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Hedgehog protein

The dually lipidated hedgehog protein N-product is a morphogen which is essential for a variety of patterning events during development. The C-terminal part of the hedgehog protein precursor displays an autoproteolysis activity that results in the cleavage of the full-length protein into two parts (N-product and C-product). In addition, the C-terminal part displays a cholesterol transferase activity that results by the covalent attachment of a cholesterol moiety to the C-terminal of the newly generated N-product.

AlphaFold DB , UniProt , Accession A0A096NG69, Species PAPAN (Papio anubis, Olive baboon), Gene DHH, Length 396 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.8	Low	51.8	Low	246 Å²	246	139.5 Å²	139.5	100%	1.212	78%	0.782	S	S	*	*				0	139.6	0	-73.7	-172	76.6	0	0	108.1
2	A	46.4	Very low	51.3	Low	94 Å²	94	134.9 Å²	134.9	78%	0.777	77%	0.765	S	S	*	*			trans	100.8	69.2	-176.2	0	0	0	0	0	115.2
3	L	50.8	Low	51.1	Low	179 Å²	179	135.5 Å²	135.5	94%	0.937	76%	0.763	S	S	*	*			trans	-135.6	47.9	163.8	-110.4	155.1	0	0	0	109
4	L	53.3	Low	50.9	Low	163 Å²	163	131.1 Å²	131.1	85%	0.853	75%	0.752	S	S	*	*			trans	-152.1	47	-171.5	-115.1	158.4	0	0	0	111.8
5	T	55.9	Low	50.6	Low	115 Å²	115	131 Å²	131	71%	0.706	75%	0.748	S	S	*	*	S	Bend	trans	-146.6	27.3	179.1	47.2	0	0	0	0	115.3
6	N	55.7	Low	50.4	Low	147 Å²	147	132.4 Å²	132.4	79%	0.786	75%	0.751	S	S	*	*	S	Bend	trans	-138.8	21.4	176.3	-91.5	-28	0	0	0	116.5
7	L	52	Low	50.6	Low	138 Å²	138	129.5 Å²	129.5	72%	0.723	75%	0.747	S	S	*	*	S	Bend	trans	-108.9	-1.5	176.6	-80.2	161.5	0	0	0	114.8
8	L	53.2	Low	50.7	Low	139 Å²	139	130.1 Å²	130.1	73%	0.728	75%	0.747	S	S	*	*	H	α-helix	trans	-74.7	-31.4	-177.2	-93.7	126.4	0	0	0	116.2
9	P	51.9	Low	50.6	Low	92 Å²	92	129.2 Å²	129.2	60%	0.597	75%	0.746	S	S	*	*	H	α-helix	trans	-84.4	-17.7	179.7	30.9	-29.6	0	0	0	113.4
10	L	50.5	Low	50.6	Low	137 Å²	137	127.6 Å²	127.6	72%	0.717	75%	0.748	S	S	*	*	H	α-helix	trans	-83.3	-29.7	175.5	-110.9	92.4	0	0	0	113.3	C12	L10-C12 VanDerWaalsContact C-N 3.33Å
11	C	47.7	Very low	50.5	Low	84 Å²	84	130.1 Å²	130.1	57%	0.568	75%	0.753	S	S	*	*	H	α-helix	trans	-70.7	-27.1	176	-86.5	0	0	0	0	113.2
12	C	46.6	Very low	50.1	Low	85 Å²	85	123.5 Å²	123.5	57%	0.574	73%	0.731	S	S	*	*	H	α-helix	trans	-78.2	-23.3	-179.7	-71.6	0	0	0	0	114	L10	L10-C12 VanDerWaalsContact C-N 3.33Å
13	L	47.9	Very low	50.6	Low	142 Å²	142	124.9 Å²	124.9	74%	0.743	73%	0.734	S	S	*	*	H	α-helix	trans	-87.5	-22.1	176.3	-114.8	89.4	0	0	0	113.8
14	A	49.1	Very low	50.9	Low	74 Å²	74	118.7 Å²	118.7	61%	0.612	71%	0.713	S	S	*	*	H	α-helix	trans	-80.1	-15.6	177.9	0	0	0	0	0	113.6	L16	A14-L16 VanDerWaalsContact C-N 3.29Å; A14-L16 PolarHBondContact O-N 2.74Å
15	L	45.5	Very low	51.1	Low	130 Å²	130	117.4 Å²	117.4	68%	0.681	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-5.3	176.3	-81.2	161.2	0	0	0	114.1
16	L	48.7	Very low	50.6	Low	154 Å²	154	114.9 Å²	114.9	81%	0.806	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	0.2	177.6	-70.1	171.9	0	0	0	114.1	A14	A14-L16 VanDerWaalsContact C-N 3.29Å; A14-L16 PolarHBondContact O-N 2.74Å
17	A	53.5	Low	50.8	Low	83 Å²	83	120.1 Å²	120.1	69%	0.686	72%	0.72	S	S	*	*			trans	-117.5	41.1	-178	0	0	0	0	0	112.9
18	L	51.9	Low	50.5	Low	140 Å²	140	115.9 Å²	115.9	73%	0.733	71%	0.71	S	S	*	*			trans	-74.1	132.2	162.1	-71.6	169.4	0	0	0	108.3	A20	L18-A20 PolarHBondContact O-N 2.71Å
19	P	48.6	Very low	50.5	Low	112 Å²	112	115.3 Å²	115.3	73%	0.727	72%	0.715	S	S	*	*			trans	-60.8	116	169.9	25.9	-30.8	0	0	0	107	Q21	P19-Q21 VanDerWaalsContact C-N 3.34Å; P19-Q21 PolarHBondContact O-N 3.4Å
20	A	50.2	Low	50.6	Low	97 Å²	97	117.8 Å²	117.8	80%	0.802	73%	0.728	S	S	*	*			trans	-59.3	103.5	168.1	0	0	0	0	0	106.7	L18 S22	L18-A20 PolarHBondContact O-N 2.71Å; A20-S22 PolarHBondContact O-N 2.8Å
21	Q	49.3	Very low	50.3	Low	181 Å²	181	114.2 Å²	114.2	85%	0.846	72%	0.724	S	S	*	*			trans	-63.8	99.5	160.7	-69.6	-164.5	14.2	0	0	105.3	P19 C23	P19-Q21 VanDerWaalsContact C-N 3.34Å; P19-Q21 PolarHBondContact O-N 3.4Å; Q21-C23 VanDerWaalsContact C-N 3.31Å; Q21-C23 PolarHBondContact O-N 3.24Å
22	S	43.4	Very low	50.2	Low	108 Å²	108	121.6 Å²	121.6	76%	0.755	74%	0.74	S	S	*	*			trans	-60.3	102.7	166.6	59.2	0	0	0	0	106.4	A20 G24	A20-S22 PolarHBondContact O-N 2.8Å; S22-G24 VanDerWaalsContact C-N 3.27Å; S22-G24 PolarHBondContact O-N 2.7Å
23	C	56.2	Low	50.1	Low	123 Å²	123	128.7 Å²	128.7	83%	0.831	76%	0.755	S	S	*	*			trans	-58.6	103	158.2	-67.1	0	0	0	0	105.3	Q21	Q21-C23 VanDerWaalsContact C-N 3.31Å; Q21-C23 PolarHBondContact O-N 3.24Å
24	G	58.2	Low	50	Low	48 Å²	48	133 Å²	133	50%	0.495	76%	0.761	S	S	.	*			trans	-50	153.1	162.8	0	0	0	0	0	108.4	S22 G26	S22-G24 VanDerWaalsContact C-N 3.27Å; S22-G24 PolarHBondContact O-N 2.7Å; G24-G26 PolarHBondContact O-N 3Å
25	P	57	Low	49.8	Very low	136 Å²	136	139.4 Å²	139.4	88%	0.883	77%	0.771	S	S	*	*			trans	-51	106.5	-173.7	22	-32.6	0	0	0	108.5	R27	P25-R27 PolarHBondContact O-N 3.08Å
26	G	45.2	Very low	49.7	Very low	63 Å²	63	137.8 Å²	137.8	65%	0.649	78%	0.776	S	S	*	*			trans	-55.1	142.9	-178.6	0	0	0	0	0	107.3	G24 G28	G24-G26 PolarHBondContact O-N 3Å; G26-G28 VanDerWaalsContact C-N 3.3Å; G26-G28 PolarHBondContact O-N 3.16Å
27	R	59.3	Low	49.9	Very low	256 Å²	256	141.9 Å²	141.9	97%	0.966	78%	0.781	S	S	*	*			trans	-51.7	106.8	167.6	-77.2	-178.3	175.9	178.2	-0.6	105.8	P25	P25-R27 PolarHBondContact O-N 3.08Å
28	G	47.5	Very low	50.3	Low	50 Å²	50	144.6 Å²	144.6	52%	0.515	78%	0.777	S	S	.	*			trans	-49.9	153	176	0	0	0	0	0	108.5	G26 V30	G26-G28 VanDerWaalsContact C-N 3.3Å; G26-G28 PolarHBondContact O-N 3.16Å; G28-V30 PolarHBondContact O-N 2.99Å
29	P	52.2	Low	51.5	Low	127 Å²	127	146.1 Å²	146.1	83%	0.825	78%	0.78	S	S	*	*	S	Bend	trans	-44.7	122.5	179.2	20.6	-32.1	0	0	0	107.3	G31	P29-G31 VanDerWaalsContact O-CA 3.29Å; P29-G31 WeakPolarHBondContact O-CA 3.37Å; P29-G31 PolarHBondContact O-N 2.94Å
30	V	53.6	Low	53.5	Low	144 Å²	144	143.5 Å²	143.5	87%	0.873	76%	0.76	S	S	*	*			trans	-36.1	105.1	-171.7	178	0	0	0	0	106.6	G28 R32	G28-V30 PolarHBondContact O-N 2.99Å; V30-R32 PolarHBondContact O-N 2.83Å
31	G	44.3	Very low	55.6	Low	61 Å²	61	142.9 Å²	142.9	63%	0.629	75%	0.746	S	S	*	*			trans	-51.5	115	-167.7	0	0	0	0	0	105.8	P29 R33	P29-G31 VanDerWaalsContact O-CA 3.29Å; P29-G31 WeakPolarHBondContact O-CA 3.37Å; P29-G31 PolarHBondContact O-N 2.94Å; G31-R33 VanDerWaalsContact C-N 3.32Å; G31-R33 PolarHBondContact O-N 3.42Å
32	R	46.9	Very low	57.9	Low	240 Å²	240	137.4 Å²	137.4	91%	0.906	73%	0.726	S	S	*	*			trans	-48.7	110.3	174.6	-91.6	-176.5	174.3	-172.2	-0.9	104	V30 R34	V30-R32 PolarHBondContact O-N 2.83Å; R32-R34 PolarHBondContact O-N 2.79Å
33	R	42.9	Very low	60.5	Low	234 Å²	234	132.4 Å²	132.4	88%	0.883	69%	0.691	S	S	*	*			trans	-45.1	110.4	178.1	-114.3	178.2	179.9	171.6	-0.1	105.3	G31 Y35	G31-R33 VanDerWaalsContact C-N 3.32Å; G31-R33 PolarHBondContact O-N 3.42Å; R33-Y35 PolarHBondContact O-N 3.5Å
34	R	46.5	Very low	62.5	Low	232 Å²	232	132.6 Å²	132.6	88%	0.875	68%	0.683	S	S	*	*	S	Bend	trans	-59.3	128	169.2	-81	-177.4	180	179.8	0.2	104.8	R32	R32-R34 PolarHBondContact O-N 2.79Å
35	Y	44.3	Very low	64.3	Low	209 Å²	209	134.9 Å²	134.9	82%	0.82	68%	0.678	S	S	*	*			trans	77.6	85.4	-170.8	-56.1	-86.1	0	0	0	114.9	R33 R37	R33-Y35 PolarHBondContact O-N 3.5Å; Y35-R37 VanDerWaalsContact C-N 3.32Å; Y35-R37 PolarHBondContact O-N 2.94Å
36	A	45.1	Very low	66.2	Low	96 Å²	96	133 Å²	133	79%	0.793	66%	0.656	S	S	*	*			trans	-55	108.4	138.2	0	0	0	0	0	105.8	K38	A36-K38 PolarHBondContact O-N 2.87Å
37	R	51.6	Low	68.7	Low	239 Å²	239	133.4 Å²	133.4	90%	0.902	64%	0.64	S	S	*	*			trans	-50.4	115.8	166.9	-97.1	179.7	171	169.3	-4	105.4	Y35 Q39	Y35-R37 VanDerWaalsContact C-N 3.32Å; Y35-R37 PolarHBondContact O-N 2.94Å; R37-Q39 PolarHBondContact O-N 3.43Å
38	K	61.7	Low	70.6	Confident	141 Å²	141	124.9 Å²	124.9	61%	0.613	61%	0.61	S	S	*	*			trans	-49.1	115.8	172.3	-169.2	-177.2	-180	-162.4	0	105.9	A36 L40 E168	A36-K38 PolarHBondContact O-N 2.87Å; K38-L40 PolarHBondContact O-N 2.78Å; K38-E168 VanDerWaalsContact NZ-CD 3.25Å; K38-E168 IonicContact NZ-OE1 2.78Å; K38-E168 PolarHBondContact NZ-OE1 3.31Å; K38-E168 IonicContact NZ-OE2 2.87Å; K38-E168 PolarHBondContact NZ-OE2 3.03Å
39	Q	78	Confident	72.9	Confident	171 Å²	171	124.1 Å²	124.1	80%	0.799	60%	0.595	S	S	*	*			trans	-63.6	113.9	-174.1	-172.5	173.2	14	0	0	107.3	R37 V41	R37-Q39 PolarHBondContact O-N 3.43Å; Q39-V41 PolarHBondContact O-N 3.01Å
40	L	90.3	Very high	75	Confident	58 Å²	58	120.1 Å²	120.1	30%	0.304	57%	0.57	S	S	.	*			trans	-75.9	98.7	179.5	-63.6	175	0	0	0	107.8	K38 P42 M117 L161 R164 L165 E168	K38-L40 PolarHBondContact O-N 2.78Å; L40-P42 WeakPolarHBondContact O-CD 3.48Å; L40-M117 HydrophobicContact CD1-CE 3.55Å; L40-L161 HydrophobicContact CB-CD1 3.91Å; L40-R164 HydrophobicContact CB-CG 3.95Å; L40-R164 HydrophobicContact CD2-CG 3.97Å; L40-L165 HydrophobicContact CD1-CD2 3.88Å; L40-E168 HydrophobicContact CD2-CG 3.68Å
41	V	94.9	Very high	77	Confident	83 Å²	83	116.5 Å²	116.5	50%	0.503	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-84.3	116.4	176.3	-178.4	0	0	0	0	108.6	Q39 R164	Q39-V41 PolarHBondContact O-N 3.01Å; V41-R164 WeakPolarHBondContact O-CB 3.18Å; V41-R164 WeakPolarHBondContact O-CG 3.44Å; V41-R164 PolarHBondContact O-NE 2.79Å; V41-R164 PolarHBondContact O-NH2 3.27Å
42	P	96.9	Very high	79.4	Confident	66 Å²	66	116.2 Å²	116.2	43%	0.429	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-53.5	144	176.4	-26.1	35.9	0	0	0	111.9	L40 G160 L161	L40-P42 WeakPolarHBondContact O-CD 3.48Å; P42-G160 CarbonylContact C-O 3.43Å; P42-G160 WeakPolarHBondContact CA-O 3.33Å; P42-L161 HydrophobicContact CG-CB 4.35Å; P42-L161 HydrophobicContact CG-CD1 4.47Å
43	L	97.7	Very high	81.7	Confident	4 Å²	4	108.9 Å²	108.9	2%	0.021	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-70.6	141.1	169.9	-86.7	63.8	0	0	0	109.4	Q47 V49 G160 A163 R164 V167 V174	L43-Q47 HydrophobicContact CB-CB 4.44Å; L43-Q47 HydrophobicContact CG-CG 4.44Å; L43-V49 HydrophobicContact CD1-CG2 4.35Å; L43-V49 HydrophobicContact CD2-CB 4.42Å; L43-V49 HydrophobicContact CD2-CG2 3.91Å; L43-V49 HydrophobicContact CG-CG2 4.13Å; L43-G160 PolarHBondContact N-O 3.39Å; L43-G160 WeakPolarHBondContact O-CA 3.46Å; L43-A163 HydrophobicContact CB-CB 3.97Å; L43-A163 HydrophobicContact CD1-CB 4.4Å; L43-A163 HydrophobicContact CD2-CB 3.92Å; L43-A163 HydrophobicContact CG-CB 4.31Å; L43-R164 HydrophobicContact CD1-CB 3.98Å; L43-V167 HydrophobicContact CD1-CG2 4.41Å; L43-V174 HydrophobicContact CD2-CG1 4.05Å
44	L	97.6	Very high	84.2	Confident	126 Å²	126	99 Å²	99	66%	0.66	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-73.7	155.5	171.5	-60.1	177.3	0	0	0	110.2	K46 Q47 Y176	L44-K46 PolarHBondContact O-N 3.42Å; L44-Q47 HydrophobicContact CB-CB 4.17Å; L44-Q47 WeakPolarHBondContact O-CB 3.46Å; L44-Q47 PolarHBondContact O-N 3Å; L44-Y176 WeakPolarHBondContact O-CD2 3.21Å
45	Y	97.3	Very high	86.4	Confident	97 Å²	97	93.1 Å²	93.1	38%	0.38	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	134.7	173.1	177.2	-122.4	0	0	0	110.2	Q47 R179	Y45-Q47 PolarHBondContact O-N 2.98Å; Y45-R179 HydrophobicContact CD2-CG 4.43Å; Y45-R179 HydrophobicContact CE2-CG 3.93Å
46	K	97.4	Very high	88.3	Confident	97 Å²	97	85.6 Å²	85.6	42%	0.422	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	8.4	-173.2	-58.3	-65.1	-170.7	177.2	0	115.9	L44 Y175 Y176 E177	L44-K46 PolarHBondContact O-N 3.42Å; K46-Y175 HydrophobicContact CD-CE2 4.28Å; K46-Y175 WeakPolarHBondContact CD-OH 3.41Å; K46-Y175 WeakPolarHBondContact O-CE2 3.24Å; K46-Y176 WeakPolarHBondContact CA-O 3.47Å; K46-Y176 PolarHBondContact N-O 3Å; K46-E177 WeakPolarHBondContact CD-O 3.43Å; K46-E177 VanDerWaalsContact CE-O 3.25Å; K46-E177 WeakPolarHBondContact CE-O 3.42Å; K46-E177 PolarHBondContact NZ-O 3.18Å
47	Q	97.8	Very high	89.9	Confident	70 Å²	70	86.5 Å²	86.5	33%	0.327	44%	0.439	S	S	.	.			trans	-81.5	139.1	171.1	-171.5	177.6	9.3	0	0	110.7	L43 L44 Y45 Y176	L43-Q47 HydrophobicContact CB-CB 4.44Å; L43-Q47 HydrophobicContact CG-CG 4.44Å; L44-Q47 HydrophobicContact CB-CB 4.17Å; L44-Q47 WeakPolarHBondContact O-CB 3.46Å; L44-Q47 PolarHBondContact O-N 3Å; Y45-Q47 PolarHBondContact O-N 2.98Å; Q47-Y176 PolarHBondContact O-N 3.17Å
48	F	97.7	Very high	91.1	Very high	78 Å²	78	77.9 Å²	77.9	34%	0.342	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.7	168.8	51.6	-86	0	0	0	111.6	P50 V52 W173 V174 Y175	F48-P50 WeakPolarHBondContact CD2-O 3.37Å; F48-V52 WeakPolarHBondContact CD2-O 3.45Å; F48-V52 WeakPolarHBondContact CE2-O 3.39Å; F48-W173 HydrophobicContact CB-CH2 4.09Å; F48-W173 HydrophobicContact CB-CZ2 3.4Å; F48-W173 VanDerWaalsContact CB-CZ2 3.4Å; F48-W173 HydrophobicContact CD1-CZ2 4.31Å; F48-W173 AromaticContact CD2-CE2 3.99Å; F48-W173 AromaticContact CD2-CZ2 3.77Å; F48-W173 HydrophobicContact CD2-CZ2 3.77Å; F48-W173 AromaticContact CD2-NE1 3.69Å; F48-W173 HydrophobicContact CG-CH2 4.48Å; F48-W173 AromaticContact CG-CZ2 3.57Å; F48-W173 HydrophobicContact CG-CZ2 3.57Å; F48-V174 CarbonylContact C-O 3.56Å; F48-V174 WeakPolarHBondContact CA-O 3.5Å; F48-V174 WeakPolarHBondContact CB-O 3.43Å; F48-Y175 HydrophobicContact CB-CD2 3.78Å; F48-Y175 HydrophobicContact CB-CG 4.13Å; F48-Y175 HydrophobicContact CD1-CD2 4.12Å; F48-Y175 HydrophobicContact CD1-CE2 4.26Å; F48-Y175 HydrophobicContact CG-CD2 4.44Å
49	V	96.4	Very high	92.6	Very high	33 Å²	33	71.2 Å²	71.2	20%	0.2	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	129.4	-179.5	177.4	0	0	0	0	108.6	L43 V167 V174	L43-V49 HydrophobicContact CD1-CG2 4.35Å; L43-V49 HydrophobicContact CD2-CB 4.42Å; L43-V49 HydrophobicContact CD2-CG2 3.91Å; L43-V49 HydrophobicContact CG-CG2 4.13Å; V49-V167 HydrophobicContact CB-CG2 3.92Å; V49-V167 HydrophobicContact CG1-CG1 4.02Å; V49-V167 HydrophobicContact CG1-CG2 3.97Å; V49-V174 PolarHBondContact N-O 2.81Å; V49-V174 PolarHBondContact O-N 2.78Å
50	P	96.2	Very high	93.3	Very high	44 Å²	44	63.1 Å²	63.1	29%	0.286	36%	0.358	S	S	.	.	S	Bend	cis	-62.4	158.1	-6.9	27.5	-34.9	0	0	0	112.3	F48 V52 G58 A59 D172 W173	F48-P50 WeakPolarHBondContact CD2-O 3.37Å; P50-V52 HydrophobicContact CB-CG2 4.18Å; P50-V52 HydrophobicContact CG-CG2 3.9Å; P50-V52 PolarHBondContact O-N 3.18Å; P50-G58 WeakPolarHBondContact CG-O 3.35Å; P50-A59 HydrophobicContact CG-CB 4.07Å; P50-D172 WeakPolarHBondContact CD-O 3.21Å; P50-W173 PolarHBondContact O-NE1 2.88Å
51	G	95.8	Very high	93.3	Very high	68 Å²	68	60.6 Å²	60.6	70%	0.701	35%	0.346	S	S	*	.	S	Bend	trans	-72.9	39.7	-176.2	0	0	0	0	0	114.6
52	V	93.8	Very high	93	Very high	54 Å²	54	60.1 Å²	60.1	33%	0.327	35%	0.345	S	S	.	.	S	Bend	trans	-126	158.8	175.7	-63.8	0	0	0	0	109.1	F48 P50 T56 A59 W173	F48-V52 WeakPolarHBondContact CD2-O 3.45Å; F48-V52 WeakPolarHBondContact CE2-O 3.39Å; P50-V52 HydrophobicContact CB-CG2 4.18Å; P50-V52 HydrophobicContact CG-CG2 3.9Å; P50-V52 PolarHBondContact O-N 3.18Å; V52-T56 VanDerWaalsContact CG2-OG1 3.3Å; V52-T56 WeakPolarHBondContact CG2-OG1 3.28Å; V52-A59 HydrophobicContact CG2-CB 3.87Å; V52-W173 PolarHBondContact O-NE1 2.74Å
53	P	95.8	Very high	92.7	Very high	87 Å²	87	58.5 Å²	58.5	57%	0.565	34%	0.338	S	S	*	.			trans	-59.4	145.4	177.8	-20	29.6	0	0	0	112.2	R55 T56	P53-R55 VanDerWaalsContact C-N 3.29Å; P53-R55 PolarHBondContact O-N 3.01Å; P53-T56 HydrophobicContact CB-CG2 3.98Å; P53-T56 HydrophobicContact CG-CG2 4.07Å; P53-T56 WeakPolarHBondContact O-CB 3.43Å; P53-T56 WeakPolarHBondContact O-CG2 3.29Å; P53-T56 PolarHBondContact O-N 2.69Å; P53-T56 VanDerWaalsContact O-N 3.07Å; P53-T56 PolarHBondContact O-OG1 3.03Å
54	E	96.3	Very high	92.2	Very high	26 Å²	26	62.1 Å²	62.1	12%	0.121	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-48.1	-174.1	-177.7	-176.7	-160.9	0	0	113.4	T56 A59 S60 G61 L140 W173 H183 S185	E54-T56 PolarHBondContact O-N 3.46Å; E54-A59 VanDerWaalsContact O-CB 3.22Å; E54-A59 WeakPolarHBondContact O-CB 3.48Å; E54-S60 WeakPolarHBondContact O-CA 3.39Å; E54-S60 PolarHBondContact O-N 2.91Å; E54-G61 PolarHBondContact O-N 3.01Å; E54-L140 HydrophobicContact CG-CD1 4.12Å; E54-L140 WeakPolarHBondContact OE1-CD1 3.36Å; E54-W173 HydrophobicContact CB-CD2 3.67Å; E54-W173 HydrophobicContact CB-CE3 3.69Å; E54-W173 HydrophobicContact CB-CG 4.25Å; E54-W173 HydrophobicContact CB-CH2 3.98Å; E54-W173 HydrophobicContact CB-CZ2 3.98Å; E54-W173 HydrophobicContact CB-CZ3 3.82Å; E54-W173 HydrophobicContact CG-CB 4.42Å; E54-W173 HydrophobicContact CG-CD2 3.82Å; E54-W173 HydrophobicContact CG-CE3 3.57Å; E54-W173 HydrophobicContact CG-CG 4.21Å; E54-W173 HydrophobicContact CG-CZ3 4.01Å; E54-H183 IonicContact OE1-CE1 3.93Å; E54-H183 IonicContact OE1-NE2 4Å; E54-H183 PolarHBondContact OE1-NE2 3.45Å; E54-H183 VanDerWaalsContact OE1-NE2 3.07Å; E54-S185 WeakPolarHBondContact OE1-CB 3.45Å; E54-S185 PolarHBondContact OE1-OG 2.88Å
55	R	92.4	Very high	91.7	Very high	108 Å²	108	57.8 Å²	57.8	41%	0.408	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	5.8	-172.7	-65.2	-171.5	-66.3	-89.1	1.1	114.6	P53 G61 D138	P53-R55 VanDerWaalsContact C-N 3.29Å; P53-R55 PolarHBondContact O-N 3.01Å; R55-G61 VanDerWaalsContact CA-O 3.29Å; R55-G61 WeakPolarHBondContact CA-O 3.5Å; R55-G61 CarbonylContact O-C 3.6Å; R55-G61 WeakPolarHBondContact O-CA 3.42Å; R55-D138 PolarHBondContact NH1-O 3.2Å
56	T	84.1	Confident	91.5	Very high	51 Å²	51	58.4 Å²	58.4	31%	0.313	35%	0.345	S	S	.	.	S	Bend	trans	-78	156.5	175.2	63	0	0	0	0	111.8	V52 P53 E54 G58 A59 G61	V52-T56 VanDerWaalsContact CG2-OG1 3.3Å; V52-T56 WeakPolarHBondContact CG2-OG1 3.28Å; P53-T56 HydrophobicContact CB-CG2 3.98Å; P53-T56 HydrophobicContact CG-CG2 4.07Å; P53-T56 WeakPolarHBondContact O-CB 3.43Å; P53-T56 WeakPolarHBondContact O-CG2 3.29Å; P53-T56 PolarHBondContact O-N 2.69Å; P53-T56 VanDerWaalsContact O-N 3.07Å; P53-T56 PolarHBondContact O-OG1 3.03Å; E54-T56 PolarHBondContact O-N 3.46Å; T56-G58 PolarHBondContact O-N 3.49Å; T56-G58 VanDerWaalsContact O-N 3.16Å; T56-A59 CarbonylContact O-C 3.52Å; T56-A59 PolarHBondContact O-N 3.39Å; T56-G61 VanDerWaalsContact O-CA 3.3Å; T56-G61 WeakPolarHBondContact O-CA 3.44Å; T56-G61 PolarHBondContact O-N 3.1Å
57	L	78.3	Confident	91.3	Very high	115 Å²	115	54 Å²	54	60%	0.602	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.2	177.5	-62.9	176.6	0	0	0	113.3	A59 K187	L57-A59 PolarHBondContact O-N 2.79Å; L57-K187 PolarHBondContact O-NZ 3.06Å
58	G	76.6	Confident	91.1	Very high	59 Å²	59	53.2 Å²	53.2	61%	0.608	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.4	174.9	0	0	0	0	0	114.8	P50 T56	P50-G58 WeakPolarHBondContact CG-O 3.35Å; T56-G58 PolarHBondContact O-N 3.49Å; T56-G58 VanDerWaalsContact O-N 3.16Å
59	A	92.4	Very high	90.8	Very high	0 Å²	0	55 Å²	55	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-128.6	-177.4	0	0	0	0	0	110.4	P50 V52 E54 T56 L57 G61 W173 K187	P50-A59 HydrophobicContact CG-CB 4.07Å; V52-A59 HydrophobicContact CG2-CB 3.87Å; E54-A59 VanDerWaalsContact O-CB 3.22Å; E54-A59 WeakPolarHBondContact O-CB 3.48Å; T56-A59 CarbonylContact O-C 3.52Å; T56-A59 PolarHBondContact O-N 3.39Å; L57-A59 PolarHBondContact O-N 2.79Å; A59-G61 VanDerWaalsContact C-N 3.32Å; A59-G61 PolarHBondContact O-N 3Å; A59-W173 HydrophobicContact CB-CB 4.12Å; A59-W173 VanDerWaalsContact CB-CD1 3.43Å; A59-W173 HydrophobicContact CB-CG 4.03Å; A59-K187 WeakPolarHBondContact O-CE 3.48Å; A59-K187 WeakPolarHBondContact O-CG 3.15Å; A59-K187 PolarHBondContact O-NZ 2.95Å
60	S	93.9	Very high	90.4	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.007	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-11.6	-179.3	-63.8	0	0	0	0	113.3	E54 R145 W173 S185 K187	E54-S60 WeakPolarHBondContact O-CA 3.39Å; E54-S60 PolarHBondContact O-N 2.91Å; S60-R145 PolarHBondContact O-NH2 3.22Å; S60-W173 VanDerWaalsContact OG-CB 3.25Å; S60-W173 WeakPolarHBondContact OG-CB 3.29Å; S60-S185 WeakPolarHBondContact CB-OG 3.18Å; S60-S185 VanDerWaalsContact OG-C 3.3Å; S60-S185 PolarHBondContact OG-O 3.45Å; S60-S185 PolarHBondContact OG-OG 3.19Å; S60-K187 VanDerWaalsContact O-CA 3.27Å; S60-K187 WeakPolarHBondContact O-CA 3.32Å
61	G	89.4	Confident	90	Very high	5 Å²	5	56.4 Å²	56.4	5%	0.052	36%	0.359	C	S	.	.			trans	74.5	174.9	179	0	0	0	0	0	113.8	E54 R55 T56 A59	E54-G61 PolarHBondContact O-N 3.01Å; R55-G61 VanDerWaalsContact CA-O 3.29Å; R55-G61 WeakPolarHBondContact CA-O 3.5Å; R55-G61 CarbonylContact O-C 3.6Å; R55-G61 WeakPolarHBondContact O-CA 3.42Å; T56-G61 VanDerWaalsContact O-CA 3.3Å; T56-G61 WeakPolarHBondContact O-CA 3.44Å; T56-G61 PolarHBondContact O-N 3.1Å; A59-G61 VanDerWaalsContact C-N 3.32Å; A59-G61 PolarHBondContact O-N 3Å
62	P	89.3	Confident	89.1	Confident	73 Å²	73	58.4 Å²	58.4	47%	0.474	35%	0.35	S	S	.	.			trans	-63.2	156.9	-170	25	-34.1	0	0	0	113	R145	P62-R145 PolarHBondContact O-NH1 3.11Å; P62-R145 PolarHBondContact O-NH2 3.09Å
63	A	90.4	Very high	88.5	Confident	33 Å²	33	59 Å²	59	27%	0.273	35%	0.346	S	S	.	.			trans	-70.7	131.4	166.6	0	0	0	0	0	108.8	D138 L140 E143	A63-D138 HydrophobicContact CB-CB 4.37Å; A63-L140 HydrophobicContact CB-CD2 4.13Å; A63-E143 VanDerWaalsContact C-OE1 3.27Å; A63-E143 WeakPolarHBondContact CA-OE1 3.5Å; A63-E143 VanDerWaalsContact CB-OE1 3.32Å; A63-E143 WeakPolarHBondContact CB-OE1 3.28Å
64	E	87.2	Confident	88.2	Confident	80 Å²	80	56.8 Å²	56.8	37%	0.374	33%	0.328	S	S	.	.			trans	-91.4	-5.8	174.7	-65.6	-175.6	170.3	0	0	111.8	R73 E143 A188 N190	E64-R73 VanDerWaalsContact CB-NH1 3.32Å; E64-R73 VanDerWaalsContact CB-NH2 3.28Å; E64-R73 PolarHBondContact O-NH1 2.57Å; E64-R73 VanDerWaalsContact O-NH1 3.08Å; E64-R73 IonicContact OE2-CZ 3.97Å; E64-R73 IonicContact OE2-NE 3.12Å; E64-R73 IonicContact OE2-NH2 3.69Å; E64-R73 PolarHBondContact OE2-NH2 3.42Å; E64-E143 PolarHBondContact N-OE1 2.88Å; E64-E143 PolarHBondContact N-OE2 3.12Å; E64-A188 HydrophobicContact CG-CB 4.39Å; E64-A188 VanDerWaalsContact OE1-CB 3.23Å; E64-A188 WeakPolarHBondContact OE1-CB 3.28Å; E64-N190 WeakPolarHBondContact OE1-CB 3.49Å; E64-N190 PolarHBondContact OE2-ND2 3.43Å
65	G	88.2	Confident	87.5	Confident	35 Å²	35	61.4 Å²	61.4	36%	0.361	34%	0.344	S	S	.	.			trans	110.4	153.1	176.3	0	0	0	0	0	113.3	V67 R73 E143	G65-V67 PolarHBondContact O-N 3Å; G65-R73 PolarHBondContact O-NH1 3.09Å; G65-E143 PolarHBondContact N-OE1 2.83Å; G65-E143 WeakPolarHBondContact O-CG 3.48Å
66	K	93.3	Very high	87.1	Confident	110 Å²	110	57.7 Å²	57.7	48%	0.478	33%	0.332	S	S	.	.			trans	-55.6	128.2	-175.2	177.4	164	-176	174.1	0	112	A68 E131 Y142	K66-A68 PolarHBondContact O-N 2.85Å; K66-E131 PolarHBondContact NZ-O 2.85Å; K66-Y142 HydrophobicContact CD-CD1 4.36Å; K66-Y142 HydrophobicContact CD-CG 4.27Å; K66-Y142 HydrophobicContact CG-CG 4.37Å
67	V	93.3	Very high	87.4	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	32%	0.321	C	S	.	.			trans	-89.7	103.4	175	178.5	0	0	0	0	108	G65 R73 F74 L77 W129 Y142 E143	G65-V67 PolarHBondContact O-N 3Å; V67-R73 HydrophobicContact CG1-CB 4.01Å; V67-R73 HydrophobicContact CG2-CB 3.85Å; V67-F74 VanDerWaalsContact CG1-CA 3.42Å; V67-F74 HydrophobicContact CG1-CB 3.86Å; V67-F74 HydrophobicContact CG1-CD2 4.3Å; V67-F74 VanDerWaalsContact CG1-N 3.31Å; V67-L77 HydrophobicContact CG1-CD1 4.12Å; V67-W129 WeakPolarHBondContact O-CZ2 3.45Å; V67-W129 PolarHBondContact O-NE1 3.06Å; V67-Y142 WeakPolarHBondContact CB-O 3.47Å; V67-Y142 PolarHBondContact N-O 3.19Å; V67-E143 HydrophobicContact CG2-CB 4.38Å; V67-E143 HydrophobicContact CG2-CG 4.4Å
68	A	93.1	Very high	87.9	Confident	54 Å²	54	51.6 Å²	51.6	45%	0.446	30%	0.299	S	S	.	.			trans	-80	148.4	176.2	0	0	0	0	0	111.5	K66 G70 S71 F74	K66-A68 PolarHBondContact O-N 2.85Å; A68-G70 PolarHBondContact O-N 2.9Å; A68-S71 WeakPolarHBondContact O-CB 3.42Å; A68-S71 PolarHBondContact O-N 3.06Å; A68-S71 PolarHBondContact O-OG 2.83Å; A68-F74 WeakPolarHBondContact O-CB 3.44Å
