282 HydrophobicContact CE1-CD2 3.59Å; F273-L282 HydrophobicContact CE1-CG 4.48Å; F273-L282 HydrophobicContact CZ-CD2 4.35Å; F273-A299 HydrophobicContact CB-CB 3.62Å; F273-W300 AromaticContact CD1-CD1 3.7Å; F273-W300 AromaticContact CD1-NE1 3.27Å; F273-W300 VanDerWaalsContact CD1-NE1 3.27Å; F273-W300 AromaticContact CD2-NE1 3.9Å; F273-W300 AromaticContact CE1-NE1 3.66Å; F273-W300 AromaticContact CG-CD1 3.81Å; F273-W300 AromaticContact CG-NE1 3.4Å
274	H	94.2	Very high	96.4	Very high	107 Å²	107	37.2 Å²	37.2	50%	0.495	20%	0.198	S	C	.	.	H	α-helix	trans	-58.7	-31.8	169.2	-69.5	-54.3	0	0	0	113.1	P270 L276	P270-H274 PolarHBondContact O-CD2 3.1Å; P270-H274 VanDerWaalsContact O-CD2 3.23Å; P270-H274 PolarHBondContact O-N 2.7Å; H274-L276 PolarHBondContact O-N 3.2Å
275	C	94.8	Very high	96.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.6	175.1	79.5	0	0	0	0	114.2	W250 W252 A271 V272 F273 P277	W250-C275 WeakPolarHBondContact O-CB 3.35Å; W252-C275 PolarHBondContact N-O 2.81Å; A271-C275 PolarHBondContact O-N 3.09Å; V272-C275 PolarHBondContact O-SG 2.86Å; F273-C275 PolarHBondContact O-N 3.48Å; C275-P277 VanDerWaalsContact O-CD 3.24Å; C275-P277 WeakPolarHBondContact O-CD 3.28Å
276	L	96.4	Very high	96.3	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.031	21%	0.214	C	C	.	.			trans	-117.7	57.8	-176.3	-57.2	-175.9	0	0	0	113.3	F222 W252 L255 L258 V272 F273 H274 N278 L279	F222-L276 HydrophobicContact CE2-CD1 3.9Å; F222-L276 HydrophobicContact CE2-CD2 4.5Å; F222-L276 HydrophobicContact CE2-CG 4.45Å; W252-L276 HydrophobicContact CB-CD2 3.82Å; W252-L276 HydrophobicContact CD2-CD2 4.38Å; W252-L276 HydrophobicContact CE3-CD2 3.97Å; W252-L276 HydrophobicContact CG-CD2 4.37Å; L255-L276 HydrophobicContact CB-CD2 4.36Å; L255-L276 HydrophobicContact CD2-CD1 4.13Å; L255-L276 HydrophobicContact CD2-CD2 3.78Å; L258-L276 HydrophobicContact CD2-CD1 3.87Å; V272-L276 WeakPolarHBondContact O-CG 3.41Å; F273-L276 PolarHBondContact O-N 3.23Å; H274-L276 PolarHBondContact O-N 3.2Å; L276-N278 PolarHBondContact O-N 2.94Å; L276-N278 VanDerWaalsContact O-N 3.09Å; L276-L279 HydrophobicContact CB-CB 4.1Å; L276-L279 HydrophobicContact CD1-CD2 4.04Å; L276-L279 WeakPolarHBondContact O-CB 3.4Å; L276-L279 PolarHBondContact O-N 3.49Å; L276-L279 VanDerWaalsContact O-N 3.17Å
277	P	96.1	Very high	96.4	Very high	25 Å²	25	34.2 Å²	34.2	16%	0.162	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.1	-169.2	26.7	-36.5	0	0	0	114.8	Y253 C275 I301 S302	Y253-P277 HydrophobicContact CD1-CG 3.75Å; Y253-P277 HydrophobicContact CE1-CG 4.03Å; C275-P277 VanDerWaalsContact O-CD 3.24Å; C275-P277 WeakPolarHBondContact O-CD 3.28Å; P277-I301 HydrophobicContact CB-CD1 4.22Å; P277-S302 VanDerWaalsContact O-CB 3.25Å; P277-S302 WeakPolarHBondContact O-CB 3.36Å; P277-S302 PolarHBondContact O-OG 2.77Å
278	N	97.6	Very high	96.6	Very high	73 Å²	73	34.2 Å²	34.2	39%	0.39	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	14.6	-177.6	-69.6	-26.9	0	0	0	113.4	Y253 L255 L276 Q280	Y253-N278 WeakPolarHBondContact O-CB 3.31Å; Y253-N278 PolarHBondContact O-ND2 2.61Å; L255-N278 CarbonylContact O-C 3.56Å; L276-N278 PolarHBondContact O-N 2.94Å; L276-N278 VanDerWaalsContact O-N 3.09Å; N278-Q280 PolarHBondContact O-N 3.41Å
279	L	98.3	Very high	96.6	Very high	6 Å²	6	33 Å²	33	3%	0.031	17%	0.174	C	C	.	.			trans	-65.9	125.3	178	-170.4	69.1	0	0	0	110.5	L255 L258 L276 L282 S302 L303	L255-L279 PolarHBondContact O-N 3.45Å; L258-L279 HydrophobicContact CB-CD1 3.74Å; L258-L279 HydrophobicContact CB-CD2 4.46Å; L276-L279 HydrophobicContact CB-CB 4.1Å; L276-L279 HydrophobicContact CD1-CD2 4.04Å; L276-L279 WeakPolarHBondContact O-CB 3.4Å; L276-L279 PolarHBondContact O-N 3.49Å; L276-L279 VanDerWaalsContact O-N 3.17Å; L279-L282 HydrophobicContact CD2-CB 4.09Å; L279-L282 HydrophobicContact CD2-CD1 4.29Å; L279-L282 HydrophobicContact CD2-CD2 4.49Å; L279-S302 CarbonylContact O-C 3.52Å; L279-S302 WeakPolarHBondContact O-CB 3.48Å; L279-S302 VanDerWaalsContact O-O 3.14Å; L279-L303 HydrophobicContact CB-CD2 4.38Å; L279-L303 HydrophobicContact CD2-CD2 4.04Å; L279-L303 HydrophobicContact CG-CD2 3.92Å; L279-L303 PolarHBondContact O-N 2.96Å
280	Q	98.3	Very high	96.7	Very high	83 Å²	83	32.1 Å²	32.1	39%	0.388	17%	0.172	S	C	.	.			trans	-109	-33	-178	-63.6	178.9	-2.9	0	0	112.4	Q256 N278 T304 T305	Q256-Q280 WeakPolarHBondContact O-CA 3.37Å; Q256-Q280 PolarHBondContact O-N 2.8Å; N278-Q280 PolarHBondContact O-N 3.41Å; Q280-T304 HydrophobicContact CB-CG2 4.39Å; Q280-T304 PolarHBondContact O-N 2.97Å; Q280-T304 PolarHBondContact O-OG1 2.95Å; Q280-T304 VanDerWaalsContact O-OG1 3.1Å; Q280-T305 PolarHBondContact O-N 3.09Å
281	V	98.6	Very high	96.7	Very high	39 Å²	39	33.5 Å²	33.5	24%	0.236	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	116.6	-176.9	-177.8	0	0	0	0	109.2	Q256 K257 L258 T305	Q256-V281 PolarHBondContact O-N 3.08Å; K257-V281 WeakPolarHBondContact CA-O 3.27Å; K257-V281 HydrophobicContact CB-CB 4.15Å; K257-V281 HydrophobicContact CD-CG1 4.42Å; K257-V281 HydrophobicContact CG-CB 3.99Å; K257-V281 HydrophobicContact CG-CG1 4.08Å; L258-V281 PolarHBondContact N-O 3.05Å; V281-T305 WeakPolarHBondContact CA-O 3.39Å; V281-T305 HydrophobicContact CG1-CG2 4.36Å
282	L	98.4	Very high	96.8	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.6	176.5	176.3	58.8	0	0	0	110.1	L258 F273 L279 L284 W300 L303 T305 I306 S307	L258-L282 HydrophobicContact CB-CD1 4.44Å; L258-L282 HydrophobicContact CD2-CD1 4.19Å; L258-L282 HydrophobicContact CG-CD1 4.34Å; F273-L282 HydrophobicContact CD1-CD2 4.21Å; F273-L282 HydrophobicContact CE1-CD1 4.03Å; F273-L282 HydrophobicContact CE1-CD2 3.59Å; F273-L282 HydrophobicContact CE1-CG 4.48Å; F273-L282 HydrophobicContact CZ-CD2 4.35Å; L279-L282 HydrophobicContact CD2-CB 4.09Å; L279-L282 HydrophobicContact CD2-CD1 4.29Å; L279-L282 HydrophobicContact CD2-CD2 4.49Å; L282-L284 HydrophobicContact CD1-CD1 4.23Å; L282-L284 HydrophobicContact CD1-CD2 4.44Å; L282-L284 HydrophobicContact CD1-CG 3.97Å; L282-L284 HydrophobicContact CD2-CD1 3.82Å; L282-L284 HydrophobicContact CD2-CG 4.42Å; L282-L284 HydrophobicContact CG-CD1 3.97Å; L282-L284 HydrophobicContact CG-CG 4.03Å; L282-W300 HydrophobicContact CD2-CZ2 4.08Å; L282-L303 HydrophobicContact CB-CD1 4.1Å; L282-L303 HydrophobicContact CB-CD2 3.68Å; L282-L303 HydrophobicContact CD2-CD1 4.08Å; L282-T305 PolarHBondContact N-O 3.13Å; L282-I306 WeakPolarHBondContact O-CA 3.5Å; L282-S307 PolarHBondContact O-N 3.4Å; L282-S307 VanDerWaalsContact O-N 3.13Å
283	N	98.3	Very high	96.8	Very high	22 Å²	22	34.5 Å²	34.5	12%	0.118	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.9	174.3	-173	4.8	0	0	0	110.3	L258 D259 L260 S261 E285 S307	L258-N283 PolarHBondContact O-N 3.03Å; D259-N283 HydrophobicContact CB-CB 4.32Å; D259-N283 VanDerWaalsContact CG-ND2 3.35Å; D259-N283 WeakPolarHBondContact OD1-CB 3.13Å; D259-N283 PolarHBondContact OD1-ND2 2.78Å; D259-N283 VanDerWaalsContact OD1-ND2 3.12Å; D259-N283 PolarHBondContact OD2-ND2 2.8Å; L260-N283 CarbonylContact C-O 3.28Å; L260-N283 WeakPolarHBondContact CA-O 3.35Å; L260-N283 PolarHBondContact N-O 2.71Å; S261-N283 WeakPolarHBondContact CB-ND2 3.02Å; S261-N283 PolarHBondContact N-O 2.87Å; S261-N283 PolarHBondContact OG-ND2 2.92Å; N283-E285 VanDerWaalsContact OD1-CB 3.22Å; N283-E285 WeakPolarHBondContact OD1-CB 3.05Å; N283-E285 PolarHBondContact OD1-N 3.34Å; N283-E285 VanDerWaalsContact OD1-N 3.09Å; N283-S307 VanDerWaalsContact OD1-CB 3.28Å; N283-S307 WeakPolarHBondContact OD1-CB 3.17Å
284	L	97.6	Very high	96.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.			trans	-121.3	16.2	177.7	-72.7	168	0	0	0	111.5	L260 I265 L268 L282 N287 L289 W300 S307 L308 N311	L260-L284 HydrophobicContact CB-CD2 4.03Å; L260-L284 HydrophobicContact CD1-CD2 4.11Å; I265-L284 HydrophobicContact CD1-CD2 4.46Å; L268-L284 HydrophobicContact CD1-CD1 3.82Å; L268-L284 HydrophobicContact CD2-CD1 4.41Å; L268-L284 HydrophobicContact CD2-CD2 4.21Å; L282-L284 HydrophobicContact CD1-CD1 4.23Å; L282-L284 HydrophobicContact CD1-CD2 4.44Å; L282-L284 HydrophobicContact CD1-CG 3.97Å; L282-L284 HydrophobicContact CD2-CD1 3.82Å; L282-L284 HydrophobicContact CD2-CG 4.42Å; L282-L284 HydrophobicContact CG-CD1 3.97Å; L282-L284 HydrophobicContact CG-CG 4.03Å; L284-N287 PolarHBondContact O-ND2 3.07Å; L284-L289 HydrophobicContact CB-CD1 4.34Å; L284-L289 HydrophobicContact CD1-CD1 4.35Å; L284-W300 HydrophobicContact CD1-CZ2 4.31Å; L284-S307 CarbonylContact C-O 3.08Å; L284-S307 WeakPolarHBondContact CA-O 3.34Å; L284-S307 PolarHBondContact N-O 2.98Å; L284-L308 HydrophobicContact CB-CD2 4.06Å; L284-L308 HydrophobicContact CD1-CD2 4.16Å; L284-N311 PolarHBondContact O-ND2 3.15Å
285	E	96.9	Very high	96.9	Very high	73 Å²	73	36.6 Å²	36.6	34%	0.341	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	150	-179.3	-164.2	-169	140.7	0	0	112.2	S261 G262 N283 N287 S307 A309	S261-E285 CarbonylContact C-O 3.5Å; S261-E285 WeakPolarHBondContact CA-O 3.38Å; S261-E285 WeakPolarHBondContact CB-O 3.28Å; G262-E285 PolarHBondContact N-O 3.15Å; N283-E285 VanDerWaalsContact OD1-CB 3.22Å; N283-E285 WeakPolarHBondContact OD1-CB 3.05Å; N283-E285 PolarHBondContact OD1-N 3.34Å; N283-E285 VanDerWaalsContact OD1-N 3.09Å; E285-N287 VanDerWaalsContact C-N 3.33Å; E285-N287 PolarHBondContact O-N 3.06Å; E285-N287 PolarHBondContact O-ND2 3.46Å; E285-N287 VanDerWaalsContact O-ND2 3.17Å; E285-S307 PolarHBondContact N-O 3.14Å; E285-A309 CarbonylContact C-O 3.47Å; E285-A309 VanDerWaalsContact CA-O 3.28Å; E285-A309 WeakPolarHBondContact CA-O 3.24Å; E285-A309 HydrophobicContact CG-CB 4.2Å; E285-A309 WeakPolarHBondContact CG-O 3.3Å
286	S	97.1	Very high	97	Very high	39 Å²	39	36.5 Å²	36.5	27%	0.273	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	43.1	173	-65	0	0	0	0	114	G262 A309 G310	G262-S286 VanDerWaalsContact CA-O 3.27Å; G262-S286 WeakPolarHBondContact CA-O 3.45Å; G262-S286 PolarHBondContact N-O 2.88Å; S286-A309 PolarHBondContact N-O 3.16Å; S286-G310 WeakPolarHBondContact CA-O 3.14Å
287	N	98.3	Very high	97	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-105.4	-159.2	174.4	-90.3	-83.9	0	0	0	111.3	L260 N263 I265 L284 E285 L289 N311	L260-N287 PolarHBondContact O-ND2 2.94Å; N263-N287 WeakPolarHBondContact CA-OD1 3.35Å; N263-N287 WeakPolarHBondContact CB-OD1 3.27Å; N263-N287 PolarHBondContact O-OD1 2.95Å; I265-N287 HydrophobicContact CB-CB 4.45Å; I265-N287 VanDerWaalsContact CB-OD1 3.27Å; I265-N287 WeakPolarHBondContact CB-OD1 3.21Å; I265-N287 VanDerWaalsContact CG1-OD1 3.28Å; I265-N287 WeakPolarHBondContact CG1-OD1 3.09Å; I265-N287 PolarHBondContact N-OD1 3.03Å; I265-N287 VanDerWaalsContact N-OD1 3.11Å; L284-N287 PolarHBondContact O-ND2 3.07Å; E285-N287 VanDerWaalsContact C-N 3.33Å; E285-N287 PolarHBondContact O-N 3.06Å; E285-N287 PolarHBondContact O-ND2 3.46Å; E285-N287 VanDerWaalsContact O-ND2 3.17Å; N287-L289 HydrophobicContact CB-CG 4.42Å; N287-N311 VanDerWaalsContact CA-OD1 3.25Å; N287-N311 WeakPolarHBondContact CA-OD1 3.42Å; N287-N311 WeakPolarHBondContact CB-OD1 3.47Å; N287-N311 PolarHBondContact N-OD1 2.93Å
288	K	97.9	Very high	97	Very high	94 Å²	94	37.7 Å²	37.7	41%	0.409	20%	0.2	S	C	.	.			trans	-121.8	27.9	178.3	-57.1	-62.7	164.8	-149.6	0	112.4	I265 Q266 N311 I312	I265-K288 CarbonylContact O-C 3.07Å; I265-K288 WeakPolarHBondContact O-CA 3.31Å; I265-K288 WeakPolarHBondContact O-CB 3.47Å; I265-K288 PolarHBondContact O-N 3.27Å; Q266-K288 WeakPolarHBondContact CA-O 3.41Å; Q266-K288 HydrophobicContact CG-CB 3.95Å; K288-N311 PolarHBondContact N-OD1 3.44Å; K288-I312 HydrophobicContact CB-CD1 4.14Å; K288-I312 HydrophobicContact CB-CG1 4.5Å; K288-I312 HydrophobicContact CD-CD1 4.49Å; K288-I312 HydrophobicContact CD-CG2 4.47Å; K288-I312 WeakPolarHBondContact O-CD1 3.32Å; K288-I312 WeakPolarHBondContact O-CG1 3.27Å
289	L	96.9	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.			trans	-67.9	132.3	176.2	-57.5	175.5	0	0	0	110.2	I265 L268 L284 N287 N311 I312 W313	I265-L289 HydrophobicContact CG2-CD2 3.96Å; I265-L289 PolarHBondContact O-N 3.16Å; I265-L289 VanDerWaalsContact O-N 3.14Å; L268-L289 HydrophobicContact CD1-CD1 4.28Å; L268-L289 HydrophobicContact CD2-CD2 3.99Å; L268-L289 HydrophobicContact CG-CD1 4.41Å; L268-L289 HydrophobicContact CG-CD2 3.89Å; L284-L289 HydrophobicContact CB-CD1 4.34Å; L284-L289 HydrophobicContact CD1-CD1 4.35Å; N287-L289 HydrophobicContact CB-CG 4.42Å; L289-N311 HydrophobicContact CB-CB 4.22Å; L289-N311 WeakPolarHBondContact CB-OD1 3.46Å; L289-N311 WeakPolarHBondContact CG-OD1 3.47Å; L289-N311 PolarHBondContact N-OD1 3.24Å; L289-I312 CarbonylContact O-C 3.54Å; L289-I312 VanDerWaalsContact O-C 3.28Å; L289-I312 WeakPolarHBondContact O-CG1 3.26Å; L289-I312 PolarHBondContact O-N 3.06Å; L289-W313 HydrophobicContact CB-CH2 3.74Å; L289-W313 HydrophobicContact CB-CZ2 4.38Å; L289-W313 HydrophobicContact CB-CZ3 3.86Å; L289-W313 HydrophobicContact CD1-CH2 3.89Å; L289-W313 HydrophobicContact CD1-CZ2 4.49Å; L289-W313 HydrophobicContact CG-CH2 4.48Å