69	R	91.6	Very high	88.8	Confident	116 Å²	116	51.1 Å²	51.1	44%	0.438	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	132.1	174.7	-164.6	172.8	-71.5	-94.4	12	110.8	S71 F74 W129 E131	R69-S71 PolarHBondContact O-N 2.9Å; R69-F74 HydrophobicContact CG-CE1 4.35Å; R69-F74 HydrophobicContact CG-CE2 4.27Å; R69-F74 HydrophobicContact CG-CZ 4.06Å; R69-W129 HydrophobicContact CB-CH2 4.01Å; R69-W129 HydrophobicContact CG-CH2 4.49Å; R69-E131 IonicContact CZ-OE1 2.8Å; R69-E131 IonicContact CZ-OE2 3.8Å; R69-E131 IonicContact NE-OE1 3.12Å; R69-E131 IonicContact NE-OE2 2.84Å; R69-E131 PolarHBondContact NE-OE2 3.43Å; R69-E131 VanDerWaalsContact NH2-CD 3.27Å; R69-E131 IonicContact NH2-OE1 3.87Å; R69-E131 PolarHBondContact NH2-OE1 3.06Å; R69-E131 IonicContact NH2-OE2 2.74Å; R69-E131 PolarHBondContact NH2-OE2 2.85Å; R69-E131 VanDerWaalsContact NH2-OE2 3.12Å
70	G	86.6	Confident	89	Confident	68 Å²	68	51.3 Å²	51.3	70%	0.701	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-4.6	-178.6	0	0	0	0	0	115.7	A68	A68-G70 PolarHBondContact O-N 2.9Å
71	S	87.9	Confident	89.1	Confident	38 Å²	38	59.2 Å²	59.2	27%	0.266	32%	0.317	S	S	.	.	S	Bend	trans	-65.9	164.9	172	70.4	0	0	0	0	112.1	A68 R69 R73 F74	A68-S71 WeakPolarHBondContact O-CB 3.42Å; A68-S71 PolarHBondContact O-N 3.06Å; A68-S71 PolarHBondContact O-OG 2.83Å; R69-S71 PolarHBondContact O-N 2.9Å; S71-R73 VanDerWaalsContact C-N 3.28Å; S71-R73 PolarHBondContact O-N 2.89Å; S71-F74 WeakPolarHBondContact O-CB 3.34Å; S71-F74 PolarHBondContact O-N 2.88Å; S71-F74 PolarHBondContact OG-N 2.97Å
72	E	78.2	Confident	89.2	Confident	110 Å²	110	60.3 Å²	60.3	51%	0.514	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-38.8	176.4	-66.3	-159.7	145.8	0	0	112.4	F74 R75	E72-F74 VanDerWaalsContact C-N 3.29Å; E72-F74 PolarHBondContact O-N 2.66Å; E72-R75 WeakPolarHBondContact O-CB 3.5Å; E72-R75 PolarHBondContact O-N 2.87Å
73	R	81.3	Confident	89.5	Confident	66 Å²	66	61.4 Å²	61.4	25%	0.249	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-70.8	-23.4	178.3	-65.8	-172.9	69.3	-153.2	-7	112.9	E64 G65 V67 S71 R75 D76 E143	E64-R73 VanDerWaalsContact CB-NH1 3.32Å; E64-R73 VanDerWaalsContact CB-NH2 3.28Å; E64-R73 PolarHBondContact O-NH1 2.57Å; E64-R73 VanDerWaalsContact O-NH1 3.08Å; E64-R73 IonicContact OE2-CZ 3.97Å; E64-R73 IonicContact OE2-NE 3.12Å; E64-R73 IonicContact OE2-NH2 3.69Å; E64-R73 PolarHBondContact OE2-NH2 3.42Å; G65-R73 PolarHBondContact O-NH1 3.09Å; V67-R73 HydrophobicContact CG1-CB 4.01Å; V67-R73 HydrophobicContact CG2-CB 3.85Å; S71-R73 VanDerWaalsContact C-N 3.28Å; S71-R73 PolarHBondContact O-N 2.89Å; R73-R75 PolarHBondContact O-N 3.12Å; R73-D76 WeakPolarHBondContact O-CB 3.41Å; R73-D76 PolarHBondContact O-N 2.77Å; R73-D76 VanDerWaalsContact O-N 3.09Å; R73-E143 IonicContact NH2-OE2 2.77Å; R73-E143 PolarHBondContact NH2-OE2 3.1Å
74	F	89.1	Confident	89.7	Confident	41 Å²	41	62.5 Å²	62.5	18%	0.18	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-63.4	-28.4	175.3	-175	-100.6	0	0	0	112.1	V67 A68 R69 S71 E72 D76 L77 L98 W129	V67-F74 VanDerWaalsContact CG1-CA 3.42Å; V67-F74 HydrophobicContact CG1-CB 3.86Å; V67-F74 HydrophobicContact CG1-CD2 4.3Å; V67-F74 VanDerWaalsContact CG1-N 3.31Å; A68-F74 WeakPolarHBondContact O-CB 3.44Å; R69-F74 HydrophobicContact CG-CE1 4.35Å; R69-F74 HydrophobicContact CG-CE2 4.27Å; R69-F74 HydrophobicContact CG-CZ 4.06Å; S71-F74 WeakPolarHBondContact O-CB 3.34Å; S71-F74 PolarHBondContact O-N 2.88Å; S71-F74 PolarHBondContact OG-N 2.97Å; E72-F74 VanDerWaalsContact C-N 3.29Å; E72-F74 PolarHBondContact O-N 2.66Å; F74-D76 PolarHBondContact O-N 2.84Å; F74-L77 HydrophobicContact CD2-CD1 4.04Å; F74-L77 HydrophobicContact CE2-CD1 4.35Å; F74-L77 WeakPolarHBondContact O-CB 3.35Å; F74-L77 PolarHBondContact O-N 2.66Å; F74-L77 VanDerWaalsContact O-N 3.12Å; F74-L98 HydrophobicContact CE2-CD1 3.6Å; F74-L98 HydrophobicContact CZ-CD1 3.51Å; F74-W129 HydrophobicContact CD2-CH2 4.01Å; F74-W129 AromaticContact CD2-CZ2 3.83Å; F74-W129 HydrophobicContact CD2-CZ2 3.83Å; F74-W129 HydrophobicContact CE2-CD2 4.41Å; F74-W129 HydrophobicContact CE2-CE3 4.13Å; F74-W129 AromaticContact CE2-CH2 3.45Å; F74-W129 HydrophobicContact CE2-CH2 3.45Å; F74-W129 VanDerWaalsContact CE2-CH2 3.45Å; F74-W129 AromaticContact CE2-CZ2 3.74Å; F74-W129 HydrophobicContact CE2-CZ2 3.74Å; F74-W129 AromaticContact CE2-CZ3 3.67Å; F74-W129 HydrophobicContact CE2-CZ3 3.67Å; F74-W129 HydrophobicContact CZ-CH2 4.43Å; F74-W129 HydrophobicContact CZ-CZ3 4.46Å
75	R	81.3	Confident	90.3	Very high	123 Å²	123	59 Å²	59	46%	0.464	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-70.2	-15.6	177.7	-54.7	178.9	69	-154.9	-1.3	113.2	E72 R73 R295	E72-R75 WeakPolarHBondContact O-CB 3.5Å; E72-R75 PolarHBondContact O-N 2.87Å; R73-R75 PolarHBondContact O-N 3.12Å; R75-R295 VanDerWaalsContact NH1-NE 3.18Å; R75-R295 VanDerWaalsContact NH1-NH2 3.18Å
76	D	83.1	Confident	90.8	Very high	30 Å²	30	59.9 Å²	59.9	16%	0.16	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-82.5	-20.5	174.7	-59.1	-47.9	0	0	0	111.7	R73 F74 R292	R73-D76 WeakPolarHBondContact O-CB 3.41Å; R73-D76 PolarHBondContact O-N 2.77Å; R73-D76 VanDerWaalsContact O-N 3.09Å; F74-D76 PolarHBondContact O-N 2.84Å; D76-R292 IonicContact OD1-CZ 3.13Å; D76-R292 IonicContact OD1-NH1 2.74Å; D76-R292 PolarHBondContact OD1-NH1 3.4Å; D76-R292 IonicContact OD2-CZ 3.07Å; D76-R292 IonicContact OD2-NH1 3.98Å; D76-R292 PolarHBondContact OD2-NH1 2.74Å
77	L	91	Very high	91	Very high	14 Å²	14	55.5 Å²	55.5	7%	0.073	29%	0.291	C	S	.	.			trans	-73.3	136.2	173.5	-55.8	-175.7	0	0	0	109.9	V67 F74 L98 M99 T100 W129 E143	V67-L77 HydrophobicContact CG1-CD1 4.12Å; F74-L77 HydrophobicContact CD2-CD1 4.04Å; F74-L77 HydrophobicContact CE2-CD1 4.35Å; F74-L77 WeakPolarHBondContact O-CB 3.35Å; F74-L77 PolarHBondContact O-N 2.66Å; F74-L77 VanDerWaalsContact O-N 3.12Å; L77-L98 HydrophobicContact CB-CB 4.35Å; L77-L98 HydrophobicContact CD1-CB 4.33Å; L77-M99 WeakPolarHBondContact CA-O 3.32Å; L77-T100 HydrophobicContact CD2-CG2 4.04Å; L77-W129 HydrophobicContact CD1-CB 4.42Å; L77-W129 HydrophobicContact CD1-CD2 4.01Å; L77-W129 HydrophobicContact CD1-CG 3.77Å; L77-E143 WeakPolarHBondContact CD2-O 3.41Å
78	V	89.1	Confident	91.2	Very high	25 Å²	25	59.8 Å²	59.8	15%	0.152	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.2	-179.5	-179.1	0	0	0	0	108.5	M99 E101 K104	V78-M99 PolarHBondContact N-O 2.82Å; V78-M99 PolarHBondContact O-N 3.2Å; V78-E101 WeakPolarHBondContact CG2-OE2 3.33Å; V78-K104 HydrophobicContact CB-CD 4.48Å; V78-K104 HydrophobicContact CG1-CD 4.1Å
79	P	95.3	Very high	91.2	Very high	49 Å²	49	58.9 Å²	58.9	32%	0.318	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.3	176.7	29	-34.9	0	0	0	110.7	Y81 R97 L98	P79-Y81 HydrophobicContact CB-CD2 4.26Å; P79-Y81 HydrophobicContact CB-CE2 3.56Å; P79-Y81 HydrophobicContact CG-CD2 4.42Å; P79-Y81 HydrophobicContact CG-CE2 3.65Å; P79-R97 CarbonylContact C-O 3.6Å; P79-R97 WeakPolarHBondContact CA-O 3.26Å; P79-L98 HydrophobicContact CB-CD2 4.02Å
80	N	96	Very high	91.2	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	29%	0.292	C	S	.	.			trans	-100.1	114.1	174.5	-165.5	-9.1	0	0	0	111.3	N82 F87 R97 M99 K104 V107 N108	N80-N82 WeakPolarHBondContact OD1-CB 3.43Å; N80-N82 PolarHBondContact OD1-N 3.27Å; N80-F87 HydrophobicContact CB-CZ 4.05Å; N80-F87 WeakPolarHBondContact O-CE2 3.47Å; N80-R97 PolarHBondContact N-O 3.1Å; N80-R97 PolarHBondContact O-NH1 2.77Å; N80-M99 HydrophobicContact CB-CE 3.67Å; N80-M99 HydrophobicContact CB-SD 3.92Å; N80-K104 HydrophobicContact CB-CG 4.45Å; N80-V107 VanDerWaalsContact ND2-CG1 3.29Å; N80-V107 WeakPolarHBondContact ND2-CG1 3.29Å; N80-N108 PolarHBondContact ND2-OD1 2.94Å
81	Y	95.9	Very high	91.3	Very high	166 Å²	166	56.1 Å²	56.1	65%	0.651	27%	0.271	S	S	*	.			trans	-109.9	24.5	177.7	-62.5	-68.7	0	0	0	112.7	P79 P83	P79-Y81 HydrophobicContact CB-CD2 4.26Å; P79-Y81 HydrophobicContact CB-CE2 3.56Å; P79-Y81 HydrophobicContact CG-CD2 4.42Å; P79-Y81 HydrophobicContact CG-CE2 3.65Å; Y81-P83 WeakPolarHBondContact O-CD 3.49Å
82	N	92.6	Very high	91.5	Very high	28 Å²	28	61.1 Å²	61.1	15%	0.15	30%	0.295	C	S	.	.			trans	-58.1	119.3	176.9	-175.1	-12.4	0	0	0	110.5	N80 D84 I85 N108	N80-N82 WeakPolarHBondContact OD1-CB 3.43Å; N80-N82 PolarHBondContact OD1-N 3.27Å; N82-D84 PolarHBondContact O-N 2.82Å; N82-D84 WeakPolarHBondContact OD1-CB 3.44Å; N82-D84 PolarHBondContact OD1-N 3.48Å; N82-I85 HydrophobicContact CB-CD1 3.95Å; N82-I85 HydrophobicContact CB-CG1 4.13Å; N82-I85 PolarHBondContact O-N 3.15Å; N82-N108 PolarHBondContact ND2-OD1 3.34Å
83	P	95	Very high	92.2	Very high	97 Å²	97	58 Å²	58	63%	0.63	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.5	-178.1	28.8	-36.9	0	0	0	113.5	Y81 I85 R122	Y81-P83 WeakPolarHBondContact O-CD 3.49Å; P83-I85 VanDerWaalsContact C-N 3.28Å; P83-R122 PolarHBondContact O-NH1 3.34Å
84	D	95.9	Very high	92.8	Very high	55 Å²	55	55.8 Å²	55.8	29%	0.294	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.6	179.2	-62.4	-33.1	0	0	0	113.2	N82 A111 M115 R122	N82-D84 PolarHBondContact O-N 2.82Å; N82-D84 WeakPolarHBondContact OD1-CB 3.44Å; N82-D84 PolarHBondContact OD1-N 3.48Å; D84-A111 HydrophobicContact CB-CB 4.45Å; D84-M115 HydrophobicContact CB-SD 3.61Å; D84-R122 WeakPolarHBondContact O-CB 3.42Å
85	I	98.4	Very high	93	Very high	8 Å²	8	54 Å²	54	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.7	178.5	-53.8	176.3	0	0	0	109.5	N82 P83 F87 V107 A111 L123 V125	N82-I85 HydrophobicContact CB-CD1 3.95Å; N82-I85 HydrophobicContact CB-CG1 4.13Å; N82-I85 PolarHBondContact O-N 3.15Å; P83-I85 VanDerWaalsContact C-N 3.28Å; I85-F87 HydrophobicContact CB-CD2 4.43Å; I85-F87 HydrophobicContact CB-CE2 3.76Å; I85-F87 HydrophobicContact CB-CZ 4.2Å; I85-F87 HydrophobicContact CG2-CD2 4.07Å; I85-F87 HydrophobicContact CG2-CE1 4.27Å; I85-F87 HydrophobicContact CG2-CE2 3.57Å; I85-F87 HydrophobicContact CG2-CZ 3.69Å; I85-V107 HydrophobicContact CD1-CG1 4Å; I85-V107 HydrophobicContact CD1-CG2 4.02Å; I85-A111 HydrophobicContact CD1-CB 4.08Å; I85-A111 HydrophobicContact CG1-CB 3.65Å; I85-L123 HydrophobicContact CD1-CD2 4.47Å; I85-L123 HydrophobicContact CG1-CD2 4.4Å; I85-V125 HydrophobicContact CG2-CG2 3.82Å
86	I	98.3	Very high	93.8	Very high	52 Å²	52	48.1 Å²	48.1	27%	0.267	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.5	169.2	-57.4	-58.7	0	0	0	108.6	R122 L123 R124 V125	I86-R122 VanDerWaalsContact CD1-CZ 3.45Å; I86-R122 HydrophobicContact CG1-CB 4.41Å; I86-L123 PolarHBondContact N-O 3.03Å; I86-R124 HydrophobicContact CB-CB 4.07Å; I86-R124 HydrophobicContact CB-CG 4.06Å; I86-R124 HydrophobicContact CG2-CG 4.03Å; I86-R124 CarbonylContact O-C 3.53Å; I86-R124 WeakPolarHBondContact O-CA 3.42Å; I86-V125 PolarHBondContact O-N 2.9Å
87	F	98.2	Very high	94.5	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.9	170.3	-67.1	-90.7	0	0	0	108.6	N80 I85 D96 R97 M99 V125	N80-F87 HydrophobicContact CB-CZ 4.05Å; N80-F87 WeakPolarHBondContact O-CE2 3.47Å; I85-F87 HydrophobicContact CB-CD2 4.43Å; I85-F87 HydrophobicContact CB-CE2 3.76Å; I85-F87 HydrophobicContact CB-CZ 4.2Å; I85-F87 HydrophobicContact CG2-CD2 4.07Å; I85-F87 HydrophobicContact CG2-CE1 4.27Å; I85-F87 HydrophobicContact CG2-CE2 3.57Å; I85-F87 HydrophobicContact CG2-CZ 3.69Å; F87-D96 HydrophobicContact CD1-CB 4.13Å; F87-D96 WeakPolarHBondContact CD1-O 3.38Å; F87-D96 VanDerWaalsContact CE1-O 3.29Å; F87-D96 WeakPolarHBondContact CE1-O 3.49Å; F87-R97 HydrophobicContact CB-CG 4.34Å; F87-R97 HydrophobicContact CD1-CG 3.91Å; F87-R97 HydrophobicContact CD2-CG 4.17Å; F87-R97 HydrophobicContact CE1-CG 4.24Å; F87-R97 HydrophobicContact CE2-CG 4.47Å; F87-R97 HydrophobicContact CG-CG 3.86Å; F87-M99 HydrophobicContact CE1-CE 3.96Å; F87-M99 HydrophobicContact CZ-CE 4.21Å; F87-V125 HydrophobicContact CD1-CB 3.77Å; F87-V125 HydrophobicContact CD1-CG1 4.07Å; F87-V125 HydrophobicContact CD1-CG2 4.2Å; F87-V125 HydrophobicContact CE1-CB 3.96Å; F87-V125 HydrophobicContact CE1-CG1 4.23Å; F87-V125 HydrophobicContact CE1-CG2 3.88Å; F87-V125 HydrophobicContact CZ-CG2 4.5Å
88	K	96.9	Very high	94.8	Very high	93 Å²	93	50 Å²	50	40%	0.404	26%	0.258	S	S	.	.			trans	-75.6	-47.3	-179.4	-174.4	-173.9	161.8	-149.7	0	110.1	E90 D96 R124 V125 T126	K88-E90 VanDerWaalsContact C-N 3.26Å; K88-E90 WeakPolarHBondContact CD-OE2 3.39Å; K88-E90 VanDerWaalsContact CE-CD 3.5Å; K88-E90 WeakPolarHBondContact CE-OE1 3.1Å; K88-E90 WeakPolarHBondContact CE-OE2 3.32Å; K88-E90 WeakPolarHBondContact CG-OE2 3.47Å; K88-E90 IonicContact NZ-OE1 2.73Å; K88-E90 PolarHBondContact NZ-OE1 3.02Å; K88-E90 IonicContact NZ-OE2 3.51Å; K88-E90 PolarHBondContact NZ-OE2 3.36Å; K88-E90 PolarHBondContact O-N 3.14Å; K88-D96 PolarHBondContact N-OD2 2.77Å; K88-R124 VanDerWaalsContact CD-NH2 3.33Å; K88-R124 VanDerWaalsContact CG-NH2 3.3Å; K88-V125 PolarHBondContact N-O 3.29Å; K88-T126 HydrophobicContact CD-CG2 4.19Å
89	D	93.8	Very high	95.2	Very high	35 Å²	35	48.8 Å²	48.8	19%	0.187	25%	0.251	C	S	.	.			trans	46.9	48.5	173	-167.5	19.5	0	0	0	112.2	E91 N92 S93 G94 D96	D89-E91 PolarHBondContact O-N 2.86Å; D89-N92 PolarHBondContact O-N 3.12Å; D89-N92 VanDerWaalsContact O-N 3.08Å; D89-N92 PolarHBondContact OD1-N 3.07Å; D89-S93 PolarHBondContact OD1-N 2.85Å; D89-S93 VanDerWaalsContact OD1-N 3.17Å; D89-G94 WeakPolarHBondContact OD1-CA 3Å; D89-G94 PolarHBondContact OD1-N 3.36Å; D89-D96 PolarHBondContact N-OD2 3.17Å
90	E	90.8	Very high	95.2	Very high	72 Å²	72	47 Å²	47	34%	0.336	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.2	179.7	63.9	-88.3	-131.7	0	0	112.8	K88 N92	K88-E90 VanDerWaalsContact C-N 3.26Å; K88-E90 WeakPolarHBondContact CD-OE2 3.39Å; K88-E90 VanDerWaalsContact CE-CD 3.5Å; K88-E90 WeakPolarHBondContact CE-OE1 3.1Å; K88-E90 WeakPolarHBondContact CE-OE2 3.32Å; K88-E90 WeakPolarHBondContact CG-OE2 3.47Å; K88-E90 IonicContact NZ-OE1 2.73Å; K88-E90 PolarHBondContact NZ-OE1 3.02Å; K88-E90 IonicContact NZ-OE2 3.51Å; K88-E90 PolarHBondContact NZ-OE2 3.36Å; K88-E90 PolarHBondContact O-N 3.14Å; E90-N92 PolarHBondContact O-N 2.93Å; E90-N92 PolarHBondContact O-ND2 3.27Å
91	E	89.8	Confident	94.6	Very high	55 Å²	55	48.6 Å²	48.6	26%	0.257	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.3	175.6	-60.3	70.4	-148.2	0	0	111.5	D89 S93	D89-E91 PolarHBondContact O-N 2.86Å; E91-S93 PolarHBondContact O-N 2.98Å
92	N	91.9	Very high	94.3	Very high	143 Å²	143	42.7 Å²	42.7	77%	0.765	22%	0.223	S	C	*	.	S	Bend	trans	52.5	31.1	-171.3	-58.7	-82.9	0	0	0	112.9	D89 E90	D89-N92 PolarHBondContact O-N 3.12Å; D89-N92 VanDerWaalsContact O-N 3.08Å; D89-N92 PolarHBondContact OD1-N 3.07Å; E90-N92 PolarHBondContact O-N 2.93Å; E90-N92 PolarHBondContact O-ND2 3.27Å
93	S	91.8	Very high	94.4	Very high	45 Å²	45	41.4 Å²	41.4	32%	0.315	22%	0.216	S	C	.	.	S	Bend	trans	-109.4	-12	-176.6	72.6	0	0	0	0	112.3	D89 E91 A95	D89-S93 PolarHBondContact OD1-N 2.85Å; D89-S93 VanDerWaalsContact OD1-N 3.17Å; E91-S93 PolarHBondContact O-N 2.98Å; S93-A95 PolarHBondContact O-N 2.92Å; S93-A95 WeakPolarHBondContact OG-CB 3.45Å; S93-A95 PolarHBondContact OG-N 3.04Å
94	G	93.7	Very high	94.4	Very high	18 Å²	18	39 Å²	39	19%	0.186	20%	0.196	C	C	.	.	S	Bend	trans	70.8	10.6	-170.9	0	0	0	0	0	113.6	D89 D96 R97	D89-G94 WeakPolarHBondContact OD1-CA 3Å; D89-G94 PolarHBondContact OD1-N 3.36Å; G94-D96 VanDerWaalsContact C-N 3.31Å; G94-D96 PolarHBondContact O-N 2.94Å; G94-R97 WeakPolarHBondContact O-CB 3.34Å; G94-R97 PolarHBondContact O-N 3.36Å
95	A	95.2	Very high	93.9	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.033	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-59.8	-40.9	-176.9	0	0	0	0	0	112.2	S93 R97 L98 W129	S93-A95 PolarHBondContact O-N 2.92Å; S93-A95 WeakPolarHBondContact OG-CB 3.45Å; S93-A95 PolarHBondContact OG-N 3.04Å; A95-R97 PolarHBondContact O-N 2.94Å; A95-L98 WeakPolarHBondContact O-CB 3.22Å; A95-L98 PolarHBondContact O-N 3.45Å; A95-W129 HydrophobicContact CB-CE3 3.85Å; A95-W129 HydrophobicContact CB-CZ3 4.11Å; A95-W129 WeakPolarHBondContact CB-O 3.4Å
96	D	97.1	Very high	93.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-49.6	-26.5	171.9	-101.3	2.2	0	0	0	115	F87 K88 D89 G94 E127 G128	F87-D96 HydrophobicContact CD1-CB 4.13Å; F87-D96 WeakPolarHBondContact CD1-O 3.38Å; F87-D96 VanDerWaalsContact CE1-O 3.29Å; F87-D96 WeakPolarHBondContact CE1-O 3.49Å; K88-D96 PolarHBondContact N-OD2 2.77Å; D89-D96 PolarHBondContact N-OD2 3.17Å; G94-D96 VanDerWaalsContact C-N 3.31Å; G94-D96 PolarHBondContact O-N 2.94Å; D96-E127 VanDerWaalsContact OD1-C 3.32Å; D96-E127 WeakPolarHBondContact OD1-CA 3.36Å; D96-G128 PolarHBondContact OD1-N 2.82Å
97	R	97.8	Very high	93.8	Very high	63 Å²	63	41.9 Å²	41.9	24%	0.238	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-87.3	-18.4	-178.8	-59.7	176.1	175.1	-80.5	-1.7	112.6	P79 N80 F87 G94 A95	P79-R97 CarbonylContact C-O 3.6Å; P79-R97 WeakPolarHBondContact CA-O 3.26Å; N80-R97 PolarHBondContact N-O 3.1Å; N80-R97 PolarHBondContact O-NH1 2.77Å; F87-R97 HydrophobicContact CB-CG 4.34Å; F87-R97 HydrophobicContact CD1-CG 3.91Å; F87-R97 HydrophobicContact CD2-CG 4.17Å; F87-R97 HydrophobicContact CE1-CG 4.24Å; F87-R97 HydrophobicContact CE2-CG 4.47Å; F87-R97 HydrophobicContact CG-CG 3.86Å; G94-R97 WeakPolarHBondContact O-CB 3.34Å; G94-R97 PolarHBondContact O-N 3.36Å; A95-R97 PolarHBondContact O-N 2.94Å
98	L	97.5	Very high	93.5	Very high	20 Å²	20	42.9 Å²	42.9	11%	0.105	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.9	-176.3	-66.9	171.4	0	0	0	110	F74 L77 P79 A95 W129	F74-L98 HydrophobicContact CE2-CD1 3.6Å; F74-L98 HydrophobicContact CZ-CD1 3.51Å; L77-L98 HydrophobicContact CB-CB 4.35Å; L77-L98 HydrophobicContact CD1-CB 4.33Å; P79-L98 HydrophobicContact CB-CD2 4.02Å; A95-L98 WeakPolarHBondContact O-CB 3.22Å; A95-L98 PolarHBondContact O-N 3.45Å; L98-W129 HydrophobicContact CB-CB 4.16Å; L98-W129 HydrophobicContact CB-CE3 4.25Å; L98-W129 HydrophobicContact CD1-CE3 3.69Å; L98-W129 HydrophobicContact CD1-CZ3 3.89Å; L98-W129 VanDerWaalsContact O-CB 3.23Å; L98-W129 WeakPolarHBondContact O-CB 3.39Å
99	M	97.3	Very high	93	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	164.3	-178.4	62.9	-169.3	69.2	0	0	110.6	L77 V78 N80 F87 C103 K104 V107 G144 L147	L77-M99 WeakPolarHBondContact CA-O 3.32Å; V78-M99 PolarHBondContact N-O 2.82Å; V78-M99 PolarHBondContact O-N 3.2Å; N80-M99 HydrophobicContact CB-CE 3.67Å; N80-M99 HydrophobicContact CB-SD 3.92Å; F87-M99 HydrophobicContact CE1-CE 3.96Å; F87-M99 HydrophobicContact CZ-CE 4.21Å; M99-C103 HydrophobicContact CB-CB 3.96Å; M99-C103 HydrophobicContact CG-CB 4.3Å; M99-K104 HydrophobicContact CG-CB 3.95Å; M99-K104 VanDerWaalsContact SD-CA 3.56Å; M99-K104 HydrophobicContact SD-CB 3.92Å; M99-V107 HydrophobicContact CE-CG1 4.43Å; M99-V107 HydrophobicContact SD-CG1 3.67Å; M99-G144 CarbonylContact C-O 3.57Å; M99-G144 VanDerWaalsContact CA-O 3.26Å; M99-G144 WeakPolarHBondContact CA-O 3.22Å; M99-L147 HydrophobicContact CE-CD1 4.43Å; M99-L147 HydrophobicContact CE-CD2 4.04Å
100	T	94.3	Very high	93.2	Very high	10 Å²	10	38.9 Å²	38.9	6%	0.061	20%	0.198	C	C	.	.			trans	-65.9	160.7	173.1	63.5	0	0	0	0	111.6	L77 R102 C103 K104 G144 R145 D189	L77-T100 HydrophobicContact CD2-CG2 4.04Å; T100-R102 VanDerWaalsContact C-N 3.28Å; T100-R102 PolarHBondContact O-N 2.78Å; T100-C103 WeakPolarHBondContact O-CB 3.35Å; T100-C103 PolarHBondContact O-N 3Å; T100-C103 VanDerWaalsContact O-N 3.12Å; T100-C103 WeakPolarHBondContact OG1-CB 3.44Å; T100-C103 PolarHBondContact OG1-N 3.25Å; T100-K104 PolarHBondContact O-N 2.89Å; T100-G144 PolarHBondContact N-O 3.49Å; T100-R145 HydrophobicContact CG2-CG 3.55Å; T100-D189 WeakPolarHBondContact CB-OD2 3.31Å
101	E	84.8	Confident	93.5	Very high	38 Å²	38	35.4 Å²	35.4	18%	0.178	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-39.4	-178.5	-164.4	69.9	-134.3	0	0	110.5	V78 C103 K104 E105 D189	V78-E101 WeakPolarHBondContact CG2-OE2 3.33Å; E101-C103 VanDerWaalsContact C-N 3.35Å; E101-C103 PolarHBondContact O-N 2.81Å; E101-K104 WeakPolarHBondContact O-CB 3.43Å; E101-K104 PolarHBondContact O-N 2.77Å; E101-K104 IonicContact OE1-NZ 2.74Å; E101-K104 PolarHBondContact OE1-NZ 2.79Å; E101-K104 IonicContact OE2-NZ 3.34Å; E101-E105 WeakPolarHBondContact O-CG 3.48Å; E101-E105 PolarHBondContact O-N 2.87Å; E101-D189 PolarHBondContact N-OD2 3.33Å
102	R	88.2	Confident	93.4	Very high	43 Å²	43	37.4 Å²	37.4	16%	0.162	19%	0.194	C	C	.	.	H	α-helix	trans	-59.8	-45.5	173.8	-176.1	176.4	-177.6	83.5	-4	111.7	T100 K104 E105 R106 D172 V186 D189	T100-R102 VanDerWaalsContact C-N 3.28Å; T100-R102 PolarHBondContact O-N 2.78Å; R102-K104 VanDerWaalsContact C-N 3.3Å; R102-K104 PolarHBondContact O-N 2.86Å; R102-E105 PolarHBondContact O-N 3.48Å; R102-R106 WeakPolarHBondContact O-CG 3.45Å; R102-R106 PolarHBondContact O-N 2.68Å; R102-D172 IonicContact CZ-OD1 3.81Å; R102-D172 IonicContact CZ-OD2 2.74Å; R102-D172 IonicContact NE-OD1 3.85Å; R102-D172 IonicContact NE-OD2 2.72Å; R102-D172 PolarHBondContact NE-OD2 3.24Å; R102-D172 IonicContact NH2-OD1 2.64Å; R102-D172 PolarHBondContact NH2-OD1 2.82Å; R102-D172 IonicContact NH2-OD2 3.58Å; R102-D172 PolarHBondContact NH2-OD2 2.74Å; R102-V186 HydrophobicContact CB-CG2 4.4Å; R102-V186 HydrophobicContact CG-CB 4.07Å; R102-V186 HydrophobicContact CG-CG1 4.26Å; R102-V186 HydrophobicContact CG-CG2 4.35Å; R102-D189 WeakPolarHBondContact CB-OD1 3.48Å; R102-D189 PolarHBondContact N-OD1 3.25Å
103	C	96.2	Very high	93.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-42.5	179.2	-166.9	0	0	0	0	110.8	M99 T100 E101 E105 R106 V107 V186	M99-C103 HydrophobicContact CB-CB 3.96Å; M99-C103 HydrophobicContact CG-CB 4.3Å; T100-C103 WeakPolarHBondContact O-CB 3.35Å; T100-C103 PolarHBondContact O-N 3Å; T100-C103 VanDerWaalsContact O-N 3.12Å; T100-C103 WeakPolarHBondContact OG1-CB 3.44Å; T100-C103 PolarHBondContact OG1-N 3.25Å; E101-C103 VanDerWaalsContact C-N 3.35Å; E101-C103 PolarHBondContact O-N 2.81Å; C103-E105 PolarHBondContact O-N 3.12Å; C103-R106 PolarHBondContact O-N 3.25Å; C103-V107 WeakPolarHBondContact O-CB 3.41Å; C103-V107 WeakPolarHBondContact O-CG1 3.38Å; C103-V107 PolarHBondContact O-N 2.73Å; C103-V186 HydrophobicContact CB-CG1 4.45Å; C103-V186 HydrophobicContact CB-CG2 3.7Å
104	K	94.7	Very high	93.7	Very high	47 Å²	47	29.8 Å²	29.8	20%	0.204	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-45	173.9	179.9	176.6	155.2	-139	0	112.7	V78 N80 M99 T100 E101 R102 V107 N108	V78-K104 HydrophobicContact CB-CD 4.48Å; V78-K104 HydrophobicContact CG1-CD 4.1Å; N80-K104 HydrophobicContact CB-CG 4.45Å; M99-K104 HydrophobicContact CG-CB 3.95Å; M99-K104 VanDerWaalsContact SD-CA 3.56Å; M99-K104 HydrophobicContact SD-CB 3.92Å; T100-K104 PolarHBondContact O-N 2.89Å; E101-K104 WeakPolarHBondContact O-CB 3.43Å; E101-K104 PolarHBondContact O-N 2.77Å; E101-K104 IonicContact OE1-NZ 2.74Å; E101-K104 PolarHBondContact OE1-NZ 2.79Å; E101-K104 IonicContact OE2-NZ 3.34Å; R102-K104 VanDerWaalsContact C-N 3.3Å; R102-K104 PolarHBondContact O-N 2.86Å; K104-V107 WeakPolarHBondContact O-CG1 3.21Å; K104-N108 VanDerWaalsContact O-CB 3.27Å; K104-N108 WeakPolarHBondContact O-CB 3.15Å; K104-N108 PolarHBondContact O-N 2.99Å; K104-N108 PolarHBondContact O-ND2 2.87Å; K104-N108 VanDerWaalsContact O-ND2 3.14Å
105	E	86.1	Confident	93.8	Very high	112 Å²	112	32.1 Å²	32.1	52%	0.523	16%	0.16	S	C	.	.	H	α-helix	trans	-59.7	-47.5	174.9	-73.4	-178.7	174.9	0	0	111.8	E101 R102 C103 A109	E101-E105 WeakPolarHBondContact O-CG 3.48Å; E101-E105 PolarHBondContact O-N 2.87Å; R102-E105 PolarHBondContact O-N 3.48Å; C103-E105 PolarHBondContact O-N 3.12Å; E105-A109 PolarHBondContact O-N 2.74Å; E105-A109 VanDerWaalsContact O-N 3.09Å
106	R	95.6	Very high	93.7	Very high	64 Å²	64	38 Å²	38	24%	0.242	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-44.2	-178.5	-59.6	-46.3	172.4	-170.8	-11.1	112.6	R102 C103 N108 A109 L110 A169 G170 F171 V186	R102-R106 WeakPolarHBondContact O-CG 3.45Å; R102-R106 PolarHBondContact O-N 2.68Å; C103-R106 PolarHBondContact O-N 3.25Å; R106-N108 VanDerWaalsContact C-N 3.34Å; R106-N108 PolarHBondContact O-N 3.02Å; R106-A109 PolarHBondContact O-N 3.45Å; R106-L110 WeakPolarHBondContact O-CB 3.31Å; R106-L110 PolarHBondContact O-N 3.31Å; R106-A169 VanDerWaalsContact CD-O 3.3Å; R106-A169 WeakPolarHBondContact CD-O 3.29Å; R106-G170 VanDerWaalsContact CD-O 3.22Å; R106-G170 WeakPolarHBondContact CD-O 3.38Å; R106-G170 PolarHBondContact NE-O 2.59Å; R106-G170 VanDerWaalsContact NE-O 3.09Å; R106-F171 HydrophobicContact CB-CD1 4.03Å; R106-F171 HydrophobicContact CB-CD2 3.87Å; R106-F171 HydrophobicContact CB-CE1 3.83Å; R106-F171 HydrophobicContact CB-CE2 3.66Å; R106-F171 HydrophobicContact CB-CG 4.06Å; R106-F171 HydrophobicContact CB-CZ 3.65Å; R106-V186 HydrophobicContact CB-CG1 4.44Å; R106-V186 HydrophobicContact CG-CG1 3.93Å
107	V	97.9	Very high	93.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.7	-34.5	-179.4	78.7	0	0	0	0	111.7	N80 I85 M99 C103 K104 L110 A111 L123 V125 L147 F171	N80-V107 VanDerWaalsContact ND2-CG1 3.29Å; N80-V107 WeakPolarHBondContact ND2-CG1 3.29Å; I85-V107 HydrophobicContact CD1-CG1 4Å; I85-V107 HydrophobicContact CD1-CG2 4.02Å; M99-V107 HydrophobicContact CE-CG1 4.43Å; M99-V107 HydrophobicContact SD-CG1 3.67Å; C103-V107 WeakPolarHBondContact O-CB 3.41Å; C103-V107 WeakPolarHBondContact O-CG1 3.38Å; C103-V107 PolarHBondContact O-N 2.73Å; K104-V107 WeakPolarHBondContact O-CG1 3.21Å; V107-L110 PolarHBondContact O-N 3.46Å; V107-A111 PolarHBondContact O-N 2.79Å; V107-L123 HydrophobicContact CG2-CD2 3.55Å; V107-V125 HydrophobicContact CG2-CG2 4.43Å; V107-L147 HydrophobicContact CB-CD1 3.82Å; V107-L147 HydrophobicContact CG1-CD1 4.4Å; V107-L147 HydrophobicContact CG2-CD1 3.57Å; V107-F171 HydrophobicContact CB-CZ 4Å; V107-F171 HydrophobicContact CG2-CZ 4.47Å
108	N	92	Very high	93.7	Very high	39 Å²	39	40 Å²	40	21%	0.209	20%	0.203	C	C	.	.	H	α-helix	trans	-68.3	-41.3	175.2	-71.9	-18.9	0	0	0	111.8	N80 N82 K104 R106 L110 A111 I112	N80-N108 PolarHBondContact ND2-OD1 2.94Å; N82-N108 PolarHBondContact ND2-OD1 3.34Å; K104-N108 VanDerWaalsContact O-CB 3.27Å; K104-N108 WeakPolarHBondContact O-CB 3.15Å; K104-N108 PolarHBondContact O-N 2.99Å; K104-N108 PolarHBondContact O-ND2 2.87Å; K104-N108 VanDerWaalsContact O-ND2 3.14Å; R106-N108 VanDerWaalsContact C-N 3.34Å; R106-N108 PolarHBondContact O-N 3.02Å; N108-L110 VanDerWaalsContact C-N 3.3Å; N108-L110 PolarHBondContact O-N 3.43Å; N108-A111 PolarHBondContact O-N 3.09Å; N108-I112 PolarHBondContact O-N 3.4Å
109	A	87.2	Confident	93.6	Very high	43 Å²	43	44.7 Å²	44.7	36%	0.355	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-40.3	172.3	0	0	0	0	0	111.7	E105 R106 I112 A113 A169	E105-A109 PolarHBondContact O-N 2.74Å; E105-A109 VanDerWaalsContact O-N 3.09Å; R106-A109 PolarHBondContact O-N 3.45Å; A109-I112 PolarHBondContact O-N 3.49Å; A109-A113 PolarHBondContact O-N 2.78Å; A109-A113 VanDerWaalsContact O-N 3.13Å; A109-A169 HydrophobicContact CB-CB 4.39Å
110	L	97.9	Very high	93.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-41.1	175.8	-179.2	57.5	0	0	0	112.4	R106 V107 N108 I112 A113 V114 L123 I149 L162 L165 A166 A169 F171	R106-L110 WeakPolarHBondContact O-CB 3.31Å; R106-L110 PolarHBondContact O-N 3.31Å; V107-L110 PolarHBondContact O-N 3.46Å; N108-L110 VanDerWaalsContact C-N 3.3Å; N108-L110 PolarHBondContact O-N 3.43Å; L110-I112 VanDerWaalsContact C-N 3.31Å; L110-I112 PolarHBondContact O-N 3.39Å; L110-A113 WeakPolarHBondContact O-CB 3.47Å; L110-A113 PolarHBondContact O-N 3.39Å; L110-V114 HydrophobicContact CD1-CG2 4.06Å; L110-V114 HydrophobicContact CG-CG2 4.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.43Å; L110-V114 PolarHBondContact O-N 3.18Å; L110-L123 HydrophobicContact CB-CD2 4.29Å; L110-L123 HydrophobicContact CD2-CD1 4.05Å; L110-L123 HydrophobicContact CD2-CD2 4.11Å; L110-L123 HydrophobicContact CG-CD1 4.25Å; L110-L123 HydrophobicContact CG-CD2 4.04Å; L110-I149 HydrophobicContact CD2-CD1 3.44Å; L110-I149 VanDerWaalsContact CD2-CD1 3.44Å; L110-L162 HydrophobicContact CD1-CD1 4.49Å; L110-L165 HydrophobicContact CD1-CB 3.62Å; L110-A166 HydrophobicContact CD1-CB 4.32Å; L110-A166 HydrophobicContact CD2-CB 3.86Å; L110-A169 HydrophobicContact CB-CB 3.84Å; L110-A169 HydrophobicContact CD1-CB 4.32Å; L110-F171 HydrophobicContact CB-CE2 4.12Å; L110-F171 HydrophobicContact CD2-CE2 3.8Å
111	A	96.7	Very high	93.7	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57	-45.4	178.1	0	0	0	0	0	111.8	D84 I85 V107 N108 A113 V114 M115 L123	D84-A111 HydrophobicContact CB-CB 4.45Å; I85-A111 HydrophobicContact CD1-CB 4.08Å; I85-A111 HydrophobicContact CG1-CB 3.65Å; V107-A111 PolarHBondContact O-N 2.79Å; N108-A111 PolarHBondContact O-N 3.09Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.2Å; A111-V114 PolarHBondContact O-N 3.17Å; A111-M115 WeakPolarHBondContact O-CG 3.39Å; A111-M115 PolarHBondContact O-N 3.08Å; A111-M115 VanDerWaalsContact O-N 3.1Å; A111-L123 HydrophobicContact CB-CB 4.26Å; A111-L123 HydrophobicContact CB-CD2 4.17Å
112	I	87.7	Confident	94.3	Very high	96 Å²	96	52.2 Å²	52.2	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-60.4	-44.6	174.4	-63.3	166.3	0	0	0	110.6	N108 A109 L110 V114 M115 N116	N108-I112 PolarHBondContact O-N 3.4Å; A109-I112 PolarHBondContact O-N 3.49Å; L110-I112 VanDerWaalsContact C-N 3.31Å; L110-I112 PolarHBondContact O-N 3.39Å; I112-V114 PolarHBondContact O-N 3.12Å; I112-M115 PolarHBondContact O-N 3.28Å; I112-N116 WeakPolarHBondContact O-CB 3.19Å; I112-N116 VanDerWaalsContact O-CG 3.25Å; I112-N116 PolarHBondContact O-N 3.18Å; I112-N116 PolarHBondContact O-ND2 3.41Å
113	A	92.8	Very high	94.8	Very high	28 Å²	28	50.2 Å²	50.2	23%	0.231	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-38.8	179.6	0	0	0	0	0	112.8	A109 L110 A111 N116 M117 L165	A109-A113 PolarHBondContact O-N 2.78Å; A109-A113 VanDerWaalsContact O-N 3.13Å; L110-A113 WeakPolarHBondContact O-CB 3.47Å; L110-A113 PolarHBondContact O-N 3.39Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.2Å; A113-N116 PolarHBondContact O-N 2.64Å; A113-M117 WeakPolarHBondContact O-CB 3.45Å; A113-M117 PolarHBondContact O-N 3.27Å; A113-L165 HydrophobicContact CB-CD2 4.38Å
114	V	97.6	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-48.5	176.9	169	0	0	0	0	111	L110 A111 I112 N116 M117 W118 V121 L123 L162 L165	L110-V114 HydrophobicContact CD1-CG2 4.06Å; L110-V114 HydrophobicContact CG-CG2 4.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.43Å; L110-V114 PolarHBondContact O-N 3.18Å; A111-V114 PolarHBondContact O-N 3.17Å; I112-V114 PolarHBondContact O-N 3.12Å; V114-N116 VanDerWaalsContact C-N 3.3Å; V114-N116 PolarHBondContact O-N 3.09Å; V114-M117 PolarHBondContact O-N 2.79Å; V114-M117 VanDerWaalsContact O-N 3.15Å; V114-W118 HydrophobicContact CG1-CE3 3.93Å; V114-W118 HydrophobicContact CG1-CZ3 4.19Å; V114-W118 HydrophobicContact CG2-CZ3 4.29Å; V114-W118 PolarHBondContact O-N 3.37Å; V114-V121 HydrophobicContact CG1-CG1 4.47Å; V114-L123 HydrophobicContact CB-CB 4.45Å; V114-L123 HydrophobicContact CG1-CB 4.46Å; V114-L123 HydrophobicContact CG2-CB 4.35Å; V114-L123 HydrophobicContact CG2-CD1 4.2Å; V114-L162 HydrophobicContact CG2-CD1 3.51Å; V114-L165 HydrophobicContact CG2-CD1 4.36Å
115	M	95.9	Very high	95.1	Very high	67 Å²	67	49.4 Å²	49.4	33%	0.33	28%	0.276	S	S	.	.	H	α-helix	trans	-63.5	-36.2	178.9	-69.8	171.8	64.1	0	0	112.5	D84 A111 I112 W118 R122	D84-M115 HydrophobicContact CB-SD 3.61Å; A111-M115 WeakPolarHBondContact O-CG 3.39Å; A111-M115 PolarHBondContact O-N 3.08Å; A111-M115 VanDerWaalsContact O-N 3.1Å; I112-M115 PolarHBondContact O-N 3.28Å; M115-W118 CarbonylContact O-C 3.6Å; M115-R122 HydrophobicContact CG-CG 4.45Å
116	N	92.4	Very high	95.7	Very high	128 Å²	128	45 Å²	45	68%	0.684	26%	0.257	S	S	*	.	H	α-helix	trans	-70.8	-33	175.3	-73.7	-26.7	0	0	0	112.7	I112 A113 V114	I112-N116 WeakPolarHBondContact O-CB 3.19Å; I112-N116 VanDerWaalsContact O-CG 3.25Å; I112-N116 PolarHBondContact O-N 3.18Å; I112-N116 PolarHBondContact O-ND2 3.41Å; A113-N116 PolarHBondContact O-N 2.64Å; V114-N116 VanDerWaalsContact C-N 3.3Å; V114-N116 PolarHBondContact O-N 3.09Å
117	M	96	Very high	95.8	Very high	67 Å²	67	43.1 Å²	43.1	33%	0.33	25%	0.251	S	S	.	.	H	α-helix	trans	-74.9	-41.2	178.2	-176.7	59.1	68.2	0	0	111.7	L40 A113 V114 L161 L165	L40-M117 HydrophobicContact CD1-CE 3.55Å; A113-M117 WeakPolarHBondContact O-CB 3.45Å; A113-M117 PolarHBondContact O-N 3.27Å; V114-M117 PolarHBondContact O-N 2.79Å; V114-M117 VanDerWaalsContact O-N 3.15Å; M117-L161 HydrophobicContact CE-CD2 4.27Å; M117-L161 HydrophobicContact CG-CD2 4.11Å; M117-L161 HydrophobicContact SD-CD2 3.93Å; M117-L165 HydrophobicContact CB-CD1 3.87Å; M117-L165 HydrophobicContact CE-CD2 3.95Å; M117-L165 HydrophobicContact CG-CD1 4.09Å
118	W	97.9	Very high	95.7	Very high	39 Å²	39	43.1 Å²	43.1	15%	0.148	25%	0.251	C	S	.	.	S	Bend	trans	-132	94.5	-175.8	-58	-66.9	0	0	0	110.2	V114 M115 G120 V121 T151 K158 L161 L162 L165	V114-W118 HydrophobicContact CG1-CE3 3.93Å; V114-W118 HydrophobicContact CG1-CZ3 4.19Å; V114-W118 HydrophobicContact CG2-CZ3 4.29Å; V114-W118 PolarHBondContact O-N 3.37Å; M115-W118 CarbonylContact O-C 3.6Å; W118-G120 PolarHBondContact O-N 2.89Å; W118-V121 HydrophobicContact CB-CB 3.74Å; W118-V121 HydrophobicContact CB-CG1 4.49Å; W118-V121 HydrophobicContact CB-CG2 3.85Å; W118-V121 WeakPolarHBondContact O-CB 3.15Å; W118-V121 PolarHBondContact O-N 2.96Å; W118-T151 HydrophobicContact CE3-CG2 4.34Å; W118-T151 HydrophobicContact CZ3-CG2 4.06Å; W118-K158 HydrophobicContact CD2-CD 3.98Å; W118-K158 HydrophobicContact CG-CD 4.17Å; W118-K158 HydrophobicContact CH2-CB 4.04Å; W118-K158 HydrophobicContact CZ2-CB 3.72Å; W118-K158 HydrophobicContact CZ2-CD 4.21Å; W118-K158 HydrophobicContact CZ2-CG 4.01Å; W118-L161 HydrophobicContact CH2-CB 4.19Å; W118-L161 HydrophobicContact CH2-CD2 4.45Å; W118-L161 HydrophobicContact CH2-CG 4.18Å; W118-L161 HydrophobicContact CZ2-CB 3.96Å; W118-L161 HydrophobicContact CZ2-CD2 3.73Å; W118-L161 HydrophobicContact CZ2-CG 3.92Å; W118-L162 HydrophobicContact CH2-CB 4.22Å; W118-L165 HydrophobicContact CH2-CD1 3.94Å; W118-L165 HydrophobicContact CZ3-CD1 3.73Å
119	P	96.3	Very high	96	Very high	117 Å²	117	41.2 Å²	41.2	76%	0.76	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	129.8	177.3	-26.7	35.1	0	0	0	111.7	V121	P119-V121 VanDerWaalsContact C-N 3.29Å; P119-V121 PolarHBondContact O-N 3.42Å
120	G	94.9	Very high	96.3	Very high	85 Å²	85	39.4 Å²	39.4	88%	0.876	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	-7.6	-177.6	0	0	0	0	0	115.2	W118	W118-G120 PolarHBondContact O-N 2.89Å
121	V	98.3	Very high	95.9	Very high	17 Å²	17	42 Å²	42	10%	0.103	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-101.7	127.7	175	-177.9	0	0	0	0	109.6	V114 W118 P119 T151	V114-V121 HydrophobicContact CG1-CG1 4.47Å; W118-V121 HydrophobicContact CB-CB 3.74Å; W118-V121 HydrophobicContact CB-CG1 4.49Å; W118-V121 HydrophobicContact CB-CG2 3.85Å; W118-V121 WeakPolarHBondContact O-CB 3.15Å; W118-V121 PolarHBondContact O-N 2.96Å; P119-V121 VanDerWaalsContact C-N 3.29Å; P119-V121 PolarHBondContact O-N 3.42Å; V121-T151 HydrophobicContact CG1-CG2 4.12Å
122	R	98.5	Very high	95.3	Very high	105 Å²	105	46.7 Å²	46.7	40%	0.396	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-98.3	159.2	171.4	-73.1	-172	-73.4	-178.1	-6.5	112.5	P83 D84 I86 M115 S152	P83-R122 PolarHBondContact O-NH1 3.34Å; D84-R122 WeakPolarHBondContact O-CB 3.42Å; I86-R122 VanDerWaalsContact CD1-CZ 3.45Å; I86-R122 HydrophobicContact CG1-CB 4.41Å; M115-R122 HydrophobicContact CG-CG 4.45Å; R122-S152 WeakPolarHBondContact CA-OG 3.09Å; R122-S152 PolarHBondContact N-OG 2.77Å; R122-S152 VanDerWaalsContact O-CB 3.3Å; R122-S152 WeakPolarHBondContact O-CB 3.2Å; R122-S152 PolarHBondContact O-N 3.31Å; R122-S152 PolarHBondContact O-OG 2.81Å
123	L	98.7	Very high	95.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	144	167.4	-179.7	65.9	0	0	0	109.4	I85 I86 V107 L110 A111 V114 I149 L162	I85-L123 HydrophobicContact CD1-CD2 4.47Å; I85-L123 HydrophobicContact CG1-CD2 4.4Å; I86-L123 PolarHBondContact N-O 3.03Å; V107-L123 HydrophobicContact CG2-CD2 3.55Å; L110-L123 HydrophobicContact CB-CD2 4.29Å; L110-L123 HydrophobicContact CD2-CD1 4.05Å; L110-L123 HydrophobicContact CD2-CD2 4.11Å; L110-L123 HydrophobicContact CG-CD1 4.25Å; L110-L123 HydrophobicContact CG-CD2 4.04Å; A111-L123 HydrophobicContact CB-CB 4.26Å; A111-L123 HydrophobicContact CB-CD2 4.17Å; V114-L123 HydrophobicContact CB-CB 4.45Å; V114-L123 HydrophobicContact CG1-CB 4.46Å; V114-L123 HydrophobicContact CG2-CB 4.35Å; V114-L123 HydrophobicContact CG2-CD1 4.2Å; L123-I149 HydrophobicContact CD1-CB 4.12Å; L123-I149 HydrophobicContact CD1-CD1 4.2Å; L123-I149 HydrophobicContact CD1-CG2 4.42Å; L123-L162 HydrophobicContact CD1-CD1 3.94Å
124	R	98.8	Very high	94.9	Very high	31 Å²	31	48.6 Å²	48.6	12%	0.117	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.2	177.3	176.2	174.2	174.9	-82.2	-7.9	111.1	I86 K88 I149 T150	I86-R124 HydrophobicContact CB-CB 4.07Å; I86-R124 HydrophobicContact CB-CG 4.06Å; I86-R124 HydrophobicContact CG2-CG 4.03Å; I86-R124 CarbonylContact O-C 3.53Å; I86-R124 WeakPolarHBondContact O-CA 3.42Å; K88-R124 VanDerWaalsContact CD-NH2 3.33Å; K88-R124 VanDerWaalsContact CG-NH2 3.3Å; R124-I149 CarbonylContact O-C 3.44Å; R124-I149 WeakPolarHBondContact O-CA 3.36Å; R124-T150 WeakPolarHBondContact CB-OG1 3.41Å; R124-T150 WeakPolarHBondContact CG-OG1 3.48Å; R124-T150 PolarHBondContact N-O 2.73Å; R124-T150 PolarHBondContact NH1-OG1 3.38Å; R124-T150 PolarHBondContact O-N 3.28Å; R124-T150 PolarHBondContact O-OG1 2.81Å
125	V	98.7	Very high	94.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.1	171.6	178.3	0	0	0	0	108.4	I85 I86 F87 K88 V107 E127 L147 D148 I149	I85-V125 HydrophobicContact CG2-CG2 3.82Å; I86-V125 PolarHBondContact O-N 2.9Å; F87-V125 HydrophobicContact CD1-CB 3.77Å; F87-V125 HydrophobicContact CD1-CG1 4.07Å; F87-V125 HydrophobicContact CD1-CG2 4.2Å; F87-V125 HydrophobicContact CE1-CB 3.96Å; F87-V125 HydrophobicContact CE1-CG1 4.23Å; F87-V125 HydrophobicContact CE1-CG2 3.88Å; F87-V125 HydrophobicContact CZ-CG2 4.5Å; K88-V125 PolarHBondContact N-O 3.29Å; V107-V125 HydrophobicContact CG2-CG2 4.43Å; V125-E127 WeakPolarHBondContact CG1-O 3.14Å; V125-L147 HydrophobicContact CG1-CD2 4.2Å; V125-L147 HydrophobicContact CG2-CD1 4.41Å; V125-D148 WeakPolarHBondContact CA-O 3.1Å; V125-I149 HydrophobicContact CG2-CG2 4.18Å
126	T	97.4	Very high	94.1	Very high	20 Å²	20	51.1 Å²	51.1	12%	0.123	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-23.4	177	44.3	0	0	0	0	114.5	K88 D148 T150	K88-T126 HydrophobicContact CD-CG2 4.19Å; T126-D148 PolarHBondContact N-O 3.21Å; T126-D148 WeakPolarHBondContact OG1-CB 3.46Å; T126-D148 PolarHBondContact OG1-O 3.29Å; T126-D148 VanDerWaalsContact OG1-O 3.04Å; T126-T150 HydrophobicContact CG2-CG2 4.09Å
127	E	97.9	Very high	93.7	Very high	23 Å²	23	53.3 Å²	53.3	11%	0.107	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	135.5	179.8	-170.1	65.5	-123.2	0	0	107.2	D96 V125 H135 L147 D148	D96-E127 VanDerWaalsContact OD1-C 3.32Å; D96-E127 WeakPolarHBondContact OD1-CA 3.36Å; V125-E127 WeakPolarHBondContact CG1-O 3.14Å; E127-H135 WeakPolarHBondContact CG-NE2 3.1Å; E127-L147 CarbonylContact O-C 3.49Å; E127-L147 VanDerWaalsContact O-CA 3.31Å; E127-L147 WeakPolarHBondContact O-CA 3.15Å; E127-D148 HydrophobicContact CB-CB 3.84Å; E127-D148 PolarHBondContact O-N 2.87Å
128	G	96.5	Very high	93.3	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.309	C	S	.	.			trans	-127.4	-117.7	179.9	0	0	0	0	0	112.7	D96 H141	D96-G128 PolarHBondContact OD1-N 2.82Å; G128-H141 PolarHBondContact O-ND1 3.07Å
129	W	97.6	Very high	93.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-77.9	117.9	171.3	170.6	69.3	0	0	0	110	V67 R69 F74 L77 A95 L98 E131 H141 Y142	V67-W129 WeakPolarHBondContact O-CZ2 3.45Å; V67-W129 PolarHBondContact O-NE1 3.06Å; R69-W129 HydrophobicContact CB-CH2 4.01Å; R69-W129 HydrophobicContact CG-CH2 4.49Å; F74-W129 HydrophobicContact CD2-CH2 4.01Å; F74-W129 AromaticContact CD2-CZ2 3.83Å; F74-W129 HydrophobicContact CD2-CZ2 3.83Å; F74-W129 HydrophobicContact CE2-CD2 4.41Å; F74-W129 HydrophobicContact CE2-CE3 4.13Å; F74-W129 AromaticContact CE2-CH2 3.45Å; F74-W129 HydrophobicContact CE2-CH2 3.45Å; F74-W129 VanDerWaalsContact CE2-CH2 3.45Å; F74-W129 AromaticContact CE2-CZ2 3.74Å; F74-W129 HydrophobicContact CE2-CZ2 3.74Å; F74-W129 AromaticContact CE2-CZ3 3.67Å; F74-W129 HydrophobicContact CE2-CZ3 3.67Å; F74-W129 HydrophobicContact CZ-CH2 4.43Å; F74-W129 HydrophobicContact CZ-CZ3 4.46Å; L77-W129 HydrophobicContact CD1-CB 4.42Å; L77-W129 HydrophobicContact CD1-CD2 4.01Å; L77-W129 HydrophobicContact CD1-CG 3.77Å; A95-W129 HydrophobicContact CB-CE3 3.85Å; A95-W129 HydrophobicContact CB-CZ3 4.11Å; A95-W129 WeakPolarHBondContact CB-O 3.4Å; L98-W129 HydrophobicContact CB-CB 4.16Å; L98-W129 HydrophobicContact CB-CE3 4.25Å; L98-W129 HydrophobicContact CD1-CE3 3.69Å; L98-W129 HydrophobicContact CD1-CZ3 3.89Å; L98-W129 VanDerWaalsContact O-CB 3.23Å; L98-W129 WeakPolarHBondContact O-CB 3.39Å; W129-E131 HydrophobicContact CH2-CB 3.79Å; W129-E131 HydrophobicContact CH2-CG 4.44Å; W129-E131 WeakPolarHBondContact CH2-OE2 3.44Å; W129-E131 HydrophobicContact CZ2-CB 4.11Å; W129-E131 HydrophobicContact CZ3-CB 4.22Å; W129-H141 VanDerWaalsContact CA-O 3.31Å; W129-H141 WeakPolarHBondContact CA-O 3.42Å; W129-Y142 PolarHBondContact NE1-O 3.15Å
130	D	94.3	Very high	93.2	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	27%	0.269	C	S	.	.			trans	-98.5	128.4	-177.3	178.6	16.3	0	0	0	111.4	D132 G133 H134 H135 H141 Y142	D130-D132 PolarHBondContact OD1-N 2.95Å; D130-G133 PolarHBondContact OD1-N 2.92Å; D130-G133 PolarHBondContact OD2-N 3.29Å; D130-H134 IonicContact OD1-ND1 3.49Å; D130-H134 PolarHBondContact OD2-N 3.15Å; D130-H135 IonicContact OD2-CD2 3.36Å; D130-H135 PolarHBondContact OD2-CD2 2.72Å; D130-H135 IonicContact OD2-NE2 3.63Å; D130-H141 HydrophobicContact CB-CB 4.21Å; D130-H141 PolarHBondContact N-O 3.26Å; D130-Y142 HydrophobicContact CB-CD1 4.14Å; D130-Y142 HydrophobicContact CB-CE1 4.16Å; D130-Y142 WeakPolarHBondContact O-CD1 3.41Å; D130-Y142 VanDerWaalsContact OD2-CE1 3.29Å; D130-Y142 WeakPolarHBondContact OD2-CE1 3.37Å
131	E	88.7	Confident	93.4	Very high	55 Å²	55	43.2 Å²	43.2	26%	0.257	23%	0.228	S	C	.	.	S	Bend	trans	-102	-19.8	173.7	64.4	-171.9	159	0	0	114	K66 R69 W129	K66-E131 PolarHBondContact NZ-O 2.85Å; R69-E131 IonicContact CZ-OE1 2.8Å; R69-E131 IonicContact CZ-OE2 3.8Å; R69-E131 IonicContact NE-OE1 3.12Å; R69-E131 IonicContact NE-OE2 2.84Å; R69-E131 PolarHBondContact NE-OE2 3.43Å; R69-E131 VanDerWaalsContact NH2-CD 3.27Å; R69-E131 IonicContact NH2-OE1 3.87Å; R69-E131 PolarHBondContact NH2-OE1 3.06Å; R69-E131 IonicContact NH2-OE2 2.74Å; R69-E131 PolarHBondContact NH2-OE2 2.85Å; R69-E131 VanDerWaalsContact NH2-OE2 3.12Å; W129-E131 HydrophobicContact CH2-CB 3.79Å; W129-E131 HydrophobicContact CH2-CG 4.44Å; W129-E131 WeakPolarHBondContact CH2-OE2 3.44Å; W129-E131 HydrophobicContact CZ2-CB 4.11Å; W129-E131 HydrophobicContact CZ3-CB 4.22Å
132	D	85.6	Confident	93.3	Very high	99 Å²	99	43.1 Å²	43.1	53%	0.529	23%	0.226	S	C	.	.	S	Bend	trans	-89.7	-22.1	-167.6	-67.2	-32.3	0	0	0	113.3	D130 H134	D130-D132 PolarHBondContact OD1-N 2.95Å; D132-H134 WeakPolarHBondContact CB-CE1 3.47Å; D132-H134 IonicContact OD2-CE1 2.66Å
133	G	85.3	Confident	93.2	Very high	36 Å²	36	38.3 Å²	38.3	37%	0.371	21%	0.208	S	C	.	.			trans	94.3	33.4	173	0	0	0	0	0	114.2	D130 H135 Y142	D130-G133 PolarHBondContact OD1-N 2.92Å; D130-G133 PolarHBondContact OD2-N 3.29Å; G133-H135 PolarHBondContact O-N 2.81Å; G133-Y142 WeakPolarHBondContact CA-OH 3.36Å; G133-Y142 PolarHBondContact O-OH 3.4Å
134	H	85.4	Confident	93.1	Very high	127 Å²	127	38.3 Å²	38.3	59%	0.588	21%	0.208	S	C	*	.			trans	-77.5	-7.6	-177.5	-63.1	125.5	0	0	0	113.7	D130 D132	D130-H134 IonicContact OD1-ND1 3.49Å; D130-H134 PolarHBondContact OD2-N 3.15Å; D132-H134 WeakPolarHBondContact CB-CE1 3.47Å; D132-H134 IonicContact OD2-CE1 2.66Å
135	H	90.3	Very high	93	Very high	46 Å²	46	37 Å²	37	21%	0.213	20%	0.203	C	C	.	.	S	Bend	trans	-109.5	170.8	-177	-57	-80.7	0	0	0	113.8	E127 D130 G133 S139 H141 Y142	E127-H135 WeakPolarHBondContact CG-NE2 3.1Å; D130-H135 IonicContact OD2-CD2 3.36Å; D130-H135 PolarHBondContact OD2-CD2 2.72Å; D130-H135 IonicContact OD2-NE2 3.63Å; G133-H135 PolarHBondContact O-N 2.81Å; H135-S139 WeakPolarHBondContact CB-OG 3.46Å; H135-H141 AromaticContact CD2-CG 3.78Å; H135-H141 AromaticContact CE1-CD2 3.56Å; H135-H141 AromaticContact CE1-CE1 3.94Å; H135-H141 AromaticContact CE1-CG 3.68Å; H135-H141 AromaticContact CE1-ND1 3.93Å; H135-H141 AromaticContact CE1-NE2 3.78Å; H135-H141 AromaticContact ND1-CD2 3.79Å; H135-H141 AromaticContact NE2-CD2 3.74Å; H135-H141 AromaticContact NE2-CG 3.37Å; H135-H141 AromaticContact NE2-ND1 3.65Å; H135-Y142 VanDerWaalsContact C-OH 3.27Å; H135-Y142 WeakPolarHBondContact CA-OH 3.39Å; H135-Y142 HydrophobicContact CB-CE1 4.4Å; H135-Y142 HydrophobicContact CB-CE2 4.46Å; H135-Y142 PolarHBondContact N-OH 2.81Å; H135-Y142 PolarHBondContact O-OH 3.16Å
136	A	87.8	Confident	93	Very high	75 Å²	75	37 Å²	37	62%	0.62	20%	0.203	S	C	*	.			trans	-56.2	152	171	0	0	0	0	0	111.6	D138 S139 Y142	A136-D138 VanDerWaalsContact C-N 3.25Å; A136-D138 PolarHBondContact O-N 3.35Å; A136-S139 WeakPolarHBondContact O-CB 3.44Å; A136-S139 PolarHBondContact O-N 3.04Å; A136-Y142 WeakPolarHBondContact O-CE2 3.35Å
137	Q	83.8	Confident	93.1	Very high	174 Å²	174	36.1 Å²	36.1	81%	0.813	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-39.3	-170.7	-172.3	172.4	4	0	0	114.8
138	D	86.9	Confident	93.1	Very high	82 Å²	82	35.5 Å²	35.5	44%	0.439	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	33.9	-178.9	-55.8	-40.4	0	0	0	112.6	R55 A63 A136	R55-D138 PolarHBondContact NH1-O 3.2Å; A63-D138 HydrophobicContact CB-CB 4.37Å; A136-D138 VanDerWaalsContact C-N 3.25Å; A136-D138 PolarHBondContact O-N 3.35Å
139	S	95.9	Very high	93.2	Very high	12 Å²	12	35.5 Å²	35.5	8%	0.084	20%	0.195	C	C	.	.			trans	-69.7	136.3	178.3	-178.4	0	0	0	0	111.7	H135 A136 H141 Y142	H135-S139 WeakPolarHBondContact CB-OG 3.46Å; A136-S139 WeakPolarHBondContact O-CB 3.44Å; A136-S139 PolarHBondContact O-N 3.04Å; S139-H141 PolarHBondContact O-N 3.34Å; S139-H141 WeakPolarHBondContact OG-CB 3.35Å; S139-H141 PolarHBondContact OG-CD2 2.97Å; S139-H141 PolarHBondContact OG-N 3.36Å; S139-Y142 WeakPolarHBondContact O-CB 3.29Å; S139-Y142 PolarHBondContact O-N 3.17Å
140	L	97.2	Very high	93.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-73.2	-10.3	174.9	-64.5	-169	0	0	0	113.2	E54 A63 Y142 E143 G144 R145 A146	E54-L140 HydrophobicContact CG-CD1 4.12Å; E54-L140 WeakPolarHBondContact OE1-CD1 3.36Å; A63-L140 HydrophobicContact CB-CD2 4.13Å; L140-Y142 VanDerWaalsContact C-N 3.26Å; L140-Y142 PolarHBondContact O-N 3.13Å; L140-E143 PolarHBondContact O-N 2.86Å; L140-G144 PolarHBondContact O-N 3.09Å; L140-R145 HydrophobicContact CB-CB 4.1Å; L140-R145 PolarHBondContact O-N 3.41Å; L140-R145 VanDerWaalsContact O-N 3.07Å; L140-A146 HydrophobicContact CB-CB 3.92Å; L140-A146 PolarHBondContact O-N 3.48Å