290	S	95.9	Very high	96.8	Very high	41 Å²	41	34.8 Å²	34.8	29%	0.287	19%	0.185	S	C	.	.	S	Bend	trans	-100	-33.1	170.9	55.9	0	0	0	0	112.4	W313 D314	S290-W313 WeakPolarHBondContact O-CA 3.38Å; S290-D314 PolarHBondContact O-N 3.18Å
291	N	94.8	Very high	96.7	Very high	62 Å²	62	36.9 Å²	36.9	33%	0.332	20%	0.197	S	C	.	.			trans	-151.1	178	174	60.4	35	0	0	0	110.5
292	V	95.9	Very high	96.6	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	20%	0.201	C	C	.	.			trans	-135.8	132.5	169.5	-178.3	0	0	0	0	107.5	L268 A296 V297 W300 W313 L322	L268-V292 HydrophobicContact CD1-CG1 4.11Å; L268-V292 HydrophobicContact CD1-CG2 4.02Å; V292-A296 HydrophobicContact CG1-CB 3.62Å; V292-V297 HydrophobicContact CB-CG1 4.29Å; V292-V297 HydrophobicContact CG1-CG1 3.63Å; V292-W300 HydrophobicContact CG1-CH2 3.86Å; V292-W300 HydrophobicContact CG1-CZ2 4.13Å; V292-W300 HydrophobicContact CG2-CH2 4.27Å; V292-W313 HydrophobicContact CG2-CH2 3.89Å; V292-W313 HydrophobicContact CG2-CZ3 3.94Å; V292-L322 HydrophobicContact CB-CB 4.34Å; V292-L322 HydrophobicContact CB-CD1 4.3Å; V292-L322 HydrophobicContact CB-CD2 4.32Å; V292-L322 HydrophobicContact CG2-CD1 4.32Å; V292-L322 HydrophobicContact CG2-CD2 3.98Å
293	S	95.9	Very high	96.6	Very high	43 Å²	43	37.9 Å²	37.9	30%	0.301	21%	0.205	S	C	.	.			trans	-75.1	164	-176.4	84	0	0	0	0	112.8	E295 A296 V297	S293-E295 VanDerWaalsContact C-N 3.28Å; S293-E295 WeakPolarHBondContact CB-OE2 3.2Å; S293-E295 PolarHBondContact O-N 3.3Å; S293-E295 PolarHBondContact OG-OE2 2.93Å; S293-A296 PolarHBondContact O-N 3.27Å; S293-A296 PolarHBondContact OG-N 3.11Å; S293-V297 PolarHBondContact O-N 2.76Å
294	Q	95.5	Very high	96.5	Very high	53 Å²	53	40.1 Å²	40.1	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-40	178.1	-176.7	63.3	25.7	0	0	111.8	A296 V297 T298 P321	Q294-A296 PolarHBondContact O-N 3.11Å; Q294-V297 VanDerWaalsContact O-CG2 3.28Å; Q294-V297 WeakPolarHBondContact O-CG2 3.15Å; Q294-V297 PolarHBondContact O-N 2.72Å; Q294-T298 HydrophobicContact CG-CG2 4.43Å; Q294-T298 WeakPolarHBondContact O-CG2 3.05Å; Q294-T298 PolarHBondContact O-N 3.44Å; Q294-T298 PolarHBondContact O-OG1 3.27Å; Q294-T298 VanDerWaalsContact O-OG1 3.1Å; Q294-P321 HydrophobicContact CB-CB 4.23Å; Q294-P321 HydrophobicContact CB-CG 4.35Å
295	E	96.2	Very high	96.6	Very high	104 Å²	104	42.2 Å²	42.2	49%	0.486	23%	0.232	S	C	.	.	H	α-helix	trans	-67.9	-36	-179	-50.7	74.2	-160.2	0	0	111.7	P270 S293 T298 A299	P270-E295 HydrophobicContact CB-CB 3.75Å; P270-E295 HydrophobicContact CG-CB 3.63Å; S293-E295 VanDerWaalsContact C-N 3.28Å; S293-E295 WeakPolarHBondContact CB-OE2 3.2Å; S293-E295 PolarHBondContact O-N 3.3Å; S293-E295 PolarHBondContact OG-OE2 2.93Å; E295-T298 WeakPolarHBondContact CA-OG1 3.41Å; E295-T298 PolarHBondContact O-OG1 2.78Å; E295-T298 VanDerWaalsContact O-OG1 3.13Å; E295-A299 WeakPolarHBondContact O-CB 3.34Å; E295-A299 PolarHBondContact O-N 3.19Å
296	A	96.1	Very high	96.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.6	-39.3	177.1	0	0	0	0	0	111.9	L268 P270 V292 S293 Q294 W300	L268-A296 HydrophobicContact CB-CB 4.42Å; P270-A296 HydrophobicContact CG-CB 4.28Å; V292-A296 HydrophobicContact CG1-CB 3.62Å; S293-A296 PolarHBondContact O-N 3.27Å; S293-A296 PolarHBondContact OG-N 3.11Å; Q294-A296 PolarHBondContact O-N 3.11Å; A296-W300 VanDerWaalsContact O-CD1 3.32Å; A296-W300 PolarHBondContact O-NE1 3.24Å
297	V	96.3	Very high	96.6	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-76.4	-30.9	177.8	-57.3	0	0	0	0	113.4	V292 S293 Q294 A299 W300 P321 L322 W325	V292-V297 HydrophobicContact CB-CG1 4.29Å; V292-V297 HydrophobicContact CG1-CG1 3.63Å; S293-V297 PolarHBondContact O-N 2.76Å; Q294-V297 VanDerWaalsContact O-CG2 3.28Å; Q294-V297 WeakPolarHBondContact O-CG2 3.15Å; Q294-V297 PolarHBondContact O-N 2.72Å; V297-A299 VanDerWaalsContact C-N 3.28Å; V297-A299 PolarHBondContact O-N 3.49Å; V297-W300 HydrophobicContact CB-CE3 4.18Å; V297-W300 HydrophobicContact CB-CZ3 4.44Å; V297-W300 HydrophobicContact CG1-CE3 3.98Å; V297-W300 HydrophobicContact CG1-CH2 4.26Å; V297-W300 HydrophobicContact CG1-CZ3 3.74Å; V297-W300 WeakPolarHBondContact O-CB 3.25Å; V297-W300 PolarHBondContact O-N 3.19Å; V297-P321 HydrophobicContact CG2-CB 4.41Å; V297-L322 HydrophobicContact CG1-CD1 4.09Å; V297-W325 HydrophobicContact CB-CB 3.97Å; V297-W325 HydrophobicContact CB-CG 3.86Å; V297-W325 HydrophobicContact CG1-CB 4.37Å; V297-W325 HydrophobicContact CG1-CG 4.47Å; V297-W325 HydrophobicContact CG2-CB 4.14Å; V297-W325 HydrophobicContact CG2-CG 4.43Å; V297-W325 PolarHBondContact O-NE1 3.01Å
298	T	95.8	Very high	96.5	Very high	54 Å²	54	38.5 Å²	38.5	33%	0.331	21%	0.214	S	C	.	.	H	α-helix	trans	-70.6	-25.6	173.5	55	0	0	0	0	112.4	Q294 E295 W300 I301 M367	Q294-T298 HydrophobicContact CG-CG2 4.43Å; Q294-T298 WeakPolarHBondContact O-CG2 3.05Å; Q294-T298 PolarHBondContact O-N 3.44Å; Q294-T298 PolarHBondContact O-OG1 3.27Å; Q294-T298 VanDerWaalsContact O-OG1 3.1Å; E295-T298 WeakPolarHBondContact CA-OG1 3.41Å; E295-T298 PolarHBondContact O-OG1 2.78Å; E295-T298 VanDerWaalsContact O-OG1 3.13Å; T298-W300 VanDerWaalsContact C-N 3.25Å; T298-W300 PolarHBondContact O-N 2.73Å; T298-I301 WeakPolarHBondContact O-CG2 3.09Å; T298-M367 HydrophobicContact CG2-SD 4.17Å
299	A	96.3	Very high	96.4	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.7	171.3	0	0	0	0	0	113.8	F273 E295 V297 I301	F273-A299 HydrophobicContact CB-CB 3.62Å; E295-A299 WeakPolarHBondContact O-CB 3.34Å; E295-A299 PolarHBondContact O-N 3.19Å; V297-A299 VanDerWaalsContact C-N 3.28Å; V297-A299 PolarHBondContact O-N 3.49Å; A299-I301 PolarHBondContact O-N 2.98Å
300	W	96.2	Very high	96.3	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.042	22%	0.221	C	C	.	.			trans	-81.6	55.5	-178	-64.6	-15.1	0	0	0	113.6	L268 F273 L282 L284 V292 A296 V297 T298 S302 L303 I306 L322 W325	L268-W300 HydrophobicContact CD1-CH2 4.39Å; L268-W300 HydrophobicContact CD1-CZ2 3.78Å; F273-W300 AromaticContact CD1-CD1 3.7Å; F273-W300 AromaticContact CD1-NE1 3.27Å; F273-W300 VanDerWaalsContact CD1-NE1 3.27Å; F273-W300 AromaticContact CD2-NE1 3.9Å; F273-W300 AromaticContact CE1-NE1 3.66Å; F273-W300 AromaticContact CG-CD1 3.81Å; F273-W300 AromaticContact CG-NE1 3.4Å; L282-W300 HydrophobicContact CD2-CZ2 4.08Å; L284-W300 HydrophobicContact CD1-CZ2 4.31Å; V292-W300 HydrophobicContact CG1-CH2 3.86Å; V292-W300 HydrophobicContact CG1-CZ2 4.13Å; V292-W300 HydrophobicContact CG2-CH2 4.27Å; A296-W300 VanDerWaalsContact O-CD1 3.32Å; A296-W300 PolarHBondContact O-NE1 3.24Å; V297-W300 HydrophobicContact CB-CE3 4.18Å; V297-W300 HydrophobicContact CB-CZ3 4.44Å; V297-W300 HydrophobicContact CG1-CE3 3.98Å; V297-W300 HydrophobicContact CG1-CH2 4.26Å; V297-W300 HydrophobicContact CG1-CZ3 3.74Å; V297-W300 WeakPolarHBondContact O-CB 3.25Å; V297-W300 PolarHBondContact O-N 3.19Å; T298-W300 VanDerWaalsContact C-N 3.25Å; T298-W300 PolarHBondContact O-N 2.73Å; W300-S302 PolarHBondContact O-N 3.05Å; W300-L303 HydrophobicContact CB-CD1 3.73Å; W300-L303 HydrophobicContact CB-CG 4.14Å; W300-L303 HydrophobicContact CD2-CD1 3.99Å; W300-L303 HydrophobicContact CE3-CD1 4.32Å; W300-L303 HydrophobicContact CG-CD1 3.74Å; W300-I306 HydrophobicContact CD2-CD1 4.48Å; W300-I306 HydrophobicContact CE3-CD1 3.82Å; W300-I306 HydrophobicContact CH2-CD1 3.96Å; W300-I306 HydrophobicContact CZ3-CD1 3.52Å; W300-L322 HydrophobicContact CH2-CD1 4.2Å; W300-L322 HydrophobicContact CZ3-CD1 3.81Å; W300-W325 HydrophobicContact CB-CZ2 3.8Å; W300-W325 HydrophobicContact CD2-CZ2 4.48Å; W300-W325 HydrophobicContact CE3-CD2 4.05Å; W300-W325 AromaticContact CE3-CE2 3.87Å; W300-W325 HydrophobicContact CE3-CE3 4.1Å; W300-W325 AromaticContact CE3-CH2 3.87Å; W300-W325 HydrophobicContact CE3-CH2 3.87Å; W300-W325 AromaticContact CE3-CZ2 3.79Å; W300-W325 HydrophobicContact CE3-CZ2 3.79Å; W300-W325 HydrophobicContact CE3-CZ3 4.01Å; W300-W325 HydrophobicContact CZ3-CE3 4.26Å; W300-W325 HydrophobicContact CZ3-CH2 4.48Å; W300-W325 HydrophobicContact CZ3-CZ3 4.22Å
301	I	95.1	Very high	96.3	Very high	126 Å²	126	35 Å²	35	65%	0.646	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-29.1	-170.1	59.8	171.7	0	0	0	115.4	P277 T298 A299	P277-I301 HydrophobicContact CB-CD1 4.22Å; T298-I301 WeakPolarHBondContact O-CG2 3.09Å; A299-I301 PolarHBondContact O-N 2.98Å
302	S	96.9	Very high	96.4	Very high	44 Å²	44	35.7 Å²	35.7	31%	0.308	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	5.1	-169.1	-67	0	0	0	0	114.7	P277 L279 W300 T304	P277-S302 VanDerWaalsContact O-CB 3.25Å; P277-S302 WeakPolarHBondContact O-CB 3.36Å; P277-S302 PolarHBondContact O-OG 2.77Å; L279-S302 CarbonylContact O-C 3.52Å; L279-S302 WeakPolarHBondContact O-CB 3.48Å; L279-S302 VanDerWaalsContact O-O 3.14Å; W300-S302 PolarHBondContact O-N 3.05Å; S302-T304 PolarHBondContact O-N 2.94Å
303	L	97.9	Very high	96.4	Very high	18 Å²	18	35.6 Å²	35.6	9%	0.094	21%	0.211	C	C	.	.			trans	-63.9	137.4	-175.6	-69.9	-175.7	0	0	0	111.7	L279 L282 W300 I306 W325 F329	L279-L303 HydrophobicContact CB-CD2 4.38Å; L279-L303 HydrophobicContact CD2-CD2 4.04Å; L279-L303 HydrophobicContact CG-CD2 3.92Å; L279-L303 PolarHBondContact O-N 2.96Å; L282-L303 HydrophobicContact CB-CD1 4.1Å; L282-L303 HydrophobicContact CB-CD2 3.68Å; L282-L303 HydrophobicContact CD2-CD1 4.08Å; W300-L303 HydrophobicContact CB-CD1 3.73Å; W300-L303 HydrophobicContact CB-CG 4.14Å; W300-L303 HydrophobicContact CD2-CD1 3.99Å; W300-L303 HydrophobicContact CE3-CD1 4.32Å; W300-L303 HydrophobicContact CG-CD1 3.74Å; L303-I306 HydrophobicContact CD1-CB 4.42Å; L303-I306 HydrophobicContact CD1-CD1 3.92Å; L303-I306 HydrophobicContact CD1-CG1 4.34Å; L303-W325 HydrophobicContact CB-CZ2 4.48Å; L303-W325 HydrophobicContact CD1-CH2 4.05Å; L303-W325 HydrophobicContact CD1-CZ2 4.19Å; L303-F329 HydrophobicContact CB-CE2 3.82Å; L303-F329 HydrophobicContact CB-CZ 4.13Å; L303-F329 VanDerWaalsContact O-CE2 3.22Å; L303-F329 WeakPolarHBondContact O-CE2 3.41Å
304	T	97.8	Very high	96.4	Very high	68 Å²	68	36.1 Å²	36.1	42%	0.417	21%	0.21	S	C	.	.	S	Bend	trans	-117.4	-23.7	171.9	68.9	0	0	0	0	111.8	Q280 S302 G331 S332	Q280-T304 HydrophobicContact CB-CG2 4.39Å; Q280-T304 PolarHBondContact O-N 2.97Å; Q280-T304 PolarHBondContact O-OG1 2.95Å; Q280-T304 VanDerWaalsContact O-OG1 3.1Å; S302-T304 PolarHBondContact O-N 2.94Å; T304-G331 CarbonylContact O-C 3.54Å; T304-G331 WeakPolarHBondContact O-CA 3.43Å; T304-S332 PolarHBondContact O-N 3.29Å
305	T	98.1	Very high	96.3	Very high	44 Å²	44	33.6 Å²	33.6	27%	0.27	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	131.5	176.2	-56.2	0	0	0	0	110.8	Q280 V281 L282 S332	Q280-T305 PolarHBondContact O-N 3.09Å; V281-T305 WeakPolarHBondContact CA-O 3.39Å; V281-T305 HydrophobicContact CG1-CG2 4.36Å; L282-T305 PolarHBondContact N-O 3.13Å; T305-S332 CarbonylContact C-O 3.55Å; T305-S332 VanDerWaalsContact CA-O 3.25Å; T305-S332 WeakPolarHBondContact CA-O 3.33Å
306	I	97.3	Very high	96.1	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.5	177	-165.3	174.8	0	0	0	112.1	L282 W300 L303 L308 W325 F329 S332 K333 D334	L282-I306 WeakPolarHBondContact O-CA 3.5Å; W300-I306 HydrophobicContact CD2-CD1 4.48Å; W300-I306 HydrophobicContact CE3-CD1 3.82Å; W300-I306 HydrophobicContact CH2-CD1 3.96Å; W300-I306 HydrophobicContact CZ3-CD1 3.52Å; L303-I306 HydrophobicContact CD1-CB 4.42Å; L303-I306 HydrophobicContact CD1-CD1 3.92Å; L303-I306 HydrophobicContact CD1-CG1 4.34Å; I306-L308 HydrophobicContact CD1-CD1 3.81Å; I306-L308 HydrophobicContact CD1-CG 4.16Å; I306-L308 HydrophobicContact CG1-CD1 4.17Å; I306-L308 HydrophobicContact CG1-CG 4.09Å; I306-W325 HydrophobicContact CD1-CH2 3.78Å; I306-W325 HydrophobicContact CD1-CZ3 3.76Å; I306-W325 HydrophobicContact CG2-CH2 4.15Å; I306-W325 HydrophobicContact CG2-CZ3 4.04Å; I306-F329 HydrophobicContact CG2-CD1 4.13Å; I306-F329 HydrophobicContact CG2-CE1 3.67Å; I306-F329 HydrophobicContact CG2-CZ 4.11Å; I306-S332 PolarHBondContact N-O 2.89Å; I306-K333 HydrophobicContact CG2-CB 3.9Å; I306-K333 WeakPolarHBondContact O-CA 3.38Å; I306-D334 PolarHBondContact O-N 2.89Å
307	S	97.1	Very high	95.8	Very high	29 Å²	29	33 Å²	33	20%	0.203	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.6	176.2	-67.1	0	0	0	0	110.6	L282 N283 L284 E285	L282-S307 PolarHBondContact O-N 3.4Å; L282-S307 VanDerWaalsContact O-N 3.13Å; N283-S307 VanDerWaalsContact OD1-CB 3.28Å; N283-S307 WeakPolarHBondContact OD1-CB 3.17Å; L284-S307 CarbonylContact C-O 3.08Å; L284-S307 WeakPolarHBondContact CA-O 3.34Å; L284-S307 PolarHBondContact N-O 2.98Å; E285-S307 PolarHBondContact N-O 3.14Å
308	L	96.3	Very high	95.6	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	23%	0.233	C	C	.	.			trans	-138	1.2	-169.2	-75	169.3	0	0	0	113.9	L284 I306 N311 W313 L322 L326 M337	L284-L308 HydrophobicContact CB-CD2 4.06Å; L284-L308 HydrophobicContact CD1-CD2 4.16Å; I306-L308 HydrophobicContact CD1-CD1 3.81Å; I306-L308 HydrophobicContact CD1-CG 4.16Å; I306-L308 HydrophobicContact CG1-CD1 4.17Å; I306-L308 HydrophobicContact CG1-CG 4.09Å; L308-N311 PolarHBondContact O-ND2 2.75Å; L308-N311 VanDerWaalsContact O-ND2 3.1Å; L308-W313 HydrophobicContact CB-CZ2 3.98Å; L308-W313 HydrophobicContact CD2-CH2 4.04Å; L308-W313 HydrophobicContact CD2-CZ2 3.87Å; L308-W313 HydrophobicContact CG-CZ2 4.41Å; L308-W313 WeakPolarHBondContact O-CZ2 3.21Å; L308-W313 PolarHBondContact O-NE1 3.25Å; L308-L322 HydrophobicContact CD1-CD1 4.01Å; L308-L326 HydrophobicContact CD1-CD1 4.43Å; L308-L326 HydrophobicContact CD1-CD2 4.33Å; L308-M337 HydrophobicContact CB-CE 4.07Å; L308-M337 HydrophobicContact CB-CG 4.07Å; L308-M337 HydrophobicContact CB-SD 3.62Å; L308-M337 HydrophobicContact CD1-CE 4.15Å; L308-M337 HydrophobicContact CD1-SD 3.98Å; L308-M337 HydrophobicContact CG-SD 4.47Å