141	H	97.9	Very high	93.5	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-60.5	-38.1	168.8	-74.9	-89.6	0	0	0	111.2	G128 W129 D130 H135 S139 E143 G144 D148 H183	G128-H141 PolarHBondContact O-ND1 3.07Å; W129-H141 VanDerWaalsContact CA-O 3.31Å; W129-H141 WeakPolarHBondContact CA-O 3.42Å; D130-H141 HydrophobicContact CB-CB 4.21Å; D130-H141 PolarHBondContact N-O 3.26Å; H135-H141 AromaticContact CD2-CG 3.78Å; H135-H141 AromaticContact CE1-CD2 3.56Å; H135-H141 AromaticContact CE1-CE1 3.94Å; H135-H141 AromaticContact CE1-CG 3.68Å; H135-H141 AromaticContact CE1-ND1 3.93Å; H135-H141 AromaticContact CE1-NE2 3.78Å; H135-H141 AromaticContact ND1-CD2 3.79Å; H135-H141 AromaticContact NE2-CD2 3.74Å; H135-H141 AromaticContact NE2-CG 3.37Å; H135-H141 AromaticContact NE2-ND1 3.65Å; S139-H141 PolarHBondContact O-N 3.34Å; S139-H141 WeakPolarHBondContact OG-CB 3.35Å; S139-H141 PolarHBondContact OG-CD2 2.97Å; S139-H141 PolarHBondContact OG-N 3.36Å; H141-E143 PolarHBondContact O-N 2.9Å; H141-G144 PolarHBondContact O-N 2.77Å; H141-D148 IonicContact CE1-OD1 3.63Å; H141-D148 IonicContact CE1-OD2 3.57Å; H141-D148 IonicContact NE2-OD1 3.74Å; H141-D148 IonicContact NE2-OD2 3.15Å; H141-H183 AromaticContact CD2-CE1 3.72Å; H141-H183 AromaticContact NE2-CE1 3.25Å; H141-H183 PolarHBondContact NE2-CE1 2.81Å; H141-H183 AromaticContact NE2-ND1 3.24Å; H141-H183 PolarHBondContact NE2-ND1 3.05Å
142	Y	96.8	Very high	93.9	Very high	16 Å²	16	34.6 Å²	34.6	6%	0.063	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-63.8	-10.1	177.4	-60.3	-35.5	0	0	0	114.4	K66 V67 W129 D130 G133 H135 A136 S139 L140	K66-Y142 HydrophobicContact CD-CD1 4.36Å; K66-Y142 HydrophobicContact CD-CG 4.27Å; K66-Y142 HydrophobicContact CG-CG 4.37Å; V67-Y142 WeakPolarHBondContact CB-O 3.47Å; V67-Y142 PolarHBondContact N-O 3.19Å; W129-Y142 PolarHBondContact NE1-O 3.15Å; D130-Y142 HydrophobicContact CB-CD1 4.14Å; D130-Y142 HydrophobicContact CB-CE1 4.16Å; D130-Y142 WeakPolarHBondContact O-CD1 3.41Å; D130-Y142 VanDerWaalsContact OD2-CE1 3.29Å; D130-Y142 WeakPolarHBondContact OD2-CE1 3.37Å; G133-Y142 WeakPolarHBondContact CA-OH 3.36Å; G133-Y142 PolarHBondContact O-OH 3.4Å; H135-Y142 VanDerWaalsContact C-OH 3.27Å; H135-Y142 WeakPolarHBondContact CA-OH 3.39Å; H135-Y142 HydrophobicContact CB-CE1 4.4Å; H135-Y142 HydrophobicContact CB-CE2 4.46Å; H135-Y142 PolarHBondContact N-OH 2.81Å; H135-Y142 PolarHBondContact O-OH 3.16Å; A136-Y142 WeakPolarHBondContact O-CE2 3.35Å; S139-Y142 WeakPolarHBondContact O-CB 3.29Å; S139-Y142 PolarHBondContact O-N 3.17Å; L140-Y142 VanDerWaalsContact C-N 3.26Å; L140-Y142 PolarHBondContact O-N 3.13Å
143	E	95.6	Very high	94.5	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.019	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-115	3.9	-179.7	-61.3	-175.1	-150.2	0	0	113	A63 E64 G65 V67 R73 L77 L140 H141 R145	A63-E143 VanDerWaalsContact C-OE1 3.27Å; A63-E143 WeakPolarHBondContact CA-OE1 3.5Å; A63-E143 VanDerWaalsContact CB-OE1 3.32Å; A63-E143 WeakPolarHBondContact CB-OE1 3.28Å; E64-E143 PolarHBondContact N-OE1 2.88Å; E64-E143 PolarHBondContact N-OE2 3.12Å; G65-E143 PolarHBondContact N-OE1 2.83Å; G65-E143 WeakPolarHBondContact O-CG 3.48Å; V67-E143 HydrophobicContact CG2-CB 4.38Å; V67-E143 HydrophobicContact CG2-CG 4.4Å; R73-E143 IonicContact NH2-OE2 2.77Å; R73-E143 PolarHBondContact NH2-OE2 3.1Å; L77-E143 WeakPolarHBondContact CD2-O 3.41Å; L140-E143 PolarHBondContact O-N 2.86Å; H141-E143 PolarHBondContact O-N 2.9Å; E143-R145 HydrophobicContact CB-CB 4.32Å; E143-R145 HydrophobicContact CB-CG 4.03Å; E143-R145 PolarHBondContact O-N 2.84Å; E143-R145 WeakPolarHBondContact OE2-CD 3.28Å; E143-R145 IonicContact OE2-CZ 3.67Å; E143-R145 IonicContact OE2-NH1 2.59Å; E143-R145 PolarHBondContact OE2-NH1 3.3Å
144	G	96.9	Very high	95.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	24.3	-174	0	0	0	0	0	112.8	M99 T100 L140 H141	M99-G144 CarbonylContact C-O 3.57Å; M99-G144 VanDerWaalsContact CA-O 3.26Å; M99-G144 WeakPolarHBondContact CA-O 3.22Å; T100-G144 PolarHBondContact N-O 3.49Å; L140-G144 PolarHBondContact O-N 3.09Å; H141-G144 PolarHBondContact O-N 2.77Å
145	R	97.4	Very high	95.7	Very high	4 Å²	4	36 Å²	36	2%	0.015	19%	0.186	C	C	.	.			trans	-104.2	-4.1	-177.8	-74.8	170.4	57.8	-164.4	-1.9	113	S60 P62 T100 L140 E143 S185 V186	S60-R145 PolarHBondContact O-NH2 3.22Å; P62-R145 PolarHBondContact O-NH1 3.11Å; P62-R145 PolarHBondContact O-NH2 3.09Å; T100-R145 HydrophobicContact CG2-CG 3.55Å; L140-R145 HydrophobicContact CB-CB 4.1Å; L140-R145 PolarHBondContact O-N 3.41Å; L140-R145 VanDerWaalsContact O-N 3.07Å; E143-R145 HydrophobicContact CB-CB 4.32Å; E143-R145 HydrophobicContact CB-CG 4.03Å; E143-R145 PolarHBondContact O-N 2.84Å; E143-R145 WeakPolarHBondContact OE2-CD 3.28Å; E143-R145 IonicContact OE2-CZ 3.67Å; E143-R145 IonicContact OE2-NH1 2.59Å; E143-R145 PolarHBondContact OE2-NH1 3.3Å; R145-S185 CarbonylContact O-C 3.45Å; R145-S185 WeakPolarHBondContact O-CA 3.09Å; R145-S185 WeakPolarHBondContact O-CB 3.45Å; R145-V186 HydrophobicContact CB-CG2 4.27Å; R145-V186 HydrophobicContact CG-CG2 4.45Å; R145-V186 PolarHBondContact NE-O 2.89Å; R145-V186 VanDerWaalsContact NE-O 3.12Å; R145-V186 PolarHBondContact NH2-O 2.9Å; R145-V186 WeakPolarHBondContact O-CG2 3.2Å; R145-V186 PolarHBondContact O-N 3.46Å
146	A	98.3	Very high	96	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.8	176.3	0	0	0	0	0	111.2	L140 V184	L140-A146 HydrophobicContact CB-CB 3.92Å; L140-A146 PolarHBondContact O-N 3.48Å; A146-V184 CarbonylContact C-O 3.54Å; A146-V184 WeakPolarHBondContact CA-O 3.14Å
147	L	98.6	Very high	96.5	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	143.5	174.4	-54.9	172.4	0	0	0	108.8	M99 V107 V125 E127 I149 V184	M99-L147 HydrophobicContact CE-CD1 4.43Å; M99-L147 HydrophobicContact CE-CD2 4.04Å; V107-L147 HydrophobicContact CB-CD1 3.82Å; V107-L147 HydrophobicContact CG1-CD1 4.4Å; V107-L147 HydrophobicContact CG2-CD1 3.57Å; V125-L147 HydrophobicContact CG1-CD2 4.2Å; V125-L147 HydrophobicContact CG2-CD1 4.41Å; E127-L147 CarbonylContact O-C 3.49Å; E127-L147 VanDerWaalsContact O-CA 3.31Å; E127-L147 WeakPolarHBondContact O-CA 3.15Å; L147-I149 HydrophobicContact CB-CG2 4.01Å; L147-V184 HydrophobicContact CB-CG2 3.88Å; L147-V184 PolarHBondContact N-O 3.38Å; L147-V184 WeakPolarHBondContact O-CG2 3.48Å; L147-V184 PolarHBondContact O-N 3.46Å
148	D	98.6	Very high	97.2	Very high	10 Å²	10	37.6 Å²	37.6	5%	0.053	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.5	162.7	-68.9	-24.4	0	0	0	109.2	V125 T126 E127 H141 H181 H183	V125-D148 WeakPolarHBondContact CA-O 3.1Å; T126-D148 PolarHBondContact N-O 3.21Å; T126-D148 WeakPolarHBondContact OG1-CB 3.46Å; T126-D148 PolarHBondContact OG1-O 3.29Å; T126-D148 VanDerWaalsContact OG1-O 3.04Å; E127-D148 HydrophobicContact CB-CB 3.84Å; E127-D148 PolarHBondContact O-N 2.87Å; H141-D148 IonicContact CE1-OD1 3.63Å; H141-D148 IonicContact CE1-OD2 3.57Å; H141-D148 IonicContact NE2-OD1 3.74Å; H141-D148 IonicContact NE2-OD2 3.15Å; D148-H181 HydrophobicContact CB-CB 4.16Å; D148-H181 VanDerWaalsContact CB-CD2 3.44Å; D148-H181 WeakPolarHBondContact CB-CD2 3.41Å; D148-H181 IonicContact OD1-CD2 2.73Å; D148-H181 PolarHBondContact OD1-CD2 3.3Å; D148-H181 VanDerWaalsContact OD1-CD2 3.23Å; D148-H181 IonicContact OD1-NE2 3.75Å; D148-H181 PolarHBondContact OD1-NE2 3.11Å; D148-H181 IonicContact OD2-CD2 3.71Å; D148-H181 PolarHBondContact OD2-CD2 3.33Å; D148-H181 IonicContact OD2-CE1 3.23Å; D148-H181 IonicContact OD2-NE2 3.36Å; D148-H181 PolarHBondContact OD2-NE2 3.29Å; D148-H181 VanDerWaalsContact OD2-NE2 3.13Å; D148-H183 IonicContact OD1-CG 3.4Å; D148-H183 IonicContact OD1-ND1 3.23Å; D148-H183 PolarHBondContact OD1-ND1 2.99Å; D148-H183 VanDerWaalsContact OD1-ND1 3.15Å
149	I	98.8	Very high	97.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.3	-169.6	62.1	166.5	0	0	0	113.2	L110 L123 R124 V125 L147 L162 A166 H181 V182 V184	L110-I149 HydrophobicContact CD2-CD1 3.44Å; L110-I149 VanDerWaalsContact CD2-CD1 3.44Å; L123-I149 HydrophobicContact CD1-CB 4.12Å; L123-I149 HydrophobicContact CD1-CD1 4.2Å; L123-I149 HydrophobicContact CD1-CG2 4.42Å; R124-I149 CarbonylContact O-C 3.44Å; R124-I149 WeakPolarHBondContact O-CA 3.36Å; V125-I149 HydrophobicContact CG2-CG2 4.18Å; L147-I149 HydrophobicContact CB-CG2 4.01Å; I149-L162 HydrophobicContact CD1-CD1 4.31Å; I149-L162 HydrophobicContact CD1-CD2 4.27Å; I149-L162 HydrophobicContact CD1-CG 4.12Å; I149-L162 HydrophobicContact CG1-CD2 4.26Å; I149-A166 HydrophobicContact CD1-CB 4.42Å; I149-H181 WeakPolarHBondContact O-CA 3.29Å; I149-V182 HydrophobicContact CG1-CB 3.99Å; I149-V182 HydrophobicContact CG1-CG1 4.49Å; I149-V182 VanDerWaalsContact CG1-O 3.25Å; I149-V182 WeakPolarHBondContact CG1-O 3.13Å; I149-V182 PolarHBondContact N-O 3.05Å; I149-V182 PolarHBondContact O-N 2.75Å; I149-V184 HydrophobicContact CD1-CG1 3.76Å; I149-V184 HydrophobicContact CD1-CG2 4.28Å; I149-V184 HydrophobicContact CG1-CG1 4.19Å; I149-V184 HydrophobicContact CG1-CG2 4.46Å; I149-V184 HydrophobicContact CG2-CG2 4.3Å
150	T	98.8	Very high	97.9	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	171.4	178.5	57.8	0	0	0	0	109.8	R124 T126 Y159 N180 H181	R124-T150 WeakPolarHBondContact CB-OG1 3.41Å; R124-T150 WeakPolarHBondContact CG-OG1 3.48Å; R124-T150 PolarHBondContact N-O 2.73Å; R124-T150 PolarHBondContact NH1-OG1 3.38Å; R124-T150 PolarHBondContact O-N 3.28Å; R124-T150 PolarHBondContact O-OG1 2.81Å; T126-T150 HydrophobicContact CG2-CG2 4.09Å; T150-Y159 WeakPolarHBondContact CB-OH 3.11Å; T150-Y159 HydrophobicContact CG2-CE1 4.42Å; T150-Y159 HydrophobicContact CG2-CE2 4.12Å; T150-Y159 WeakPolarHBondContact CG2-OH 3.08Å; T150-N180 WeakPolarHBondContact CG2-O 3.46Å; T150-H181 HydrophobicContact CG2-CB 4.06Å
151	T	98.6	Very high	97.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.3	161.6	54.6	0	0	0	0	110.1	W118 V121 D153 R154 K158 L162	W118-T151 HydrophobicContact CE3-CG2 4.34Å; W118-T151 HydrophobicContact CZ3-CG2 4.06Å; V121-T151 HydrophobicContact CG1-CG2 4.12Å; T151-D153 WeakPolarHBondContact CB-OD1 3.41Å; T151-D153 PolarHBondContact O-N 3.49Å; T151-D153 PolarHBondContact OG1-OD1 3.2Å; T151-R154 WeakPolarHBondContact O-CA 3.17Å; T151-R154 PolarHBondContact O-N 2.83Å; T151-K158 HydrophobicContact CG2-CB 3.99Å; T151-K158 HydrophobicContact CG2-CD 4.12Å; T151-L162 HydrophobicContact CG2-CD2 4.32Å
152	S	98.3	Very high	97.9	Very high	38 Å²	38	35.4 Å²	35.4	27%	0.266	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.1	179.8	47	0	0	0	0	114.4	R122 R154	R122-S152 WeakPolarHBondContact CA-OG 3.09Å; R122-S152 PolarHBondContact N-OG 2.77Å; R122-S152 VanDerWaalsContact O-CB 3.3Å; R122-S152 WeakPolarHBondContact O-CB 3.2Å; R122-S152 PolarHBondContact O-N 3.31Å; R122-S152 PolarHBondContact O-OG 2.81Å; S152-R154 PolarHBondContact O-N 3.38Å
153	D	98	Very high	98	Very high	71 Å²	71	34.6 Å²	34.6	38%	0.38	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-5.8	173.6	66.5	-5.6	0	0	0	113.6	T151 D155 K158	T151-D153 WeakPolarHBondContact CB-OD1 3.41Å; T151-D153 PolarHBondContact O-N 3.49Å; T151-D153 PolarHBondContact OG1-OD1 3.2Å; D153-D155 PolarHBondContact O-N 3.28Å; D153-D155 PolarHBondContact OD1-N 3.47Å; D153-K158 WeakPolarHBondContact OD2-CE 3.17Å; D153-K158 IonicContact OD2-NZ 3.89Å; D153-K158 PolarHBondContact OD2-NZ 3.32Å
154	R	97.9	Very high	98.1	Very high	171 Å²	171	36.5 Å²	36.5	65%	0.645	17%	0.171	S	C	*	.			trans	57.2	25.3	-179.8	-54	172.5	69.3	-176.8	2.8	113.7	T151 S152 R156	T151-R154 WeakPolarHBondContact O-CA 3.17Å; T151-R154 PolarHBondContact O-N 2.83Å; S152-R154 PolarHBondContact O-N 3.38Å; R154-R156 PolarHBondContact O-N 3.08Å
155	D	97.9	Very high	98.2	Very high	51 Å²	51	37 Å²	37	27%	0.273	17%	0.173	S	C	.	.			trans	-75.4	103.9	175.4	179.6	8.3	0	0	0	111.4	D153 N157 K158 Y159	D153-D155 PolarHBondContact O-N 3.28Å; D153-D155 PolarHBondContact OD1-N 3.47Å; D155-N157 PolarHBondContact O-N 2.74Å; D155-N157 VanDerWaalsContact O-N 3.14Å; D155-N157 VanDerWaalsContact OD1-CB 3.31Å; D155-N157 WeakPolarHBondContact OD1-CB 3.45Å; D155-N157 PolarHBondContact OD1-N 2.84Å; D155-N157 PolarHBondContact OD1-ND2 3.03Å; D155-K158 HydrophobicContact CB-CD 4.15Å; D155-K158 HydrophobicContact CB-CG 4.15Å; D155-K158 WeakPolarHBondContact O-CB 3.24Å; D155-K158 PolarHBondContact O-N 2.68Å; D155-K158 IonicContact OD2-NZ 2.79Å; D155-K158 PolarHBondContact OD2-NZ 2.97Å; D155-Y159 WeakPolarHBondContact O-CD1 3.48Å; D155-Y159 WeakPolarHBondContact O-CE1 3.2Å
156	R	97.1	Very high	98.2	Very high	143 Å²	143	36.8 Å²	36.8	54%	0.54	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-61	-22.9	-178.9	-62.5	177.7	174.8	162.3	-4.3	113.6	R154 K158 Y159 R179 N180	R154-R156 PolarHBondContact O-N 3.08Å; R156-K158 PolarHBondContact O-N 2.71Å; R156-Y159 HydrophobicContact CB-CD2 4.45Å; R156-Y159 HydrophobicContact CB-CE2 4.37Å; R156-Y159 HydrophobicContact CG-CD2 4.48Å; R156-Y159 HydrophobicContact CG-CE2 3.96Å; R156-Y159 PolarHBondContact O-N 3.36Å; R156-R179 VanDerWaalsContact CD-O 3.31Å; R156-R179 WeakPolarHBondContact CD-O 3.4Å; R156-R179 WeakPolarHBondContact CG-O 3.34Å; R156-R179 PolarHBondContact NE-O 3.37Å; R156-N180 PolarHBondContact NH2-OD1 3.19Å
157	N	97.3	Very high	98.2	Very high	146 Å²	146	38.3 Å²	38.3	78%	0.781	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-67.2	-22.4	176.9	-58.6	-54	0	0	0	111.8	D155	D155-N157 PolarHBondContact O-N 2.74Å; D155-N157 VanDerWaalsContact O-N 3.14Å; D155-N157 VanDerWaalsContact OD1-CB 3.31Å; D155-N157 WeakPolarHBondContact OD1-CB 3.45Å; D155-N157 PolarHBondContact OD1-N 2.84Å; D155-N157 PolarHBondContact OD1-ND2 3.03Å
158	K	98.3	Very high	97.9	Very high	38 Å²	38	42.2 Å²	42.2	17%	0.165	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-80	-17.4	177.7	-62.1	-175.1	176.4	83.1	0	113.1	W118 T151 D153 D155 R156 G160 L161 L162	W118-K158 HydrophobicContact CD2-CD 3.98Å; W118-K158 HydrophobicContact CG-CD 4.17Å; W118-K158 HydrophobicContact CH2-CB 4.04Å; W118-K158 HydrophobicContact CZ2-CB 3.72Å; W118-K158 HydrophobicContact CZ2-CD 4.21Å; W118-K158 HydrophobicContact CZ2-CG 4.01Å; T151-K158 HydrophobicContact CG2-CB 3.99Å; T151-K158 HydrophobicContact CG2-CD 4.12Å; D153-K158 WeakPolarHBondContact OD2-CE 3.17Å; D153-K158 IonicContact OD2-NZ 3.89Å; D153-K158 PolarHBondContact OD2-NZ 3.32Å; D155-K158 HydrophobicContact CB-CD 4.15Å; D155-K158 HydrophobicContact CB-CG 4.15Å; D155-K158 WeakPolarHBondContact O-CB 3.24Å; D155-K158 PolarHBondContact O-N 2.68Å; D155-K158 IonicContact OD2-NZ 2.79Å; D155-K158 PolarHBondContact OD2-NZ 2.97Å; R156-K158 PolarHBondContact O-N 2.71Å; K158-G160 PolarHBondContact O-N 3.46Å; K158-L161 CarbonylContact O-C 3.56Å; K158-L161 PolarHBondContact O-N 3.27Å; K158-L161 VanDerWaalsContact O-N 3.08Å; K158-L162 PolarHBondContact O-N 3.4Å
159	Y	98.5	Very high	97.6	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.02	20%	0.203	C	C	.	.	H	α-helix	trans	-67.9	-34.6	-165.9	-70.1	5.5	0	0	0	113.9	T150 D155 R156 L161 L162 A163 Y176 N180 V182	T150-Y159 WeakPolarHBondContact CB-OH 3.11Å; T150-Y159 HydrophobicContact CG2-CE1 4.42Å; T150-Y159 HydrophobicContact CG2-CE2 4.12Å; T150-Y159 WeakPolarHBondContact CG2-OH 3.08Å; D155-Y159 WeakPolarHBondContact O-CD1 3.48Å; D155-Y159 WeakPolarHBondContact O-CE1 3.2Å; R156-Y159 HydrophobicContact CB-CD2 4.45Å; R156-Y159 HydrophobicContact CB-CE2 4.37Å; R156-Y159 HydrophobicContact CG-CD2 4.48Å; R156-Y159 HydrophobicContact CG-CE2 3.96Å; R156-Y159 PolarHBondContact O-N 3.36Å; Y159-L161 VanDerWaalsContact C-N 3.29Å; Y159-L161 PolarHBondContact O-N 2.91Å; Y159-L162 HydrophobicContact CD1-CD2 4.36Å; Y159-L162 WeakPolarHBondContact O-CB 3.48Å; Y159-L162 PolarHBondContact O-N 2.9Å; Y159-A163 WeakPolarHBondContact O-CB 3.31Å; Y159-A163 PolarHBondContact O-N 2.91Å; Y159-Y176 WeakPolarHBondContact CB-OH 3.29Å; Y159-Y176 HydrophobicContact CD2-CE1 4.26Å; Y159-N180 WeakPolarHBondContact CE2-O 3.36Å; Y159-V182 WeakPolarHBondContact O-CG2 3.27Å
160	G	98.1	Very high	97.2	Very high	8 Å²	8	43.5 Å²	43.5	8%	0.082	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-40.2	173.6	0	0	0	0	0	111.9	P42 L43 K158 R164	P42-G160 CarbonylContact C-O 3.43Å; P42-G160 WeakPolarHBondContact CA-O 3.33Å; L43-G160 PolarHBondContact N-O 3.39Å; L43-G160 WeakPolarHBondContact O-CA 3.46Å; K158-G160 PolarHBondContact O-N 3.46Å; G160-R164 PolarHBondContact O-N 3.31Å
161	L	98.2	Very high	97.1	Very high	36 Å²	36	44 Å²	44	19%	0.188	22%	0.216	C	C	.	.	H	α-helix	trans	-76.4	-35.4	176.9	-174.9	57.1	0	0	0	111.7	L40 P42 M117 W118 K158 Y159 A163 R164 L165	L40-L161 HydrophobicContact CB-CD1 3.91Å; P42-L161 HydrophobicContact CG-CB 4.35Å; P42-L161 HydrophobicContact CG-CD1 4.47Å; M117-L161 HydrophobicContact CE-CD2 4.27Å; M117-L161 HydrophobicContact CG-CD2 4.11Å; M117-L161 HydrophobicContact SD-CD2 3.93Å; W118-L161 HydrophobicContact CH2-CB 4.19Å; W118-L161 HydrophobicContact CH2-CD2 4.45Å; W118-L161 HydrophobicContact CH2-CG 4.18Å; W118-L161 HydrophobicContact CZ2-CB 3.96Å; W118-L161 HydrophobicContact CZ2-CD2 3.73Å; W118-L161 HydrophobicContact CZ2-CG 3.92Å; K158-L161 CarbonylContact O-C 3.56Å; K158-L161 PolarHBondContact O-N 3.27Å; K158-L161 VanDerWaalsContact O-N 3.08Å; Y159-L161 VanDerWaalsContact C-N 3.29Å; Y159-L161 PolarHBondContact O-N 2.91Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.33Å; L161-R164 HydrophobicContact CD1-CB 4.38Å; L161-R164 WeakPolarHBondContact O-CB 3.23Å; L161-R164 PolarHBondContact O-N 3.47Å; L161-R164 VanDerWaalsContact O-N 3.12Å; L161-L165 WeakPolarHBondContact O-CG 3.33Å; L161-L165 PolarHBondContact O-N 3.11Å
162	L	98.6	Very high	97	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.8	-45.5	172	176	63.9	0	0	0	110.7	L110 V114 W118 L123 I149 T151 K158 Y159 R164 L165 A166	L110-L162 HydrophobicContact CD1-CD1 4.49Å; V114-L162 HydrophobicContact CG2-CD1 3.51Å; W118-L162 HydrophobicContact CH2-CB 4.22Å; L123-L162 HydrophobicContact CD1-CD1 3.94Å; I149-L162 HydrophobicContact CD1-CD1 4.31Å; I149-L162 HydrophobicContact CD1-CD2 4.27Å; I149-L162 HydrophobicContact CD1-CG 4.12Å; I149-L162 HydrophobicContact CG1-CD2 4.26Å; T151-L162 HydrophobicContact CG2-CD2 4.32Å; K158-L162 PolarHBondContact O-N 3.4Å; Y159-L162 HydrophobicContact CD1-CD2 4.36Å; Y159-L162 WeakPolarHBondContact O-CB 3.48Å; Y159-L162 PolarHBondContact O-N 2.9Å; L162-R164 VanDerWaalsContact C-N 3.32Å; L162-R164 PolarHBondContact O-N 2.97Å; L162-L165 WeakPolarHBondContact O-CB 3.48Å; L162-L165 PolarHBondContact O-N 3.26Å; L162-L165 VanDerWaalsContact O-N 3.15Å; L162-A166 PolarHBondContact O-N 2.86Å
163	A	98.5	Very high	97	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-40.3	176.1	0	0	0	0	0	111.6	L43 Y159 L161 L165 A166 V167 V174 V182	L43-A163 HydrophobicContact CB-CB 3.97Å; L43-A163 HydrophobicContact CD1-CB 4.4Å; L43-A163 HydrophobicContact CD2-CB 3.92Å; L43-A163 HydrophobicContact CG-CB 4.31Å; Y159-A163 WeakPolarHBondContact O-CB 3.31Å; Y159-A163 PolarHBondContact O-N 2.91Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.33Å; A163-L165 VanDerWaalsContact C-N 3.35Å; A163-L165 PolarHBondContact O-N 2.79Å; A163-A166 WeakPolarHBondContact O-CB 2.86Å; A163-A166 PolarHBondContact O-N 3.03Å; A163-V167 PolarHBondContact O-N 2.93Å; A163-V167 VanDerWaalsContact O-N 3.09Å; A163-V174 HydrophobicContact CB-CG1 3.94Å; A163-V182 HydrophobicContact CB-CB 4.39Å; A163-V182 HydrophobicContact CB-CG1 3.57Å; A163-V182 HydrophobicContact CB-CG2 3.9Å
164	R	98.2	Very high	97	Very high	43 Å²	43	40.8 Å²	40.8	16%	0.162	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-40.5	173.9	175	56.3	63.7	-167.1	-0.8	111.8	L40 V41 L43 G160 L161 L162 A166 V167 E168	L40-R164 HydrophobicContact CB-CG 3.95Å; L40-R164 HydrophobicContact CD2-CG 3.97Å; V41-R164 WeakPolarHBondContact O-CB 3.18Å; V41-R164 WeakPolarHBondContact O-CG 3.44Å; V41-R164 PolarHBondContact O-NE 2.79Å; V41-R164 PolarHBondContact O-NH2 3.27Å; L43-R164 HydrophobicContact CD1-CB 3.98Å; G160-R164 PolarHBondContact O-N 3.31Å; L161-R164 HydrophobicContact CD1-CB 4.38Å; L161-R164 WeakPolarHBondContact O-CB 3.23Å; L161-R164 PolarHBondContact O-N 3.47Å; L161-R164 VanDerWaalsContact O-N 3.12Å; L162-R164 VanDerWaalsContact C-N 3.32Å; L162-R164 PolarHBondContact O-N 2.97Å; R164-A166 VanDerWaalsContact C-N 3.28Å; R164-A166 PolarHBondContact O-N 3.47Å; R164-V167 WeakPolarHBondContact O-CB 3.03Å; R164-V167 PolarHBondContact O-N 3.36Å; R164-E168 PolarHBondContact O-N 3.22Å; R164-E168 VanDerWaalsContact O-N 3.1Å
165	L	97.9	Very high	97.1	Very high	11 Å²	11	34.8 Å²	34.8	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-37.8	174.8	-67.9	175.2	0	0	0	111.4	L40 L110 A113 V114 M117 W118 L161 L162 A163 V167 E168 A169	L40-L165 HydrophobicContact CD1-CD2 3.88Å; L110-L165 HydrophobicContact CD1-CB 3.62Å; A113-L165 HydrophobicContact CB-CD2 4.38Å; V114-L165 HydrophobicContact CG2-CD1 4.36Å; M117-L165 HydrophobicContact CB-CD1 3.87Å; M117-L165 HydrophobicContact CE-CD2 3.95Å; M117-L165 HydrophobicContact CG-CD1 4.09Å; W118-L165 HydrophobicContact CH2-CD1 3.94Å; W118-L165 HydrophobicContact CZ3-CD1 3.73Å; L161-L165 WeakPolarHBondContact O-CG 3.33Å; L161-L165 PolarHBondContact O-N 3.11Å; L162-L165 WeakPolarHBondContact O-CB 3.48Å; L162-L165 PolarHBondContact O-N 3.26Å; L162-L165 VanDerWaalsContact O-N 3.15Å; A163-L165 VanDerWaalsContact C-N 3.35Å; A163-L165 PolarHBondContact O-N 2.79Å; L165-V167 VanDerWaalsContact C-N 3.34Å; L165-V167 PolarHBondContact O-N 3.31Å; L165-E168 CarbonylContact O-C 3.49Å; L165-E168 PolarHBondContact O-N 3Å; L165-A169 WeakPolarHBondContact O-CB 3.2Å; L165-A169 PolarHBondContact O-N 2.9Å
166	A	98.3	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-40.8	174.7	0	0	0	0	0	112.1	L110 I149 L162 A163 R164 E168 A169 G170 F171 V174 V184	L110-A166 HydrophobicContact CD1-CB 4.32Å; L110-A166 HydrophobicContact CD2-CB 3.86Å; I149-A166 HydrophobicContact CD1-CB 4.42Å; L162-A166 PolarHBondContact O-N 2.86Å; A163-A166 WeakPolarHBondContact O-CB 2.86Å; A163-A166 PolarHBondContact O-N 3.03Å; R164-A166 VanDerWaalsContact C-N 3.28Å; R164-A166 PolarHBondContact O-N 3.47Å; A166-E168 VanDerWaalsContact C-N 3.35Å; A166-E168 PolarHBondContact O-N 2.81Å; A166-A169 PolarHBondContact O-N 3.12Å; A166-G170 PolarHBondContact O-N 2.97Å; A166-F171 HydrophobicContact CB-CD2 3.93Å; A166-F171 HydrophobicContact CB-CE2 4.46Å; A166-F171 WeakPolarHBondContact O-CD2 3.37Å; A166-F171 PolarHBondContact O-N 3.02Å; A166-V174 HydrophobicContact CB-CG1 4.19Å; A166-V174 HydrophobicContact CB-CG2 3.84Å; A166-V184 HydrophobicContact CB-CG1 3.7Å
167	V	97.3	Very high	97	Very high	31 Å²	31	29.2 Å²	29.2	19%	0.188	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-46.3	173.6	174.4	0	0	0	0	110.8	L43 V49 A163 R164 L165 A169 G170 V174	L43-V167 HydrophobicContact CD1-CG2 4.41Å; V49-V167 HydrophobicContact CB-CG2 3.92Å; V49-V167 HydrophobicContact CG1-CG1 4.02Å; V49-V167 HydrophobicContact CG1-CG2 3.97Å; A163-V167 PolarHBondContact O-N 2.93Å; A163-V167 VanDerWaalsContact O-N 3.09Å; R164-V167 WeakPolarHBondContact O-CB 3.03Å; R164-V167 PolarHBondContact O-N 3.36Å; L165-V167 VanDerWaalsContact C-N 3.34Å; L165-V167 PolarHBondContact O-N 3.31Å; V167-A169 VanDerWaalsContact C-N 3.33Å; V167-A169 PolarHBondContact O-N 3.01Å; V167-G170 PolarHBondContact O-N 2.8Å; V167-G170 VanDerWaalsContact O-N 3.11Å; V167-V174 HydrophobicContact CG2-CB 3.8Å; V167-V174 HydrophobicContact CG2-CG1 4.25Å; V167-V174 HydrophobicContact CG2-CG2 3.73Å
168	E	93	Very high	96.9	Very high	82 Å²	82	23.4 Å²	23.4	38%	0.383	12%	0.121	S	C	.	.	H	α-helix	trans	-72.9	-24.4	179.7	-60	-61.7	137.7	0	0	113.1	K38 L40 R164 L165 A166 G170	K38-E168 VanDerWaalsContact NZ-CD 3.25Å; K38-E168 IonicContact NZ-OE1 2.78Å; K38-E168 PolarHBondContact NZ-OE1 3.31Å; K38-E168 IonicContact NZ-OE2 2.87Å; K38-E168 PolarHBondContact NZ-OE2 3.03Å; L40-E168 HydrophobicContact CD2-CG 3.68Å; R164-E168 PolarHBondContact O-N 3.22Å; R164-E168 VanDerWaalsContact O-N 3.1Å; L165-E168 CarbonylContact O-C 3.49Å; L165-E168 PolarHBondContact O-N 3Å; A166-E168 VanDerWaalsContact C-N 3.35Å; A166-E168 PolarHBondContact O-N 2.81Å; E168-G170 PolarHBondContact O-N 3.05Å
169	A	92.1	Very high	96.7	Very high	14 Å²	14	28.2 Å²	28.2	12%	0.116	14%	0.138	C	C	.	.	H	α-helix	trans	-70.3	-12.8	170.5	0	0	0	0	0	112.5	R106 A109 L110 L165 A166 V167 F171	R106-A169 VanDerWaalsContact CD-O 3.3Å; R106-A169 WeakPolarHBondContact CD-O 3.29Å; A109-A169 HydrophobicContact CB-CB 4.39Å; L110-A169 HydrophobicContact CB-CB 3.84Å; L110-A169 HydrophobicContact CD1-CB 4.32Å; L165-A169 WeakPolarHBondContact O-CB 3.2Å; L165-A169 PolarHBondContact O-N 2.9Å; A166-A169 PolarHBondContact O-N 3.12Å; V167-A169 VanDerWaalsContact C-N 3.33Å; V167-A169 PolarHBondContact O-N 3.01Å; A169-F171 HydrophobicContact CB-CD2 4.39Å
170	G	90.1	Very high	96.6	Very high	23 Å²	23	32.4 Å²	32.4	24%	0.237	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	26.2	172.9	0	0	0	0	0	114.4	R106 A166 V167 E168	R106-G170 VanDerWaalsContact CD-O 3.22Å; R106-G170 WeakPolarHBondContact CD-O 3.38Å; R106-G170 PolarHBondContact NE-O 2.59Å; R106-G170 VanDerWaalsContact NE-O 3.09Å; A166-G170 PolarHBondContact O-N 2.97Å; V167-G170 PolarHBondContact O-N 2.8Å; V167-G170 VanDerWaalsContact O-N 3.11Å; E168-G170 PolarHBondContact O-N 3.05Å
171	F	97.5	Very high	96.6	Very high	12 Å²	12	33.4 Å²	33.4	5%	0.053	16%	0.163	C	C	.	.			trans	-59.1	139.8	162.9	-78.7	-86.8	0	0	0	109.7	R106 V107 L110 A166 A169 W173 V174 V184 V186	R106-F171 HydrophobicContact CB-CD1 4.03Å; R106-F171 HydrophobicContact CB-CD2 3.87Å; R106-F171 HydrophobicContact CB-CE1 3.83Å; R106-F171 HydrophobicContact CB-CE2 3.66Å; R106-F171 HydrophobicContact CB-CG 4.06Å; R106-F171 HydrophobicContact CB-CZ 3.65Å; V107-F171 HydrophobicContact CB-CZ 4Å; V107-F171 HydrophobicContact CG2-CZ 4.47Å; L110-F171 HydrophobicContact CB-CE2 4.12Å; L110-F171 HydrophobicContact CD2-CE2 3.8Å; A166-F171 HydrophobicContact CB-CD2 3.93Å; A166-F171 HydrophobicContact CB-CE2 4.46Å; A166-F171 WeakPolarHBondContact O-CD2 3.37Å; A166-F171 PolarHBondContact O-N 3.02Å; A169-F171 HydrophobicContact CB-CD2 4.39Å; F171-W173 VanDerWaalsContact C-N 3.32Å; F171-V174 HydrophobicContact CB-CG2 3.72Å; F171-V184 HydrophobicContact CB-CB 4.42Å; F171-V184 HydrophobicContact CD1-CB 3.59Å; F171-V184 HydrophobicContact CD1-CG2 3.74Å; F171-V184 HydrophobicContact CD2-CB 4.38Å; F171-V184 HydrophobicContact CE1-CB 3.83Å; F171-V184 HydrophobicContact CE1-CG2 3.4Å; F171-V184 HydrophobicContact CE2-CG2 4.31Å; F171-V184 HydrophobicContact CG-CB 3.88Å; F171-V184 HydrophobicContact CG-CG1 4.43Å; F171-V184 HydrophobicContact CG-CG2 4.32Å; F171-V184 HydrophobicContact CZ-CB 4.32Å; F171-V184 HydrophobicContact CZ-CG2 3.7Å; F171-V186 HydrophobicContact CD1-CG1 3.73Å; F171-V186 HydrophobicContact CE1-CG1 4.15Å
172	D	95.5	Very high	96.6	Very high	25 Å²	25	31.7 Å²	31.7	13%	0.134	16%	0.155	C	C	.	.	S	Bend	trans	-76.6	-25.7	-174.3	-62.6	-70.4	0	0	0	111.8	P50 R102 S185 V186 K187	P50-D172 WeakPolarHBondContact CD-O 3.21Å; R102-D172 IonicContact CZ-OD1 3.81Å; R102-D172 IonicContact CZ-OD2 2.74Å; R102-D172 IonicContact NE-OD1 3.85Å; R102-D172 IonicContact NE-OD2 2.72Å; R102-D172 PolarHBondContact NE-OD2 3.24Å; R102-D172 IonicContact NH2-OD1 2.64Å; R102-D172 PolarHBondContact NH2-OD1 2.82Å; R102-D172 IonicContact NH2-OD2 3.58Å; R102-D172 PolarHBondContact NH2-OD2 2.74Å; D172-S185 PolarHBondContact N-O 3.29Å; D172-V186 VanDerWaalsContact OD2-CA 3.25Å; D172-V186 WeakPolarHBondContact OD2-CA 3.29Å; D172-V186 WeakPolarHBondContact OD2-CB 3.41Å; D172-K187 HydrophobicContact CB-CG 4.03Å; D172-K187 PolarHBondContact OD2-N 3.29Å
173	W	98.4	Very high	96.6	Very high	17 Å²	17	32.2 Å²	32.2	6%	0.064	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	137.3	170.8	-161.6	77.4	0	0	0	110.7	F48 P50 V52 E54 A59 S60 F171 Y175 H183 V184 S185	F48-W173 HydrophobicContact CB-CH2 4.09Å; F48-W173 HydrophobicContact CB-CZ2 3.4Å; F48-W173 VanDerWaalsContact CB-CZ2 3.4Å; F48-W173 HydrophobicContact CD1-CZ2 4.31Å; F48-W173 AromaticContact CD2-CE2 3.99Å; F48-W173 AromaticContact CD2-CZ2 3.77Å; F48-W173 HydrophobicContact CD2-CZ2 3.77Å; F48-W173 AromaticContact CD2-NE1 3.69Å; F48-W173 HydrophobicContact CG-CH2 4.48Å; F48-W173 AromaticContact CG-CZ2 3.57Å; F48-W173 HydrophobicContact CG-CZ2 3.57Å; P50-W173 PolarHBondContact O-NE1 2.88Å; V52-W173 PolarHBondContact O-NE1 2.74Å; E54-W173 HydrophobicContact CB-CD2 3.67Å; E54-W173 HydrophobicContact CB-CE3 3.69Å; E54-W173 HydrophobicContact CB-CG 4.25Å; E54-W173 HydrophobicContact CB-CH2 3.98Å; E54-W173 HydrophobicContact CB-CZ2 3.98Å; E54-W173 HydrophobicContact CB-CZ3 3.82Å; E54-W173 HydrophobicContact CG-CB 4.42Å; E54-W173 HydrophobicContact CG-CD2 3.82Å; E54-W173 HydrophobicContact CG-CE3 3.57Å; E54-W173 HydrophobicContact CG-CG 4.21Å; E54-W173 HydrophobicContact CG-CZ3 4.01Å; A59-W173 HydrophobicContact CB-CB 4.12Å; A59-W173 VanDerWaalsContact CB-CD1 3.43Å; A59-W173 HydrophobicContact CB-CG 4.03Å; S60-W173 VanDerWaalsContact OG-CB 3.25Å; S60-W173 WeakPolarHBondContact OG-CB 3.29Å; F171-W173 VanDerWaalsContact C-N 3.32Å; W173-Y175 AromaticContact CH2-CD1 3.59Å; W173-Y175 HydrophobicContact CH2-CD1 3.59Å; W173-Y175 HydrophobicContact CH2-CD2 4.43Å; W173-Y175 HydrophobicContact CH2-CE1 4.46Å; W173-Y175 AromaticContact CH2-CG 3.57Å; W173-Y175 HydrophobicContact CH2-CG 3.57Å; W173-Y175 HydrophobicContact CZ2-CG 4.37Å; W173-Y175 AromaticContact CZ3-CD1 3.87Å; W173-Y175 HydrophobicContact CZ3-CD1 3.87Å; W173-Y175 AromaticContact CZ3-CG 3.9Å; W173-Y175 HydrophobicContact CZ3-CG 3.9Å; W173-H183 AromaticContact CE3-CD2 3.83Å; W173-H183 AromaticContact CZ3-CD2 3.63Å; W173-V184 WeakPolarHBondContact O-CA 3.34Å; W173-S185 PolarHBondContact N-O 2.71Å; W173-S185 VanDerWaalsContact N-O 3.16Å; W173-S185 PolarHBondContact O-N 2.95Å
174	V	98.8	Very high	96.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	130.5	178.6	177.8	0	0	0	0	108.5	L43 F48 V49 A163 A166 V167 F171 V182 V184	L43-V174 HydrophobicContact CD2-CG1 4.05Å; F48-V174 CarbonylContact C-O 3.56Å; F48-V174 WeakPolarHBondContact CA-O 3.5Å; F48-V174 WeakPolarHBondContact CB-O 3.43Å; V49-V174 PolarHBondContact N-O 2.81Å; V49-V174 PolarHBondContact O-N 2.78Å; A163-V174 HydrophobicContact CB-CG1 3.94Å; A166-V174 HydrophobicContact CB-CG1 4.19Å; A166-V174 HydrophobicContact CB-CG2 3.84Å; V167-V174 HydrophobicContact CG2-CB 3.8Å; V167-V174 HydrophobicContact CG2-CG1 4.25Å; V167-V174 HydrophobicContact CG2-CG2 3.73Å; F171-V174 HydrophobicContact CB-CG2 3.72Å; V174-V182 HydrophobicContact CG1-CG1 3.86Å; V174-V184 HydrophobicContact CB-CG1 4.49Å; V174-V184 HydrophobicContact CG1-CG1 4.09Å; V174-V184 HydrophobicContact CG2-CG1 4.09Å
175	Y	98.5	Very high	96.6	Very high	45 Å²	45	30.1 Å²	30.1	18%	0.176	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	123.5	-179	174.9	-145.1	0	0	0	110.7	K46 F48 W173 E177 H183	K46-Y175 HydrophobicContact CD-CE2 4.28Å; K46-Y175 WeakPolarHBondContact CD-OH 3.41Å; K46-Y175 WeakPolarHBondContact O-CE2 3.24Å; F48-Y175 HydrophobicContact CB-CD2 3.78Å; F48-Y175 HydrophobicContact CB-CG 4.13Å; F48-Y175 HydrophobicContact CD1-CD2 4.12Å; F48-Y175 HydrophobicContact CD1-CE2 4.26Å; F48-Y175 HydrophobicContact CG-CD2 4.44Å; W173-Y175 AromaticContact CH2-CD1 3.59Å; W173-Y175 HydrophobicContact CH2-CD1 3.59Å; W173-Y175 HydrophobicContact CH2-CD2 4.43Å; W173-Y175 HydrophobicContact CH2-CE1 4.46Å; W173-Y175 AromaticContact CH2-CG 3.57Å; W173-Y175 HydrophobicContact CH2-CG 3.57Å; W173-Y175 HydrophobicContact CZ2-CG 4.37Å; W173-Y175 AromaticContact CZ3-CD1 3.87Å; W173-Y175 HydrophobicContact CZ3-CD1 3.87Å; W173-Y175 AromaticContact CZ3-CG 3.9Å; W173-Y175 HydrophobicContact CZ3-CG 3.9Å; Y175-E177 HydrophobicContact CD1-CB 3.48Å; Y175-E177 VanDerWaalsContact CD1-CB 3.48Å; Y175-E177 HydrophobicContact CD1-CG 3.92Å; Y175-E177 HydrophobicContact CE1-CB 3.53Å; Y175-E177 HydrophobicContact CE1-CG 3.52Å; Y175-E177 HydrophobicContact CG-CB 4.1Å; Y175-E177 PolarHBondContact O-N 2.85Å; Y175-H183 PolarHBondContact N-O 3.39Å; Y175-H183 PolarHBondContact O-N 2.67Å
176	Y	98.3	Very high	96.5	Very high	14 Å²	14	29.6 Å²	29.6	6%	0.055	15%	0.146	C	C	.	.			trans	-77.1	73	169.3	-165.2	1.5	0	0	0	109.4	L44 K46 Q47 Y159 S178 V182	L44-Y176 WeakPolarHBondContact O-CD2 3.21Å; K46-Y176 WeakPolarHBondContact CA-O 3.47Å; K46-Y176 PolarHBondContact N-O 3Å; Q47-Y176 PolarHBondContact O-N 3.17Å; Y159-Y176 WeakPolarHBondContact CB-OH 3.29Å; Y159-Y176 HydrophobicContact CD2-CE1 4.26Å; Y176-S178 WeakPolarHBondContact CD1-O 3.39Å; Y176-S178 WeakPolarHBondContact CE1-O 3.39Å; Y176-V182 HydrophobicContact CD1-CG2 3.99Å; Y176-V182 HydrophobicContact CE1-CG2 4.35Å
177	E	94.8	Very high	96.2	Very high	64 Å²	64	31.4 Å²	31.4	30%	0.299	15%	0.154	S	C	.	.			trans	-65.4	-49.8	-167.2	178.6	174.1	-142	0	0	112.8	K46 Y175 H181 H183	K46-E177 WeakPolarHBondContact CD-O 3.43Å; K46-E177 VanDerWaalsContact CE-O 3.25Å; K46-E177 WeakPolarHBondContact CE-O 3.42Å; K46-E177 PolarHBondContact NZ-O 3.18Å; Y175-E177 HydrophobicContact CD1-CB 3.48Å; Y175-E177 VanDerWaalsContact CD1-CB 3.48Å; Y175-E177 HydrophobicContact CD1-CG 3.92Å; Y175-E177 HydrophobicContact CE1-CB 3.53Å; Y175-E177 HydrophobicContact CE1-CG 3.52Å; Y175-E177 HydrophobicContact CG-CB 4.1Å; Y175-E177 PolarHBondContact O-N 2.85Å; E177-H181 IonicContact OE2-CD2 2.71Å; E177-H181 IonicContact OE2-CE1 2.68Å; E177-H181 IonicContact OE2-NE2 3.73Å; E177-H181 PolarHBondContact OE2-NE2 3.16Å; E177-H183 HydrophobicContact CB-CB 3.98Å
178	S	95.6	Very high	95.6	Very high	23 Å²	23	30.2 Å²	30.2	16%	0.161	15%	0.148	C	C	.	.			trans	-133.7	169.1	-171.9	92.7	0	0	0	0	110.3	Y176 N180 H181	Y176-S178 WeakPolarHBondContact CD1-O 3.39Å; Y176-S178 WeakPolarHBondContact CE1-O 3.39Å; S178-N180 PolarHBondContact O-N 2.8Å; S178-N180 WeakPolarHBondContact OG-CB 3.34Å; S178-N180 PolarHBondContact OG-N 2.83Å; S178-H181 PolarHBondContact N-O 2.78Å; S178-H181 PolarHBondContact OG-CE1 2.91Å; S178-H181 PolarHBondContact OG-N 3.43Å; S178-H181 VanDerWaalsContact OG-N 3.14Å; S178-H181 PolarHBondContact OG-ND1 3.03Å
179	R	94.3	Very high	94.6	Very high	140 Å²	140	27.5 Å²	27.5	53%	0.528	14%	0.136	S	C	.	.	S	Bend	trans	-73.7	-7.5	171.2	-65	-64.6	-171.5	151.6	3.4	112.7	Y45 R156	Y45-R179 HydrophobicContact CD2-CG 4.43Å; Y45-R179 HydrophobicContact CE2-CG 3.93Å; R156-R179 VanDerWaalsContact CD-O 3.31Å; R156-R179 WeakPolarHBondContact CD-O 3.4Å; R156-R179 WeakPolarHBondContact CG-O 3.34Å; R156-R179 PolarHBondContact NE-O 3.37Å
180	N	96.1	Very high	93	Very high	92 Å²	92	28.6 Å²	28.6	49%	0.492	14%	0.139	S	C	.	.	S	Bend	trans	-103.6	-19.1	-174.3	-65.5	-35.2	0	0	0	113	T150 R156 Y159 S178	T150-N180 WeakPolarHBondContact CG2-O 3.46Å; R156-N180 PolarHBondContact NH2-OD1 3.19Å; Y159-N180 WeakPolarHBondContact CE2-O 3.36Å; S178-N180 PolarHBondContact O-N 2.8Å; S178-N180 WeakPolarHBondContact OG-CB 3.34Å; S178-N180 PolarHBondContact OG-N 2.83Å
181	H	98	Very high	91.2	Very high	30 Å²	30	28.8 Å²	28.8	14%	0.139	14%	0.137	C	C	.	.			trans	-162.7	165.8	-179.2	64.8	-87.2	0	0	0	112.1	D148 I149 T150 E177 S178	D148-H181 HydrophobicContact CB-CB 4.16Å; D148-H181 VanDerWaalsContact CB-CD2 3.44Å; D148-H181 WeakPolarHBondContact CB-CD2 3.41Å; D148-H181 IonicContact OD1-CD2 2.73Å; D148-H181 PolarHBondContact OD1-CD2 3.3Å; D148-H181 VanDerWaalsContact OD1-CD2 3.23Å; D148-H181 IonicContact OD1-NE2 3.75Å; D148-H181 PolarHBondContact OD1-NE2 3.11Å; D148-H181 IonicContact OD2-CD2 3.71Å; D148-H181 PolarHBondContact OD2-CD2 3.33Å; D148-H181 IonicContact OD2-CE1 3.23Å; D148-H181 IonicContact OD2-NE2 3.36Å; D148-H181 PolarHBondContact OD2-NE2 3.29Å; D148-H181 VanDerWaalsContact OD2-NE2 3.13Å; I149-H181 WeakPolarHBondContact O-CA 3.29Å; T150-H181 HydrophobicContact CG2-CB 4.06Å; E177-H181 IonicContact OE2-CD2 2.71Å; E177-H181 IonicContact OE2-CE1 2.68Å; E177-H181 IonicContact OE2-NE2 3.73Å; E177-H181 PolarHBondContact OE2-NE2 3.16Å; S178-H181 PolarHBondContact N-O 2.78Å; S178-H181 PolarHBondContact OG-CE1 2.91Å; S178-H181 PolarHBondContact OG-N 3.43Å; S178-H181 VanDerWaalsContact OG-N 3.14Å; S178-H181 PolarHBondContact OG-ND1 3.03Å
182	V	98.6	Very high	88.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.3	167.2	177.8	0	0	0	0	107.3	I149 Y159 A163 V174 Y176 V184	I149-V182 HydrophobicContact CG1-CB 3.99Å; I149-V182 HydrophobicContact CG1-CG1 4.49Å; I149-V182 VanDerWaalsContact CG1-O 3.25Å; I149-V182 WeakPolarHBondContact CG1-O 3.13Å; I149-V182 PolarHBondContact N-O 3.05Å; I149-V182 PolarHBondContact O-N 2.75Å; Y159-V182 WeakPolarHBondContact O-CG2 3.27Å; A163-V182 HydrophobicContact CB-CB 4.39Å; A163-V182 HydrophobicContact CB-CG1 3.57Å; A163-V182 HydrophobicContact CB-CG2 3.9Å; V174-V182 HydrophobicContact CG1-CG1 3.86Å; Y176-V182 HydrophobicContact CD1-CG2 3.99Å; Y176-V182 HydrophobicContact CE1-CG2 4.35Å; V182-V184 HydrophobicContact CG1-CG1 4.15Å
183	H	98.7	Very high	86.3	Confident	10 Å²	10	31.7 Å²	31.7	5%	0.046	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	134.1	173.6	178.2	89.9	0	0	0	109.6	E54 H141 D148 W173 Y175 E177	E54-H183 IonicContact OE1-CE1 3.93Å; E54-H183 IonicContact OE1-NE2 4Å; E54-H183 PolarHBondContact OE1-NE2 3.45Å; E54-H183 VanDerWaalsContact OE1-NE2 3.07Å; H141-H183 AromaticContact CD2-CE1 3.72Å; H141-H183 AromaticContact NE2-CE1 3.25Å; H141-H183 PolarHBondContact NE2-CE1 2.81Å; H141-H183 AromaticContact NE2-ND1 3.24Å; H141-H183 PolarHBondContact NE2-ND1 3.05Å; D148-H183 IonicContact OD1-CG 3.4Å; D148-H183 IonicContact OD1-ND1 3.23Å; D148-H183 PolarHBondContact OD1-ND1 2.99Å; D148-H183 VanDerWaalsContact OD1-ND1 3.15Å; W173-H183 AromaticContact CE3-CD2 3.83Å; W173-H183 AromaticContact CZ3-CD2 3.63Å; Y175-H183 PolarHBondContact N-O 3.39Å; Y175-H183 PolarHBondContact O-N 2.67Å; E177-H183 HydrophobicContact CB-CB 3.98Å
184	V	98.8	Very high	83.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.9	176.2	-60.1	0	0	0	0	109.9	A146 L147 I149 A166 F171 W173 V174 V182	A146-V184 CarbonylContact C-O 3.54Å; A146-V184 WeakPolarHBondContact CA-O 3.14Å; L147-V184 HydrophobicContact CB-CG2 3.88Å; L147-V184 PolarHBondContact N-O 3.38Å; L147-V184 WeakPolarHBondContact O-CG2 3.48Å; L147-V184 PolarHBondContact O-N 3.46Å; I149-V184 HydrophobicContact CD1-CG1 3.76Å; I149-V184 HydrophobicContact CD1-CG2 4.28Å; I149-V184 HydrophobicContact CG1-CG1 4.19Å; I149-V184 HydrophobicContact CG1-CG2 4.46Å; I149-V184 HydrophobicContact CG2-CG2 4.3Å; A166-V184 HydrophobicContact CB-CG1 3.7Å; F171-V184 HydrophobicContact CB-CB 4.42Å; F171-V184 HydrophobicContact CD1-CB 3.59Å; F171-V184 HydrophobicContact CD1-CG2 3.74Å; F171-V184 HydrophobicContact CD2-CB 4.38Å; F171-V184 HydrophobicContact CE1-CB 3.83Å; F171-V184 HydrophobicContact CE1-CG2 3.4Å; F171-V184 HydrophobicContact CE2-CG2 4.31Å; F171-V184 HydrophobicContact CG-CB 3.88Å; F171-V184 HydrophobicContact CG-CG1 4.43Å; F171-V184 HydrophobicContact CG-CG2 4.32Å; F171-V184 HydrophobicContact CZ-CB 4.32Å; F171-V184 HydrophobicContact CZ-CG2 3.7Å; W173-V184 WeakPolarHBondContact O-CA 3.34Å; V174-V184 HydrophobicContact CB-CG1 4.49Å; V174-V184 HydrophobicContact CG1-CG1 4.09Å; V174-V184 HydrophobicContact CG2-CG1 4.09Å; V182-V184 HydrophobicContact CG1-CG1 4.15Å
185	S	98.4	Very high	81.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163.9	177.1	67.1	0	0	0	0	113.7	E54 S60 R145 D172 W173	E54-S185 WeakPolarHBondContact OE1-CB 3.45Å; E54-S185 PolarHBondContact OE1-OG 2.88Å; S60-S185 WeakPolarHBondContact CB-OG 3.18Å; S60-S185 VanDerWaalsContact OG-C 3.3Å; S60-S185 PolarHBondContact OG-O 3.45Å; S60-S185 PolarHBondContact OG-OG 3.19Å; R145-S185 CarbonylContact O-C 3.45Å; R145-S185 WeakPolarHBondContact O-CA 3.09Å; R145-S185 WeakPolarHBondContact O-CB 3.45Å; D172-S185 PolarHBondContact N-O 3.29Å; W173-S185 PolarHBondContact N-O 2.71Å; W173-S185 VanDerWaalsContact N-O 3.16Å; W173-S185 PolarHBondContact O-N 2.95Å
186	V	96.4	Very high	79.6	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.			trans	-128	157.3	-178	-60.9	0	0	0	0	112.4	R102 C103 R106 R145 F171 D172	R102-V186 HydrophobicContact CB-CG2 4.4Å; R102-V186 HydrophobicContact CG-CB 4.07Å; R102-V186 HydrophobicContact CG-CG1 4.26Å; R102-V186 HydrophobicContact CG-CG2 4.35Å; C103-V186 HydrophobicContact CB-CG1 4.45Å; C103-V186 HydrophobicContact CB-CG2 3.7Å; R106-V186 HydrophobicContact CB-CG1 4.44Å; R106-V186 HydrophobicContact CG-CG1 3.93Å; R145-V186 HydrophobicContact CB-CG2 4.27Å; R145-V186 HydrophobicContact CG-CG2 4.45Å; R145-V186 PolarHBondContact NE-O 2.89Å; R145-V186 VanDerWaalsContact NE-O 3.12Å; R145-V186 PolarHBondContact NH2-O 2.9Å; R145-V186 WeakPolarHBondContact O-CG2 3.2Å; R145-V186 PolarHBondContact O-N 3.46Å; F171-V186 HydrophobicContact CD1-CG1 3.73Å; F171-V186 HydrophobicContact CE1-CG1 4.15Å; D172-V186 VanDerWaalsContact OD2-CA 3.25Å; D172-V186 WeakPolarHBondContact OD2-CA 3.29Å; D172-V186 WeakPolarHBondContact OD2-CB 3.41Å
187	K	90.6	Very high	77.8	Confident	38 Å²	38	32.6 Å²	32.6	17%	0.165	18%	0.177	C	C	.	.			trans	-57.5	147.2	164.8	-69	175.3	-176.4	-60	0	110.9	L57 A59 S60 D172	L57-K187 PolarHBondContact O-NZ 3.06Å; A59-K187 WeakPolarHBondContact O-CE 3.48Å; A59-K187 WeakPolarHBondContact O-CG 3.15Å; A59-K187 PolarHBondContact O-NZ 2.95Å; S60-K187 VanDerWaalsContact O-CA 3.27Å; S60-K187 WeakPolarHBondContact O-CA 3.32Å; D172-K187 HydrophobicContact CB-CG 4.03Å; D172-K187 PolarHBondContact OD2-N 3.29Å
188	A	84.8	Confident	76.8	Confident	6 Å²	6	29.7 Å²	29.7	5%	0.05	16%	0.164	C	C	.	.			trans	-57.3	144.1	172.4	0	0	0	0	0	110.4	E64 N190 S191	E64-A188 HydrophobicContact CG-CB 4.39Å; E64-A188 VanDerWaalsContact OE1-CB 3.23Å; E64-A188 WeakPolarHBondContact OE1-CB 3.28Å; A188-N190 PolarHBondContact O-N 3.18Å; A188-S191 VanDerWaalsContact O-CB 3.31Å; A188-S191 WeakPolarHBondContact O-CB 3.23Å; A188-S191 PolarHBondContact O-N 3.07Å; A188-S191 PolarHBondContact O-OG 2.96Å
189	D	71.6	Confident	76.5	Confident	25 Å²	25	28.6 Å²	28.6	13%	0.134	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.1	174	-75.3	-8.1	0	0	0	111.9	T100 E101 R102 V194	T100-D189 WeakPolarHBondContact CB-OD2 3.31Å; E101-D189 PolarHBondContact N-OD2 3.33Å; R102-D189 WeakPolarHBondContact CB-OD1 3.48Å; R102-D189 PolarHBondContact N-OD1 3.25Å; D189-V194 WeakPolarHBondContact O-CG1 3.39Å
190	N	59.7	Low	76.5	Confident	36 Å²	36	22 Å²	22	19%	0.193	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.8	179	-45.8	-1.8	0	0	0	113.1	E64 A188 L192 R195 W270	E64-N190 WeakPolarHBondContact OE1-CB 3.49Å; E64-N190 PolarHBondContact OE2-ND2 3.43Å; A188-N190 PolarHBondContact O-N 3.18Å; N190-L192 PolarHBondContact O-N 3.15Å; N190-R195 WeakPolarHBondContact O-CD 3.23Å; N190-W270 HydrophobicContact CB-CH2 3.78Å; N190-W270 HydrophobicContact CB-CZ2 3.95Å; N190-W270 VanDerWaalsContact CG-CZ2 3.45Å; N190-W270 WeakPolarHBondContact OD1-CH2 3.29Å; N190-W270 WeakPolarHBondContact OD1-CZ2 3.3Å
191	S	52.6	Low	76.4	Confident	28 Å²	28	17.6 Å²	17.6	20%	0.196	11%	0.108	C	C	.	.	S	Bend	trans	-56.6	135.3	-177.8	60.9	0	0	0	0	109.6	A188 A193 V194 R195	A188-S191 VanDerWaalsContact O-CB 3.31Å; A188-S191 WeakPolarHBondContact O-CB 3.23Å; A188-S191 PolarHBondContact O-N 3.07Å; A188-S191 PolarHBondContact O-OG 2.96Å; S191-A193 PolarHBondContact O-N 3.47Å; S191-V194 WeakPolarHBondContact O-CA 3.47Å; S191-V194 PolarHBondContact O-N 2.83Å; S191-V194 WeakPolarHBondContact OG-CG2 3.38Å; S191-R195 PolarHBondContact O-N 2.88Å; S191-R195 VanDerWaalsContact O-N 3.09Å
192	L	48.6	Very low	76	Confident	27 Å²	27	16.4 Å²	16.4	14%	0.141	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.7	-176.5	-75.5	161	0	0	0	111.9	N190 R195 V346 A391 E392	N190-L192 PolarHBondContact O-N 3.15Å; L192-R195 PolarHBondContact O-N 2.96Å; L192-V346 HydrophobicContact CD2-CG1 3.28Å; L192-A391 HydrophobicContact CD1-CB 3.86Å; L192-E392 HydrophobicContact CB-CG 3.51Å; L192-E392 WeakPolarHBondContact CB-OE1 3.47Å; L192-E392 HydrophobicContact CD1-CB 4.2Å; L192-E392 HydrophobicContact CD1-CG 3.4Å; L192-E392 HydrophobicContact CG-CG 4.04Å
193	A	41.2	Very low	75.7	Confident	71 Å²	71	21.6 Å²	21.6	59%	0.587	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.1	168.9	0	0	0	0	0	116.3	S191 E392	S191-A193 PolarHBondContact O-N 3.47Å; A193-E392 PolarHBondContact N-OE1 2.89Å; A193-E392 VanDerWaalsContact N-OE1 3.13Å
194	V	48.6	Very low	75.5	Confident	41 Å²	41	21.2 Å²	21.2	25%	0.248	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.3	176.5	176.4	0	0	0	0	111.8	D189 S191 A196	D189-V194 WeakPolarHBondContact O-CG1 3.39Å; S191-V194 WeakPolarHBondContact O-CA 3.47Å; S191-V194 PolarHBondContact O-N 2.83Å; S191-V194 WeakPolarHBondContact OG-CG2 3.38Å; V194-A196 PolarHBondContact O-N 3.23Å
195	R	55.2	Low	75.4	Confident	29 Å²	29	23 Å²	23	11%	0.109	14%	0.141	C	C	.	.			trans	-69.1	71.6	169.1	-58.8	173.4	113.2	172.3	-0.6	110.3	N190 S191 L192 G197 F290 A345 V346	N190-R195 WeakPolarHBondContact O-CD 3.23Å; S191-R195 PolarHBondContact O-N 2.88Å; S191-R195 VanDerWaalsContact O-N 3.09Å; L192-R195 PolarHBondContact O-N 2.96Å; R195-G197 VanDerWaalsContact C-N 3.27Å; R195-G197 PolarHBondContact O-N 2.57Å; R195-F290 VanDerWaalsContact NH2-CZ 3.28Å; R195-A345 PolarHBondContact NH2-O 3.27Å; R195-V346 HydrophobicContact CB-CG2 4.37Å; R195-V346 VanDerWaalsContact CZ-CA 3.47Å; R195-V346 PolarHBondContact NH1-O 2.69Å; R195-V346 PolarHBondContact NH2-O 3.4Å
196	A	51.3	Low	75.3	Confident	19 Å²	19	23 Å²	23	16%	0.157	14%	0.141	C	C	.	.			trans	-50.3	107.9	147.1	0	0	0	0	0	105.2	V194 G198 R249	V194-A196 PolarHBondContact O-N 3.23Å; A196-G198 PolarHBondContact O-N 2.88Å; A196-R249 VanDerWaalsContact CB-NH1 3.27Å
197	G	60.6	Low	75.3	Confident	6 Å²	6	27 Å²	27	6%	0.062	16%	0.156	C	C	.	.			trans	-44.6	131.1	-170.7	0	0	0	0	0	108.4	R195 C199 Y388	R195-G197 VanDerWaalsContact C-N 3.27Å; R195-G197 PolarHBondContact O-N 2.57Å; G197-C199 PolarHBondContact O-N 2.87Å; G197-C199 PolarHBondContact O-SG 2.89Å; G197-Y388 WeakPolarHBondContact CA-OH 3.35Å
198	G	73.3	Confident	75.5	Confident	3 Å²	3	26 Å²	26	3%	0.031	15%	0.152	C	C	.	.			trans	-39.3	127.9	-168.5	0	0	0	0	0	112.6	A196 T268 H271 A326	A196-G198 PolarHBondContact O-N 2.88Å; G198-T268 VanDerWaalsContact CA-OG1 3.24Å; G198-T268 WeakPolarHBondContact CA-OG1 3.47Å; G198-H271 VanDerWaalsContact C-CE1 3.4Å; G198-H271 PolarHBondContact O-CE1 3.15Å; G198-H271 PolarHBondContact O-ND1 3.49Å; G198-A326 WeakPolarHBondContact O-CB 3.5Å
199	C	89.9	Confident	75.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.			trans	-122.2	162.4	-170.8	-79.8	0	0	0	0	110.6	G197 L267 T268 H271 V324 F325	G197-C199 PolarHBondContact O-N 2.87Å; G197-C199 PolarHBondContact O-SG 2.89Å; C199-L267 WeakPolarHBondContact O-CA 3.27Å; C199-T268 HydrophobicContact CB-CG2 3.96Å; C199-T268 PolarHBondContact N-OG1 2.88Å; C199-T268 PolarHBondContact O-N 3.47Å; C199-H271 PolarHBondContact N-ND1 3.36Å; C199-H271 VanDerWaalsContact N-ND1 3.13Å; C199-H271 PolarHBondContact O-ND1 3.23Å; C199-V324 HydrophobicContact CB-CB 3.67Å; C199-V324 HydrophobicContact CB-CG1 4.2Å; C199-F325 WeakPolarHBondContact CA-O 3.17Å