309	A	95.5	Very high	95.5	Very high	5 Å²	5	32.2 Å²	32.2	4%	0.041	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	167.9	178.6	0	0	0	0	0	112.5	E285 S286 N311 D334 T336	E285-A309 CarbonylContact C-O 3.47Å; E285-A309 VanDerWaalsContact CA-O 3.28Å; E285-A309 WeakPolarHBondContact CA-O 3.24Å; E285-A309 HydrophobicContact CG-CB 4.2Å; E285-A309 WeakPolarHBondContact CG-O 3.3Å; S286-A309 PolarHBondContact N-O 3.16Å; A309-N311 PolarHBondContact O-N 2.84Å; A309-N311 VanDerWaalsContact O-N 3.16Å; A309-N311 PolarHBondContact O-ND2 3.38Å; A309-D334 VanDerWaalsContact CB-OD2 3.25Å; A309-D334 WeakPolarHBondContact CB-OD2 3.45Å; A309-T336 VanDerWaalsContact CB-OG1 3.29Å; A309-T336 WeakPolarHBondContact CB-OG1 3.4Å
310	G	95	Very high	95.3	Very high	50 Å²	50	32 Å²	32	52%	0.515	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	11.1	177.8	0	0	0	0	0	116.3	S286	S286-G310 WeakPolarHBondContact CA-O 3.14Å
311	N	97.1	Very high	95.2	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.037	22%	0.217	C	C	.	.	S	Bend	trans	-92.8	165.6	174.2	-81.2	-76.3	0	0	0	111.9	L284 N287 K288 L289 L308 A309 W313	L284-N311 PolarHBondContact O-ND2 3.15Å; N287-N311 VanDerWaalsContact CA-OD1 3.25Å; N287-N311 WeakPolarHBondContact CA-OD1 3.42Å; N287-N311 WeakPolarHBondContact CB-OD1 3.47Å; N287-N311 PolarHBondContact N-OD1 2.93Å; K288-N311 PolarHBondContact N-OD1 3.44Å; L289-N311 HydrophobicContact CB-CB 4.22Å; L289-N311 WeakPolarHBondContact CB-OD1 3.46Å; L289-N311 WeakPolarHBondContact CG-OD1 3.47Å; L289-N311 PolarHBondContact N-OD1 3.24Å; L308-N311 PolarHBondContact O-ND2 2.75Å; L308-N311 VanDerWaalsContact O-ND2 3.1Å; A309-N311 PolarHBondContact O-N 2.84Å; A309-N311 VanDerWaalsContact O-N 3.16Å; A309-N311 PolarHBondContact O-ND2 3.38Å; N311-W313 VanDerWaalsContact C-N 3.31Å; N311-W313 HydrophobicContact CB-CD2 4.1Å; N311-W313 VanDerWaalsContact CB-CE2 3.47Å; N311-W313 HydrophobicContact CB-CG 4.37Å; N311-W313 HydrophobicContact CB-CH2 4.47Å; N311-W313 HydrophobicContact CB-CZ2 3.69Å; N311-W313 PolarHBondContact O-N 3.46Å
312	I	96.6	Very high	95.2	Very high	77 Å²	77	26.1 Å²	26.1	40%	0.395	19%	0.186	S	C	.	.			trans	-94	48.7	-174.6	58.4	174.4	0	0	0	112.6	K288 L289 D314 S340	K288-I312 HydrophobicContact CB-CD1 4.14Å; K288-I312 HydrophobicContact CB-CG1 4.5Å; K288-I312 HydrophobicContact CD-CD1 4.49Å; K288-I312 HydrophobicContact CD-CG2 4.47Å; K288-I312 WeakPolarHBondContact O-CD1 3.32Å; K288-I312 WeakPolarHBondContact O-CG1 3.27Å; L289-I312 CarbonylContact O-C 3.54Å; L289-I312 VanDerWaalsContact O-C 3.28Å; L289-I312 WeakPolarHBondContact O-CG1 3.26Å; L289-I312 PolarHBondContact O-N 3.06Å; I312-D314 PolarHBondContact O-N 3.33Å; I312-S340 WeakPolarHBondContact CA-OG 3.5Å
313	W	96.4	Very high	95.1	Very high	0 Å²	0	24 Å²	24	0%	0	17%	0.172	C	C	.	.			trans	-54.8	129.9	-170.4	-61.7	114.9	0	0	0	113.9	L289 S290 V292 L308 N311 I319 L322 M337 S340 S341 I350	L289-W313 HydrophobicContact CB-CH2 3.74Å; L289-W313 HydrophobicContact CB-CZ2 4.38Å; L289-W313 HydrophobicContact CB-CZ3 3.86Å; L289-W313 HydrophobicContact CD1-CH2 3.89Å; L289-W313 HydrophobicContact CD1-CZ2 4.49Å; L289-W313 HydrophobicContact CG-CH2 4.48Å; S290-W313 WeakPolarHBondContact O-CA 3.38Å; V292-W313 HydrophobicContact CG2-CH2 3.89Å; V292-W313 HydrophobicContact CG2-CZ3 3.94Å; L308-W313 HydrophobicContact CB-CZ2 3.98Å; L308-W313 HydrophobicContact CD2-CH2 4.04Å; L308-W313 HydrophobicContact CD2-CZ2 3.87Å; L308-W313 HydrophobicContact CG-CZ2 4.41Å; L308-W313 WeakPolarHBondContact O-CZ2 3.21Å; L308-W313 PolarHBondContact O-NE1 3.25Å; N311-W313 VanDerWaalsContact C-N 3.31Å; N311-W313 HydrophobicContact CB-CD2 4.1Å; N311-W313 VanDerWaalsContact CB-CE2 3.47Å; N311-W313 HydrophobicContact CB-CG 4.37Å; N311-W313 HydrophobicContact CB-CH2 4.47Å; N311-W313 HydrophobicContact CB-CZ2 3.69Å; N311-W313 PolarHBondContact O-N 3.46Å; W313-I319 HydrophobicContact CD2-CD1 4.26Å; W313-I319 HydrophobicContact CE3-CD1 3.59Å; W313-I319 HydrophobicContact CZ3-CD1 4.26Å; W313-L322 HydrophobicContact CE3-CD2 4.12Å; W313-L322 HydrophobicContact CH2-CD2 3.65Å; W313-L322 HydrophobicContact CZ2-CD2 4.23Å; W313-L322 HydrophobicContact CZ3-CD2 3.58Å; W313-M337 HydrophobicContact CD2-CE 4.36Å; W313-M337 HydrophobicContact CZ2-CE 4.05Å; W313-S340 PolarHBondContact O-N 3.13Å; W313-S341 PolarHBondContact O-N 2.03Å; W313-S341 VanDerWaalsContact O-N 3.15Å; W313-I350 HydrophobicContact CB-CD1 3.38Å; W313-I350 HydrophobicContact CD2-CD1 4.18Å; W313-I350 HydrophobicContact CG-CD1 3.39Å
314	D	95.6	Very high	94.8	Very high	54 Å²	54	24.4 Å²	24.4	29%	0.289	18%	0.178	S	C	.	.	B	Isolated β-bridge	trans	-97.6	108.7	171.6	-177.3	37.6	0	0	0	109.7	S290 I312 G316 S341	S290-D314 PolarHBondContact O-N 3.18Å; I312-D314 PolarHBondContact O-N 3.33Å; D314-G316 PolarHBondContact O-N 2.94Å; D314-G316 VanDerWaalsContact O-N 3.15Å; D314-S341 WeakPolarHBondContact OD1-CB 3.16Å; D314-S341 PolarHBondContact OD1-OG 2.98Å
315	C	93.9	Very high	94.7	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.007	16%	0.164	C	C	.	.			trans	-84	28.8	-175	-69.5	0	0	0	0	113.7	C339 S341 L345 V353	C315-C339 HydrophobicContact CB-CB 3.85Å; C315-C339 WeakPolarHBondContact CB-SG 3.25Å; C315-C339 VanDerWaalsContact SG-CA 3.5Å; C315-C339 WeakPolarHBondContact SG-CB 3.19Å; C315-C339 CovalentContact SG-SG 2.03Å; C315-C339 PolarHBondContact SG-SG 3.23Å; C315-S341 PolarHBondContact N-O 3.38Å; C315-L345 HydrophobicContact CB-CD1 4.26Å; C315-V353 HydrophobicContact CB-CG1 4.39Å
316	G	91.4	Very high	94.5	Very high	24 Å²	24	20.9 Å²	20.9	25%	0.247	15%	0.152	C	C	.	.	S	Bend	trans	-75.7	-173.5	161.3	0	0	0	0	0	112	D314 G318 I319	D314-G316 PolarHBondContact O-N 2.94Å; D314-G316 VanDerWaalsContact O-N 3.15Å; G316-G318 PolarHBondContact O-N 3.19Å; G316-I319 WeakPolarHBondContact O-CG2 3.32Å; G316-I319 PolarHBondContact O-N 2.79Å; G316-I319 VanDerWaalsContact O-N 3.12Å
317	A	89.8	Confident	94.2	Very high	66 Å²	66	25.6 Å²	25.6	55%	0.545	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-56.4	-25	-179.7	0	0	0	0	0	114.1	I319 C320	A317-I319 PolarHBondContact O-N 2.96Å; A317-I319 VanDerWaalsContact O-N 3.12Å; A317-C320 VanDerWaalsContact O-CB 3.32Å; A317-C320 WeakPolarHBondContact O-CB 3.44Å; A317-C320 PolarHBondContact O-N 3.08Å; A317-C320 VanDerWaalsContact O-N 3.11Å; A317-C320 PolarHBondContact O-SG 2.94Å
318	G	90.9	Very high	94	Very high	40 Å²	40	30.2 Å²	30.2	41%	0.412	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-62.9	-14.4	177.4	0	0	0	0	0	115.3	G316 C320	G316-G318 PolarHBondContact O-N 3.19Å; G318-C320 VanDerWaalsContact C-N 3.35Å
319	I	93.4	Very high	94	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-82.3	-12.9	175.9	-152.4	62.7	0	0	0	113.1	W313 G316 A317 L322 V323 I350 T354	W313-I319 HydrophobicContact CD2-CD1 4.26Å; W313-I319 HydrophobicContact CE3-CD1 3.59Å; W313-I319 HydrophobicContact CZ3-CD1 4.26Å; G316-I319 WeakPolarHBondContact O-CG2 3.32Å; G316-I319 PolarHBondContact O-N 2.79Å; G316-I319 VanDerWaalsContact O-N 3.12Å; A317-I319 PolarHBondContact O-N 2.96Å; A317-I319 VanDerWaalsContact O-N 3.12Å; I319-L322 HydrophobicContact CD1-CD2 4.07Å; I319-L322 PolarHBondContact O-N 3.34Å; I319-V323 HydrophobicContact CG1-CG2 4.14Å; I319-V323 HydrophobicContact CG2-CG2 4.15Å; I319-V323 PolarHBondContact O-N 3Å; I319-I350 HydrophobicContact CG1-CG2 3.96Å; I319-T354 HydrophobicContact CG2-CG2 3.93Å
320	C	93.4	Very high	93.9	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-39.8	-168.6	-64.7	0	0	0	0	115.5	A317 G318 L322 V323 A324 C360 Y365	A317-C320 VanDerWaalsContact O-CB 3.32Å; A317-C320 WeakPolarHBondContact O-CB 3.44Å; A317-C320 PolarHBondContact O-N 3.08Å; A317-C320 VanDerWaalsContact O-N 3.11Å; A317-C320 PolarHBondContact O-SG 2.94Å; G318-C320 VanDerWaalsContact C-N 3.35Å; C320-L322 VanDerWaalsContact C-N 3.33Å; C320-L322 PolarHBondContact O-N 3.31Å; C320-V323 PolarHBondContact O-N 3.45Å; C320-A324 WeakPolarHBondContact O-CB 3.26Å; C320-A324 PolarHBondContact O-N 3.24Å; C320-C360 WeakPolarHBondContact CA-SG 3.34Å; C320-C360 HydrophobicContact CB-CB 3.75Å; C320-C360 WeakPolarHBondContact CB-SG 3.43Å; C320-C360 WeakPolarHBondContact SG-CA 3.18Å; C320-C360 WeakPolarHBondContact SG-CB 3.36Å; C320-C360 CovalentContact SG-SG 2.04Å; C320-C360 PolarHBondContact SG-SG 2.89Å; C320-Y365 HydrophobicContact CB-CD2 4.42Å; C320-Y365 HydrophobicContact CB-CE2 3.71Å
321	P	94.6	Very high	93.8	Very high	12 Å²	12	41.7 Å²	41.7	8%	0.078	23%	0.228	C	C	.	.	H	α-helix	trans	-52.8	-47.6	170.8	-31.6	39	0	0	0	113.3	Q294 V297 W325 Y365	Q294-P321 HydrophobicContact CB-CB 4.23Å; Q294-P321 HydrophobicContact CB-CG 4.35Å; V297-P321 HydrophobicContact CG2-CB 4.41Å; P321-W325 WeakPolarHBondContact O-CB 3.47Å; P321-W325 PolarHBondContact O-N 3.35Å; P321-Y365 HydrophobicContact CG-CE1 4Å
322	L	95	Very high	93.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-42	179.2	-177.5	60	0	0	0	111.8	V292 V297 W300 L308 W313 I319 C320 W325 L326 M337	V292-L322 HydrophobicContact CB-CB 4.34Å; V292-L322 HydrophobicContact CB-CD1 4.3Å; V292-L322 HydrophobicContact CB-CD2 4.32Å; V292-L322 HydrophobicContact CG2-CD1 4.32Å; V292-L322 HydrophobicContact CG2-CD2 3.98Å; V297-L322 HydrophobicContact CG1-CD1 4.09Å; W300-L322 HydrophobicContact CH2-CD1 4.2Å; W300-L322 HydrophobicContact CZ3-CD1 3.81Å; L308-L322 HydrophobicContact CD1-CD1 4.01Å; W313-L322 HydrophobicContact CE3-CD2 4.12Å; W313-L322 HydrophobicContact CH2-CD2 3.65Å; W313-L322 HydrophobicContact CZ2-CD2 4.23Å; W313-L322 HydrophobicContact CZ3-CD2 3.58Å; I319-L322 HydrophobicContact CD1-CD2 4.07Å; I319-L322 PolarHBondContact O-N 3.34Å; C320-L322 VanDerWaalsContact C-N 3.33Å; C320-L322 PolarHBondContact O-N 3.31Å; L322-W325 PolarHBondContact O-N 3.48Å; L322-L326 HydrophobicContact CD1-CD1 4.16Å; L322-L326 HydrophobicContact CD1-CG 4.27Å; L322-L326 HydrophobicContact CG-CD1 3.91Å; L322-L326 HydrophobicContact CG-CG 4.44Å; L322-L326 VanDerWaalsContact O-CB 3.29Å; L322-L326 WeakPolarHBondContact O-CB 3.27Å; L322-L326 WeakPolarHBondContact O-CG 3.37Å; L322-L326 PolarHBondContact O-N 2.83Å; L322-M337 HydrophobicContact CD2-CE 3.86Å
323	V	93.6	Very high	93.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-69.1	-40.4	179.2	168.5	0	0	0	0	111.8	I319 C320 L326 R327 I350 M351 T354	I319-V323 HydrophobicContact CG1-CG2 4.14Å; I319-V323 HydrophobicContact CG2-CG2 4.15Å; I319-V323 PolarHBondContact O-N 3Å; C320-V323 PolarHBondContact O-N 3.45Å; V323-L326 PolarHBondContact O-N 3.19Å; V323-R327 HydrophobicContact CG1-CG 4.48Å; V323-R327 VanDerWaalsContact O-CG 3.3Å; V323-R327 WeakPolarHBondContact O-CG 3.47Å; V323-R327 PolarHBondContact O-N 2.85Å; V323-I350 HydrophobicContact CG2-CG2 3.67Å; V323-M351 HydrophobicContact CG1-CE 4.48Å; V323-M351 HydrophobicContact CG1-SD 4.34Å; V323-M351 HydrophobicContact CG2-SD 4.45Å; V323-T354 HydrophobicContact CG1-CG2 4.35Å; V323-T354 WeakPolarHBondContact CG1-OG1 3.3Å; V323-T354 HydrophobicContact CG2-CG2 4.09Å
324	A	93	Very high	92.7	Very high	26 Å²	26	47.1 Å²	47.1	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-47.1	174.5	0	0	0	0	0	111.1	C320 R327 N328	C320-A324 WeakPolarHBondContact O-CB 3.26Å; C320-A324 PolarHBondContact O-N 3.24Å; A324-R327 PolarHBondContact O-N 2.86Å; A324-N328 PolarHBondContact O-N 2.9Å