200	F	93.9	Very high	76.8	Confident	1 Å²	1	37.4 Å²	37.4	0%	0.004	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-111	154.6	165.4	-56.4	-74.7	0	0	0	109	A204 L216 L265 L266 L267 H271 F325 P327 V336 A341	F200-A204 HydrophobicContact CB-CB 4.25Å; F200-L216 HydrophobicContact CB-CD1 3.23Å; F200-L216 HydrophobicContact CD2-CD1 3.95Å; F200-L216 HydrophobicContact CG-CD1 3.83Å; F200-L265 HydrophobicContact CD1-CD1 4.35Å; F200-L265 HydrophobicContact CE1-CD1 4.13Å; F200-L266 WeakPolarHBondContact CD1-O 3.16Å; F200-L267 HydrophobicContact CD1-CB 3.94Å; F200-L267 HydrophobicContact CE1-CB 3.9Å; F200-H271 AromaticContact CD2-CE1 3.63Å; F200-H271 AromaticContact CE1-CE1 3.71Å; F200-H271 AromaticContact CE1-ND1 3.93Å; F200-H271 AromaticContact CE1-NE2 3.99Å; F200-H271 AromaticContact CE2-CE1 3.08Å; F200-H271 WeakPolarHBondContact CE2-CE1 3.42Å; F200-H271 AromaticContact CE2-ND1 4Å; F200-H271 AromaticContact CE2-NE2 3.48Å; F200-H271 WeakPolarHBondContact CE2-NE2 3.48Å; F200-H271 AromaticContact CZ-CD2 3.96Å; F200-H271 AromaticContact CZ-CE1 3.11Å; F200-H271 WeakPolarHBondContact CZ-CE1 3.37Å; F200-H271 AromaticContact CZ-ND1 3.79Å; F200-H271 AromaticContact CZ-NE2 3.2Å; F200-H271 WeakPolarHBondContact CZ-NE2 3.29Å; F200-F325 PolarHBondContact N-O 3.12Å; F200-F325 PolarHBondContact O-N 2.94Å; F200-P327 HydrophobicContact CD2-CG 4.47Å; F200-V336 HydrophobicContact CD1-CB 4.25Å; F200-V336 HydrophobicContact CD1-CG1 3.89Å; F200-V336 HydrophobicContact CD1-CG2 4.11Å; F200-V336 HydrophobicContact CD2-CG2 4.12Å; F200-V336 HydrophobicContact CE1-CB 4.08Å; F200-V336 HydrophobicContact CE1-CG1 4.23Å; F200-V336 HydrophobicContact CE1-CG2 3.83Å; F200-V336 HydrophobicContact CE2-CG2 3.82Å; F200-V336 HydrophobicContact CG-CG1 4.24Å; F200-V336 HydrophobicContact CG-CG2 4.26Å; F200-V336 HydrophobicContact CZ-CB 4.41Å; F200-V336 HydrophobicContact CZ-CG2 3.68Å; F200-A341 HydrophobicContact CE1-CB 3.95Å; F200-A341 HydrophobicContact CZ-CB 3.59Å
201	P	93.8	Very high	78.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.217	C	C	.	.			trans	-74.7	161.5	177.5	33.4	-36.5	0	0	0	111.9	N203 A204 F253 L266 A321 G323	P201-N203 VanDerWaalsContact CB-OD1 3.24Å; P201-N203 WeakPolarHBondContact CB-OD1 3.4Å; P201-N203 WeakPolarHBondContact CG-OD1 2.97Å; P201-N203 PolarHBondContact O-N 3.06Å; P201-A204 HydrophobicContact CG-CB 4.07Å; P201-A204 WeakPolarHBondContact O-CB 3.45Å; P201-A204 PolarHBondContact O-N 2.78Å; P201-A204 VanDerWaalsContact O-N 3.09Å; P201-F253 HydrophobicContact CB-CD1 4.45Å; P201-F253 HydrophobicContact CB-CD2 4.5Å; P201-F253 HydrophobicContact CB-CE1 4Å; P201-F253 HydrophobicContact CB-CE2 4.05Å; P201-F253 HydrophobicContact CB-CZ 3.77Å; P201-F253 HydrophobicContact CG-CD1 4.36Å; P201-F253 HydrophobicContact CG-CE1 4.27Å; P201-L266 WeakPolarHBondContact CD-O 3.3Å; P201-L266 HydrophobicContact CG-CB 3.61Å; P201-L266 HydrophobicContact CG-CD1 4.06Å; P201-L266 HydrophobicContact CG-CG 4.49Å; P201-A321 HydrophobicContact CB-CB 3.64Å; P201-A321 HydrophobicContact CG-CB 4.4Å; P201-G323 WeakPolarHBondContact CA-O 3.08Å
202	G	90.2	Very high	80.2	Confident	5 Å²	5	42.1 Å²	42.1	5%	0.052	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.7	-177.7	0	0	0	0	0	115	R217 V322	G202-R217 WeakPolarHBondContact O-CB 3.1Å; G202-R217 PolarHBondContact O-N 3.04Å; G202-V322 PolarHBondContact N-O 3.35Å; G202-V322 VanDerWaalsContact N-O 3.11Å
203	N	91.8	Very high	82.4	Confident	109 Å²	109	47.4 Å²	47.4	58%	0.583	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.9	176.5	67.3	-22.5	0	0	0	113.6	P201	P201-N203 VanDerWaalsContact CB-OD1 3.24Å; P201-N203 WeakPolarHBondContact CB-OD1 3.4Å; P201-N203 WeakPolarHBondContact CG-OD1 2.97Å; P201-N203 PolarHBondContact O-N 3.06Å
204	A	95.3	Very high	85	Confident	2 Å²	2	45.8 Å²	45.8	2%	0.017	23%	0.233	C	C	.	.			trans	-68.5	152.6	171.5	0	0	0	0	0	110.2	F200 P201 G215 L216 V336	F200-A204 HydrophobicContact CB-CB 4.25Å; P201-A204 HydrophobicContact CG-CB 4.07Å; P201-A204 WeakPolarHBondContact O-CB 3.45Å; P201-A204 PolarHBondContact O-N 2.78Å; P201-A204 VanDerWaalsContact O-N 3.09Å; A204-G215 CarbonylContact O-C 3.56Å; A204-G215 WeakPolarHBondContact O-CA 3.31Å; A204-L216 HydrophobicContact CB-CD1 3.82Å; A204-L216 HydrophobicContact CB-CG 4.3Å; A204-L216 PolarHBondContact O-N 2.75Å; A204-V336 HydrophobicContact CB-CG1 3.74Å
205	T	96.6	Very high	87.2	Confident	37 Å²	37	44.7 Å²	44.7	23%	0.227	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149	-173.3	63.9	0	0	0	0	111	K214 V336 N337	T205-K214 CarbonylContact C-O 3.13Å; T205-K214 VanDerWaalsContact CA-O 3.31Å; T205-K214 WeakPolarHBondContact CA-O 3.26Å; T205-V336 CarbonylContact O-C 3.51Å; T205-V336 WeakPolarHBondContact O-CA 3.45Å; T205-N337 PolarHBondContact N-OD1 3.07Å; T205-N337 PolarHBondContact O-N 3.16Å; T205-N337 PolarHBondContact O-OD1 3.18Å; T205-N337 PolarHBondContact OG1-OD1 2.88Å
206	V	96.4	Very high	89	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.4	170.9	-64.7	0	0	0	0	109	R213 K214 L216 L219 V225 L334 V336	V206-R213 WeakPolarHBondContact O-CA 3.47Å; V206-K214 HydrophobicContact CG2-CB 4.46Å; V206-K214 PolarHBondContact N-O 3.09Å; V206-K214 PolarHBondContact O-N 3.34Å; V206-L216 HydrophobicContact CG1-CD2 3.56Å; V206-L216 HydrophobicContact CG1-CG 4.34Å; V206-L216 HydrophobicContact CG2-CD2 4.45Å; V206-L219 HydrophobicContact CG2-CD1 3.8Å; V206-L219 HydrophobicContact CG2-CD2 4.2Å; V206-V225 HydrophobicContact CB-CG1 4.28Å; V206-V225 HydrophobicContact CG2-CG1 3.81Å; V206-L334 HydrophobicContact CG1-CD1 4.02Å; V206-L334 HydrophobicContact CG1-CD2 3.84Å; V206-L334 HydrophobicContact CG1-CG 4.05Å; V206-V336 HydrophobicContact CG1-CG2 4.19Å
207	R	94.8	Very high	91	Very high	82 Å²	82	47.6 Å²	47.6	31%	0.309	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.2	169.3	-77.7	174.2	70.1	-161.1	-1.1	109.4	E212 R213 V225 L226 D338	R207-E212 WeakPolarHBondContact CA-O 3.37Å; R207-R213 HydrophobicContact CG-CG 3.99Å; R207-V225 WeakPolarHBondContact O-CA 3.28Å; R207-L226 HydrophobicContact CB-CD1 3.89Å; R207-L226 HydrophobicContact CB-CG 4.32Å; R207-L226 PolarHBondContact O-N 2.82Å; R207-D338 WeakPolarHBondContact CD-OD1 3.5Å; R207-D338 IonicContact NH1-OD1 3.66Å
208	L	95	Very high	92.5	Very high	18 Å²	18	52.9 Å²	52.9	9%	0.094	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-71.9	160.9	169.8	-60.3	-173.7	0	0	0	110.1	S210 G211 E212 K214 L219 D223 W224 V225	L208-S210 WeakPolarHBondContact CB-OG 3.31Å; L208-S210 PolarHBondContact O-N 3.06Å; L208-G211 PolarHBondContact O-N 3.41Å; L208-E212 HydrophobicContact CD1-CB 4.31Å; L208-E212 PolarHBondContact N-O 2.89Å; L208-K214 HydrophobicContact CD1-CB 4.35Å; L208-K214 HydrophobicContact CD1-CD 4.19Å; L208-K214 HydrophobicContact CD2-CB 4.14Å; L208-K214 HydrophobicContact CD2-CD 4.11Å; L208-K214 HydrophobicContact CG-CB 4.11Å; L208-L219 HydrophobicContact CD2-CD1 4.42Å; L208-D223 HydrophobicContact CD2-CB 4.32Å; L208-W224 CarbonylContact C-O 3.58Å; L208-W224 WeakPolarHBondContact CA-O 3.47Å; L208-V225 HydrophobicContact CD2-CG1 3.98Å
209	W	92.6	Very high	93.5	Very high	177 Å²	177	52.7 Å²	52.7	67%	0.67	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.4	171.4	174.4	37.1	0	0	0	112.3	G211 W224 P236	W209-G211 PolarHBondContact O-N 3.37Å; W209-G211 VanDerWaalsContact O-N 3.15Å; W209-W224 HydrophobicContact CB-CB 3.97Å; W209-W224 PolarHBondContact N-O 3.35Å; W209-P236 HydrophobicContact CB-CB 4.11Å; W209-P236 HydrophobicContact CD2-CB 4.46Å; W209-P236 HydrophobicContact CG-CB 3.89Å
210	S	91.6	Very high	93.5	Very high	93 Å²	93	57.5 Å²	57.5	65%	0.65	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.1	172.9	61	0	0	0	0	114.1	L208 E212	L208-S210 WeakPolarHBondContact CB-OG 3.31Å; L208-S210 PolarHBondContact O-N 3.06Å; S210-E212 PolarHBondContact OG-N 3.48Å
211	G	89.2	Confident	93.3	Very high	40 Å²	40	64 Å²	64	41%	0.412	31%	0.305	S	S	.	.	S	Bend	trans	93	-14.4	-174.3	0	0	0	0	0	114.2	L208 W209	L208-G211 PolarHBondContact O-N 3.41Å; W209-G211 PolarHBondContact O-N 3.37Å; W209-G211 VanDerWaalsContact O-N 3.15Å
212	E	93.9	Very high	93.1	Very high	123 Å²	123	66 Å²	66	58%	0.575	33%	0.325	S	S	*	.			trans	-64.5	145.1	176	-172.7	-173.8	171.3	0	0	111.5	R207 L208 S210	R207-E212 WeakPolarHBondContact CA-O 3.37Å; L208-E212 HydrophobicContact CD1-CB 4.31Å; L208-E212 PolarHBondContact N-O 2.89Å; S210-E212 PolarHBondContact OG-N 3.48Å
213	R	94.8	Very high	93.3	Very high	138 Å²	138	67.3 Å²	67.3	52%	0.521	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	127.9	169.2	-69.9	-177.9	-175.4	-95.8	-3.7	109.8	V206 R207 D338	V206-R213 WeakPolarHBondContact O-CA 3.47Å; R207-R213 HydrophobicContact CG-CG 3.99Å; R213-D338 IonicContact CZ-OD2 3.75Å; R213-D338 IonicContact NH1-OD2 3.82Å; R213-D338 PolarHBondContact NH1-OD2 2.98Å; R213-D338 IonicContact NH2-OD1 3.37Å; R213-D338 IonicContact NH2-OD2 3.35Å; R213-D338 PolarHBondContact NH2-OD2 3.5Å
214	K	95.4	Very high	93.5	Very high	38 Å²	38	68 Å²	68	17%	0.165	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.9	177.9	-163.3	175.9	-160.3	177.8	0	110.7	T205 V206 L208 E218 L219 D223	T205-K214 CarbonylContact C-O 3.13Å; T205-K214 VanDerWaalsContact CA-O 3.31Å; T205-K214 WeakPolarHBondContact CA-O 3.26Å; V206-K214 HydrophobicContact CG2-CB 4.46Å; V206-K214 PolarHBondContact N-O 3.09Å; V206-K214 PolarHBondContact O-N 3.34Å; L208-K214 HydrophobicContact CD1-CB 4.35Å; L208-K214 HydrophobicContact CD1-CD 4.19Å; L208-K214 HydrophobicContact CD2-CB 4.14Å; L208-K214 HydrophobicContact CD2-CD 4.11Å; L208-K214 HydrophobicContact CG-CB 4.11Å; K214-E218 WeakPolarHBondContact CE-O 3.44Å; K214-E218 HydrophobicContact CG-CB 4.22Å; K214-E218 PolarHBondContact NZ-O 3.23Å; K214-L219 HydrophobicContact CD-CD1 4.33Å; K214-D223 IonicContact NZ-OD1 3.71Å; K214-D223 PolarHBondContact NZ-OD1 3.04Å; K214-D223 IonicContact NZ-OD2 3.13Å; K214-D223 PolarHBondContact NZ-OD2 3.43Å
215	G	95	Very high	93.6	Very high	17 Å²	17	68 Å²	68	18%	0.175	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	145.3	174	0	0	0	0	0	111.7	A204 R217 E218 L219	A204-G215 CarbonylContact O-C 3.56Å; A204-G215 WeakPolarHBondContact O-CA 3.31Å; G215-R217 PolarHBondContact O-N 3.06Å; G215-E218 CarbonylContact O-C 3.56Å; G215-E218 PolarHBondContact O-N 2.83Å; G215-L219 PolarHBondContact O-N 2.85Å
216	L	93.5	Very high	93.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-63	-30	178	-77.1	-175.1	0	0	0	112.9	F200 A204 V206 E218 L219 F325 P327 V336	F200-L216 HydrophobicContact CB-CD1 3.23Å; F200-L216 HydrophobicContact CD2-CD1 3.95Å; F200-L216 HydrophobicContact CG-CD1 3.83Å; A204-L216 HydrophobicContact CB-CD1 3.82Å; A204-L216 HydrophobicContact CB-CG 4.3Å; A204-L216 PolarHBondContact O-N 2.75Å; V206-L216 HydrophobicContact CG1-CD2 3.56Å; V206-L216 HydrophobicContact CG1-CG 4.34Å; V206-L216 HydrophobicContact CG2-CD2 4.45Å; L216-E218 PolarHBondContact O-N 3.45Å; L216-L219 HydrophobicContact CD2-CB 4.44Å; L216-L219 HydrophobicContact CD2-CD2 3.58Å; L216-L219 WeakPolarHBondContact O-CB 3.34Å; L216-L219 PolarHBondContact O-N 2.76Å; L216-F325 HydrophobicContact CB-CB 4.36Å; L216-F325 HydrophobicContact CB-CG 4.34Å; L216-F325 HydrophobicContact CD1-CB 4.41Å; L216-P327 HydrophobicContact CD2-CG 4.25Å; L216-V336 HydrophobicContact CD1-CG1 4.5Å
217	R	93.2	Very high	93.4	Very high	110 Å²	110	67.1 Å²	67.1	42%	0.415	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.8	-32.3	172.2	180	177.8	-74.2	-172.3	-4	112.8	G202 G215 L247 F325	G202-R217 WeakPolarHBondContact O-CB 3.1Å; G202-R217 PolarHBondContact O-N 3.04Å; G215-R217 PolarHBondContact O-N 3.06Å; R217-L247 HydrophobicContact CG-CD2 4.32Å; R217-F325 HydrophobicContact CB-CZ 4.05Å; R217-F325 HydrophobicContact CG-CZ 4.31Å
218	E	92.8	Very high	93.3	Very high	116 Å²	116	63.5 Å²	63.5	54%	0.542	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-98.5	-4.4	-177.6	-64.5	165.9	-168.2	0	0	112.5	K214 G215 L216 H220	K214-E218 WeakPolarHBondContact CE-O 3.44Å; K214-E218 HydrophobicContact CG-CB 4.22Å; K214-E218 PolarHBondContact NZ-O 3.23Å; G215-E218 CarbonylContact O-C 3.56Å; G215-E218 PolarHBondContact O-N 2.83Å; L216-E218 PolarHBondContact O-N 3.45Å; E218-H220 PolarHBondContact O-CE1 3.19Å; E218-H220 PolarHBondContact O-ND1 3.28Å
219	L	92.8	Very high	93	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.31	C	S	.	.			trans	-70.6	133	179.5	-170.8	69.9	0	0	0	110	V206 L208 K214 G215 L216 D223 V225 V239 F242 P327	V206-L219 HydrophobicContact CG2-CD1 3.8Å; V206-L219 HydrophobicContact CG2-CD2 4.2Å; L208-L219 HydrophobicContact CD2-CD1 4.42Å; K214-L219 HydrophobicContact CD-CD1 4.33Å; G215-L219 PolarHBondContact O-N 2.85Å; L216-L219 HydrophobicContact CD2-CB 4.44Å; L216-L219 HydrophobicContact CD2-CD2 3.58Å; L216-L219 WeakPolarHBondContact O-CB 3.34Å; L216-L219 PolarHBondContact O-N 2.76Å; L219-D223 HydrophobicContact CD1-CB 3.73Å; L219-V225 HydrophobicContact CD1-CG1 3.82Å; L219-V239 HydrophobicContact CD1-CG2 4.19Å; L219-V239 HydrophobicContact CD2-CG1 4.49Å; L219-V239 HydrophobicContact CD2-CG2 3.93Å; L219-V239 HydrophobicContact CG-CG2 4.19Å; L219-F242 HydrophobicContact CB-CZ 3.99Å; L219-F242 HydrophobicContact CD2-CE1 4.34Å; L219-F242 HydrophobicContact CD2-CZ 4.09Å; L219-F242 HydrophobicContact CG-CZ 4.07Å; L219-F242 VanDerWaalsContact O-CZ 3.27Å; L219-F242 WeakPolarHBondContact O-CZ 3.3Å; L219-P327 HydrophobicContact CD2-CB 4.21Å
220	H	90.9	Very high	92.6	Very high	101 Å²	101	61.1 Å²	61.1	47%	0.468	32%	0.323	S	S	.	.			trans	-116.9	155.9	-179.2	-65.1	92	0	0	0	111.1	E218 G222 D223	E218-H220 PolarHBondContact O-CE1 3.19Å; E218-H220 PolarHBondContact O-ND1 3.28Å; H220-G222 PolarHBondContact O-N 2.84Å; H220-D223 PolarHBondContact N-OD2 3.08Å; H220-D223 WeakPolarHBondContact O-CB 3.26Å; H220-D223 PolarHBondContact O-N 3.33Å
221	R	90.3	Very high	92.2	Very high	136 Å²	136	60.4 Å²	60.4	51%	0.513	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	135.5	166.7	168.5	174.8	175.5	-169.9	-0.7	108.8	D223 L240	R221-D223 VanDerWaalsContact C-N 3.34Å; R221-L240 WeakPolarHBondContact CD-O 3.42Å; R221-L240 WeakPolarHBondContact CG-O 3.49Å; R221-L240 PolarHBondContact NE-O 3.3Å
222	G	89.6	Confident	92	Very high	42 Å²	42	59.9 Å²	59.9	43%	0.433	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-14.3	-177.9	0	0	0	0	0	114.3	H220 W224 V239	H220-G222 PolarHBondContact O-N 2.84Å; G222-W224 VanDerWaalsContact O-CD1 3.27Å; G222-W224 PolarHBondContact O-N 2.91Å; G222-V239 PolarHBondContact N-O 3.36Å
223	D	93.6	Very high	91.9	Very high	33 Å²	33	61.2 Å²	61.2	18%	0.176	31%	0.312	C	S	.	.			trans	-60.8	137	171.4	-73.9	-23.1	0	0	0	109.7	L208 K214 L219 H220 R221 V239	L208-D223 HydrophobicContact CD2-CB 4.32Å; K214-D223 IonicContact NZ-OD1 3.71Å; K214-D223 PolarHBondContact NZ-OD1 3.04Å; K214-D223 IonicContact NZ-OD2 3.13Å; K214-D223 PolarHBondContact NZ-OD2 3.43Å; L219-D223 HydrophobicContact CD1-CB 3.73Å; H220-D223 PolarHBondContact N-OD2 3.08Å; H220-D223 WeakPolarHBondContact O-CB 3.26Å; H220-D223 PolarHBondContact O-N 3.33Å; R221-D223 VanDerWaalsContact C-N 3.34Å; D223-V239 WeakPolarHBondContact O-CG2 3.42Å; D223-V239 PolarHBondContact O-N 3.32Å
224	W	96.1	Very high	91.8	Very high	125 Å²	125	56.1 Å²	56.1	47%	0.473	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.9	177	-75.6	75.8	0	0	0	109.7	L208 W209 G222 P236 P238	L208-W224 CarbonylContact C-O 3.58Å; L208-W224 WeakPolarHBondContact CA-O 3.47Å; W209-W224 HydrophobicContact CB-CB 3.97Å; W209-W224 PolarHBondContact N-O 3.35Å; G222-W224 VanDerWaalsContact O-CD1 3.27Å; G222-W224 PolarHBondContact O-N 2.91Å; W224-P236 HydrophobicContact CE3-CB 4.1Å; W224-P238 HydrophobicContact CD2-CB 4.3Å; W224-P238 HydrophobicContact CH2-CG 4.41Å; W224-P238 HydrophobicContact CZ2-CB 4.29Å; W224-P238 HydrophobicContact CZ2-CG 4.42Å
225	V	96.6	Very high	91.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	163.6	-175.3	-65.8	0	0	0	0	110.6	V206 R207 L208 L219 P236 T237 V239 T329 L334	V206-V225 HydrophobicContact CB-CG1 4.28Å; V206-V225 HydrophobicContact CG2-CG1 3.81Å; R207-V225 WeakPolarHBondContact O-CA 3.28Å; L208-V225 HydrophobicContact CD2-CG1 3.98Å; L219-V225 HydrophobicContact CD1-CG1 3.82Å; V225-P236 CarbonylContact O-C 3.57Å; V225-P236 WeakPolarHBondContact O-CA 3.47Å; V225-T237 HydrophobicContact CG2-CG2 3.91Å; V225-T237 WeakPolarHBondContact CG2-O 3.48Å; V225-T237 PolarHBondContact N-O 3.42Å; V225-T237 PolarHBondContact O-N 3.24Å; V225-V239 HydrophobicContact CB-CG2 4.47Å; V225-V239 HydrophobicContact CG1-CG2 3.86Å; V225-V239 HydrophobicContact CG2-CG2 3.73Å; V225-T329 HydrophobicContact CG2-CG2 3.95Å; V225-L334 HydrophobicContact CB-CD1 3.8Å; V225-L334 HydrophobicContact CG1-CD1 4.47Å; V225-L334 HydrophobicContact CG2-CD1 3.37Å
226	L	95.5	Very high	91.8	Very high	21 Å²	21	57.2 Å²	57.2	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	134.9	175.2	-58.1	179.9	0	0	0	111.5	R207 V234 L335	R207-L226 HydrophobicContact CB-CD1 3.89Å; R207-L226 HydrophobicContact CB-CG 4.32Å; R207-L226 PolarHBondContact O-N 2.82Å; L226-V234 HydrophobicContact CB-CG1 4.15Å; L226-V234 HydrophobicContact CD1-CG1 4.34Å; L226-V234 HydrophobicContact CD2-CG1 4.39Å; L226-L335 HydrophobicContact CB-CD1 3.86Å; L226-L335 PolarHBondContact O-N 3.48Å
227	A	94.6	Very high	91.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-170.7	176.2	0	0	0	0	0	109.9	V234 V235 T237 H331 T333	A227-V234 CarbonylContact O-C 3.52Å; A227-V234 WeakPolarHBondContact O-CA 3.37Å; A227-V235 PolarHBondContact N-O 2.81Å; A227-V235 PolarHBondContact O-N 3.27Å; A227-T237 HydrophobicContact CB-CG2 3.3Å; A227-H331 HydrophobicContact CB-CB 4.4Å; A227-T333 WeakPolarHBondContact CB-O 3.41Å
228	A	92.5	Very high	91.9	Very high	5 Å²	5	53.4 Å²	53.4	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.6	173.1	0	0	0	0	0	111.9	R233 L308 T333 L340	A228-R233 VanDerWaalsContact CA-O 3.26Å; A228-R233 WeakPolarHBondContact CA-O 3.19Å; A228-L308 HydrophobicContact CB-CD1 3.46Å; A228-L308 VanDerWaalsContact CB-CD1 3.46Å; A228-L308 HydrophobicContact CB-CG 4.29Å; A228-T333 PolarHBondContact N-OG1 2.98Å; A228-T333 VanDerWaalsContact N-OG1 3.1Å; A228-T333 PolarHBondContact O-OG1 3.34Å; A228-L340 HydrophobicContact CB-CD1 3.58Å; A228-L340 HydrophobicContact CB-CD2 4.13Å
229	D	89	Confident	92	Very high	30 Å²	30	47.9 Å²	47.9	16%	0.16	27%	0.268	C	S	.	.			trans	-79.6	177	174	73.4	11.2	0	0	0	111.8	S231 G232 R233 V235	D229-S231 PolarHBondContact O-N 2.9Å; D229-S231 VanDerWaalsContact O-N 3.12Å; D229-S231 VanDerWaalsContact OD1-CA 3.32Å; D229-S231 WeakPolarHBondContact OD1-CA 3.39Å; D229-S231 WeakPolarHBondContact OD1-CB 3.49Å; D229-S231 PolarHBondContact OD1-N 2.85Å; D229-S231 PolarHBondContact OD1-OG 2.81Å; D229-S231 PolarHBondContact OD2-OG 3.25Å; D229-S231 VanDerWaalsContact OD2-OG 3.06Å; D229-G232 PolarHBondContact O-N 3.03Å; D229-G232 PolarHBondContact OD1-N 3.48Å; D229-G232 VanDerWaalsContact OD1-N 3.1Å; D229-R233 PolarHBondContact N-O 2.91Å; D229-R233 PolarHBondContact OD1-N 3.26Å; D229-R233 IonicContact OD2-CZ 3.4Å; D229-R233 IonicContact OD2-NE 3.09Å; D229-R233 PolarHBondContact OD2-NE 3.06Å; D229-R233 VanDerWaalsContact OD2-NE 3.09Å; D229-R233 IonicContact OD2-NH2 2.83Å; D229-R233 PolarHBondContact OD2-NH2 3.44Å; D229-V235 HydrophobicContact CB-CG1 4.21Å; D229-V235 HydrophobicContact CB-CG2 4.15Å
230	A	83.4	Confident	91.9	Very high	116 Å²	116	49 Å²	49	96%	0.959	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.6	179.3	0	0	0	0	0	113.9
231	S	83.8	Confident	92	Very high	78 Å²	78	44.3 Å²	44.3	55%	0.545	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.3	175.4	68.3	0	0	0	0	113.3	D229 R233	D229-S231 PolarHBondContact O-N 2.9Å; D229-S231 VanDerWaalsContact O-N 3.12Å; D229-S231 VanDerWaalsContact OD1-CA 3.32Å; D229-S231 WeakPolarHBondContact OD1-CA 3.39Å; D229-S231 WeakPolarHBondContact OD1-CB 3.49Å; D229-S231 PolarHBondContact OD1-N 2.85Å; D229-S231 PolarHBondContact OD1-OG 2.81Å; D229-S231 PolarHBondContact OD2-OG 3.25Å; D229-S231 VanDerWaalsContact OD2-OG 3.06Å; S231-R233 VanDerWaalsContact C-N 3.33Å; S231-R233 WeakPolarHBondContact OG-CG 3.42Å; S231-R233 PolarHBondContact OG-NE 3.14Å
232	G	85.1	Confident	92	Very high	28 Å²	28	38 Å²	38	29%	0.289	23%	0.228	S	C	.	.	S	Bend	trans	78.7	13.4	-178.9	0	0	0	0	0	114.3	D229 L308	D229-G232 PolarHBondContact O-N 3.03Å; D229-G232 PolarHBondContact OD1-N 3.48Å; D229-G232 VanDerWaalsContact OD1-N 3.1Å; G232-L308 WeakPolarHBondContact O-CG 3.33Å; G232-L308 PolarHBondContact O-N 3.12Å
233	R	90.8	Very high	92	Very high	151 Å²	151	36.3 Å²	36.3	57%	0.57	21%	0.209	S	C	*	.	B	Isolated β-bridge	trans	-83.7	142.5	174.9	-64.5	-179.4	-58.3	169.9	6.4	110.2	A228 D229 S231 V235	A228-R233 VanDerWaalsContact CA-O 3.26Å; A228-R233 WeakPolarHBondContact CA-O 3.19Å; D229-R233 PolarHBondContact N-O 2.91Å; D229-R233 PolarHBondContact OD1-N 3.26Å; D229-R233 IonicContact OD2-CZ 3.4Å; D229-R233 IonicContact OD2-NE 3.09Å; D229-R233 PolarHBondContact OD2-NE 3.06Å; D229-R233 VanDerWaalsContact OD2-NE 3.09Å; D229-R233 IonicContact OD2-NH2 2.83Å; D229-R233 PolarHBondContact OD2-NH2 3.44Å; S231-R233 VanDerWaalsContact C-N 3.33Å; S231-R233 WeakPolarHBondContact OG-CG 3.42Å; S231-R233 PolarHBondContact OG-NE 3.14Å; R233-V235 PolarHBondContact O-N 3.14Å
234	V	93.1	Very high	91.7	Very high	31 Å²	31	35 Å²	35	19%	0.188	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122.3	176.7	-178.1	0	0	0	0	108.8	L226 A227 P303 D306 L308 L335	L226-V234 HydrophobicContact CB-CG1 4.15Å; L226-V234 HydrophobicContact CD1-CG1 4.34Å; L226-V234 HydrophobicContact CD2-CG1 4.39Å; A227-V234 CarbonylContact O-C 3.52Å; A227-V234 WeakPolarHBondContact O-CA 3.37Å; V234-P303 HydrophobicContact CG2-CB 4.34Å; V234-D306 PolarHBondContact N-O 2.72Å; V234-L308 HydrophobicContact CG2-CD2 4.07Å; V234-L308 HydrophobicContact CG2-CG 4.34Å; V234-L335 HydrophobicContact CG1-CD1 4.02Å
235	V	94.7	Very high	91.3	Very high	26 Å²	26	30.9 Å²	30.9	16%	0.158	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.6	-175.5	-63.6	0	0	0	0	111.6	A227 D229 R233	A227-V235 PolarHBondContact N-O 2.81Å; A227-V235 PolarHBondContact O-N 3.27Å; D229-V235 HydrophobicContact CB-CG1 4.21Å; D229-V235 HydrophobicContact CB-CG2 4.15Å; R233-V235 PolarHBondContact O-N 3.14Å
236	P	95.3	Very high	90.9	Very high	53 Å²	53	33 Å²	33	34%	0.344	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	137.6	170.4	30.5	-33.6	0	0	0	110.3	W209 W224 V225	W209-P236 HydrophobicContact CB-CB 4.11Å; W209-P236 HydrophobicContact CD2-CB 4.46Å; W209-P236 HydrophobicContact CG-CB 3.89Å; W224-P236 HydrophobicContact CE3-CB 4.1Å; V225-P236 CarbonylContact O-C 3.57Å; V225-P236 WeakPolarHBondContact O-CA 3.47Å
237	T	95.1	Very high	90.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.6	178.3	-173.3	0	0	0	0	110.4	V225 A227 T329 A330 H331	V225-T237 HydrophobicContact CG2-CG2 3.91Å; V225-T237 WeakPolarHBondContact CG2-O 3.48Å; V225-T237 PolarHBondContact N-O 3.42Å; V225-T237 PolarHBondContact O-N 3.24Å; A227-T237 HydrophobicContact CB-CG2 3.3Å; T237-T329 HydrophobicContact CG2-CG2 3.81Å; T237-A330 PolarHBondContact OG1-N 3.06Å; T237-H331 WeakPolarHBondContact CB-ND1 3.18Å; T237-H331 PolarHBondContact OG1-N 3.24Å; T237-H331 PolarHBondContact OG1-ND1 3.3Å; T237-H331 VanDerWaalsContact OG1-ND1 3.09Å
238	P	95	Very high	90.2	Very high	29 Å²	29	41.5 Å²	41.5	19%	0.188	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	145.3	174	30.7	-34.5	0	0	0	110.9	W224 L240 T329 A330	W224-P238 HydrophobicContact CD2-CB 4.3Å; W224-P238 HydrophobicContact CH2-CG 4.41Å; W224-P238 HydrophobicContact CZ2-CB 4.29Å; W224-P238 HydrophobicContact CZ2-CG 4.42Å; P238-L240 HydrophobicContact CG-CD2 4.12Å; P238-L240 PolarHBondContact O-N 2.87Å; P238-T329 WeakPolarHBondContact O-CA 3.25Å; P238-A330 HydrophobicContact CG-CB 4.16Å; P238-A330 PolarHBondContact O-N 3.13Å
239	V	94.3	Very high	89.7	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	113.8	164	179.4	0	0	0	0	108.2	L219 G222 D223 V225 F242 P327	L219-V239 HydrophobicContact CD1-CG2 4.19Å; L219-V239 HydrophobicContact CD2-CG1 4.49Å; L219-V239 HydrophobicContact CD2-CG2 3.93Å; L219-V239 HydrophobicContact CG-CG2 4.19Å; G222-V239 PolarHBondContact N-O 3.36Å; D223-V239 WeakPolarHBondContact O-CG2 3.42Å; D223-V239 PolarHBondContact O-N 3.32Å; V225-V239 HydrophobicContact CB-CG2 4.47Å; V225-V239 HydrophobicContact CG1-CG2 3.86Å; V225-V239 HydrophobicContact CG2-CG2 3.73Å; V239-F242 HydrophobicContact CG1-CE2 4.36Å; V239-P327 HydrophobicContact CG1-CB 4.42Å