325	W	94.6	Very high	91.4	Very high	35 Å²	35	49.7 Å²	49.7	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-46.8	173.9	-174.5	95.4	0	0	0	111.7	V297 W300 L303 I306 P321 L322 R327 N328 F329	V297-W325 HydrophobicContact CB-CB 3.97Å; V297-W325 HydrophobicContact CB-CG 3.86Å; V297-W325 HydrophobicContact CG1-CB 4.37Å; V297-W325 HydrophobicContact CG1-CG 4.47Å; V297-W325 HydrophobicContact CG2-CB 4.14Å; V297-W325 HydrophobicContact CG2-CG 4.43Å; V297-W325 PolarHBondContact O-NE1 3.01Å; W300-W325 HydrophobicContact CB-CZ2 3.8Å; W300-W325 HydrophobicContact CD2-CZ2 4.48Å; W300-W325 HydrophobicContact CE3-CD2 4.05Å; W300-W325 AromaticContact CE3-CE2 3.87Å; W300-W325 HydrophobicContact CE3-CE3 4.1Å; W300-W325 AromaticContact CE3-CH2 3.87Å; W300-W325 HydrophobicContact CE3-CH2 3.87Å; W300-W325 AromaticContact CE3-CZ2 3.79Å; W300-W325 HydrophobicContact CE3-CZ2 3.79Å; W300-W325 HydrophobicContact CE3-CZ3 4.01Å; W300-W325 HydrophobicContact CZ3-CE3 4.26Å; W300-W325 HydrophobicContact CZ3-CH2 4.48Å; W300-W325 HydrophobicContact CZ3-CZ3 4.22Å; L303-W325 HydrophobicContact CB-CZ2 4.48Å; L303-W325 HydrophobicContact CD1-CH2 4.05Å; L303-W325 HydrophobicContact CD1-CZ2 4.19Å; I306-W325 HydrophobicContact CD1-CH2 3.78Å; I306-W325 HydrophobicContact CD1-CZ3 3.76Å; I306-W325 HydrophobicContact CG2-CH2 4.15Å; I306-W325 HydrophobicContact CG2-CZ3 4.04Å; P321-W325 WeakPolarHBondContact O-CB 3.47Å; P321-W325 PolarHBondContact O-N 3.35Å; L322-W325 PolarHBondContact O-N 3.48Å; W325-R327 VanDerWaalsContact C-N 3.33Å; W325-R327 PolarHBondContact O-N 2.8Å; W325-N328 PolarHBondContact O-N 3.09Å; W325-N328 VanDerWaalsContact O-N 3.15Å; W325-F329 HydrophobicContact CE3-CB 4.14Å; W325-F329 HydrophobicContact CE3-CG 4.44Å; W325-F329 HydrophobicContact CH2-CB 4.22Å; W325-F329 HydrophobicContact CH2-CD1 4.26Å; W325-F329 AromaticContact CH2-CD2 3.22Å; W325-F329 HydrophobicContact CH2-CD2 3.22Å; W325-F329 HydrophobicContact CH2-CE1 4.43Å; W325-F329 AromaticContact CH2-CE2 3.45Å; W325-F329 HydrophobicContact CH2-CE2 3.45Å; W325-F329 VanDerWaalsContact CH2-CE2 3.45Å; W325-F329 AromaticContact CH2-CG 3.66Å; W325-F329 HydrophobicContact CH2-CG 3.66Å; W325-F329 HydrophobicContact CH2-CZ 4.06Å; W325-F329 AromaticContact CZ2-CD2 3.45Å; W325-F329 HydrophobicContact CZ2-CD2 3.45Å; W325-F329 VanDerWaalsContact CZ2-CD2 3.45Å; W325-F329 AromaticContact CZ2-CE2 3.77Å; W325-F329 HydrophobicContact CZ2-CE2 3.77Å; W325-F329 HydrophobicContact CZ2-CG 4.22Å; W325-F329 HydrophobicContact CZ3-CB 3.97Å; W325-F329 HydrophobicContact CZ3-CD1 4.31Å; W325-F329 AromaticContact CZ3-CD2 3.84Å; W325-F329 HydrophobicContact CZ3-CD2 3.84Å; W325-F329 HydrophobicContact CZ3-CE2 4.38Å; W325-F329 AromaticContact CZ3-CG 3.78Å; W325-F329 HydrophobicContact CZ3-CG 3.78Å; W325-F329 WeakPolarHBondContact O-CB 3.46Å; W325-F329 PolarHBondContact O-N 3.05Å
326	L	94	Very high	91	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-64.2	-31.5	178.4	-76.7	170.6	0	0	0	113.4	L308 L322 V323 N328 K333 M337 M351	L308-L326 HydrophobicContact CD1-CD1 4.43Å; L308-L326 HydrophobicContact CD1-CD2 4.33Å; L322-L326 HydrophobicContact CD1-CD1 4.16Å; L322-L326 HydrophobicContact CD1-CG 4.27Å; L322-L326 HydrophobicContact CG-CD1 3.91Å; L322-L326 HydrophobicContact CG-CG 4.44Å; L322-L326 VanDerWaalsContact O-CB 3.29Å; L322-L326 WeakPolarHBondContact O-CB 3.27Å; L322-L326 WeakPolarHBondContact O-CG 3.37Å; L322-L326 PolarHBondContact O-N 2.83Å; V323-L326 PolarHBondContact O-N 3.19Å; L326-N328 VanDerWaalsContact C-N 3.34Å; L326-K333 HydrophobicContact CD2-CD 4.06Å; L326-K333 PolarHBondContact O-NZ 3.19Å; L326-M337 HydrophobicContact CD1-CE 3.73Å; L326-M337 HydrophobicContact CD1-SD 3.68Å; L326-M351 HydrophobicContact CB-SD 4.26Å; L326-M351 HydrophobicContact CD1-SD 4.43Å
327	R	91.6	Very high	91.1	Very high	100 Å²	100	52.4 Å²	52.4	38%	0.377	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-43.1	173.3	-75.5	174.2	-172.3	-167.1	4.3	110.7	V323 A324 W325 M351 T354	V323-R327 HydrophobicContact CG1-CG 4.48Å; V323-R327 VanDerWaalsContact O-CG 3.3Å; V323-R327 WeakPolarHBondContact O-CG 3.47Å; V323-R327 PolarHBondContact O-N 2.85Å; A324-R327 PolarHBondContact O-N 2.86Å; W325-R327 VanDerWaalsContact C-N 3.33Å; W325-R327 PolarHBondContact O-N 2.8Å; R327-M351 HydrophobicContact CG-CE 3.88Å; R327-T354 PolarHBondContact NH2-O 3.05Å; R327-T354 VanDerWaalsContact NH2-O 3.11Å
328	N	92.8	Very high	91.4	Very high	126 Å²	126	53 Å²	53	67%	0.674	28%	0.283	S	S	*	.	H	α-helix	trans	-82.2	-22.8	-178.4	-68.3	-29.5	0	0	0	114	A324 W325 L326 R330	A324-N328 PolarHBondContact O-N 2.9Å; W325-N328 PolarHBondContact O-N 3.09Å; W325-N328 VanDerWaalsContact O-N 3.15Å; L326-N328 VanDerWaalsContact C-N 3.34Å; N328-R330 PolarHBondContact O-N 3.17Å
329	F	95.1	Very high	91.6	Very high	22 Å²	22	51.1 Å²	51.1	10%	0.096	26%	0.263	C	S	.	.			trans	-64.2	114.4	-179.1	-171.4	-107.2	0	0	0	112.8	L303 I306 W325 G331 K333	L303-F329 HydrophobicContact CB-CE2 3.82Å; L303-F329 HydrophobicContact CB-CZ 4.13Å; L303-F329 VanDerWaalsContact O-CE2 3.22Å; L303-F329 WeakPolarHBondContact O-CE2 3.41Å; I306-F329 HydrophobicContact CG2-CD1 4.13Å; I306-F329 HydrophobicContact CG2-CE1 3.67Å; I306-F329 HydrophobicContact CG2-CZ 4.11Å; W325-F329 HydrophobicContact CE3-CB 4.14Å; W325-F329 HydrophobicContact CE3-CG 4.44Å; W325-F329 HydrophobicContact CH2-CB 4.22Å; W325-F329 HydrophobicContact CH2-CD1 4.26Å; W325-F329 AromaticContact CH2-CD2 3.22Å; W325-F329 HydrophobicContact CH2-CD2 3.22Å; W325-F329 HydrophobicContact CH2-CE1 4.43Å; W325-F329 AromaticContact CH2-CE2 3.45Å; W325-F329 HydrophobicContact CH2-CE2 3.45Å; W325-F329 VanDerWaalsContact CH2-CE2 3.45Å; W325-F329 AromaticContact CH2-CG 3.66Å; W325-F329 HydrophobicContact CH2-CG 3.66Å; W325-F329 HydrophobicContact CH2-CZ 4.06Å; W325-F329 AromaticContact CZ2-CD2 3.45Å; W325-F329 HydrophobicContact CZ2-CD2 3.45Å; W325-F329 VanDerWaalsContact CZ2-CD2 3.45Å; W325-F329 AromaticContact CZ2-CE2 3.77Å; W325-F329 HydrophobicContact CZ2-CE2 3.77Å; W325-F329 HydrophobicContact CZ2-CG 4.22Å; W325-F329 HydrophobicContact CZ3-CB 3.97Å; W325-F329 HydrophobicContact CZ3-CD1 4.31Å; W325-F329 AromaticContact CZ3-CD2 3.84Å; W325-F329 HydrophobicContact CZ3-CD2 3.84Å; W325-F329 HydrophobicContact CZ3-CE2 4.38Å; W325-F329 AromaticContact CZ3-CG 3.78Å; W325-F329 HydrophobicContact CZ3-CG 3.78Å; W325-F329 WeakPolarHBondContact O-CB 3.46Å; W325-F329 PolarHBondContact O-N 3.05Å; F329-G331 VanDerWaalsContact CE1-C 3.43Å; F329-K333 HydrophobicContact CD1-CB 4.12Å; F329-K333 HydrophobicContact CD1-CD 4.17Å; F329-K333 HydrophobicContact CD1-CG 4.46Å; F329-K333 HydrophobicContact CE1-CB 4.28Å; F329-K333 PolarHBondContact O-NZ 3.29Å
330	R	93.7	Very high	91.7	Very high	249 Å²	249	53.3 Å²	53.3	94%	0.94	28%	0.279	S	S	*	.			trans	-90.4	-5.9	-179.6	-59.7	-172	-179.2	-164	0.5	114.6	N328	N328-R330 PolarHBondContact O-N 3.17Å
331	G	94.1	Very high	91.8	Very high	28 Å²	28	55.4 Å²	55.4	29%	0.289	29%	0.293	S	S	.	.	S	Bend	trans	-76	-176.9	178.9	0	0	0	0	0	113.7	T304 F329 K333	T304-G331 CarbonylContact O-C 3.54Å; T304-G331 WeakPolarHBondContact O-CA 3.43Å; F329-G331 VanDerWaalsContact CE1-C 3.43Å; G331-K333 PolarHBondContact O-N 3.25Å
332	S	95	Very high	91.8	Very high	79 Å²	79	56.4 Å²	56.4	55%	0.552	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	118.6	173.1	-174	0	0	0	0	109.9	T304 T305 I306	T304-S332 PolarHBondContact O-N 3.29Å; T305-S332 CarbonylContact C-O 3.55Å; T305-S332 VanDerWaalsContact CA-O 3.25Å; T305-S332 WeakPolarHBondContact CA-O 3.33Å; I306-S332 PolarHBondContact N-O 2.89Å
333	K	90.3	Very high	91.7	Very high	72 Å²	72	65.6 Å²	65.6	31%	0.313	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143	177	58.8	-174.5	168.6	-142.9	0	110.3	I306 L326 F329 G331	I306-K333 HydrophobicContact CG2-CB 3.9Å; I306-K333 WeakPolarHBondContact O-CA 3.38Å; L326-K333 HydrophobicContact CD2-CD 4.06Å; L326-K333 PolarHBondContact O-NZ 3.19Å; F329-K333 HydrophobicContact CD1-CB 4.12Å; F329-K333 HydrophobicContact CD1-CD 4.17Å; F329-K333 HydrophobicContact CD1-CG 4.46Å; F329-K333 HydrophobicContact CE1-CB 4.28Å; F329-K333 PolarHBondContact O-NZ 3.29Å; G331-K333 PolarHBondContact O-N 3.25Å
334	D	80.1	Confident	91.6	Very high	48 Å²	48	72.9 Å²	72.9	26%	0.257	37%	0.374	S	S	.	.			trans	-65.5	140	166.3	-161.9	-22.3	0	0	0	109.9	I306 A309 T336	I306-D334 PolarHBondContact O-N 2.89Å; A309-D334 VanDerWaalsContact CB-OD2 3.25Å; A309-D334 WeakPolarHBondContact CB-OD2 3.45Å; D334-T336 VanDerWaalsContact CG-OG1 3.22Å; D334-T336 WeakPolarHBondContact OD1-CB 3.45Å; D334-T336 WeakPolarHBondContact OD1-CG2 3.22Å; D334-T336 PolarHBondContact OD1-N 3.01Å; D334-T336 PolarHBondContact OD1-OG1 3.15Å; D334-T336 PolarHBondContact OD2-OG1 2.89Å
335	T	70.1	Confident	91.6	Very high	108 Å²	108	72 Å²	72	66%	0.663	37%	0.365	S	S	*	.			trans	-104.2	-3.7	178.6	59.7	0	0	0	0	112.9	M337	T335-M337 PolarHBondContact O-N 2.87Å
336	T	85.3	Confident	91.6	Very high	75 Å²	75	76.1 Å²	76.1	46%	0.46	39%	0.386	S	S	.	.			trans	-86.9	22.6	-176.3	65.2	0	0	0	0	114	A309 D334 I338	A309-T336 VanDerWaalsContact CB-OG1 3.29Å; A309-T336 WeakPolarHBondContact CB-OG1 3.4Å; D334-T336 VanDerWaalsContact CG-OG1 3.22Å; D334-T336 WeakPolarHBondContact OD1-CB 3.45Å; D334-T336 WeakPolarHBondContact OD1-CG2 3.22Å; D334-T336 PolarHBondContact OD1-N 3.01Å; D334-T336 PolarHBondContact OD1-OG1 3.15Å; D334-T336 PolarHBondContact OD2-OG1 2.89Å; T336-I338 PolarHBondContact O-N 3.5Å
337	M	93.3	Very high	91.5	Very high	6 Å²	6	78.3 Å²	78.3	3%	0.03	41%	0.409	C	S	.	.			trans	-67.9	121.6	172.8	-67.2	173	62.5	0	0	110.5	L308 W313 L322 L326 T335 I350	L308-M337 HydrophobicContact CB-CE 4.07Å; L308-M337 HydrophobicContact CB-CG 4.07Å; L308-M337 HydrophobicContact CB-SD 3.62Å; L308-M337 HydrophobicContact CD1-CE 4.15Å; L308-M337 HydrophobicContact CD1-SD 3.98Å; L308-M337 HydrophobicContact CG-SD 4.47Å; W313-M337 HydrophobicContact CD2-CE 4.36Å; W313-M337 HydrophobicContact CZ2-CE 4.05Å; L322-M337 HydrophobicContact CD2-CE 3.86Å; L326-M337 HydrophobicContact CD1-CE 3.73Å; L326-M337 HydrophobicContact CD1-SD 3.68Å; T335-M337 PolarHBondContact O-N 2.87Å; M337-I350 HydrophobicContact CB-CD1 3.96Å; M337-I350 HydrophobicContact CB-CG1 4.12Å; M337-I350 HydrophobicContact CE-CD1 4.1Å; M337-I350 PolarHBondContact O-N 2.85Å; M337-I350 VanDerWaalsContact O-N 3.15Å
338	I	94.9	Very high	91.5	Very high	78 Å²	78	78.3 Å²	78.3	40%	0.4	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-121.3	140.9	-174.8	-71.5	164.7	0	0	0	109.9	T336 G347 E348	T336-I338 PolarHBondContact O-N 3.5Å; I338-G347 WeakPolarHBondContact CG2-O 3.31Å; I338-E348 CarbonylContact C-O 3.53Å; I338-E348 WeakPolarHBondContact CA-O 3.35Å
339	C	95.4	Very high	91.6	Very high	1 Å²	1	77.8 Å²	77.8	1%	0.007	41%	0.405	C	S	.	.			trans	-69	130.4	173.2	-62.2	0	0	0	0	111.2	C315 L345 Q346 G347 E348	C315-C339 HydrophobicContact CB-CB 3.85Å; C315-C339 WeakPolarHBondContact CB-SG 3.25Å; C315-C339 VanDerWaalsContact SG-CA 3.5Å; C315-C339 WeakPolarHBondContact SG-CB 3.19Å; C315-C339 CovalentContact SG-SG 2.03Å; C315-C339 PolarHBondContact SG-SG 3.23Å; C339-L345 HydrophobicContact CB-CB 4.34Å; C339-L345 WeakPolarHBondContact CB-O 3.31Å; C339-Q346 WeakPolarHBondContact O-CA 3.21Å; C339-G347 PolarHBondContact O-N 2.87Å; C339-E348 PolarHBondContact N-O 3.4Å
340	S	96.7	Very high	91.4	Very high	46 Å²	46	76.8 Å²	76.8	32%	0.322	40%	0.401	S	S	.	.			trans	-102	-26.3	170.4	-64.7	0	0	0	0	112.6	I312 W313	I312-S340 WeakPolarHBondContact CA-OG 3.5Å; W313-S340 PolarHBondContact O-N 3.13Å
341	S	94.8	Very high	91.2	Very high	48 Å²	48	67.9 Å²	67.9	34%	0.336	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-139.3	157.8	176.2	170.7	0	0	0	0	108.9	W313 D314 C315	W313-S341 PolarHBondContact O-N 2.03Å; W313-S341 VanDerWaalsContact O-N 3.15Å; D314-S341 WeakPolarHBondContact OD1-CB 3.16Å; D314-S341 PolarHBondContact OD1-OG 2.98Å; C315-S341 PolarHBondContact N-O 3.38Å
342	P	94.2	Very high	90.9	Very high	34 Å²	34	70.9 Å²	70.9	22%	0.221	38%	0.377	C	S	.	.	S	Bend	cis	-67.2	163.9	-15.6	30.5	-37.3	0	0	0	112.1	H344 L345 Q346	P342-H344 WeakPolarHBondContact CG-CE1 3.44Å; P342-H344 PolarHBondContact O-N 3.36Å; P342-L345 HydrophobicContact CG-CB 4.49Å; P342-L345 HydrophobicContact CG-CD1 3.96Å; P342-L345 HydrophobicContact CG-CG 4.33Å; P342-L345 PolarHBondContact O-N 3Å; P342-Q346 PolarHBondContact O-N 3.45Å
343	K	92.9	Very high	90.5	Very high	193 Å²	193	67.2 Å²	67.2	84%	0.839	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-51.9	-31.9	-174.3	-69.2	-172.4	177.9	-176	0	115.1	L345 Q346	K343-L345 VanDerWaalsContact C-N 3.27Å; K343-L345 PolarHBondContact O-N 3.44Å; K343-Q346 PolarHBondContact O-N 3.42Å
344	H	91.8	Very high	90.2	Very high	153 Å²	153	63.9 Å²	63.9	71%	0.708	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-78.8	-8.2	-179.2	64.3	-93.3	0	0	0	114	P342	P342-H344 WeakPolarHBondContact CG-CE1 3.44Å; P342-H344 PolarHBondContact O-N 3.36Å
345	L	92.4	Very high	90.2	Very high	7 Å²	7	70.6 Å²	70.6	4%	0.037	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-114.9	2.8	173.6	-62.9	170.9	0	0	0	111.7	C315 C339 P342 K343 G347 E348 V353 I359	C315-L345 HydrophobicContact CB-CD1 4.26Å; C339-L345 HydrophobicContact CB-CB 4.34Å; C339-L345 WeakPolarHBondContact CB-O 3.31Å; P342-L345 HydrophobicContact CG-CB 4.49Å; P342-L345 HydrophobicContact CG-CD1 3.96Å; P342-L345 HydrophobicContact CG-CG 4.33Å; P342-L345 PolarHBondContact O-N 3Å; K343-L345 VanDerWaalsContact C-N 3.27Å; K343-L345 PolarHBondContact O-N 3.44Å; L345-G347 PolarHBondContact O-N 3.21Å; L345-E348 WeakPolarHBondContact O-CB 3.29Å; L345-E348 PolarHBondContact O-N 3.43Å; L345-E348 VanDerWaalsContact O-N 3.15Å; L345-V353 HydrophobicContact CD1-CG1 3.75Å; L345-V353 HydrophobicContact CD2-CG1 3.86Å; L345-V353 HydrophobicContact CD2-CG2 4.24Å; L345-V353 HydrophobicContact CG-CG1 4.25Å; L345-I359 HydrophobicContact CD1-CD1 3.93Å
346	Q	94.3	Very high	90.6	Very high	123 Å²	123	70.4 Å²	70.4	58%	0.575	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	128.6	-174.2	-175.4	177.4	-6.1	0	0	111.3	C339 P342 K343	C339-Q346 WeakPolarHBondContact O-CA 3.21Å; P342-Q346 PolarHBondContact O-N 3.45Å; K343-Q346 PolarHBondContact O-N 3.42Å
347	G	93	Very high	89.9	Confident	49 Å²	49	72.5 Å²	72.5	51%	0.505	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-16.2	-176	0	0	0	0	0	114.5	I338 C339 L345	I338-G347 WeakPolarHBondContact CG2-O 3.31Å; C339-G347 PolarHBondContact O-N 2.87Å; L345-G347 PolarHBondContact O-N 3.21Å
348	E	92.4	Very high	88.9	Confident	99 Å²	99	74.5 Å²	74.5	46%	0.463	38%	0.38	S	S	.	.	S	Bend	trans	-79.4	155	180	-66.6	-62.7	156.5	0	0	113.3	I338 C339 L345 V353	I338-E348 CarbonylContact C-O 3.53Å; I338-E348 WeakPolarHBondContact CA-O 3.35Å; C339-E348 PolarHBondContact N-O 3.4Å; L345-E348 WeakPolarHBondContact O-CB 3.29Å; L345-E348 PolarHBondContact O-N 3.43Å; L345-E348 VanDerWaalsContact O-N 3.15Å; E348-V353 HydrophobicContact CB-CG2 3.33Å; E348-V353 HydrophobicContact CG-CG2 4.22Å
349	K	92.9	Very high	88.2	Confident	116 Å²	116	72.9 Å²	72.9	50%	0.504	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-79.4	128.4	179.8	-70	174.1	-175.6	163.6	0	111.7	M351 E352 V353	K349-M351 VanDerWaalsContact C-N 3.32Å; K349-M351 PolarHBondContact O-N 3.19Å; K349-E352 HydrophobicContact CB-CB 4.17Å; K349-E352 WeakPolarHBondContact O-CB 3.14Å; K349-E352 PolarHBondContact O-N 3.48Å; K349-V353 WeakPolarHBondContact O-CG2 3.12Å; K349-V353 PolarHBondContact O-N 2.88Å
350	I	92.6	Very high	87.6	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-56.8	-43.5	-174.4	-52.7	-167.6	0	0	0	112.5	W313 I319 V323 M337 E352 T354	W313-I350 HydrophobicContact CB-CD1 3.38Å; W313-I350 HydrophobicContact CD2-CD1 4.18Å; W313-I350 HydrophobicContact CG-CD1 3.39Å; I319-I350 HydrophobicContact CG1-CG2 3.96Å; V323-I350 HydrophobicContact CG2-CG2 3.67Å; M337-I350 HydrophobicContact CB-CD1 3.96Å; M337-I350 HydrophobicContact CB-CG1 4.12Å; M337-I350 HydrophobicContact CE-CD1 4.1Å; M337-I350 PolarHBondContact O-N 2.85Å; M337-I350 VanDerWaalsContact O-N 3.15Å; I350-E352 PolarHBondContact O-N 2.89Å; I350-T354 HydrophobicContact CG2-CG2 4.33Å; I350-T354 WeakPolarHBondContact O-CB 3.33Å; I350-T354 WeakPolarHBondContact O-CG2 3.46Å; I350-T354 PolarHBondContact O-N 2.93Å; I350-T354 PolarHBondContact O-OG1 2.95Å
351	M	88.9	Confident	86.3	Confident	62 Å²	62	79 Å²	79	31%	0.305	40%	0.397	S	S	.	.	H	α-helix	trans	-70.1	-16.7	-178	-61.4	-57	-61.2	0	0	113.9	V323 L326 R327 K349	V323-M351 HydrophobicContact CG1-CE 4.48Å; V323-M351 HydrophobicContact CG1-SD 4.34Å; V323-M351 HydrophobicContact CG2-SD 4.45Å; L326-M351 HydrophobicContact CB-SD 4.26Å; L326-M351 HydrophobicContact CD1-SD 4.43Å; R327-M351 HydrophobicContact CG-CE 3.88Å; K349-M351 VanDerWaalsContact C-N 3.32Å; K349-M351 PolarHBondContact O-N 3.19Å
352	E	86.9	Confident	84.5	Confident	91 Å²	91	84.6 Å²	84.6	43%	0.425	42%	0.418	S	S	.	.	H	α-helix	trans	-95.1	-47.5	177.9	-177.6	161.4	-166.7	0	0	110.2	K349 I350 T354 R355 N356	K349-E352 HydrophobicContact CB-CB 4.17Å; K349-E352 WeakPolarHBondContact O-CB 3.14Å; K349-E352 PolarHBondContact O-N 3.48Å; I350-E352 PolarHBondContact O-N 2.89Å; E352-T354 PolarHBondContact O-N 3.01Å; E352-R355 PolarHBondContact O-N 3.29Å; E352-N356 WeakPolarHBondContact O-CB 3.29Å; E352-N356 VanDerWaalsContact O-CG 3.3Å; E352-N356 PolarHBondContact O-N 3.03Å
353	V	87.4	Confident	82.4	Confident	3 Å²	3	88.8 Å²	88.8	2%	0.018	44%	0.439	C	S	.	.	H	α-helix	trans	-53.2	-50.9	173.7	167	0	0	0	0	111.9	C315 L345 E348 K349 R355 N356 H357 I359	C315-V353 HydrophobicContact CB-CG1 4.39Å; L345-V353 HydrophobicContact CD1-CG1 3.75Å; L345-V353 HydrophobicContact CD2-CG1 3.86Å; L345-V353 HydrophobicContact CD2-CG2 4.24Å; L345-V353 HydrophobicContact CG-CG1 4.25Å; E348-V353 HydrophobicContact CB-CG2 3.33Å; E348-V353 HydrophobicContact CG-CG2 4.22Å; K349-V353 WeakPolarHBondContact O-CG2 3.12Å; K349-V353 PolarHBondContact O-N 2.88Å; V353-R355 PolarHBondContact O-N 3.03Å; V353-N356 PolarHBondContact O-N 2.97Å; V353-H357 WeakPolarHBondContact O-CB 3.49Å; V353-H357 PolarHBondContact O-N 3.41Å; V353-H357 PolarHBondContact O-ND1 2.86Å; V353-I359 HydrophobicContact CG1-CD1 3.5Å; V353-I359 VanDerWaalsContact CG1-CD1 3.5Å
354	T	83.6	Confident	80.1	Confident	2 Å²	2	86.4 Å²	86.4	1%	0.012	44%	0.435	C	S	.	.	H	α-helix	trans	-72	-9.5	179.7	55.9	0	0	0	0	114.8	I319 V323 R327 I350 E352	I319-T354 HydrophobicContact CG2-CG2 3.93Å; V323-T354 HydrophobicContact CG1-CG2 4.35Å; V323-T354 WeakPolarHBondContact CG1-OG1 3.3Å; V323-T354 HydrophobicContact CG2-CG2 4.09Å; R327-T354 PolarHBondContact NH2-O 3.05Å; R327-T354 VanDerWaalsContact NH2-O 3.11Å; I350-T354 HydrophobicContact CG2-CG2 4.33Å; I350-T354 WeakPolarHBondContact O-CB 3.33Å; I350-T354 WeakPolarHBondContact O-CG2 3.46Å; I350-T354 PolarHBondContact O-N 2.93Å; I350-T354 PolarHBondContact O-OG1 2.95Å; E352-T354 PolarHBondContact O-N 3.01Å
355	R	80.6	Confident	77.9	Confident	189 Å²	189	84.1 Å²	84.1	71%	0.713	42%	0.421	S	S	*	.	H	α-helix	trans	-90.8	-46	169.2	-177.2	-174.6	-67.5	151.5	-0.8	110.9	E352 V353	E352-R355 PolarHBondContact O-N 3.29Å; V353-R355 PolarHBondContact O-N 3.03Å
356	N	77.4	Confident	75.5	Confident	104 Å²	104	91.6 Å²	91.6	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-81.1	-31.6	-169.7	-63	-5.8	0	0	0	113	E352 V353	E352-N356 WeakPolarHBondContact O-CB 3.29Å; E352-N356 VanDerWaalsContact O-CG 3.3Å; E352-N356 PolarHBondContact O-N 3.03Å; V353-N356 PolarHBondContact O-N 2.97Å
357	H	71.2	Confident	73	Confident	118 Å²	118	91.7 Å²	91.7	55%	0.546	46%	0.455	S	S	.	.	S	Bend	trans	-100.1	1.6	-176.2	-65.4	84.4	0	0	0	114.1	V353 I359	V353-H357 WeakPolarHBondContact O-CB 3.49Å; V353-H357 PolarHBondContact O-N 3.41Å; V353-H357 PolarHBondContact O-ND1 2.86Å; H357-I359 HydrophobicContact CB-CD1 3.86Å; H357-I359 HydrophobicContact CB-CG1 3.8Å; H357-I359 PolarHBondContact O-N 3.21Å; H357-I359 VanDerWaalsContact O-N 3.09Å
358	G	73.4	Confident	70.1	Confident	48 Å²	48	96.1 Å²	96.1	50%	0.495	47%	0.473	S	S	.	.			trans	62.9	15.8	178	0	0	0	0	0	115.8	C360	G358-C360 PolarHBondContact O-N 3.38Å; G358-C360 VanDerWaalsContact O-N 3.07Å
359	I	79.4	Confident	67.2	Low	44 Å²	44	100.1 Å²	100.1	23%	0.226	49%	0.491	C	S	.	.			trans	-56.9	-29.4	-172.3	-63.6	164.7	0	0	0	113	L345 V353 H357	L345-I359 HydrophobicContact CD1-CD1 3.93Å; V353-I359 HydrophobicContact CG1-CD1 3.5Å; V353-I359 VanDerWaalsContact CG1-CD1 3.5Å; H357-I359 HydrophobicContact CB-CD1 3.86Å; H357-I359 HydrophobicContact CB-CG1 3.8Å; H357-I359 PolarHBondContact O-N 3.21Å; H357-I359 VanDerWaalsContact O-N 3.09Å
360	C	81.9	Confident	64.3	Low	15 Å²	15	100.9 Å²	100.9	10%	0.101	51%	0.506	C	S	.	.	S	Bend	trans	-112.2	104.2	173.1	-52	0	0	0	0	108	C320 G358	C320-C360 WeakPolarHBondContact CA-SG 3.34Å; C320-C360 HydrophobicContact CB-CB 3.75Å; C320-C360 WeakPolarHBondContact CB-SG 3.43Å; C320-C360 WeakPolarHBondContact SG-CA 3.18Å; C320-C360 WeakPolarHBondContact SG-CB 3.36Å; C320-C360 CovalentContact SG-SG 2.04Å; C320-C360 PolarHBondContact SG-SG 2.89Å; G358-C360 PolarHBondContact O-N 3.38Å; G358-C360 VanDerWaalsContact O-N 3.07Å
361	E	69.1	Low	61.5	Low	160 Å²	160	106.9 Å²	106.9	75%	0.748	55%	0.545	S	S	*	.			trans	-60.9	142.2	170.3	-62.4	-169.1	175.6	0	0	109.7	N363	E361-N363 PolarHBondContact O-N 3.22Å; E361-N363 VanDerWaalsContact O-N 3.08Å
362	E	58.5	Low	58.7	Low	167 Å²	167	108.9 Å²	108.9	78%	0.78	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	1.2	-169.5	-62.7	-163.4	130.2	0	0	114.6
363	N	49.5	Very low	56.2	Low	122 Å²	122	110.6 Å²	110.6	65%	0.652	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-17.8	-162.9	-87.3	-7	0	0	0	118.1	E361	E361-N363 PolarHBondContact O-N 3.22Å; E361-N363 VanDerWaalsContact O-N 3.08Å
364	D	44.3	Very low	53.6	Low	143 Å²	143	118.7 Å²	118.7	77%	0.765	62%	0.624	S	S	*	*	S	Bend	trans	-106.6	8.2	-167.9	-95.6	-5	0	0	0	116.2
365	Y	46.5	Very low	51.2	Low	104 Å²	104	123.8 Å²	123.8	41%	0.408	66%	0.657	S	S	.	*			trans	-125.5	45.6	176.3	-59.2	-72.8	0	0	0	113	C320 P321 M367	C320-Y365 HydrophobicContact CB-CD2 4.42Å; C320-Y365 HydrophobicContact CB-CE2 3.71Å; P321-Y365 HydrophobicContact CG-CE1 4Å; Y365-M367 PolarHBondContact O-N 3Å
366	F	40.9	Very low	48.8	Very low	164 Å²	164	124 Å²	124	72%	0.719	67%	0.666	S	S	*	*			trans	-65.1	119.3	161.9	-82.2	-86.1	0	0	0	109.5	T368	F366-T368 PolarHBondContact O-N 3Å; F366-T368 VanDerWaalsContact O-N 3.12Å
367	M	41.5	Very low	46.5	Very low	125 Å²	125	127.4 Å²	127.4	62%	0.616	68%	0.683	S	S	*	*			trans	-56.1	116	162	-68.3	-85.5	-89.9	0	0	107.2	T298 Y365 E369	T298-M367 HydrophobicContact CG2-SD 4.17Å; Y365-M367 PolarHBondContact O-N 3Å; M367-E369 PolarHBondContact O-N 2.86Å
368	T	33.1	Very low	44.6	Very low	143 Å²	143	129.1 Å²	129.1	88%	0.877	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-57.4	132.6	172.6	32.1	0	0	0	0	109.2	F366	F366-T368 PolarHBondContact O-N 3Å; F366-T368 VanDerWaalsContact O-N 3.12Å
369	E	32	Very low	42.5	Very low	182 Å²	182	131.6 Å²	131.6	85%	0.85	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-63.4	151	-167.3	-62.8	-178.3	135	0	0	112.3	M367	M367-E369 PolarHBondContact O-N 2.86Å
370	T	31.2	Very low	40.1	Very low	132 Å²	132	137.4 Å²	137.4	81%	0.81	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-49.5	125.5	166.9	40.1	0	0	0	0	110.9	S372	T370-S372 PolarHBondContact O-N 2.96Å
371	P	33.6	Very low	37.6	Very low	127 Å²	127	140 Å²	140	83%	0.825	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-67.5	120.4	173.5	27.2	-32.3	0	0	0	109.5
372	S	30.5	Very low	35.7	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-70	159.5	167.7	52.8	0	0	0	0	110.7	T370 M374	T370-S372 PolarHBondContact O-N 2.96Å; S372-M374 PolarHBondContact O-N 2.8Å
373	P	35.2	Very low	34.4	Very low	126 Å²	126	136.1 Å²	136.1	82%	0.818	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.1	-171.6	-16.9	30.9	0	0	0	112.4
374	M	32.3	Very low	33.4	Very low	174 Å²	174	139 Å²	139	86%	0.857	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67.7	148.9	163.1	-94.8	-92.9	-83.9	0	0	110.4	S372	S372-M374 PolarHBondContact O-N 2.8Å
375	P	32.8	Very low	32.7	Very low	109 Å²	109	137.9 Å²	137.9	71%	0.708	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-70.7	151	179.8	-10.7	26.6	0	0	0	112	L377	P375-L377 PolarHBondContact O-N 3Å
376	E	31.1	Very low	31.9	Very low	192 Å²	192	139.4 Å²	139.4	90%	0.897	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-60	132.9	170	-62	176.6	135.4	0	0	110.9
377	L	29	Very low	31.4	Very low	176 Å²	176	141.1 Å²	141.1	92%	0.921	81%	0.806	S	S	*	*			trans	-126.2	144.2	153.2	-125.1	90.7	0	0	0	109.7	P375	P375-L377 PolarHBondContact O-N 3Å
378	I	30.4	Very low	30.9	Very low	155 Å²	155	139.7 Å²	139.7	80%	0.795	82%	0.815	S	S	*	*			trans	-80.1	154.5	-161.1	-71.2	157.5	0	0	0	112.1
379	S	30.5	Very low	31.1	Very low	99 Å²	99	138.5 Å²	138.5	69%	0.692	81%	0.809	S	S	*	*			trans	-42.9	145.8	174.6	54.6	0	0	0	0	116.1
380	D	27.6	Very low	31	Very low	166 Å²	166	136.4 Å²	136.4	89%	0.888	81%	0.809	S	S	*	*				-150	168.7	111.9	-139	-23.6	0	0	0	112.6
381	A	30.6	Very low	30.8	Very low	71 Å²	71	135.6 Å²	135.6	59%	0.587	81%	0.809	S	S	*	*			trans	-106.5	169.1	-161.7	0	0	0	0	0	115.6
382	T	29.4	Very low	30.7	Very low	140 Å²	140	133.5 Å²	133.5	86%	0.859	81%	0.811	S	S	*	*			trans	58.2	112.9	156	48.9	0	0	0	0	120.1
383	A	30.1	Very low	30.8	Very low	105 Å²	105	134.1 Å²	134.1	87%	0.868	82%	0.815	S	S	*	*				-172	161.1	118.1	0	0	0	0	0	112.6
384	E	29.5	Very low	31.2	Very low	181 Å²	181	133.3 Å²	133.3	85%	0.846	81%	0.809	S	S	*	*			trans	-63.6	158.5	-168.6	-58.1	170.5	130.9	0	0	117
385	P	29.8	Very low	31.2	Very low	121 Å²	121	132 Å²	132	79%	0.786	81%	0.812	S	S	*	*			trans	-95.2	120.4	169.2	35.1	-28.4	0	0	0	112.6
386	T	28.6	Very low	31.2	Very low	135 Å²	135	133.1 Å²	133.1	83%	0.828	82%	0.816	S	S	*	*			trans	-110	126.7	169.7	-55	0	0	0	0	110.9
387	F	30	Very low	32.1	Very low	200 Å²	200	129.4 Å²	129.4	88%	0.877	81%	0.809	S	S	*	*			trans	-71	136.7	177.3	-81.1	-109	0	0	0	112.6
388	A	30.8	Very low	33	Very low	96 Å²	96	127 Å²	127	79%	0.793	80%	0.804	S	S	*	*			trans	-168.4	142.2	133.9	0	0	0	0	0	111.6
389	P	38.4	Very low	32.9	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	80%	0.802	S	S	*	*			trans	-109	151	176.6	38.3	-30.5	0	0	0	113.4
390	T	29.2	Very low	32.9	Very low	138 Å²	138	125.5 Å²	125.5	85%	0.847	80%	0.802	S	S	*	*			trans	-159.6	129	149.7	6.3	0	0	0	0	115.2
391	S	27.8	Very low	33.1	Very low	114 Å²	114	124.9 Å²	124.9	80%	0.797	80%	0.804	S	S	*	*			trans	10.6	134.8	144.3	58.9	0	0	0	0	121.8
392	G	30.2	Very low	33.1	Very low	84 Å²	84	131.4 Å²	131.4	87%	0.866	82%	0.82	S	S	*	*			trans	178.5	101.2	156.8	0	0	0	0	0	113.8
393	S	32.6	Very low	33.2	Very low	116 Å²	116	128 Å²	128	81%	0.811	81%	0.813	S	S	*	*			trans	-106.2	-173.5	168.6	56.6	0	0	0	0	109.9
394	P	45.3	Very low	33.9	Very low	109 Å²	109	129.4 Å²	129.4	71%	0.708	81%	0.814	S	S	*	*				-124.8	168.2	-66.6	37.6	-24.7	0	0	0	111.8
395	T	30.7	Very low	34.1	Very low	147 Å²	147	128.6 Å²	128.6	90%	0.902	81%	0.814	S	S	*	*			trans	-152.1	150.6	160.9	-4.4	0	0	0	0	113.2
396	T	33.3	Very low	35.2	Very low	132 Å²	132	128.1 Å²	128.1	81%	0.81	81%	0.811	S	S	*	*			trans	-110.2	-161.4	-170.7	57.8	0	0	0	0	111.3
397	P	51	Low	36.3	Very low	114 Å²	114	127.3 Å²	127.3	74%	0.74	81%	0.808	S	S	*	*				-103.6	-169.2	-127.6	29.6	-6.6	0	0	0	113.3
398	P	46.5	Very low	36.3	Very low	125 Å²	125	127.1 Å²	127.1	81%	0.812	81%	0.807	S	S	*	*				-148.1	166.1	109.1	36.2	-18.8	0	0	0	118.6