240	L	91.4	Very high	89.3	Confident	23 Å²	23	54.3 Å²	54.3	12%	0.12	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-44	-175.3	-59.8	-179.6	0	0	0	111.9	R221 P238 L328 A330 R361 H364	R221-L240 WeakPolarHBondContact CD-O 3.42Å; R221-L240 WeakPolarHBondContact CG-O 3.49Å; R221-L240 PolarHBondContact NE-O 3.3Å; P238-L240 HydrophobicContact CG-CD2 4.12Å; P238-L240 PolarHBondContact O-N 2.87Å; L240-L328 PolarHBondContact N-O 2.85Å; L240-A330 HydrophobicContact CD1-CB 4.26Å; L240-A330 HydrophobicContact CD2-CB 4.45Å; L240-A330 HydrophobicContact CG-CB 4.49Å; L240-R361 HydrophobicContact CD1-CB 4.16Å; L240-R361 HydrophobicContact CD1-CG 3.73Å; L240-H364 HydrophobicContact CD1-CB 4.46Å; L240-H364 HydrophobicContact CD2-CB 4.37Å; L240-H364 PolarHBondContact O-CE1 3.08Å; L240-H364 PolarHBondContact O-ND1 3.39Å
241	L	91.7	Very high	89.1	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	-179.4	-179.3	60.4	70.8	0	0	0	110.2	L243 L328 L360 H364	L241-L243 HydrophobicContact CD1-CD2 3.76Å; L241-L243 HydrophobicContact CD1-CG 4.27Å; L241-L328 HydrophobicContact CD1-CB 3.74Å; L241-L328 HydrophobicContact CD1-CD2 3.88Å; L241-L328 HydrophobicContact CD1-CG 4.46Å; L241-L328 HydrophobicContact CG-CB 4.33Å; L241-L328 HydrophobicContact CG-CD2 4.16Å; L241-L328 PolarHBondContact O-N 3.1Å; L241-L360 HydrophobicContact CD1-CD2 4.38Å; L241-L360 HydrophobicContact CD2-CD1 4.06Å; L241-L360 HydrophobicContact CD2-CD2 3.77Å; L241-L360 HydrophobicContact CD2-CG 4.05Å; L241-H364 WeakPolarHBondContact CD2-NE2 3.48Å
242	F	90.7	Very high	88.9	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.013	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.9	166.2	-58.4	-107.4	0	0	0	110.6	L219 V239 R245 F325 A326 P327 Q376	L219-F242 HydrophobicContact CB-CZ 3.99Å; L219-F242 HydrophobicContact CD2-CE1 4.34Å; L219-F242 HydrophobicContact CD2-CZ 4.09Å; L219-F242 HydrophobicContact CG-CZ 4.07Å; L219-F242 VanDerWaalsContact O-CZ 3.27Å; L219-F242 WeakPolarHBondContact O-CZ 3.3Å; V239-F242 HydrophobicContact CG1-CE2 4.36Å; F242-R245 HydrophobicContact CB-CB 4.13Å; F242-F325 HydrophobicContact CD1-CB 4.36Å; F242-F325 HydrophobicContact CD1-CD1 4.29Å; F242-F325 HydrophobicContact CE1-CB 4.41Å; F242-F325 HydrophobicContact CE1-CD1 4.09Å; F242-A326 CarbonylContact C-O 3.56Å; F242-A326 WeakPolarHBondContact CA-O 3.41Å; F242-P327 HydrophobicContact CD1-CB 4.02Å; F242-P327 HydrophobicContact CE1-CB 3.91Å; F242-Q376 VanDerWaalsContact CD2-OE1 3.24Å; F242-Q376 PolarHBondContact O-NE2 2.92Å; F242-Q376 PolarHBondContact O-OE1 3.31Å
243	L	89.1	Confident	89.2	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	-26.7	175.9	-62.5	178.2	0	0	0	112.5	L241 A326 L328 C343 Y344 F357 L360 M380 H381 S384	L241-L243 HydrophobicContact CD1-CD2 3.76Å; L241-L243 HydrophobicContact CD1-CG 4.27Å; L243-A326 HydrophobicContact CB-CB 4Å; L243-A326 PolarHBondContact N-O 3.46Å; L243-L328 HydrophobicContact CD2-CB 4.32Å; L243-L328 HydrophobicContact CD2-CD2 4.16Å; L243-L328 HydrophobicContact CG-CB 4.09Å; L243-C343 WeakPolarHBondContact CD1-O 3.44Å; L243-Y344 HydrophobicContact CD1-CD1 4.4Å; L243-F357 HydrophobicContact CD1-CE1 4.22Å; L243-F357 HydrophobicContact CD1-CZ 4.11Å; L243-F357 HydrophobicContact CD2-CD1 3.98Å; L243-F357 HydrophobicContact CD2-CE1 3.44Å; L243-F357 VanDerWaalsContact CD2-CE1 3.44Å; L243-F357 HydrophobicContact CD2-CZ 4.08Å; L243-F357 HydrophobicContact CG-CE1 4.48Å; L243-L360 HydrophobicContact CD2-CD2 4.38Å; L243-M380 WeakPolarHBondContact O-CA 3.2Å; L243-H381 WeakPolarHBondContact O-CB 3.46Å; L243-H381 PolarHBondContact O-N 3.34Å; L243-S384 WeakPolarHBondContact CD2-OG 3.4Å
244	D	87.3	Confident	89.2	Confident	4 Å²	4	39 Å²	39	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	141.3	171	-164.6	3.6	0	0	0	108.2	A326 G379 M380	D244-A326 HydrophobicContact CB-CB 4.12Å; D244-A326 PolarHBondContact O-N 3.32Å; D244-G379 WeakPolarHBondContact OD1-CA 3.43Å; D244-M380 PolarHBondContact OD1-N 3.48Å; D244-M380 VanDerWaalsContact OD1-N 3.14Å
245	R	88.6	Confident	89.4	Confident	40 Å²	40	37.5 Å²	37.5	15%	0.151	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	109.8	-179.3	-177.1	175.2	178.2	152.6	2.1	110.6	F242 L247 V324 F325 T378 G379	F242-R245 HydrophobicContact CB-CB 4.13Å; R245-L247 HydrophobicContact CG-CD1 4.47Å; R245-V324 CarbonylContact C-O 3.56Å; R245-V324 VanDerWaalsContact CA-O 3.29Å; R245-V324 WeakPolarHBondContact CA-O 3.45Å; R245-F325 HydrophobicContact CG-CD1 3.91Å; R245-F325 HydrophobicContact CG-CE1 3.86Å; R245-T378 CarbonylContact O-C 3.46Å; R245-T378 VanDerWaalsContact O-CA 3.3Å; R245-T378 WeakPolarHBondContact O-CA 3.45Å; R245-G379 PolarHBondContact N-O 2.86Å; R245-G379 PolarHBondContact O-N 3.31Å
246	D	87.9	Confident	89.5	Confident	44 Å²	44	36.3 Å²	36.3	24%	0.235	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	121.8	169.8	-176.6	-27.6	0	0	0	109.4	Q248 R249 G323 V324 T378	D246-Q248 VanDerWaalsContact C-N 3.34Å; D246-Q248 PolarHBondContact OD1-N 3.09Å; D246-R249 HydrophobicContact CB-CB 3.96Å; D246-R249 PolarHBondContact OD1-N 2.77Å; D246-G323 CarbonylContact O-C 3.55Å; D246-G323 WeakPolarHBondContact O-CA 3.22Å; D246-V324 HydrophobicContact CB-CG2 3.77Å; D246-V324 PolarHBondContact N-O 3.48Å; D246-V324 PolarHBondContact O-N 3.38Å; D246-T378 HydrophobicContact CB-CG2 3.85Å
247	L	89.4	Confident	89.5	Confident	55 Å²	55	36.1 Å²	36.1	29%	0.288	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-21.3	-173.6	-71.3	83	0	0	0	113.3	R217 R245 F325	R217-L247 HydrophobicContact CG-CD2 4.32Å; R245-L247 HydrophobicContact CG-CD1 4.47Å; L247-F325 HydrophobicContact CG-CZ 4.06Å
248	Q	86.3	Confident	89.5	Confident	144 Å²	144	36.4 Å²	36.4	67%	0.673	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	-16.5	-168.8	-58	-55.9	-35.9	0	0	112.9	D246 R250	D246-Q248 VanDerWaalsContact C-N 3.34Å; D246-Q248 PolarHBondContact OD1-N 3.09Å; Q248-R250 PolarHBondContact O-N 3.41Å
249	R	80.8	Confident	89.4	Confident	105 Å²	105	39.1 Å²	39.1	40%	0.396	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	124.8	177.7	-175.8	170.7	-179.2	179.6	0.7	111.4	A196 D246 G323 V324	A196-R249 VanDerWaalsContact CB-NH1 3.27Å; D246-R249 HydrophobicContact CB-CB 3.96Å; D246-R249 PolarHBondContact OD1-N 2.77Å; R249-G323 PolarHBondContact O-N 2.82Å; R249-V324 HydrophobicContact CB-CG1 4.4Å; R249-V324 HydrophobicContact CB-CG2 4.14Å; R249-V324 HydrophobicContact CG-CG1 4.23Å; R249-V324 HydrophobicContact CG-CG2 4.4Å
250	R	80.8	Confident	89	Confident	200 Å²	200	49.7 Å²	49.7	76%	0.755	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	139.4	166.2	-72.7	177.3	173.2	-167.9	-3	109.2	Q248 V322	Q248-R250 PolarHBondContact O-N 3.41Å; R250-V322 HydrophobicContact CG-CG2 4Å
251	A	79	Confident	88.8	Confident	20 Å²	20	51.6 Å²	51.6	17%	0.165	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	155.7	177.1	0	0	0	0	0	111	F253 E320 A321 V324	A251-F253 HydrophobicContact CB-CE2 3.89Å; A251-F253 HydrophobicContact CB-CZ 4.24Å; A251-F253 WeakPolarHBondContact O-CD2 3.49Å; A251-F253 WeakPolarHBondContact O-CE2 3.33Å; A251-E320 VanDerWaalsContact C-OE2 3.26Å; A251-A321 PolarHBondContact N-O 3.25Å; A251-A321 VanDerWaalsContact N-O 3.16Å; A251-A321 PolarHBondContact O-N 2.87Å; A251-A321 VanDerWaalsContact O-N 3.11Å; A251-V324 HydrophobicContact CB-CG1 4.11Å
252	S	81.6	Confident	88.8	Confident	25 Å²	25	56.9 Å²	56.9	18%	0.175	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.8	166.9	-176.3	0	0	0	0	111	E320	S252-E320 WeakPolarHBondContact CA-OE1 3.49Å; S252-E320 WeakPolarHBondContact CB-OE1 3.27Å; S252-E320 PolarHBondContact N-OE1 3Å
253	F	89.5	Confident	89	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	152.7	174.6	-64.6	-95	0	0	0	110.3	P201 A251 L266 T268 R318 E319 A321 V324	P201-F253 HydrophobicContact CB-CD1 4.45Å; P201-F253 HydrophobicContact CB-CD2 4.5Å; P201-F253 HydrophobicContact CB-CE1 4Å; P201-F253 HydrophobicContact CB-CE2 4.05Å; P201-F253 HydrophobicContact CB-CZ 3.77Å; P201-F253 HydrophobicContact CG-CD1 4.36Å; P201-F253 HydrophobicContact CG-CE1 4.27Å; A251-F253 HydrophobicContact CB-CE2 3.89Å; A251-F253 HydrophobicContact CB-CZ 4.24Å; A251-F253 WeakPolarHBondContact O-CD2 3.49Å; A251-F253 WeakPolarHBondContact O-CE2 3.33Å; F253-L266 HydrophobicContact CB-CB 4.33Å; F253-L266 HydrophobicContact CB-CD2 4.06Å; F253-T268 HydrophobicContact CD1-CG2 3.94Å; F253-T268 HydrophobicContact CE1-CG2 3.66Å; F253-T268 HydrophobicContact CZ-CG2 4.28Å; F253-R318 WeakPolarHBondContact O-CA 3.35Å; F253-E319 PolarHBondContact N-O 3.03Å; F253-E319 PolarHBondContact O-N 2.87Å; F253-A321 HydrophobicContact CD2-CB 3.64Å; F253-A321 HydrophobicContact CE2-CB 3.7Å; F253-V324 HydrophobicContact CZ-CG1 4.2Å
254	V	92.3	Very high	89.3	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.03	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.7	165.3	-178.3	0	0	0	0	107.6	V256 L266 L267 P269 A291 V316 A317	V254-V256 HydrophobicContact CG1-CG2 4.01Å; V254-L266 WeakPolarHBondContact O-CA 3.32Å; V254-L267 PolarHBondContact N-O 2.94Å; V254-L267 PolarHBondContact O-N 2.87Å; V254-P269 HydrophobicContact CG2-CB 4.35Å; V254-P269 HydrophobicContact CG2-CG 4.2Å; V254-A291 HydrophobicContact CB-CB 4.1Å; V254-A291 HydrophobicContact CG1-CB 4.44Å; V254-A291 HydrophobicContact CG2-CB 4.16Å; V254-V316 HydrophobicContact CG1-CG1 3.5Å; V254-A317 CarbonylContact C-O 3.59Å; V254-A317 WeakPolarHBondContact CA-O 3.45Å
255	A	96.1	Very high	89.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	110.6	173.8	0	0	0	0	0	109.4	L266 V316 A317 E319	A255-L266 HydrophobicContact CB-CD2 3.54Å; A255-V316 CarbonylContact O-C 3.45Å; A255-V316 VanDerWaalsContact O-CA 3.29Å; A255-V316 WeakPolarHBondContact O-CA 3.46Å; A255-A317 HydrophobicContact CB-CB 4.35Å; A255-A317 PolarHBondContact N-O 2.91Å; A255-A317 PolarHBondContact O-N 3.09Å; A255-E319 HydrophobicContact CB-CB 4.45Å; A255-E319 HydrophobicContact CB-CG 3.87Å
256	V	96.8	Very high	90.1	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.8	177.5	-174.6	0	0	0	0	107.9	V254 K264 L265 L267 L294 V313	V254-V256 HydrophobicContact CG1-CG2 4.01Å; V256-K264 WeakPolarHBondContact O-CA 3.44Å; V256-L265 HydrophobicContact CB-CB 4.41Å; V256-L265 PolarHBondContact N-O 3.05Å; V256-L265 PolarHBondContact O-N 3.22Å; V256-L267 HydrophobicContact CG2-CD2 3.92Å; V256-L294 HydrophobicContact CB-CD1 4.36Å; V256-L294 HydrophobicContact CG1-CD1 3.94Å; V256-L294 HydrophobicContact CG2-CD1 3.48Å; V256-L294 VanDerWaalsContact CG2-CD1 3.48Å; V256-V313 HydrophobicContact CG1-CB 4.47Å; V256-V313 HydrophobicContact CG1-CG1 3.81Å; V256-V313 HydrophobicContact CG1-CG2 3.83Å
257	E	96.8	Very high	90.4	Very high	49 Å²	49	58.1 Å²	58.1	23%	0.229	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.1	179.6	-65.7	178	177.6	0	0	109.7	R263 K264 V313 A314 R315	E257-R263 CarbonylContact C-O 3.49Å; E257-R263 VanDerWaalsContact CA-O 3.28Å; E257-R263 WeakPolarHBondContact CA-O 3.49Å; E257-K264 HydrophobicContact CG-CB 4.3Å; E257-K264 HydrophobicContact CG-CD 4.24Å; E257-K264 HydrophobicContact CG-CG 4.01Å; E257-K264 WeakPolarHBondContact OE1-CE 3.17Å; E257-K264 IonicContact OE1-NZ 3.38Å; E257-K264 PolarHBondContact OE1-NZ 3.37Å; E257-V313 CarbonylContact O-C 3.58Å; E257-A314 WeakPolarHBondContact O-CA 3.5Å; E257-A314 WeakPolarHBondContact O-CB 3.3Å; E257-A314 PolarHBondContact O-N 2.92Å; E257-R315 HydrophobicContact CB-CB 4.31Å; E257-R315 PolarHBondContact N-O 3.48Å; E257-R315 PolarHBondContact O-N 3.36Å
258	T	94.8	Very high	90.4	Very high	6 Å²	6	56.3 Å²	56.3	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	154.7	179.4	60	0	0	0	0	112.4	P261 P262 R263 V300 T311 R312	T258-P261 PolarHBondContact OG1-O 2.63Å; T258-P262 WeakPolarHBondContact O-CA 3.14Å; T258-R263 HydrophobicContact CG2-CB 4.49Å; T258-R263 PolarHBondContact N-O 2.95Å; T258-R263 WeakPolarHBondContact OG1-CA 3.21Å; T258-R263 VanDerWaalsContact OG1-CB 3.28Å; T258-R263 WeakPolarHBondContact OG1-CB 3.42Å; T258-R263 PolarHBondContact OG1-N 2.95Å; T258-R263 PolarHBondContact OG1-O 3.35Å; T258-V300 HydrophobicContact CG2-CG2 3.85Å; T258-T311 HydrophobicContact CG2-CG2 3.79Å; T258-R312 CarbonylContact C-O 3.56Å; T258-R312 VanDerWaalsContact CA-O 3.29Å; T258-R312 WeakPolarHBondContact CA-O 3.41Å
259	E	91.5	Very high	90.4	Very high	85 Å²	85	50.5 Å²	50.5	40%	0.397	24%	0.236	S	C	.	.	S	Bend	trans	-72.6	-61.5	-177.6	-67.7	179.2	-179.3	0	0	112.8	R312 A314	E259-R312 HydrophobicContact CG-CB 4.47Å; E259-R312 PolarHBondContact N-O 2.89Å; E259-R312 IonicContact OE1-CZ 3.58Å; E259-R312 IonicContact OE1-NE 3.85Å; E259-R312 IonicContact OE1-NH1 2.71Å; E259-R312 PolarHBondContact OE1-NH1 3.27Å; E259-R312 IonicContact OE2-NH1 3.8Å; E259-A314 HydrophobicContact CB-CB 4.37Å; E259-A314 HydrophobicContact CG-CB 3.5Å; E259-A314 VanDerWaalsContact CG-CB 3.5Å
260	R	86.7	Confident	90.5	Very high	223 Å²	223	46.9 Å²	46.9	84%	0.842	22%	0.223	S	C	*	.	S	Bend	trans	-146.8	124.7	-175.8	-66.4	-174.8	-171.2	169.7	3.3	111.4
261	P	87.7	Confident	91	Very high	64 Å²	64	37.4 Å²	37.4	42%	0.416	19%	0.187	S	C	.	.	S	Bend	cis	-62.4	153.5	-15.1	29	-35.1	0	0	0	111	T258 R263	T258-P261 PolarHBondContact OG1-O 2.63Å; P261-R263 PolarHBondContact O-N 3.07Å
262	P	92	Very high	91.5	Very high	112 Å²	112	36.5 Å²	36.5	73%	0.727	18%	0.179	S	C	*	.			trans	-68.1	118.9	176.8	27.8	-33.3	0	0	0	109.9	T258	T258-P262 WeakPolarHBondContact O-CA 3.14Å
263	R	94.4	Very high	92.1	Very high	44 Å²	44	35.3 Å²	35.3	17%	0.166	17%	0.171	C	C	.	.			trans	-130.6	148.1	175.8	-56.1	175.9	-176.2	-173.5	10.3	107.5	E257 T258 P261 P303 D338 V339	E257-R263 CarbonylContact C-O 3.49Å; E257-R263 VanDerWaalsContact CA-O 3.28Å; E257-R263 WeakPolarHBondContact CA-O 3.49Å; T258-R263 HydrophobicContact CG2-CB 4.49Å; T258-R263 PolarHBondContact N-O 2.95Å; T258-R263 WeakPolarHBondContact OG1-CA 3.21Å; T258-R263 VanDerWaalsContact OG1-CB 3.28Å; T258-R263 WeakPolarHBondContact OG1-CB 3.42Å; T258-R263 PolarHBondContact OG1-N 2.95Å; T258-R263 PolarHBondContact OG1-O 3.35Å; P261-R263 PolarHBondContact O-N 3.07Å; R263-P303 PolarHBondContact NH1-O 3.31Å; R263-P303 PolarHBondContact NH2-O 2.73Å; R263-D338 WeakPolarHBondContact CD-O 3.3Å; R263-D338 PolarHBondContact NH1-O 3.43Å; R263-V339 HydrophobicContact CB-CG2 4.2Å
264	K	96.1	Very high	92.3	Very high	69 Å²	69	36.5 Å²	36.5	30%	0.3	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	109.6	177	-177.6	169.7	-174.2	144.9	0	109.4	V256 E257 E319 N337	V256-K264 WeakPolarHBondContact O-CA 3.44Å; E257-K264 HydrophobicContact CG-CB 4.3Å; E257-K264 HydrophobicContact CG-CD 4.24Å; E257-K264 HydrophobicContact CG-CG 4.01Å; E257-K264 WeakPolarHBondContact OE1-CE 3.17Å; E257-K264 IonicContact OE1-NZ 3.38Å; E257-K264 PolarHBondContact OE1-NZ 3.37Å; K264-E319 WeakPolarHBondContact CE-OE1 3.42Å; K264-E319 WeakPolarHBondContact CE-OE2 3.35Å; K264-E319 VanDerWaalsContact NZ-CD 3.28Å; K264-E319 IonicContact NZ-OE1 2.73Å; K264-E319 PolarHBondContact NZ-OE1 2.86Å; K264-E319 IonicContact NZ-OE2 2.66Å; K264-E319 PolarHBondContact NZ-OE2 3.23Å; K264-E319 VanDerWaalsContact NZ-OE2 3.12Å; K264-N337 VanDerWaalsContact O-CB 3.32Å; K264-N337 WeakPolarHBondContact O-CB 3.47Å; K264-N337 PolarHBondContact O-ND2 3.26Å
265	L	96.6	Very high	92.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.1	174	177.9	68.6	0	0	0	109.2	F200 V256 L267 V273 V336 V339	F200-L265 HydrophobicContact CD1-CD1 4.35Å; F200-L265 HydrophobicContact CE1-CD1 4.13Å; V256-L265 HydrophobicContact CB-CB 4.41Å; V256-L265 PolarHBondContact N-O 3.05Å; V256-L265 PolarHBondContact O-N 3.22Å; L265-L267 HydrophobicContact CD2-CD1 4.11Å; L265-L267 HydrophobicContact CD2-CD2 3.84Å; L265-L267 HydrophobicContact CG-CD2 3.87Å; L265-V273 HydrophobicContact CD2-CG2 4.37Å; L265-V336 HydrophobicContact CD1-CB 3.72Å; L265-V336 HydrophobicContact CD1-CG1 3.77Å; L265-V336 WeakPolarHBondContact CD1-O 3.34Å; L265-V339 HydrophobicContact CB-CB 4.18Å; L265-V339 HydrophobicContact CB-CG2 4.2Å; L265-V339 HydrophobicContact CD2-CB 3.95Å; L265-V339 HydrophobicContact CD2-CG1 3.72Å; L265-V339 HydrophobicContact CG-CB 4.43Å
266	L	95.1	Very high	92.3	Very high	13 Å²	13	36.8 Å²	36.8	7%	0.068	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.1	172.6	-73.1	167.5	0	0	0	109	F200 P201 F253 V254 A255 E319	F200-L266 WeakPolarHBondContact CD1-O 3.16Å; P201-L266 WeakPolarHBondContact CD-O 3.3Å; P201-L266 HydrophobicContact CG-CB 3.61Å; P201-L266 HydrophobicContact CG-CD1 4.06Å; P201-L266 HydrophobicContact CG-CG 4.49Å; F253-L266 HydrophobicContact CB-CB 4.33Å; F253-L266 HydrophobicContact CB-CD2 4.06Å; V254-L266 WeakPolarHBondContact O-CA 3.32Å; A255-L266 HydrophobicContact CB-CD2 3.54Å; L266-E319 HydrophobicContact CD2-CB 4.05Å
267	L	93.5	Very high	91.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	148.5	-179	70.9	171.9	0	0	0	109.7	C199 F200 V254 V256 L265 H271 V273 A291	C199-L267 WeakPolarHBondContact O-CA 3.27Å; F200-L267 HydrophobicContact CD1-CB 3.94Å; F200-L267 HydrophobicContact CE1-CB 3.9Å; V254-L267 PolarHBondContact N-O 2.94Å; V254-L267 PolarHBondContact O-N 2.87Å; V256-L267 HydrophobicContact CG2-CD2 3.92Å; L265-L267 HydrophobicContact CD2-CD1 4.11Å; L265-L267 HydrophobicContact CD2-CD2 3.84Å; L265-L267 HydrophobicContact CG-CD2 3.87Å; L267-H271 HydrophobicContact CB-CB 3.87Å; L267-H271 HydrophobicContact CD1-CB 3.82Å; L267-H271 HydrophobicContact CG-CB 4.02Å; L267-V273 HydrophobicContact CD1-CB 4.1Å; L267-A291 HydrophobicContact CD1-CB 3.59Å; L267-A291 HydrophobicContact CD2-CB 3.81Å; L267-A291 HydrophobicContact CG-CB 3.46Å; L267-A291 VanDerWaalsContact CG-CB 3.46Å
268	T	89.5	Confident	90.8	Very high	16 Å²	16	44 Å²	44	10%	0.098	22%	0.215	C	C	.	.			trans	-63.6	156.4	-179.9	59.1	0	0	0	0	110.9	G198 C199 F253 W270 H271	G198-T268 VanDerWaalsContact CA-OG1 3.24Å; G198-T268 WeakPolarHBondContact CA-OG1 3.47Å; C199-T268 HydrophobicContact CB-CG2 3.96Å; C199-T268 PolarHBondContact N-OG1 2.88Å; C199-T268 PolarHBondContact O-N 3.47Å; F253-T268 HydrophobicContact CD1-CG2 3.94Å; F253-T268 HydrophobicContact CE1-CG2 3.66Å; F253-T268 HydrophobicContact CZ-CG2 4.28Å; T268-W270 PolarHBondContact O-N 3.34Å; T268-H271 VanDerWaalsContact O-CB 3.28Å; T268-H271 WeakPolarHBondContact O-CB 3.42Å; T268-H271 PolarHBondContact O-N 3.3Å
269	P	86	Confident	89.5	Confident	23 Å²	23	50.3 Å²	50.3	15%	0.149	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-31.2	-175.1	-33.1	37.8	0	0	0	115.9	V254 A291 R292	V254-P269 HydrophobicContact CG2-CB 4.35Å; V254-P269 HydrophobicContact CG2-CG 4.2Å; P269-A291 PolarHBondContact O-N 2.96Å; P269-R292 HydrophobicContact CB-CB 3.96Å; P269-R292 WeakPolarHBondContact O-CB 3.42Å; P269-R292 WeakPolarHBondContact O-CG 3.43Å; P269-R292 PolarHBondContact O-N 3.32Å
270	W	84.8	Confident	88.5	Confident	29 Å²	29	50.6 Å²	50.6	11%	0.11	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.1	-176.8	-61.8	107.4	0	0	0	114.5	N190 T268 F290 R292 A345	N190-W270 HydrophobicContact CB-CH2 3.78Å; N190-W270 HydrophobicContact CB-CZ2 3.95Å; N190-W270 VanDerWaalsContact CG-CZ2 3.45Å; N190-W270 WeakPolarHBondContact OD1-CH2 3.29Å; N190-W270 WeakPolarHBondContact OD1-CZ2 3.3Å; T268-W270 PolarHBondContact O-N 3.34Å; W270-F290 HydrophobicContact CB-CD1 4.47Å; W270-F290 AromaticContact CE3-CD1 3.91Å; W270-F290 HydrophobicContact CE3-CD1 3.91Å; W270-F290 AromaticContact CE3-CD2 3.95Å; W270-F290 HydrophobicContact CE3-CD2 3.95Å; W270-F290 AromaticContact CE3-CE1 3.97Å; W270-F290 HydrophobicContact CE3-CE1 3.97Å; W270-F290 HydrophobicContact CE3-CE2 4Å; W270-F290 AromaticContact CE3-CG 3.9Å; W270-F290 HydrophobicContact CE3-CG 3.9Å; W270-F290 HydrophobicContact CE3-CZ 4.03Å; W270-F290 AromaticContact CZ3-CD2 3.95Å; W270-F290 HydrophobicContact CZ3-CD2 3.95Å; W270-F290 AromaticContact CZ3-CE2 3.94Å; W270-F290 HydrophobicContact CZ3-CE2 3.94Å; W270-F290 HydrophobicContact CZ3-CG 4.34Å; W270-F290 HydrophobicContact CZ3-CZ 4.33Å; W270-F290 WeakPolarHBondContact O-CD1 3.22Å; W270-F290 WeakPolarHBondContact O-CE1 3.47Å; W270-R292 VanDerWaalsContact CZ3-NH2 3.26Å; W270-A345 CarbonylContact O-C 3.5Å; W270-A345 WeakPolarHBondContact O-CA 3.36Å; W270-A345 VanDerWaalsContact O-CB 3.22Å; W270-A345 WeakPolarHBondContact O-CB 3.2Å
271	H	89.5	Confident	88.2	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	24%	0.237	C	C	.	.			trans	-72.9	132.5	177.5	-157	134.7	0	0	0	109.4	G198 C199 F200 L267 T268 A291 S342	G198-H271 VanDerWaalsContact C-CE1 3.4Å; G198-H271 PolarHBondContact O-CE1 3.15Å; G198-H271 PolarHBondContact O-ND1 3.49Å; C199-H271 PolarHBondContact N-ND1 3.36Å; C199-H271 VanDerWaalsContact N-ND1 3.13Å; C199-H271 PolarHBondContact O-ND1 3.23Å; F200-H271 AromaticContact CD2-CE1 3.63Å; F200-H271 AromaticContact CE1-CE1 3.71Å; F200-H271 AromaticContact CE1-ND1 3.93Å; F200-H271 AromaticContact CE1-NE2 3.99Å; F200-H271 AromaticContact CE2-CE1 3.08Å; F200-H271 WeakPolarHBondContact CE2-CE1 3.42Å; F200-H271 AromaticContact CE2-ND1 4Å; F200-H271 AromaticContact CE2-NE2 3.48Å; F200-H271 WeakPolarHBondContact CE2-NE2 3.48Å; F200-H271 AromaticContact CZ-CD2 3.96Å; F200-H271 AromaticContact CZ-CE1 3.11Å; F200-H271 WeakPolarHBondContact CZ-CE1 3.37Å; F200-H271 AromaticContact CZ-ND1 3.79Å; F200-H271 AromaticContact CZ-NE2 3.2Å; F200-H271 WeakPolarHBondContact CZ-NE2 3.29Å; L267-H271 HydrophobicContact CB-CB 3.87Å; L267-H271 HydrophobicContact CD1-CB 3.82Å; L267-H271 HydrophobicContact CG-CB 4.02Å; T268-H271 VanDerWaalsContact O-CB 3.28Å; T268-H271 WeakPolarHBondContact O-CB 3.42Å; T268-H271 PolarHBondContact O-N 3.3Å; H271-A291 WeakPolarHBondContact O-CB 3.38Å; H271-A291 PolarHBondContact O-N 3.32Å; H271-S342 PolarHBondContact CD2-O 3.13Å; H271-S342 PolarHBondContact NE2-O 3.32Å
272	L	91.3	Very high	87.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.5	179.2	-59.4	167.9	0	0	0	111.7	P288 V289 F290 S342 Y344 L347 E348	L272-P288 HydrophobicContact CB-CB 4.46Å; L272-P288 HydrophobicContact CD1-CB 4.34Å; L272-P288 HydrophobicContact CD2-CB 4.46Å; L272-V289 WeakPolarHBondContact CA-O 3.45Å; L272-F290 HydrophobicContact CD2-CD1 3.52Å; L272-F290 HydrophobicContact CD2-CE1 3.56Å; L272-F290 HydrophobicContact CD2-CG 4.25Å; L272-F290 HydrophobicContact CD2-CZ 4.31Å; L272-F290 HydrophobicContact CG-CD1 4.39Å; L272-F290 HydrophobicContact CG-CE1 4.32Å; L272-S342 PolarHBondContact O-N 3.25Å; L272-Y344 WeakPolarHBondContact CB-O 3.44Å; L272-Y344 WeakPolarHBondContact CD1-O 3.18Å; L272-Y344 WeakPolarHBondContact CG-O 3.4Å; L272-Y344 PolarHBondContact N-O 2.85Å; L272-L347 WeakPolarHBondContact CD1-O 3.49Å; L272-E348 HydrophobicContact CD2-CB 4.5Å; L272-E348 HydrophobicContact CD2-CG 4.11Å
273	V	93.6	Very high	86.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.9	171.1	60.3	0	0	0	0	108.5	L265 L267 A275 V289 L294 V300 V339	L265-V273 HydrophobicContact CD2-CG2 4.37Å; L267-V273 HydrophobicContact CD1-CB 4.1Å; V273-A275 PolarHBondContact O-N 3.24Å; V273-V289 PolarHBondContact N-O 3.43Å; V273-V289 PolarHBondContact O-N 3Å; V273-L294 HydrophobicContact CG1-CD1 3.53Å; V273-L294 HydrophobicContact CG1-CD2 4.25Å; V273-L294 HydrophobicContact CG1-CG 3.9Å; V273-V300 HydrophobicContact CG2-CG1 4.01Å; V273-V339 HydrophobicContact CG2-CG1 4.49Å
274	F	93.7	Very high	85.8	Confident	25 Å²	25	41.8 Å²	41.8	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	113.5	177.5	-63	-87.9	0	0	0	108.9	A287 P288 V300 L301 T333 L340 H350	F274-A287 WeakPolarHBondContact CA-O 3.4Å; F274-P288 HydrophobicContact CE1-CB 4.37Å; F274-V300 WeakPolarHBondContact O-CA 3.42Å; F274-L301 HydrophobicContact CB-CD1 3.93Å; F274-L301 HydrophobicContact CB-CG 4.43Å; F274-T333 HydrophobicContact CE2-CG2 3.91Å; F274-T333 HydrophobicContact CZ-CG2 3.93Å; F274-L340 HydrophobicContact CB-CD2 4.31Å; F274-L340 HydrophobicContact CD2-CB 4.45Å; F274-L340 HydrophobicContact CD2-CD2 3.34Å; F274-L340 HydrophobicContact CD2-CG 3.69Å; F274-L340 HydrophobicContact CE2-CD2 3.74Å; F274-L340 HydrophobicContact CE2-CG 4.02Å; F274-L340 HydrophobicContact CG-CD2 3.91Å; F274-H350 HydrophobicContact CE1-CB 4.4Å; F274-H350 HydrophobicContact CZ-CB 4.41Å; F274-H350 AromaticContact CZ-ND1 3.85Å