399	T	28.2	Very low	36.3	Very low	125 Å²	125	134.1 Å²	134.1	77%	0.767	81%	0.813	S	S	*	*			trans	-50.6	141.3	173.4	12.2	0	0	0	0	120.7
400	S	32.3	Very low	35.8	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	82%	0.818	S	S	*	*				37.4	135.5	129.8	69.7	0	0	0	0	124
401	T	30.9	Very low	36.1	Very low	152 Å²	152	139.8 Å²	139.8	93%	0.933	82%	0.815	S	S	*	*			trans	-151	167.4	145.3	-13	0	0	0	0	113.4
402	F	31	Very low	36.5	Very low	208 Å²	208	140.5 Å²	140.5	91%	0.912	82%	0.817	S	S	*	*			trans	-111.6	144.9	-158.9	-106.5	-106.5	0	0	0	116
403	G	30.3	Very low	36.8	Very low	70 Å²	70	141.5 Å²	141.5	72%	0.722	80%	0.802	S	S	*	*			trans	72.2	175.6	146.1	0	0	0	0	0	120
404	P	45.9	Very low	37.3	Very low	134 Å²	134	141.3 Å²	141.3	87%	0.87	80%	0.798	S	S	*	*			cis	-133.6	179.6	-8.2	41.3	-23.8	0	0	0	116.5
405	L	32.7	Very low	36.6	Very low	164 Å²	164	144 Å²	144	86%	0.859	80%	0.801	S	S	*	*			trans	-77.3	-177.1	165.2	-80.3	156.9	0	0	0	111.3
406	P	52.7	Low	37.6	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	79%	0.792	S	S	*	*			cis	-133.4	-148.6	19.1	39.5	-14.6	0	0	0	111.8
407	P	52.1	Low	37.4	Very low	119 Å²	119	142.8 Å²	142.8	77%	0.773	80%	0.795	S	S	*	*			cis	-136.2	-149.4	0.7	43.4	-21.3	0	0	0	116.8
408	F	30.4	Very low	36.5	Very low	195 Å²	195	148 Å²	148	86%	0.855	80%	0.801	S	S	*	*			trans	-110.6	164.9	-159.7	-68.2	-103.4	0	0	0	116.2
409	R	30.6	Very low	36.7	Very low	243 Å²	243	148 Å²	148	92%	0.917	80%	0.801	S	S	*	*			trans	-156.3	169.7	130.3	-111.7	176.6	-168.1	-143.7	2.2	114
410	L	28.9	Very low	36.6	Very low	166 Å²	166	145.8 Å²	145.8	87%	0.869	80%	0.803	S	S	*	*			trans	-98.4	162.1	-151	-71.4	97	0	0	0	118.2
411	R	34.6	Very low	36.6	Very low	209 Å²	209	149.5 Å²	149.5	79%	0.789	81%	0.809	S	S	*	*			trans	-70.4	163.2	162.9	-111.2	-179.5	-171.6	-176	3.4	112.5
412	P	36.9	Very low	36.4	Very low	130 Å²	130	149.6 Å²	149.6	84%	0.844	80%	0.801	S	S	*	*				-148.1	175.2	85.2	35.9	-15.1	0	0	0	117.9
413	I	35.6	Very low	36.4	Very low	104 Å²	104	143.9 Å²	143.9	53%	0.533	79%	0.787	S	S	.	*			trans	-133.9	142.6	-178.3	-69.5	164.4	0	0	0	104.9
414	P	44	Very low	36.4	Very low	113 Å²	113	149.2 Å²	149.2	73%	0.734	79%	0.79	S	S	*	*				-161.9	135	93.5	39.4	-15.7	0	0	0	121.6
415	H	30.1	Very low	35.6	Very low	166 Å²	166	148.1 Å²	148.1	77%	0.769	78%	0.777	S	S	*	*				57.4	-172.4	127.9	-54.2	-52.6	0	0	0	121
416	P	50.8	Low	35.5	Very low	110 Å²	110	145.9 Å²	145.9	71%	0.714	77%	0.77	S	S	*	*				-133.6	-179.6	-106.9	38.8	-17.2	0	0	0	114.7
417	T	29	Very low	34.6	Very low	142 Å²	142	151.1 Å²	151.1	87%	0.871	78%	0.776	S	S	*	*			trans	-172.1	141.4	150.9	8.5	0	0	0	0	115.9
418	Y	33.5	Very low	33.5	Very low	225 Å²	225	151.7 Å²	151.7	88%	0.882	77%	0.772	S	S	*	*			trans	-122.3	177.3	147.1	-100	-89.8	0	0	0	105.2
419	P	49.4	Very low	33.5	Very low	125 Å²	125	148.3 Å²	148.3	81%	0.812	77%	0.768	S	S	*	*			cis	-130.5	-167.6	-6.5	36.5	-15.8	0	0	0	113.5
420	G	27.8	Very low	33.7	Very low	78 Å²	78	141.2 Å²	141.2	80%	0.804	76%	0.761	S	S	*	*			trans	-173.4	150	170.5	0	0	0	0	0	115.3
421	H	30.5	Very low	33.7	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.815	77%	0.765	S	S	*	*			trans	-125.5	154.8	-161.4	-132.4	-116.8	0	0	0	114.4
422	M	27.3	Very low	33.7	Very low	155 Å²	155	141.5 Å²	141.5	76%	0.764	77%	0.768	S	S	*	*			trans	65.2	121.6	146.3	-88.8	172.4	75.3	0	0	124.4
423	S	30.3	Very low	33.2	Very low	88 Å²	88	142.3 Å²	142.3	62%	0.615	77%	0.771	S	S	*	*				146.7	132.6	103.6	-85.3	0	0	0	0	118
424	K	30.4	Very low	32.8	Very low	182 Å²	182	148.3 Å²	148.3	79%	0.791	79%	0.786	S	S	*	*			trans	62.6	155.4	137.3	-69.4	-175.3	157	-160.5	0	121.1
425	D	30.2	Very low	33.5	Very low	110 Å²	110	147.6 Å²	147.6	59%	0.588	78%	0.782	S	S	*	*			cis	-163.1	149.8	-8.1	-117.9	-35.2	0	0	0	111.3
426	T	30.1	Very low	33.4	Very low	118 Å²	118	147 Å²	147	72%	0.724	79%	0.79	S	S	*	*			trans	60.8	157.6	150.9	62.2	0	0	0	0	121
427	R	33.3	Very low	32.7	Very low	219 Å²	219	149.4 Å²	149.4	83%	0.826	80%	0.796	S	S	*	*			cis	-166.4	167	-6.4	-123.8	177.5	-173.5	171.2	2.3	112.6
428	N	28.8	Very low	32.7	Very low	131 Å²	131	150.7 Å²	150.7	70%	0.701	80%	0.796	S	S	*	*			trans	112.8	114	142.4	-74.4	-5.6	0	0	0	123.3
429	T	31.7	Very low	32.5	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	79%	0.79	S	S	*	*			trans	43.4	127.7	137.1	55	0	0	0	0	121.9
430	A	33.6	Very low	32.8	Very low	95 Å²	95	144.7 Å²	144.7	79%	0.785	79%	0.787	S	S	*	*			cis	88.6	116.4	27.3	0	0	0	0	0	117.3
431	V	30.3	Very low	34.5	Very low	156 Å²	156	146.7 Å²	146.7	95%	0.945	79%	0.786	S	S	*	*			trans	-140.9	154.6	159.1	179.1	0	0	0	0	109.6
432	R	33.1	Very low	34.4	Very low	225 Å²	225	143.3 Å²	143.3	85%	0.849	79%	0.788	S	S	*	*			trans	-149.9	151	-157.5	163.4	-167.6	-178.1	-177	2.6	110.1
433	T	27.1	Very low	34.9	Very low	147 Å²	147	143.9 Å²	143.9	90%	0.902	79%	0.791	S	S	*	*			trans	-161.8	155.9	147.1	12.8	0	0	0	0	113.8
434	R	27.8	Very low	35.3	Very low	229 Å²	229	146.9 Å²	146.9	86%	0.864	80%	0.796	S	S	*	*			trans	-156.9	-171	-175.8	-151.2	-158.6	-175.6	-166.8	5.5	108.2
435	P	59.2	Low	35.9	Very low	98 Å²	98	145.7 Å²	145.7	64%	0.636	79%	0.793	S	S	*	*				-112.1	-169.5	-107.6	43.2	-26.9	0	0	0	114.9
436	T	27.1	Very low	36.6	Very low	153 Å²	153	147.8 Å²	147.8	94%	0.939	80%	0.801	S	S	*	*			trans	-150.7	175.2	155.4	4.5	0	0	0	0	113.2
437	L	36	Very low	37.7	Very low	161 Å²	161	145.5 Å²	145.5	84%	0.843	79%	0.793	S	S	*	*			trans	-135.3	159.2	-152.5	-169.2	91.6	0	0	0	112.1
438	I	29.1	Very low	38.7	Very low	169 Å²	169	140.7 Å²	140.7	87%	0.867	78%	0.783	S	S	*	*			trans	169.2	159.5	142.5	-86.7	153.6	0	0	0	110.8
439	S	28.6	Very low	40	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	78%	0.782	S	S	*	*			trans	-133.1	173.9	-163.6	63.7	0	0	0	0	115.2
440	P	57.4	Low	41.2	Very low	116 Å²	116	142.5 Å²	142.5	75%	0.753	78%	0.777	S	S	*	*			trans	-100.8	-161.5	-159.2	46.4	-41.7	0	0	0	113.2
441	P	61.7	Low	42.8	Very low	121 Å²	121	142.7 Å²	142.7	79%	0.786	77%	0.768	S	S	*	*			cis	-145.5	-176	7.2	45.6	-25.6	0	0	0	119.2
442	A	29.8	Very low	44.5	Very low	104 Å²	104	138.8 Å²	138.8	86%	0.86	74%	0.744	S	S	*	*			trans	-149.7	150.6	151.3	0	0	0	0	0	110.7
443	M	36.4	Very low	46.3	Very low	168 Å²	168	132.2 Å²	132.2	83%	0.828	73%	0.729	S	S	*	*			trans	-125.6	163.4	-159.1	-175	176.3	-72.7	0	0	111.8
444	E	39.6	Very low	48.3	Very low	151 Å²	151	127 Å²	127	71%	0.706	70%	0.704	S	S	*	*				160.7	145.5	120.5	-86	-175.3	163	0	0	121.9	M446	E444-M446 PolarHBondContact O-N 3.3Å
445	H	42.7	Very low	50.7	Low	157 Å²	157	119.1 Å²	119.1	73%	0.727	68%	0.684	S	S	*	*	S	Bend	trans	70.1	-25.9	146.4	-71.7	-49	0	0	0	126.2	A447	H445-A447 PolarHBondContact O-N 2.81Å
446	M	45.3	Very low	51.6	Low	154 Å²	154	117.8 Å²	117.8	76%	0.759	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-12.5	-176.9	-143.2	-161.7	-173.9	0	0	115.8	E444	E444-M446 PolarHBondContact O-N 3.3Å
447	A	53.8	Low	54	Low	69 Å²	69	113 Å²	113	57%	0.57	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-37.9	-173.4	0	0	0	0	0	114.4	H445 H449 K450 V451	H445-A447 PolarHBondContact O-N 2.81Å; A447-H449 PolarHBondContact O-N 2.94Å; A447-K450 PolarHBondContact O-N 3.09Å; A447-V451 PolarHBondContact O-N 3.21Å
448	L	53.3	Low	56.2	Low	118 Å²	118	110.4 Å²	110.4	62%	0.618	64%	0.636	S	S	*	*	H	α-helix	trans	-63.9	-43	-166.2	-153.9	83.6	0	0	0	112.5	K450 V451 V452	L448-K450 VanDerWaalsContact C-N 3.28Å; L448-K450 PolarHBondContact O-N 3.43Å; L448-V451 PolarHBondContact O-N 3.07Å; L448-V451 VanDerWaalsContact O-N 3.15Å; L448-V452 WeakPolarHBondContact O-CG2 3.46Å; L448-V452 PolarHBondContact O-N 2.91Å
449	H	56.7	Low	58.8	Low	147 Å²	147	109.4 Å²	109.4	68%	0.681	63%	0.626	S	S	*	*	H	α-helix	trans	-66.4	-29.5	-177.5	-146.9	-61.7	0	0	0	112.8	A447 V453	A447-H449 PolarHBondContact O-N 2.94Å; H449-V453 WeakPolarHBondContact O-CB 3.17Å; H449-V453 VanDerWaalsContact O-CG2 3.24Å; H449-V453 WeakPolarHBondContact O-CG2 3.44Å; H449-V453 PolarHBondContact O-N 2.93Å
450	K	57.3	Low	61.3	Low	147 Å²	147	111.1 Å²	111.1	64%	0.639	62%	0.62	S	S	*	*	H	α-helix	trans	-74.3	-36.9	173.8	-70.8	179.8	177.2	174.8	0	111.8	A447 L448 G454	A447-K450 PolarHBondContact O-N 3.09Å; L448-K450 VanDerWaalsContact C-N 3.28Å; L448-K450 PolarHBondContact O-N 3.43Å; K450-G454 PolarHBondContact O-N 2.91Å
451	V	65.7	Low	62.6	Low	98 Å²	98	108.8 Å²	108.8	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-42.1	174.5	175	0	0	0	0	111.1	A447 L448 G454 S455	A447-V451 PolarHBondContact O-N 3.21Å; L448-V451 PolarHBondContact O-N 3.07Å; L448-V451 VanDerWaalsContact O-N 3.15Å; V451-G454 PolarHBondContact O-N 3.07Å; V451-S455 PolarHBondContact O-N 3.26Å; V451-S455 PolarHBondContact O-OG 3.03Å
452	V	67.8	Low	64	Low	75 Å²	75	107.4 Å²	107.4	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-69.2	-44.1	178.1	174.9	0	0	0	0	112.1	L448 G454 S455 V456	L448-V452 WeakPolarHBondContact O-CG2 3.46Å; L448-V452 PolarHBondContact O-N 2.91Å; V452-G454 VanDerWaalsContact C-N 3.29Å; V452-G454 PolarHBondContact O-N 3.31Å; V452-S455 PolarHBondContact O-N 3.04Å; V452-S455 PolarHBondContact O-OG 3.2Å; V452-S455 VanDerWaalsContact O-OG 3.04Å; V452-V456 WeakPolarHBondContact O-CB 3.29Å; V452-V456 VanDerWaalsContact O-CG2 3.27Å; V452-V456 WeakPolarHBondContact O-CG2 3.35Å; V452-V456 PolarHBondContact O-N 2.96Å
453	V	69.3	Low	66.4	Low	87 Å²	87	104.8 Å²	104.8	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-38.2	174.1	171	0	0	0	0	110.9	H449 A457	H449-V453 WeakPolarHBondContact O-CB 3.17Å; H449-V453 VanDerWaalsContact O-CG2 3.24Å; H449-V453 WeakPolarHBondContact O-CG2 3.44Å; H449-V453 PolarHBondContact O-N 2.93Å; V453-A457 WeakPolarHBondContact O-CB 3.25Å; V453-A457 PolarHBondContact O-N 2.98Å
454	G	70.4	Confident	68.7	Low	36 Å²	36	102.1 Å²	102.1	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-61.5	-47.2	174.5	0	0	0	0	0	113.1	K450 V451 V452 A457 L458	K450-G454 PolarHBondContact O-N 2.91Å; V451-G454 PolarHBondContact O-N 3.07Å; V452-G454 VanDerWaalsContact C-N 3.29Å; V452-G454 PolarHBondContact O-N 3.31Å; G454-A457 PolarHBondContact O-N 3.35Å; G454-L458 WeakPolarHBondContact O-CB 3.2Å; G454-L458 PolarHBondContact O-N 2.94Å
455	S	76.6	Confident	71.1	Confident	65 Å²	65	98.7 Å²	98.7	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-68.5	-37.7	179.8	63.5	0	0	0	0	112.6	V451 V452 L458 F459	V451-S455 PolarHBondContact O-N 3.26Å; V451-S455 PolarHBondContact O-OG 3.03Å; V452-S455 PolarHBondContact O-N 3.04Å; V452-S455 PolarHBondContact O-OG 3.2Å; V452-S455 VanDerWaalsContact O-OG 3.04Å; S455-L458 PolarHBondContact O-N 3.09Å; S455-F459 PolarHBondContact O-N 2.72Å
456	V	79.3	Confident	73.1	Confident	69 Å²	69	96.6 Å²	96.6	42%	0.418	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-44.1	174.5	171.7	0	0	0	0	111.2	V452 L458 F459 F460	V452-V456 WeakPolarHBondContact O-CB 3.29Å; V452-V456 VanDerWaalsContact O-CG2 3.27Å; V452-V456 WeakPolarHBondContact O-CG2 3.35Å; V452-V456 PolarHBondContact O-N 2.96Å; V456-L458 VanDerWaalsContact C-N 3.33Å; V456-L458 PolarHBondContact O-N 3.25Å; V456-F459 PolarHBondContact O-N 3.05Å; V456-F460 HydrophobicContact CG1-CD2 3.71Å; V456-F460 HydrophobicContact CG1-CE2 3.54Å; V456-F460 VanDerWaalsContact O-CD2 3.27Å; V456-F460 WeakPolarHBondContact O-CD2 3.21Å; V456-F460 PolarHBondContact O-N 2.93Å
457	A	76.9	Confident	74.9	Confident	53 Å²	53	93.2 Å²	93.2	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-63.2	-37.9	174.7	0	0	0	0	0	112.4	V453 G454 T461	V453-A457 WeakPolarHBondContact O-CB 3.25Å; V453-A457 PolarHBondContact O-N 2.98Å; G454-A457 PolarHBondContact O-N 3.35Å; A457-T461 WeakPolarHBondContact O-CB 3.32Å; A457-T461 WeakPolarHBondContact O-CG2 3.34Å; A457-T461 PolarHBondContact O-N 3.43Å; A457-T461 PolarHBondContact O-OG1 3.17Å
458	L	82.6	Confident	76.3	Confident	106 Å²	106	94.4 Å²	94.4	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-64.1	-40	173.8	-124.5	158.6	0	0	0	111.8	G454 S455 V456 T461 M462	G454-L458 WeakPolarHBondContact O-CB 3.2Å; G454-L458 PolarHBondContact O-N 2.94Å; S455-L458 PolarHBondContact O-N 3.09Å; V456-L458 VanDerWaalsContact C-N 3.33Å; V456-L458 PolarHBondContact O-N 3.25Å; L458-T461 WeakPolarHBondContact CA-OG1 3.35Å; L458-T461 PolarHBondContact O-OG1 3.41Å; L458-M462 HydrophobicContact CD2-CE 4.34Å; L458-M462 HydrophobicContact CD2-CG 4.11Å; L458-M462 WeakPolarHBondContact O-CB 3.36Å; L458-M462 VanDerWaalsContact O-CG 3.24Å; L458-M462 WeakPolarHBondContact O-CG 3.29Å; L458-M462 PolarHBondContact O-N 3.34Å
459	F	83.9	Confident	77.6	Confident	149 Å²	149	93.4 Å²	93.4	65%	0.654	51%	0.509	S	S	*	.	H	α-helix	trans	-65.8	-47	177.5	-159.3	-89.6	0	0	0	112.1	S455 V456 T461 M462 S463	S455-F459 PolarHBondContact O-N 2.72Å; V456-F459 PolarHBondContact O-N 3.05Å; F459-T461 PolarHBondContact O-N 2.66Å; F459-M462 PolarHBondContact O-N 3.07Å; F459-S463 PolarHBondContact O-N 2.94Å; F459-S463 PolarHBondContact O-OG 3.21Å
460	F	80.1	Confident	78.9	Confident	144 Å²	144	92.3 Å²	92.3	63%	0.632	50%	0.5	S	S	*	.	H	α-helix	trans	-64.7	-39.6	177.1	-78.8	-64.6	0	0	0	113	V456 S463 L464	V456-F460 HydrophobicContact CG1-CD2 3.71Å; V456-F460 HydrophobicContact CG1-CE2 3.54Å; V456-F460 VanDerWaalsContact O-CD2 3.27Å; V456-F460 WeakPolarHBondContact O-CD2 3.21Å; V456-F460 PolarHBondContact O-N 2.93Å; F460-S463 PolarHBondContact O-N 2.99Å; F460-L464 WeakPolarHBondContact O-CB 3.5Å; F460-L464 PolarHBondContact O-N 3.43Å
461	T	85.6	Confident	80.1	Confident	67 Å²	67	88.9 Å²	88.9	41%	0.411	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-39.8	175.8	48.8	0	0	0	0	112	A457 L458 F459 L464 I465	A457-T461 WeakPolarHBondContact O-CB 3.32Å; A457-T461 WeakPolarHBondContact O-CG2 3.34Å; A457-T461 PolarHBondContact O-N 3.43Å; A457-T461 PolarHBondContact O-OG1 3.17Å; L458-T461 WeakPolarHBondContact CA-OG1 3.35Å; L458-T461 PolarHBondContact O-OG1 3.41Å; F459-T461 PolarHBondContact O-N 2.66Å; T461-L464 PolarHBondContact O-N 2.86Å; T461-I465 WeakPolarHBondContact O-CB 3.15Å; T461-I465 WeakPolarHBondContact O-CD1 3.01Å; T461-I465 VanDerWaalsContact O-CG1 3.23Å; T461-I465 WeakPolarHBondContact O-CG1 3.36Å; T461-I465 PolarHBondContact O-N 3.48Å
462	M	90.3	Very high	80.7	Confident	92 Å²	92	87.5 Å²	87.5	45%	0.453	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-43.5	173.3	-71.9	-62.1	119.5	0	0	112.4	L458 F459 L464 I465 L466	L458-M462 HydrophobicContact CD2-CE 4.34Å; L458-M462 HydrophobicContact CD2-CG 4.11Å; L458-M462 WeakPolarHBondContact O-CB 3.36Å; L458-M462 VanDerWaalsContact O-CG 3.24Å; L458-M462 WeakPolarHBondContact O-CG 3.29Å; L458-M462 PolarHBondContact O-N 3.34Å; F459-M462 PolarHBondContact O-N 3.07Å; M462-L464 VanDerWaalsContact C-N 3.34Å; M462-L464 PolarHBondContact O-N 3.34Å; M462-I465 HydrophobicContact CE-CD1 3.83Å; M462-I465 PolarHBondContact O-N 2.89Å; M462-L466 WeakPolarHBondContact O-CB 3.45Å; M462-L466 VanDerWaalsContact O-CG 3.31Å; M462-L466 WeakPolarHBondContact O-CG 3.37Å; M462-L466 PolarHBondContact O-N 3.01Å
463	S	80.9	Confident	80.9	Confident	49 Å²	49	91.2 Å²	91.2	34%	0.343	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-40.8	173.4	-73.7	0	0	0	0	112.1	F459 F460 L466 T467	F459-S463 PolarHBondContact O-N 2.94Å; F459-S463 PolarHBondContact O-OG 3.21Å; F460-S463 PolarHBondContact O-N 2.99Å; S463-L466 PolarHBondContact O-N 3.25Å; S463-T467 WeakPolarHBondContact O-CB 3.35Å; S463-T467 PolarHBondContact O-N 2.9Å; S463-T467 PolarHBondContact O-OG1 3.07Å
464	L	85.7	Confident	81.2	Confident	112 Å²	112	96.3 Å²	96.3	59%	0.586	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-46.7	176.4	-168.3	81.9	0	0	0	111.1	F460 T461 M462 T467 I468	F460-L464 WeakPolarHBondContact O-CB 3.5Å; F460-L464 PolarHBondContact O-N 3.43Å; T461-L464 PolarHBondContact O-N 2.86Å; M462-L464 VanDerWaalsContact C-N 3.34Å; M462-L464 PolarHBondContact O-N 3.34Å; L464-T467 PolarHBondContact O-N 2.82Å; L464-I468 HydrophobicContact CD2-CD1 4.3Å; L464-I468 HydrophobicContact CG-CD1 4.03Å; L464-I468 VanDerWaalsContact O-CG1 3.3Å; L464-I468 WeakPolarHBondContact O-CG1 3.35Å; L464-I468 PolarHBondContact O-N 3.38Å
465	I	88.4	Confident	81.2	Confident	78 Å²	78	103.4 Å²	103.4	40%	0.4	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-46.1	178	-71.2	163.9	0	0	0	111	T461 M462 T467 I468 I469	T461-I465 WeakPolarHBondContact O-CB 3.15Å; T461-I465 WeakPolarHBondContact O-CD1 3.01Å; T461-I465 VanDerWaalsContact O-CG1 3.23Å; T461-I465 WeakPolarHBondContact O-CG1 3.36Å; T461-I465 PolarHBondContact O-N 3.48Å; M462-I465 HydrophobicContact CE-CD1 3.83Å; M462-I465 PolarHBondContact O-N 2.89Å; I465-T467 VanDerWaalsContact C-N 3.31Å; I465-T467 PolarHBondContact O-N 2.9Å; I465-I468 PolarHBondContact O-N 3.43Å; I465-I469 HydrophobicContact CG2-CD1 3.69Å; I465-I469 HydrophobicContact CG2-CG1 4.38Å; I465-I469 WeakPolarHBondContact O-CB 3.19Å; I465-I469 VanDerWaalsContact O-CG1 3.26Å; I465-I469 WeakPolarHBondContact O-CG1 3.48Å; I465-I469 PolarHBondContact O-N 3.42Å
466	L	85.2	Confident	80.8	Confident	114 Å²	114	106.9 Å²	106.9	60%	0.597	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-38.9	175.8	-73.4	168.4	0	0	0	111.8	M462 S463 I469 Y470	M462-L466 WeakPolarHBondContact O-CB 3.45Å; M462-L466 VanDerWaalsContact O-CG 3.31Å; M462-L466 WeakPolarHBondContact O-CG 3.37Å; M462-L466 PolarHBondContact O-N 3.01Å; S463-L466 PolarHBondContact O-N 3.25Å; L466-I469 PolarHBondContact O-N 3.13Å; L466-Y470 VanDerWaalsContact O-CB 3.3Å; L466-Y470 WeakPolarHBondContact O-CB 3.3Å; L466-Y470 PolarHBondContact O-N 3.01Å
467	T	82.9	Confident	80	Confident	82 Å²	82	107.6 Å²	107.6	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-42.9	175.7	-50	0	0	0	0	111.4	S463 L464 I465 Y470 V471	S463-T467 WeakPolarHBondContact O-CB 3.35Å; S463-T467 PolarHBondContact O-N 2.9Å; S463-T467 PolarHBondContact O-OG1 3.07Å; L464-T467 PolarHBondContact O-N 2.82Å; I465-T467 VanDerWaalsContact C-N 3.31Å; I465-T467 PolarHBondContact O-N 2.9Å; T467-Y470 PolarHBondContact O-N 3.17Å; T467-V471 WeakPolarHBondContact O-CG2 3.45Å; T467-V471 PolarHBondContact O-N 2.97Å
468	I	83.2	Confident	79.3	Confident	94 Å²	94	107.7 Å²	107.7	48%	0.482	53%	0.53	S	S	.	.	H	α-helix	trans	-63.4	-45.6	175.3	-69.5	164.7	0	0	0	110.4	L464 I465 Y470 V471 V472	L464-I468 HydrophobicContact CD2-CD1 4.3Å; L464-I468 HydrophobicContact CG-CD1 4.03Å; L464-I468 VanDerWaalsContact O-CG1 3.3Å; L464-I468 WeakPolarHBondContact O-CG1 3.35Å; L464-I468 PolarHBondContact O-N 3.38Å; I465-I468 PolarHBondContact O-N 3.43Å; I468-Y470 VanDerWaalsContact C-N 3.34Å; I468-Y470 PolarHBondContact O-N 2.83Å; I468-V471 PolarHBondContact O-N 3.12Å; I468-V472 HydrophobicContact CG2-CG2 4.25Å; I468-V472 WeakPolarHBondContact O-CB 3.47Å; I468-V472 VanDerWaalsContact O-CG2 3.24Å; I468-V472 WeakPolarHBondContact O-CG2 3.38Å; I468-V472 PolarHBondContact O-N 3.16Å
469	I	80.1	Confident	78.2	Confident	97 Å²	97	105.2 Å²	105.2	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-59.8	-44.8	175.7	-70.5	167.3	0	0	0	110.5	I465 L466 V472 W473	I465-I469 HydrophobicContact CG2-CD1 3.69Å; I465-I469 HydrophobicContact CG2-CG1 4.38Å; I465-I469 WeakPolarHBondContact O-CB 3.19Å; I465-I469 VanDerWaalsContact O-CG1 3.26Å; I465-I469 WeakPolarHBondContact O-CG1 3.48Å; I465-I469 PolarHBondContact O-N 3.42Å; L466-I469 PolarHBondContact O-N 3.13Å; I469-V472 PolarHBondContact O-N 3.48Å; I469-W473 WeakPolarHBondContact O-CB 3.35Å; I469-W473 PolarHBondContact O-N 3.4Å
470	Y	84.9	Confident	76.9	Confident	124 Å²	124	100.6 Å²	100.6	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-45.4	177.4	178.1	-97	0	0	0	112.2	L466 T467 I468 W473 R474	L466-Y470 VanDerWaalsContact O-CB 3.3Å; L466-Y470 WeakPolarHBondContact O-CB 3.3Å; L466-Y470 PolarHBondContact O-N 3.01Å; T467-Y470 PolarHBondContact O-N 3.17Å; I468-Y470 VanDerWaalsContact C-N 3.34Å; I468-Y470 PolarHBondContact O-N 2.83Å; Y470-W473 PolarHBondContact O-N 2.92Å; Y470-R474 VanDerWaalsContact O-CB 3.29Å; Y470-R474 WeakPolarHBondContact O-CB 3.2Å; Y470-R474 PolarHBondContact O-N 3.4Å
471	V	82.3	Confident	75.8	Confident	76 Å²	76	102.8 Å²	102.8	46%	0.461	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-42.4	176.6	170.5	0	0	0	0	111.5	T467 I468 R475	T467-V471 WeakPolarHBondContact O-CG2 3.45Å; T467-V471 PolarHBondContact O-N 2.97Å; I468-V471 PolarHBondContact O-N 3.12Å; V471-R475 WeakPolarHBondContact O-CB 3.36Å; V471-R475 PolarHBondContact O-N 3.18Å
472	V	77.9	Confident	74.5	Confident	68 Å²	68	104.3 Å²	104.3	41%	0.412	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-41.8	176.9	169.5	0	0	0	0	111.1	I468 I469 R475 Y476	I468-V472 HydrophobicContact CG2-CG2 4.25Å; I468-V472 WeakPolarHBondContact O-CB 3.47Å; I468-V472 VanDerWaalsContact O-CG2 3.24Å; I468-V472 WeakPolarHBondContact O-CG2 3.38Å; I468-V472 PolarHBondContact O-N 3.16Å; I469-V472 PolarHBondContact O-N 3.48Å; V472-R475 PolarHBondContact O-N 2.94Å; V472-Y476 WeakPolarHBondContact O-CA 3.44Å; V472-Y476 PolarHBondContact O-N 2.98Å
473	W	72	Confident	72.8	Confident	154 Å²	154	105.9 Å²	105.9	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-65.1	-42.5	177.6	-174.5	49.4	0	0	0	111.8	I469 Y470	I469-W473 WeakPolarHBondContact O-CB 3.35Å; I469-W473 PolarHBondContact O-N 3.4Å; Y470-W473 PolarHBondContact O-N 2.92Å
474	R	75.3	Confident	71.6	Confident	193 Å²	193	110.4 Å²	110.4	73%	0.728	54%	0.543	S	S	*	.	H	α-helix	trans	-70.9	-28.5	177.1	-165.8	175.3	-176.8	-170.8	0.2	113.2	Y470	Y470-R474 VanDerWaalsContact O-CB 3.29Å; Y470-R474 WeakPolarHBondContact O-CB 3.2Å; Y470-R474 PolarHBondContact O-N 3.4Å
475	R	71.1	Confident	70.1	Confident	185 Å²	185	110.9 Å²	110.9	70%	0.698	54%	0.543	S	S	*	.	H	α-helix	trans	-97.1	-21.9	-177	-159.8	165.7	-174.7	144.2	0.6	114.2	V471 V472	V471-R475 WeakPolarHBondContact O-CB 3.36Å; V471-R475 PolarHBondContact O-N 3.18Å; V472-R475 PolarHBondContact O-N 2.94Å
476	Y	68.3	Low	68.3	Low	139 Å²	139	116 Å²	116	55%	0.545	56%	0.557	S	S	.	*			trans	-142	64	-177.8	-58.7	-77.5	0	0	0	113	V472 G478 A479	V472-Y476 WeakPolarHBondContact O-CA 3.44Å; V472-Y476 PolarHBondContact O-N 2.98Å; Y476-G478 PolarHBondContact O-N 3.03Å; Y476-A479 PolarHBondContact O-N 2.88Å; Y476-A479 VanDerWaalsContact O-N 3.13Å
477	P	63.1	Low	66.6	Low	84 Å²	84	115.3 Å²	115.3	55%	0.545	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-17.8	-176.3	25.5	-35.5	0	0	0	114.6	T480	P477-T480 PolarHBondContact O-OG1 3.33Å
478	G	62	Low	65.1	Low	54 Å²	54	118.7 Å²	118.7	56%	0.557	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-26.1	176	0	0	0	0	0	114.8	Y476	Y476-G478 PolarHBondContact O-N 3.03Å
479	A	59.5	Low	63.5	Low	55 Å²	55	118.5 Å²	118.5	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-74.3	-30.7	-171.4	0	0	0	0	0	113.5	Y476 R481 L482	Y476-A479 PolarHBondContact O-N 2.88Å; Y476-A479 VanDerWaalsContact O-N 3.13Å; A479-R481 PolarHBondContact O-N 3.33Å; A479-L482 PolarHBondContact O-N 3.36Å
480	T	56.4	Low	61.6	Low	52 Å²	52	116.7 Å²	116.7	32%	0.319	58%	0.582	S	S	.	*	H	α-helix	trans	-70.4	-30.3	-178.4	52.1	0	0	0	0	113	P477 L482 L483 Q484	P477-T480 PolarHBondContact O-OG1 3.33Å; T480-L482 VanDerWaalsContact C-N 3.25Å; T480-L482 PolarHBondContact O-N 3.39Å; T480-L483 PolarHBondContact O-N 3.2Å; T480-L483 VanDerWaalsContact O-N 3.16Å; T480-Q484 PolarHBondContact O-N 3.19Å
481	R	57.7	Low	59.5	Low	190 Å²	190	122.4 Å²	122.4	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-59.8	-35.4	175	-67.1	-175.1	175.8	-176.7	-1.6	112.1	A479 L483 Q485	A479-R481 PolarHBondContact O-N 3.33Å; R481-L483 PolarHBondContact O-N 3.21Å; R481-Q485 PolarHBondContact O-N 3.27Å
482	L	57.3	Low	57.6	Low	98 Å²	98	128 Å²	128	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-68.9	-31.3	178.3	-134.1	84	0	0	0	113	A479 T480 R486	A479-L482 PolarHBondContact O-N 3.36Å; T480-L482 VanDerWaalsContact C-N 3.25Å; T480-L482 PolarHBondContact O-N 3.39Å; L482-R486 WeakPolarHBondContact O-CG 3.49Å; L482-R486 PolarHBondContact O-N 2.98Å
483	L	54.2	Low	55.6	Low	125 Å²	125	135.6 Å²	135.6	65%	0.654	64%	0.642	S	S	*	*	H	α-helix	trans	-75.8	-38.6	179	-78.5	164.6	0	0	0	112.2	T480 R481 R486 S487	T480-L483 PolarHBondContact O-N 3.2Å; T480-L483 VanDerWaalsContact O-N 3.16Å; R481-L483 PolarHBondContact O-N 3.21Å; L483-R486 PolarHBondContact O-N 3.17Å; L483-S487 PolarHBondContact O-N 3.37Å
484	Q	55.3	Low	53.9	Low	144 Å²	144	139.9 Å²	139.9	67%	0.673	66%	0.658	S	S	*	*	H	α-helix	trans	-62.5	-42.7	172.1	-82.1	-178.2	-37.5	0	0	111.9	T480 R486 S487 M488	T480-Q484 PolarHBondContact O-N 3.19Å; Q484-R486 PolarHBondContact O-N 3.17Å; Q484-S487 PolarHBondContact O-N 3.12Å; Q484-M488 PolarHBondContact O-N 2.99Å
485	Q	55.3	Low	52.2	Low	122 Å²	122	140.4 Å²	140.4	57%	0.57	67%	0.666	S	S	*	*	H	α-helix	trans	-59.5	-45.4	174.7	-77.6	-178.5	-33.5	0	0	112.5	R481 S487 M488 V489	R481-Q485 PolarHBondContact O-N 3.27Å; Q485-S487 VanDerWaalsContact C-N 3.33Å; Q485-S487 PolarHBondContact O-N 3.41Å; Q485-M488 PolarHBondContact O-N 3.12Å; Q485-V489 WeakPolarHBondContact O-CG2 3.46Å; Q485-V489 PolarHBondContact O-N 2.98Å; Q485-V489 VanDerWaalsContact O-N 3.15Å
486	R	51.1	Low	50.2	Low	187 Å²	187	141.8 Å²	141.8	71%	0.706	68%	0.677	S	S	*	*	H	α-helix	trans	-63.6	-34.7	-179.9	-77.1	-176.6	174.4	-169.4	-1.1	113.5	L482 L483 Q484 M488 V489 G490	L482-R486 WeakPolarHBondContact O-CG 3.49Å; L482-R486 PolarHBondContact O-N 2.98Å; L483-R486 PolarHBondContact O-N 3.17Å; Q484-R486 PolarHBondContact O-N 3.17Å; R486-M488 PolarHBondContact O-N 3.46Å; R486-V489 PolarHBondContact O-N 2.89Å; R486-G490 PolarHBondContact O-N 3.01Å
487	S	49.6	Very low	48.4	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	69%	0.689	S	S	*	*	H	α-helix	trans	-63.7	-38.2	175.5	-171.5	0	0	0	0	112.7	L483 Q484 Q485	L483-S487 PolarHBondContact O-N 3.37Å; Q484-S487 PolarHBondContact O-N 3.12Å; Q485-S487 VanDerWaalsContact C-N 3.33Å; Q485-S487 PolarHBondContact O-N 3.41Å
488	M	50.3	Low	47.6	Very low	154 Å²	154	142.3 Å²	142.3	76%	0.759	70%	0.7	S	S	*	*	H	α-helix	trans	-74.7	-32.4	178.3	-65.5	-173	177.4	0	0	113.2	Q484 Q485 R486	Q484-M488 PolarHBondContact O-N 2.99Å; Q485-M488 PolarHBondContact O-N 3.12Å; R486-M488 PolarHBondContact O-N 3.46Å
489	V	50.9	Low	46	Very low	89 Å²	89	148.6 Å²	148.6	54%	0.539	72%	0.715	S	S	.	*	H	α-helix	trans	-72.3	-30.7	178.5	173.7	0	0	0	0	112.4	Q485 R486 R491 K492	Q485-V489 WeakPolarHBondContact O-CG2 3.46Å; Q485-V489 PolarHBondContact O-N 2.98Å; Q485-V489 VanDerWaalsContact O-N 3.15Å; R486-V489 PolarHBondContact O-N 2.89Å; V489-R491 PolarHBondContact O-N 2.96Å; V489-R491 VanDerWaalsContact O-N 3.16Å; V489-K492 PolarHBondContact O-N 3.02Å; V489-K492 VanDerWaalsContact O-N 3.15Å
490	G	39.4	Very low	44.9	Very low	60 Å²	60	151.7 Å²	151.7	62%	0.619	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-27.1	-178.3	0	0	0	0	0	115.4	R486	R486-G490 PolarHBondContact O-N 3.01Å
491	R	40.8	Very low	43.7	Very low	243 Å²	243	158.2 Å²	158.2	92%	0.917	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-10.7	178.9	-86.7	-176.4	172	175.2	-2.1	115.2	V489	V489-R491 PolarHBondContact O-N 2.96Å; V489-R491 VanDerWaalsContact O-N 3.16Å
492	K	41.8	Very low	42.3	Very low	195 Å²	195	157.7 Å²	157.7	85%	0.848	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-10.7	-178.1	-77.4	-172.1	175	-178.4	0	115.5	V489 R494	V489-K492 PolarHBondContact O-N 3.02Å; V489-K492 VanDerWaalsContact O-N 3.15Å; K492-R494 PolarHBondContact O-N 3.24Å
493	R	36.1	Very low	40.9	Very low	227 Å²	227	159.7 Å²	159.7	86%	0.857	77%	0.774	S	S	*	*			trans	-97	73.2	178.1	-84.6	-173.1	169.2	-179.1	-2.5	113.3
494	R	36.9	Very low	40	Very low	243 Å²	243	162.5 Å²	162.5	92%	0.917	79%	0.789	S	S	*	*			trans	-147.3	51.2	163.2	-144	-179.9	-166.6	-163.5	4	114.8	K492	K492-R494 PolarHBondContact O-N 3.24Å
495	K	39.2	Very low	38.8	Very low	204 Å²	204	160.8 Å²	160.8	89%	0.887	79%	0.793	S	S	*	*	S	Bend	trans	-176	98.3	154.6	-107.3	170.8	-176.4	-176.9	0	112.5
496	K	30.1	Very low	37.6	Very low	215 Å²	215	159.7 Å²	159.7	94%	0.935	80%	0.799	S	S	*	*				168.4	147.1	128.9	-95.9	-175.7	172.4	-174.2	0	111.6
497	S	30.1	Very low	36.6	Very low	114 Å²	114	160.3 Å²	160.3	80%	0.797	81%	0.81	S	S	*	*			trans	-89.7	169.8	178.9	40.7	0	0	0	0	112.2
498	P	45.2	Very low	35.9	Very low	120 Å²	120	163.5 Å²	163.5	78%	0.779	82%	0.818	S	S	*	*			trans	-109.4	156.4	-160.1	40	-32.7	0	0	0	115.4
499	E	29.5	Very low	35	Very low	186 Å²	186	164.7 Å²	164.7	87%	0.869	82%	0.822	S	S	*	*			trans	177.8	162.7	144.5	-108.8	-179.1	-162.9	0	0	110.1
500	P	35.4	Very low	34.1	Very low	120 Å²	120	169 Å²	169	78%	0.779	84%	0.836	S	S	*	*				-120.5	-173.4	-70.6	28.1	-7.7	0	0	0	113.1
501	E	31.3	Very low	33.5	Very low	188 Å²	188	176.8 Å²	176.8	88%	0.879	85%	0.848	S	S	*	*			trans	-75.5	139.1	-164.1	-54	171.8	127.5	0	0	115.4
502	Q	29.5	Very low	33	Very low	179 Å²	179	174.3 Å²	174.3	84%	0.836	84%	0.84	S	S	*	*			trans	-174	103.1	134.5	-106.4	171.7	25.5	0	0	112.6
503	N	27.9	Very low	32.2	Very low	141 Å²	141	173.6 Å²	173.6	75%	0.754	84%	0.842	S	S	*	*				166.3	127.8	121	-89.5	-57.9	0	0	0	112	S505	N503-S505 PolarHBondContact O-N 3Å
504	L	33.6	Very low	31.8	Very low	183 Å²	183	168.3 Å²	168.3	96%	0.958	84%	0.84	S	S	*	*			trans	-90.5	71.3	-173.2	-167.7	75.4	0	0	0	111.4
505	S	31.4	Very low	31.3	Very low	109 Å²	109	165.9 Å²	165.9	76%	0.762	83%	0.832	S	S	*	*			trans	-149.6	52.7	174.9	72.8	0	0	0	0	114.2	N503	N503-S505 PolarHBondContact O-N 3Å
506	S	30.7	Very low	30.9	Very low	99 Å²	99	161.5 Å²	161.5	69%	0.692	82%	0.818	S	S	*	*			trans	-149.2	75.7	177.4	49.5	0	0	0	0	113.1
507	Q	30.1	Very low	30.9	Very low	200 Å²	200	156.7 Å²	156.7	94%	0.935	81%	0.809	S	S	*	*	S	Bend	trans	-125.5	19.1	168.4	-85.7	-164.1	-22	0	0	114.3
508	L	34	Very low	31.2	Very low	165 Å²	165	155.6 Å²	155.6	86%	0.864	81%	0.807	S	S	*	*	S	Bend	trans	-125.9	5.2	177.7	-91.8	159.3	0	0	0	114.9	E510	L508-E510 PolarHBondContact O-N 2.94Å
509	Q	31.8	Very low	30.7	Very low	179 Å²	179	153.3 Å²	153.3	84%	0.836	80%	0.799	S	S	*	*			trans	-100.2	40.6	-177.3	-154.9	75.7	13.6	0	0	113.3
510	E	31.5	Very low	30.7	Very low	179 Å²	179	149.4 Å²	149.4	84%	0.836	79%	0.788	S	S	*	*			trans	-144.2	38.9	-177	-139.4	172.8	-141.5	0	0	115.6	L508	L508-E510 PolarHBondContact O-N 2.94Å
511	Y	27.3	Very low	30.8	Very low	224 Å²	224	149.9 Å²	149.9	88%	0.878	79%	0.791	S	S	*	*			trans	-143.4	78.5	160.4	-91.9	-78.3	0	0	0	111.9
512	Y	29.5	Very low	30.7	Very low	190 Å²	190	149.7 Å²	149.7	75%	0.745	79%	0.79	S	S	*	*			trans	-131.7	109.8	159.3	-97.2	-85.1	0	0	0	108.8
513	M	26.1	Very low	30.8	Very low	181 Å²	181	145.7 Å²	145.7	89%	0.892	79%	0.787	S	S	*	*			trans	-78.8	124.8	162.4	-68.9	-154.5	-61.2	0	0	108.3	Y515	M513-Y515 PolarHBondContact O-N 2.79Å; M513-Y515 VanDerWaalsContact O-N 3.09Å
514	S	26.8	Very low	31	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	79%	0.794	S	S	*	*			trans	-65.3	105.1	168.9	52.9	0	0	0	0	109.3	N516	S514-N516 PolarHBondContact O-N 3.42Å; S514-N516 VanDerWaalsContact O-N 3.16Å
515	Y	27.3	Very low	30.8	Very low	191 Å²	191	147.3 Å²	147.3	75%	0.749	79%	0.79	S	S	*	*			trans	-71	108.7	174.6	-163	-90.2	0	0	0	109.1	M513 P517	M513-Y515 PolarHBondContact O-N 2.79Å; M513-Y515 VanDerWaalsContact O-N 3.09Å; Y515-P517 WeakPolarHBondContact O-CD 3.36Å
516	N	30.8	Very low	30.7	Very low	112 Å²	112	148.6 Å²	148.6	60%	0.599	79%	0.793	S	S	*	*			trans	-88.7	111.5	177	-174.1	5.1	0	0	0	108.9	S514 A518	S514-N516 PolarHBondContact O-N 3.42Å; S514-N516 VanDerWaalsContact O-N 3.16Å; N516-A518 PolarHBondContact O-N 2.99Å
517	P	29.2	Very low	30.7	Very low	114 Å²	114	152.2 Å²	152.2	74%	0.74	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-5.6	-171.2	-20.1	33.8	0	0	0	115.3	Y515	Y515-P517 WeakPolarHBondContact O-CD 3.36Å
518	A	35.7	Very low	30.5	Very low	91 Å²	91	146.1 Å²	146.1	75%	0.752	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	14	-171.8	0	0	0	0	0	115.1	N516	N516-A518 PolarHBondContact O-N 2.99Å
519	A	34.8	Very low	30.2	Very low	73 Å²	73	146.3 Å²	146.3	60%	0.603	80%	0.796	S	S	*	*	S	Bend	trans	-135.9	36.6	-163.4	0	0	0	0	0	116.9
520	T	30	Very low	30.5	Very low	104 Å²	104	141.3 Å²	141.3	64%	0.638	79%	0.792	S	S	*	*			trans	-154.4	119.9	160.8	44.7	0	0	0	0	110.7
521	P	37	Very low	30.7	Very low	130 Å²	130	140 Å²	140	84%	0.844	80%	0.797	S	S	*	*			trans	-95	17.8	-178.3	36.3	-32.8	0	0	0	114.8
522	E	30.9	Very low	31.2	Very low	184 Å²	184	132.7 Å²	132.7	86%	0.86	79%	0.79	S	S	*	*			trans	-120.6	64.9	-169.7	-67.3	177.2	170.7	0	0	112.4
523	A	31	Very low	31.3	Very low	94 Å²	94	129.1 Å²	129.1	78%	0.777	79%	0.793	S	S	*	*			trans	-158.5	47.7	170.5	0	0	0	0	0	112.5
524	L	32.4	Very low	31.9	Very low	171 Å²	171	123.2 Å²	123.2	90%	0.895	77%	0.768	S	S	*	*			trans	-147.7	76.1	174.8	-152.8	90.7	0	0	0	113
525	E	28.5	Very low	32.3	Very low	188 Å²	188	122.6 Å²	122.6	88%	0.879	76%	0.76	S	S	*	*			trans	-131.9	157.5	159.4	-81.1	-157.9	136.3	0	0	111
526	V	30.3	Very low	32.7	Very low	135 Å²	135	118.3 Å²	118.3	82%	0.818	76%	0.757	S	S	*	*	S	Bend	trans	71.9	74.5	-178.2	-161.3	0	0	0	0	115.3
527	L	29	Very low	33.2	Very low	175 Å²	175	116.8 Å²	116.8	92%	0.916	75%	0.752	S	S	*	*				-170.3	115.7	112.3	-98	167.6	0	0	0	109.5
528	G	25.9	Very low	33.6	Very low	73 Å²	73	120.3 Å²	120.3	75%	0.753	76%	0.763	S	S	*	*			trans	-90.3	130.2	-177.3	0	0	0	0	0	113.2
529	N	28.8	Very low	33.5	Very low	169 Å²	169	120.4 Å²	120.4	90%	0.904	76%	0.758	S	S	*	*				-169.8	125	102	-114.6	-14	0	0	0	112.3
530	G	38.5	Very low	33.6	Very low	73 Å²	73	120.4 Å²	120.4	75%	0.753	77%	0.765	S	S	*	*			trans	43.3	94.1	158.4	0	0	0	0	0	120.3
531	T	35.6	Very low	33.6	Very low	152 Å²	152	118.2 Å²	118.2	93%	0.933	75%	0.754	S	S	*	*			trans	-152.6	146.9	140.7	26.2	0	0	0	0	110.2
532	G	36.8	Very low	33.7	Very low	71 Å²	71	120.6 Å²	120.6	73%	0.732	75%	0.746	S	S	*	*			trans	-78.8	161.5	-169	0	0	0	0	0	116
533	S	31.6	Very low	33.9	Very low	114 Å²	114	119.7 Å²	119.7	80%	0.797	74%	0.741	S	S	*	*			trans	-67.1	126.6	176.5	163.3	0	0	0	0	112.2
534	C	39.3	Very low	34.5	Very low	57 Å²	57	119.2 Å²	119.2	39%	0.385	73%	0.732	S	S	.	*			trans	-109.2	125	165.1	-61.9	0	0	0	0	109.6	C544	C534-C544 VanDerWaalsContact SG-SG 3.65Å
535	T	35.3	Very low	34.6	Very low	104 Å²	104	120.2 Å²	120.2	64%	0.638	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-97.8	131	168.7	42.1	0	0	0	0	110.2
536	C	34.6	Very low	34.8	Very low	101 Å²	101	118.2 Å²	118.2	68%	0.682	73%	0.727	S	S	*	*	B	Isolated β-bridge	trans	-94.8	131.7	172.8	-70	0	0	0	0	109.9
537	T	41.3	Very low	35.2	Very low	80 Å²	80	120.6 Å²	120.6	49%	0.491	73%	0.729	S	S	.	*	P	Polyproline II helix	trans	-94	160	170.1	58.2	0	0	0	0	111.1	S539 G540	T537-S539 PolarHBondContact O-N 3.12Å; T537-S539 PolarHBondContact OG1-OG 3.09Å; T537-G540 PolarHBondContact O-N 3.33Å
538	I	38.4	Very low	35.2	Very low	188 Å²	188	122.7 Å²	122.7	96%	0.964	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-14.9	-171.1	-65.1	170.6	0	0	0	112.8
539	S	34.6	Very low	35.4	Very low	93 Å²	93	125.8 Å²	125.8	65%	0.65	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-3.2	174.9	48.9	0	0	0	0	115	T537 S541	T537-S539 PolarHBondContact O-N 3.12Å; T537-S539 PolarHBondContact OG1-OG 3.09Å; S539-S541 VanDerWaalsContact C-N 3.29Å; S539-S541 PolarHBondContact O-N 3.41Å; S539-S541 PolarHBondContact OG-OG 2.89Å
540	G	35.4	Very low	35.2	Very low	73 Å²	73	123.4 Å²	123.4	75%	0.753	73%	0.727	S	S	*	*	S	Bend	trans	75.9	9.2	177	0	0	0	0	0	115.6	T537	T537-G540 PolarHBondContact O-N 3.33Å
541	S	31.1	Very low	34.8	Very low	58 Å²	58	126 Å²	126	41%	0.406	73%	0.73	S	S	.	*			trans	-83	145.7	167.1	44	0	0	0	0	110.6	S539	S539-S541 VanDerWaalsContact C-N 3.29Å; S539-S541 PolarHBondContact O-N 3.41Å; S539-S541 PolarHBondContact OG-OG 2.89Å
542	R	38.7	Very low	34.6	Very low	179 Å²	179	129.9 Å²	129.9	68%	0.675	73%	0.727	S	S	*	*	B	Isolated β-bridge	trans	-124.1	108.9	-176.2	-161.4	177.6	-174	170.3	1.8	108.5
543	E	35.8	Very low	34.4	Very low	165 Å²	165	132.5 Å²	132.5	77%	0.771	73%	0.731	S	S	*	*			trans	-105.4	135.4	175.7	-70.8	176.6	175.2	0	0	108.9
544	C	41.8	Very low	34.2	Very low	85 Å²	85	135.2 Å²	135.2	57%	0.574	74%	0.736	S	S	*	*			trans	-130.6	123.8	179.7	-60.9	0	0	0	0	108.5	C534 N546	C534-C544 VanDerWaalsContact SG-SG 3.65Å; C544-N546 PolarHBondContact O-N 3.49Å
545	E	34.7	Very low	34.1	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	76%	0.756	S	S	*	*	S	Bend	trans	-73.3	94.3	170.7	-73.1	-175	136.6	0	0	110.4
546	N	33.4	Very low	33.8	Very low	145 Å²	145	136.9 Å²	136.9	78%	0.775	76%	0.762	S	S	*	*				163.9	139.5	122.9	-85	-51.3	0	0	0	112.1	C544 Y548	C544-N546 PolarHBondContact O-N 3.49Å; N546-Y548 PolarHBondContact O-N 3.19Å
547	E	37.7	Very low	33.4	Very low	185 Å²	185	136.2 Å²	136.2	86%	0.864	76%	0.763	S	S	*	*			trans	-77.1	97.4	173.2	-65.6	-178.2	121.7	0	0	111.5
548	Y	29.5	Very low	32.8	Very low	219 Å²	219	143.9 Å²	143.9	86%	0.859	78%	0.783	S	S	*	*			trans	-137.8	133.1	152.6	-78.3	-68.4	0	0	0	111.8	N546	N546-Y548 PolarHBondContact O-N 3.19Å
549	T	29.6	Very low	32.5	Very low	138 Å²	138	142.9 Å²	142.9	85%	0.847	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.1	125.2	-170.9	31.8	0	0	0	0	112.9
550	C	26.2	Very low	32.1	Very low	120 Å²	120	141.7 Å²	141.7	81%	0.811	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.1	134.5	164.9	-66.5	0	0	0	0	110.6
551	P	30.3	Very low	31.8	Very low	126 Å²	126	146 Å²	146	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.8	139	174.3	28.9	-33.3	0	0	0	111.3
552	R	31.4	Very low	31.9	Very low	235 Å²	235	149 Å²	149	89%	0.887	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.9	143.6	170.8	-68.8	178.1	174.5	177	-2.1	110.5
553	P	30.8	Very low	31.9	Very low	125 Å²	125	146.4 Å²	146.4	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-72.8	139.6	162.5	31.1	-32.2	0	0	0	110.5
554	L	29.1	Very low	31.8	Very low	171 Å²	171	143.9 Å²	143.9	90%	0.895	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.9	153.6	172.5	-81.8	166.3	0	0	0	111.5
555	P	35.8	Very low	31.4	Very low	123 Å²	123	146.8 Å²	146.8	80%	0.799	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-101.5	150.2	-178.7	37.5	-32.6	0	0	0	114.3
556	G	29.4	Very low	31.5	Very low	74 Å²	74	149.5 Å²	149.5	76%	0.763	83%	0.826	S	S	*	*			trans	124.5	131.7	146.6	0	0	0	0	0	118.8
557	A	27.2	Very low	31.4	Very low	86 Å²	86	149.8 Å²	149.8	71%	0.711	83%	0.828	S	S	*	*			trans	65.2	140.8	166.5	0	0	0	0	0	117
558	W	28.6	Very low	31	Very low	241 Å²	241	147.9 Å²	147.9	91%	0.913	83%	0.826	S	S	*	*			cis	-139.3	165.7	32	-88.1	79.5	0	0	0	115.4
559	L	30.7	Very low	31.1	Very low	167 Å²	167	143.9 Å²	143.9	87%	0.874	83%	0.825	S	S	*	*			trans	-66.6	159.3	164.5	-76.6	69.9	0	0	0	111.3
560	G	27.9	Very low	31.2	Very low	69 Å²	69	144.3 Å²	144.3	71%	0.711	82%	0.823	S	S	*	*			trans	169.2	71.6	167.7	0	0	0	0	0	116.1
561	D	27.7	Very low	31.5	Very low	162 Å²	162	145.8 Å²	145.8	87%	0.866	82%	0.824	S	S	*	*			trans	44.5	141.9	147.1	-57.5	-33.6	0	0	0	124.6
562	V	34	Very low	31.6	Very low	123 Å²	123	147.1 Å²	147.1	75%	0.745	83%	0.825	S	S	*	*			trans	-75.5	148	169.4	175	0	0	0	0	110.2	T564	V562-T564 HydrophobicContact CG1-CG2 4.31Å
563	P	37.7	Very low	31.6	Very low	124 Å²	124	140.9 Å²	140.9	81%	0.805	82%	0.82	S	S	*	*				-127.8	141.1	124.1	34.5	-27.9	0	0	0	113.2
564	T	35	Very low	31.7	Very low	111 Å²	111	142.1 Å²	142.1	68%	0.681	82%	0.821	S	S	*	*			trans	-75	-176.1	164.9	41.3	0	0	0	0	111.1	V562	V562-T564 HydrophobicContact CG1-CG2 4.31Å
565	I	31.7	Very low	31.9	Very low	146 Å²	146	139.7 Å²	139.7	75%	0.749	82%	0.815	S	S	*	*			trans	91.7	124.5	171.8	-50.9	163.5	0	0	0	111.8
566	H	36.8	Very low	31.5	Very low	250 Å²	250	141.2 Å²	141.2	100%	1.157	82%	0.816	S	S	*	*			cis	-132.1	0	12.7	-127.3	-41	0	0	0	113.5

Retrieved 566 of 566 residues in 147.3 ms (Link to these results)

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