275	A	93.9	Very high	85.2	Confident	7 Å²	7	42.9 Å²	42.9	6%	0.058	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.5	-173	0	0	0	0	0	112.3	V273 A287 V289 L294 S299	V273-A275 PolarHBondContact O-N 3.24Å; A275-A287 PolarHBondContact N-O 2.91Å; A275-A287 PolarHBondContact O-N 2.85Å; A275-V289 HydrophobicContact CB-CB 4.39Å; A275-V289 HydrophobicContact CB-CG2 4.43Å; A275-L294 HydrophobicContact CB-CD2 3.48Å; A275-L294 VanDerWaalsContact CB-CD2 3.48Å; A275-S299 CarbonylContact C-O 3.6Å; A275-S299 WeakPolarHBondContact CA-O 3.46Å
276	A	93.4	Very high	84.9	Confident	5 Å²	5	44.1 Å²	44.1	4%	0.041	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	147.5	174.5	0	0	0	0	0	109.9	P281 D285 F286 S299	A276-P281 HydrophobicContact CB-CB 3.41Å; A276-P281 VanDerWaalsContact CB-CB 3.41Å; A276-P281 HydrophobicContact CB-CG 3.96Å; A276-D285 HydrophobicContact CB-CB 4.01Å; A276-D285 WeakPolarHBondContact CB-O 3.36Å; A276-F286 HydrophobicContact CB-CD1 3.87Å; A276-F286 HydrophobicContact CB-CD2 4.05Å; A276-F286 HydrophobicContact CB-CE1 3.88Å; A276-F286 HydrophobicContact CB-CE2 4.03Å; A276-F286 HydrophobicContact CB-CG 3.97Å; A276-F286 HydrophobicContact CB-CZ 3.95Å; A276-S299 PolarHBondContact N-O 2.73Å; A276-S299 PolarHBondContact O-N 3.06Å
277	R	87.9	Confident	84.6	Confident	169 Å²	169	45.6 Å²	45.6	64%	0.638	29%	0.293	S	S	*	.			trans	-95.2	145.1	175.5	-66.7	-177.8	178.5	168.1	1	109.9
278	G	74.8	Confident	84.4	Confident	34 Å²	34	47 Å²	47	35%	0.351	30%	0.302	S	S	.	.	S	Bend	trans	108.1	170.1	174.2	0	0	0	0	0	114.2
279	P	67.6	Low	84.5	Confident	137 Å²	137	47.8 Å²	47.8	89%	0.89	31%	0.306	S	S	*	.	S	Bend	trans	-78.5	-22.4	-166.5	28.7	-34.2	0	0	0	115
280	A	70.9	Confident	84.6	Confident	91 Å²	91	47.1 Å²	47.1	75%	0.752	30%	0.301	S	S	*	.	S	Bend	trans	-149	70.6	-178.4	0	0	0	0	0	110.6
281	P	79.6	Confident	84.9	Confident	15 Å²	15	45.7 Å²	45.7	10%	0.097	30%	0.296	C	S	.	.			trans	-68.4	137.2	-177.9	27.9	-32.7	0	0	0	111.1	A276 D285 F286 P310	A276-P281 HydrophobicContact CB-CB 3.41Å; A276-P281 VanDerWaalsContact CB-CB 3.41Å; A276-P281 HydrophobicContact CB-CG 3.96Å; P281-D285 HydrophobicContact CB-CB 4.11Å; P281-F286 HydrophobicContact CB-CE2 3.87Å; P281-F286 HydrophobicContact CB-CZ 4.15Å; P281-F286 HydrophobicContact CG-CE2 3.9Å; P281-F286 HydrophobicContact CG-CZ 3.73Å; P281-P310 HydrophobicContact CG-CB 4.24Å
282	S	77	Confident	84.7	Confident	54 Å²	54	47.6 Å²	47.6	38%	0.378	30%	0.303	S	S	.	.			trans	-74.5	160.1	168.3	74.3	0	0	0	0	110.5	G284 D285 F286	S282-G284 PolarHBondContact O-N 2.89Å; S282-G284 VanDerWaalsContact O-N 3.08Å; S282-D285 WeakPolarHBondContact CA-OD2 3.19Å; S282-D285 WeakPolarHBondContact CB-OD2 3.49Å; S282-D285 PolarHBondContact N-OD2 2.7Å; S282-D285 WeakPolarHBondContact O-CB 3.25Å; S282-D285 PolarHBondContact O-N 3.44Å; S282-D285 PolarHBondContact OG-OD2 2.77Å; S282-F286 WeakPolarHBondContact O-CD2 3.27Å
283	P	71	Confident	84.5	Confident	120 Å²	120	51.5 Å²	51.5	78%	0.779	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-54.8	-28.4	177.6	-27.5	35.5	0	0	0	114.3	D285	P283-D285 VanDerWaalsContact C-N 3.34Å
284	G	75.1	Confident	84.4	Confident	70 Å²	70	51.6 Å²	51.6	72%	0.722	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-77.6	-14.5	178.7	0	0	0	0	0	114.9	S282 F286	S282-G284 PolarHBondContact O-N 2.89Å; S282-G284 VanDerWaalsContact O-N 3.08Å; G284-F286 VanDerWaalsContact C-N 3.29Å; G284-F286 PolarHBondContact O-N 3.13Å
285	D	84.9	Confident	84.3	Confident	91 Å²	91	55 Å²	55	49%	0.487	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-81.9	-10.4	-177.9	-60.9	-40.6	0	0	0	112.7	A276 P281 S282 P283 A287	A276-D285 HydrophobicContact CB-CB 4.01Å; A276-D285 WeakPolarHBondContact CB-O 3.36Å; P281-D285 HydrophobicContact CB-CB 4.11Å; S282-D285 WeakPolarHBondContact CA-OD2 3.19Å; S282-D285 WeakPolarHBondContact CB-OD2 3.49Å; S282-D285 PolarHBondContact N-OD2 2.7Å; S282-D285 WeakPolarHBondContact O-CB 3.25Å; S282-D285 PolarHBondContact O-N 3.44Å; S282-D285 PolarHBondContact OG-OD2 2.77Å; P283-D285 VanDerWaalsContact C-N 3.34Å; D285-A287 PolarHBondContact O-N 3.22Å
286	F	89.9	Confident	84.2	Confident	26 Å²	26	57.8 Å²	57.8	11%	0.114	35%	0.353	C	S	.	.			trans	-79.9	115.4	-178.5	-73.2	-92.6	0	0	0	111.1	A276 P281 S282 G284 S299 L301 P310	A276-F286 HydrophobicContact CB-CD1 3.87Å; A276-F286 HydrophobicContact CB-CD2 4.05Å; A276-F286 HydrophobicContact CB-CE1 3.88Å; A276-F286 HydrophobicContact CB-CE2 4.03Å; A276-F286 HydrophobicContact CB-CG 3.97Å; A276-F286 HydrophobicContact CB-CZ 3.95Å; P281-F286 HydrophobicContact CB-CE2 3.87Å; P281-F286 HydrophobicContact CB-CZ 4.15Å; P281-F286 HydrophobicContact CG-CE2 3.9Å; P281-F286 HydrophobicContact CG-CZ 3.73Å; S282-F286 WeakPolarHBondContact O-CD2 3.27Å; G284-F286 VanDerWaalsContact C-N 3.29Å; G284-F286 PolarHBondContact O-N 3.13Å; F286-S299 WeakPolarHBondContact CE1-O 3.43Å; F286-L301 HydrophobicContact CB-CD1 4.08Å; F286-L301 HydrophobicContact CD1-CD1 3.97Å; F286-L301 HydrophobicContact CD1-CD2 3.77Å; F286-L301 HydrophobicContact CD1-CG 3.48Å; F286-L301 VanDerWaalsContact CD1-CG 3.48Å; F286-L301 HydrophobicContact CD2-CD2 3.96Å; F286-L301 HydrophobicContact CD2-CG 4.42Å; F286-L301 HydrophobicContact CE1-CD2 3.62Å; F286-L301 HydrophobicContact CE1-CG 3.68Å; F286-L301 HydrophobicContact CE2-CD2 3.83Å; F286-L301 HydrophobicContact CG-CD1 3.95Å; F286-L301 HydrophobicContact CG-CD2 3.93Å; F286-L301 HydrophobicContact CG-CG 3.88Å; F286-L301 HydrophobicContact CZ-CD2 3.65Å; F286-L301 HydrophobicContact CZ-CG 4.25Å; F286-P310 HydrophobicContact CE2-CB 4.35Å; F286-P310 HydrophobicContact CE2-CG 3.83Å; F286-P310 HydrophobicContact CZ-CB 3.77Å; F286-P310 HydrophobicContact CZ-CG 3.75Å
287	A	89.1	Confident	84.2	Confident	45 Å²	45	58.5 Å²	58.5	37%	0.372	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	153.4	175.7	0	0	0	0	0	110.6	F274 A275 D285 V289	F274-A287 WeakPolarHBondContact CA-O 3.4Å; A275-A287 PolarHBondContact N-O 2.91Å; A275-A287 PolarHBondContact O-N 2.85Å; D285-A287 PolarHBondContact O-N 3.22Å; A287-V289 HydrophobicContact CB-CG2 4.48Å; A287-V289 PolarHBondContact O-N 3.31Å
288	P	89.9	Confident	84.4	Confident	30 Å²	30	51.3 Å²	51.3	20%	0.195	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	119.3	167.6	28.9	-32.9	0	0	0	109.1	L272 F274 E348 H350	L272-P288 HydrophobicContact CB-CB 4.46Å; L272-P288 HydrophobicContact CD1-CB 4.34Å; L272-P288 HydrophobicContact CD2-CB 4.46Å; F274-P288 HydrophobicContact CE1-CB 4.37Å; P288-E348 WeakPolarHBondContact O-CG 3.19Å; P288-H350 HydrophobicContact CB-CB 4.06Å; P288-H350 HydrophobicContact CG-CB 4.06Å
289	V	89.8	Confident	85.4	Confident	31 Å²	31	50 Å²	50	19%	0.188	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.7	-179	177.3	0	0	0	0	108.8	L272 V273 A275 A287 R293	L272-V289 WeakPolarHBondContact CA-O 3.45Å; V273-V289 PolarHBondContact N-O 3.43Å; V273-V289 PolarHBondContact O-N 3Å; A275-V289 HydrophobicContact CB-CB 4.39Å; A275-V289 HydrophobicContact CB-CG2 4.43Å; A287-V289 HydrophobicContact CB-CG2 4.48Å; A287-V289 PolarHBondContact O-N 3.31Å; V289-R293 HydrophobicContact CG1-CB 3.67Å
290	F	88.5	Confident	86.7	Confident	9 Å²	9	43.5 Å²	43.5	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	136.3	172.2	-67	-54.8	0	0	0	111.7	R195 W270 L272 R292 R293 A345 E348	R195-F290 VanDerWaalsContact NH2-CZ 3.28Å; W270-F290 HydrophobicContact CB-CD1 4.47Å; W270-F290 AromaticContact CE3-CD1 3.91Å; W270-F290 HydrophobicContact CE3-CD1 3.91Å; W270-F290 AromaticContact CE3-CD2 3.95Å; W270-F290 HydrophobicContact CE3-CD2 3.95Å; W270-F290 AromaticContact CE3-CE1 3.97Å; W270-F290 HydrophobicContact CE3-CE1 3.97Å; W270-F290 HydrophobicContact CE3-CE2 4Å; W270-F290 AromaticContact CE3-CG 3.9Å; W270-F290 HydrophobicContact CE3-CG 3.9Å; W270-F290 HydrophobicContact CE3-CZ 4.03Å; W270-F290 AromaticContact CZ3-CD2 3.95Å; W270-F290 HydrophobicContact CZ3-CD2 3.95Å; W270-F290 AromaticContact CZ3-CE2 3.94Å; W270-F290 HydrophobicContact CZ3-CE2 3.94Å; W270-F290 HydrophobicContact CZ3-CG 4.34Å; W270-F290 HydrophobicContact CZ3-CZ 4.33Å; W270-F290 WeakPolarHBondContact O-CD1 3.22Å; W270-F290 WeakPolarHBondContact O-CE1 3.47Å; L272-F290 HydrophobicContact CD2-CD1 3.52Å; L272-F290 HydrophobicContact CD2-CE1 3.56Å; L272-F290 HydrophobicContact CD2-CG 4.25Å; L272-F290 HydrophobicContact CD2-CZ 4.31Å; L272-F290 HydrophobicContact CG-CD1 4.39Å; L272-F290 HydrophobicContact CG-CE1 4.32Å; F290-R292 HydrophobicContact CB-CG 4.08Å; F290-R292 PolarHBondContact O-N 2.92Å; F290-R293 HydrophobicContact CB-CG 4.45Å; F290-R293 WeakPolarHBondContact O-CB 3.12Å; F290-R293 PolarHBondContact O-N 2.92Å; F290-A345 WeakPolarHBondContact CE1-O 3.5Å; F290-E348 HydrophobicContact CD2-CB 4.34Å; F290-E348 HydrophobicContact CD2-CG 4.04Å; F290-E348 HydrophobicContact CE2-CB 3.67Å; F290-E348 HydrophobicContact CE2-CG 3.88Å; F290-E348 HydrophobicContact CZ-CB 3.82Å; F290-E348 HydrophobicContact CZ-CG 4.28Å; F290-E348 PolarHBondContact N-OE1 3.39Å
291	A	90.4	Very high	87.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-49.1	-39.7	179.7	0	0	0	0	0	113.9	V254 L267 P269 H271 R293 L294	V254-A291 HydrophobicContact CB-CB 4.1Å; V254-A291 HydrophobicContact CG1-CB 4.44Å; V254-A291 HydrophobicContact CG2-CB 4.16Å; L267-A291 HydrophobicContact CD1-CB 3.59Å; L267-A291 HydrophobicContact CD2-CB 3.81Å; L267-A291 HydrophobicContact CG-CB 3.46Å; L267-A291 VanDerWaalsContact CG-CB 3.46Å; P269-A291 PolarHBondContact O-N 2.96Å; H271-A291 WeakPolarHBondContact O-CB 3.38Å; H271-A291 PolarHBondContact O-N 3.32Å; A291-R293 PolarHBondContact O-N 3.04Å; A291-R293 VanDerWaalsContact O-N 3.14Å; A291-L294 WeakPolarHBondContact O-CB 3.4Å; A291-L294 PolarHBondContact O-N 3.24Å; A291-L294 VanDerWaalsContact O-N 3.12Å
292	R	86	Confident	88.4	Confident	40 Å²	40	39.5 Å²	39.5	15%	0.151	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.6	-21.8	178.2	72.2	-169	-173.3	118.6	2.8	114.7	D76 P269 W270 F290	D76-R292 IonicContact OD1-CZ 3.13Å; D76-R292 IonicContact OD1-NH1 2.74Å; D76-R292 PolarHBondContact OD1-NH1 3.4Å; D76-R292 IonicContact OD2-CZ 3.07Å; D76-R292 IonicContact OD2-NH1 3.98Å; D76-R292 PolarHBondContact OD2-NH1 2.74Å; P269-R292 HydrophobicContact CB-CB 3.96Å; P269-R292 WeakPolarHBondContact O-CB 3.42Å; P269-R292 WeakPolarHBondContact O-CG 3.43Å; P269-R292 PolarHBondContact O-N 3.32Å; W270-R292 VanDerWaalsContact CZ3-NH2 3.26Å; F290-R292 HydrophobicContact CB-CG 4.08Å; F290-R292 PolarHBondContact O-N 2.92Å
293	R	87.4	Confident	89	Confident	82 Å²	82	37.6 Å²	37.6	31%	0.309	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-89	-12.3	-179.4	-66	-177.7	174.3	179.6	0.6	112.9	V289 F290 A291 E348	V289-R293 HydrophobicContact CG1-CB 3.67Å; F290-R293 HydrophobicContact CB-CG 4.45Å; F290-R293 WeakPolarHBondContact O-CB 3.12Å; F290-R293 PolarHBondContact O-N 2.92Å; A291-R293 PolarHBondContact O-N 3.04Å; A291-R293 VanDerWaalsContact O-N 3.14Å; R293-E348 IonicContact CZ-OE1 2.83Å; R293-E348 IonicContact CZ-OE2 3.91Å; R293-E348 IonicContact NE-OE1 2.57Å; R293-E348 IonicContact NH1-OE1 3.23Å; R293-E348 PolarHBondContact NH1-OE1 2.91Å; R293-E348 IonicContact NH1-OE2 3.8Å; R293-E348 PolarHBondContact NH1-OE2 2.88Å; R293-E348 IonicContact NH2-OE2 3.19Å
294	L	91.5	Very high	89.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	21%	0.21	C	C	.	.			trans	-61.8	145.9	174.6	-76.8	178.3	0	0	0	111.5	V256 V273 A275 A291 D298 V300 V316	V256-L294 HydrophobicContact CB-CD1 4.36Å; V256-L294 HydrophobicContact CG1-CD1 3.94Å; V256-L294 HydrophobicContact CG2-CD1 3.48Å; V256-L294 VanDerWaalsContact CG2-CD1 3.48Å; V273-L294 HydrophobicContact CG1-CD1 3.53Å; V273-L294 HydrophobicContact CG1-CD2 4.25Å; V273-L294 HydrophobicContact CG1-CG 3.9Å; A275-L294 HydrophobicContact CB-CD2 3.48Å; A275-L294 VanDerWaalsContact CB-CD2 3.48Å; A291-L294 WeakPolarHBondContact O-CB 3.4Å; A291-L294 PolarHBondContact O-N 3.24Å; A291-L294 VanDerWaalsContact O-N 3.12Å; L294-D298 HydrophobicContact CD2-CB 4.26Å; L294-V300 HydrophobicContact CD1-CG1 4.29Å; L294-V300 HydrophobicContact CD2-CG1 4.22Å; L294-V316 HydrophobicContact CB-CG2 4.1Å
295	R	91.2	Very high	89.8	Confident	98 Å²	98	33 Å²	33	37%	0.37	20%	0.204	S	C	.	.			trans	-131.6	156.5	176.6	-57.2	-177.8	-174.7	-136	5.4	109.9	R75 G297 D298	R75-R295 VanDerWaalsContact NH1-NE 3.18Å; R75-R295 VanDerWaalsContact NH1-NH2 3.18Å; R295-G297 PolarHBondContact O-N 2.76Å; R295-D298 PolarHBondContact N-OD2 3.04Å; R295-D298 WeakPolarHBondContact O-CB 3.25Å; R295-D298 PolarHBondContact O-N 3.16Å; R295-D298 VanDerWaalsContact O-N 3.16Å
296	A	93.1	Very high	89.5	Confident	65 Å²	65	35.7 Å²	35.7	54%	0.537	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	135.8	165.1	0	0	0	0	0	109.3	A314	A296-A314 WeakPolarHBondContact CB-O 3.46Å
297	G	91.6	Very high	89.3	Confident	20 Å²	20	36.8 Å²	36.8	21%	0.206	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-15.9	-174.2	0	0	0	0	0	115.3	R295 V313	R295-G297 PolarHBondContact O-N 2.76Å; G297-V313 PolarHBondContact N-O 2.84Å
298	D	94	Very high	89.3	Confident	18 Å²	18	35.9 Å²	35.9	10%	0.096	22%	0.221	C	C	.	.			trans	-66.3	166.2	168.8	-67.2	-18.7	0	0	0	110.4	L294 R295 V313	L294-D298 HydrophobicContact CD2-CB 4.26Å; R295-D298 PolarHBondContact N-OD2 3.04Å; R295-D298 WeakPolarHBondContact O-CB 3.25Å; R295-D298 PolarHBondContact O-N 3.16Å; R295-D298 VanDerWaalsContact O-N 3.16Å; D298-V313 HydrophobicContact CB-CG2 4.47Å; D298-V313 WeakPolarHBondContact O-CB 3.3Å; D298-V313 WeakPolarHBondContact O-CG2 3.22Å; D298-V313 PolarHBondContact O-N 2.86Å
299	S	94.4	Very high	89.4	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.8	173.2	-63.8	0	0	0	0	111.2	A275 A276 F286 T311	A275-S299 CarbonylContact C-O 3.6Å; A275-S299 WeakPolarHBondContact CA-O 3.46Å; A276-S299 PolarHBondContact N-O 2.73Å; A276-S299 PolarHBondContact O-N 3.06Å; F286-S299 WeakPolarHBondContact CE1-O 3.43Å; S299-T311 WeakPolarHBondContact CA-O 3.38Å
300	V	94.6	Very high	89.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	161.1	172.4	-66.2	0	0	0	0	110.5	T258 V273 F274 L294 T311 V313 V339	T258-V300 HydrophobicContact CG2-CG2 3.85Å; V273-V300 HydrophobicContact CG2-CG1 4.01Å; F274-V300 WeakPolarHBondContact O-CA 3.42Å; L294-V300 HydrophobicContact CD1-CG1 4.29Å; L294-V300 HydrophobicContact CD2-CG1 4.22Å; V300-T311 PolarHBondContact N-O 3.44Å; V300-T311 PolarHBondContact O-N 2.81Å; V300-V313 HydrophobicContact CG1-CG2 3.82Å; V300-V313 HydrophobicContact CG2-CG2 4.21Å; V300-V339 HydrophobicContact CB-CG1 4.08Å; V300-V339 HydrophobicContact CG2-CG1 3.93Å
301	L	93.6	Very high	89.7	Confident	22 Å²	22	41.1 Å²	41.1	12%	0.115	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.3	178.7	-67.7	174.6	0	0	0	112.2	F274 F286 L308 L340	F274-L301 HydrophobicContact CB-CD1 3.93Å; F274-L301 HydrophobicContact CB-CG 4.43Å; F286-L301 HydrophobicContact CB-CD1 4.08Å; F286-L301 HydrophobicContact CD1-CD1 3.97Å; F286-L301 HydrophobicContact CD1-CD2 3.77Å; F286-L301 HydrophobicContact CD1-CG 3.48Å; F286-L301 VanDerWaalsContact CD1-CG 3.48Å; F286-L301 HydrophobicContact CD2-CD2 3.96Å; F286-L301 HydrophobicContact CD2-CG 4.42Å; F286-L301 HydrophobicContact CE1-CD2 3.62Å; F286-L301 HydrophobicContact CE1-CG 3.68Å; F286-L301 HydrophobicContact CE2-CD2 3.83Å; F286-L301 HydrophobicContact CG-CD1 3.95Å; F286-L301 HydrophobicContact CG-CD2 3.93Å; F286-L301 HydrophobicContact CG-CG 3.88Å; F286-L301 HydrophobicContact CZ-CD2 3.65Å; F286-L301 HydrophobicContact CZ-CG 4.25Å; L301-L308 HydrophobicContact CB-CB 4.41Å; L301-L308 HydrophobicContact CB-CD1 4.26Å; L301-L308 HydrophobicContact CD1-CD1 4.21Å; L301-L308 HydrophobicContact CD2-CB 4.4Å; L301-L340 HydrophobicContact CB-CB 4.01Å; L301-L340 HydrophobicContact CB-CD2 4.33Å; L301-L340 HydrophobicContact CD1-CD2 4.08Å; L301-L340 PolarHBondContact O-N 2.84Å
302	A	92.7	Very high	89.8	Confident	1 Å²	1	47 Å²	47	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	146.9	-175.3	0	0	0	0	0	109.8	G304 L308 Q309 T311 D338	A302-G304 PolarHBondContact O-N 3.23Å; A302-L308 WeakPolarHBondContact O-CA 3.4Å; A302-Q309 PolarHBondContact N-O 3.21Å; A302-Q309 PolarHBondContact O-N 3.11Å; A302-T311 VanDerWaalsContact CB-OG1 3.28Å; A302-T311 WeakPolarHBondContact CB-OG1 3.43Å; A302-D338 WeakPolarHBondContact CB-O 3.47Å
303	P	90.2	Very high	90.3	Very high	14 Å²	14	45 Å²	45	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	132.7	177.9	22.5	-35.7	0	0	0	111.9	V234 R263 L335 D338	V234-P303 HydrophobicContact CG2-CB 4.34Å; R263-P303 PolarHBondContact NH1-O 3.31Å; R263-P303 PolarHBondContact NH2-O 2.73Å; P303-L335 HydrophobicContact CB-CD1 4.43Å; P303-L335 HydrophobicContact CG-CD1 4.13Å; P303-L335 HydrophobicContact CG-CD2 4.4Å; P303-D338 WeakPolarHBondContact CD-O 3.11Å; P303-D338 HydrophobicContact CG-CB 4Å
304	G	83.4	Confident	90.6	Very high	35 Å²	35	43.3 Å²	43.3	36%	0.361	27%	0.265	S	S	.	.	S	Bend	trans	-129.1	50	173.8	0	0	0	0	0	111.4	A302 A307 Q309	A302-G304 PolarHBondContact O-N 3.23Å; G304-A307 PolarHBondContact N-O 3.22Å; G304-Q309 PolarHBondContact O-NE2 3.37Å
305	G	79.4	Confident	90.8	Very high	57 Å²	57	50.1 Å²	50.1	59%	0.588	29%	0.291	S	S	*	.	S	Bend	trans	106.3	-134.1	-167.3	0	0	0	0	0	110.4	A307	G305-A307 VanDerWaalsContact C-N 3.32Å
306	D	78.3	Confident	90.9	Very high	149 Å²	149	47.6 Å²	47.6	80%	0.797	29%	0.286	S	S	*	.	S	Bend	trans	-82.3	-9.9	178.7	-64.2	-24.4	0	0	0	113.6	V234	V234-D306 PolarHBondContact N-O 2.72Å
307	A	85.8	Confident	90.9	Very high	49 Å²	49	45.5 Å²	45.5	41%	0.405	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-117.7	155	179.3	0	0	0	0	0	111.6	G304 G305	G304-A307 PolarHBondContact N-O 3.22Å; G305-A307 VanDerWaalsContact C-N 3.32Å
308	L	90.5	Very high	90.7	Very high	25 Å²	25	49.8 Å²	49.8	13%	0.131	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	142.8	169.1	-64.5	174.7	0	0	0	110.9	A228 G232 V234 L301 A302 L335 L340	A228-L308 HydrophobicContact CB-CD1 3.46Å; A228-L308 VanDerWaalsContact CB-CD1 3.46Å; A228-L308 HydrophobicContact CB-CG 4.29Å; G232-L308 WeakPolarHBondContact O-CG 3.33Å; G232-L308 PolarHBondContact O-N 3.12Å; V234-L308 HydrophobicContact CG2-CD2 4.07Å; V234-L308 HydrophobicContact CG2-CG 4.34Å; L301-L308 HydrophobicContact CB-CB 4.41Å; L301-L308 HydrophobicContact CB-CD1 4.26Å; L301-L308 HydrophobicContact CD1-CD1 4.21Å; L301-L308 HydrophobicContact CD2-CB 4.4Å; A302-L308 WeakPolarHBondContact O-CA 3.4Å; L308-L335 HydrophobicContact CD2-CD2 4.18Å; L308-L340 HydrophobicContact CD1-CD1 4.41Å; L308-L340 HydrophobicContact CD1-CD2 3.65Å; L308-L340 HydrophobicContact CD1-CG 4.39Å
309	Q	90.5	Very high	90.4	Very high	106 Å²	106	51.8 Å²	51.8	50%	0.495	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.6	176.7	-66.3	-175.3	-7.2	0	0	110.4	A302 G304 T311	A302-Q309 PolarHBondContact N-O 3.21Å; A302-Q309 PolarHBondContact O-N 3.11Å; G304-Q309 PolarHBondContact O-NE2 3.37Å; Q309-T311 PolarHBondContact O-N 3.37Å
310	P	92.2	Very high	89.9	Confident	61 Å²	61	57.6 Å²	57.6	40%	0.396	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	131	167.8	-26.9	37	0	0	0	111.5	P281 F286	P281-P310 HydrophobicContact CG-CB 4.24Å; F286-P310 HydrophobicContact CE2-CB 4.35Å; F286-P310 HydrophobicContact CE2-CG 3.83Å; F286-P310 HydrophobicContact CZ-CB 3.77Å; F286-P310 HydrophobicContact CZ-CG 3.75Å
311	T	92.1	Very high	89.6	Confident	13 Å²	13	58.3 Å²	58.3	8%	0.08	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.3	172.3	-55.9	0	0	0	0	109.2	T258 S299 V300 A302 Q309	T258-T311 HydrophobicContact CG2-CG2 3.79Å; S299-T311 WeakPolarHBondContact CA-O 3.38Å; V300-T311 PolarHBondContact N-O 3.44Å; V300-T311 PolarHBondContact O-N 2.81Å; A302-T311 VanDerWaalsContact CB-OG1 3.28Å; A302-T311 WeakPolarHBondContact CB-OG1 3.43Å; Q309-T311 PolarHBondContact O-N 3.37Å
312	R	93.6	Very high	89.4	Confident	123 Å²	123	59.8 Å²	59.8	46%	0.464	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.8	-176.7	-166.8	168.7	-172.3	-120.5	7.8	112	T258 E259 A314	T258-R312 CarbonylContact C-O 3.56Å; T258-R312 VanDerWaalsContact CA-O 3.29Å; T258-R312 WeakPolarHBondContact CA-O 3.41Å; E259-R312 HydrophobicContact CG-CB 4.47Å; E259-R312 PolarHBondContact N-O 2.89Å; E259-R312 IonicContact OE1-CZ 3.58Å; E259-R312 IonicContact OE1-NE 3.85Å; E259-R312 IonicContact OE1-NH1 2.71Å; E259-R312 PolarHBondContact OE1-NH1 3.27Å; E259-R312 IonicContact OE2-NH1 3.8Å; R312-A314 PolarHBondContact O-N 2.86Å
313	V	95.5	Very high	89.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	114.7	174.8	179.6	0	0	0	0	108.9	V256 E257 G297 D298 V300 V316	V256-V313 HydrophobicContact CG1-CB 4.47Å; V256-V313 HydrophobicContact CG1-CG1 3.81Å; V256-V313 HydrophobicContact CG1-CG2 3.83Å; E257-V313 CarbonylContact O-C 3.58Å; G297-V313 PolarHBondContact N-O 2.84Å; D298-V313 HydrophobicContact CB-CG2 4.47Å; D298-V313 WeakPolarHBondContact O-CB 3.3Å; D298-V313 WeakPolarHBondContact O-CG2 3.22Å; D298-V313 PolarHBondContact O-N 2.86Å; V300-V313 HydrophobicContact CG1-CG2 3.82Å; V300-V313 HydrophobicContact CG2-CG2 4.21Å; V313-V316 HydrophobicContact CG1-CG2 3.57Å
314	A	95.1	Very high	89	Confident	45 Å²	45	59.2 Å²	59.2	37%	0.372	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-44.5	175.6	0	0	0	0	0	111.1	E257 E259 A296 R312	E257-A314 WeakPolarHBondContact O-CA 3.5Å; E257-A314 WeakPolarHBondContact O-CB 3.3Å; E257-A314 PolarHBondContact O-N 2.92Å; E259-A314 HydrophobicContact CB-CB 4.37Å; E259-A314 HydrophobicContact CG-CB 3.5Å; E259-A314 VanDerWaalsContact CG-CB 3.5Å; A296-A314 WeakPolarHBondContact CB-O 3.46Å; R312-A314 PolarHBondContact O-N 2.86Å
315	R	94.4	Very high	89.4	Confident	146 Å²	146	57.5 Å²	57.5	55%	0.551	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.8	143.8	-171.4	-177.9	179	174.9	-176.1	-2.2	111	E257	E257-R315 HydrophobicContact CB-CB 4.31Å; E257-R315 PolarHBondContact N-O 3.48Å; E257-R315 PolarHBondContact O-N 3.36Å
316	V	94.4	Very high	90	Very high	45 Å²	45	55 Å²	55	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.6	168.1	-175.9	0	0	0	0	108	V254 A255 L294 V313	V254-V316 HydrophobicContact CG1-CG1 3.5Å; A255-V316 CarbonylContact O-C 3.45Å; A255-V316 VanDerWaalsContact O-CA 3.29Å; A255-V316 WeakPolarHBondContact O-CA 3.46Å; L294-V316 HydrophobicContact CB-CG2 4.1Å; V313-V316 HydrophobicContact CG1-CG2 3.57Å
317	A	92.3	Very high	90.8	Very high	20 Å²	20	47.9 Å²	47.9	17%	0.165	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	172.1	178.9	0	0	0	0	0	111	V254 A255	V254-A317 CarbonylContact C-O 3.59Å; V254-A317 WeakPolarHBondContact CA-O 3.45Å; A255-A317 HydrophobicContact CB-CB 4.35Å; A255-A317 PolarHBondContact N-O 2.91Å; A255-A317 PolarHBondContact O-N 3.09Å
318	R	87.2	Confident	91.1	Very high	111 Å²	111	45.6 Å²	45.6	42%	0.419	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.4	170.8	-69.7	-177.3	179.1	-109	8	109.4	F253	F253-R318 WeakPolarHBondContact O-CA 3.35Å
319	E	89.1	Confident	91.3	Very high	60 Å²	60	44.4 Å²	44.4	28%	0.28	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	141.2	179.2	-67.5	-173.9	-176.4	0	0	110.7	F253 A255 K264 L266	F253-E319 PolarHBondContact N-O 3.03Å; F253-E319 PolarHBondContact O-N 2.87Å; A255-E319 HydrophobicContact CB-CB 4.45Å; A255-E319 HydrophobicContact CB-CG 3.87Å; K264-E319 WeakPolarHBondContact CE-OE1 3.42Å; K264-E319 WeakPolarHBondContact CE-OE2 3.35Å; K264-E319 VanDerWaalsContact NZ-CD 3.28Å; K264-E319 IonicContact NZ-OE1 2.73Å; K264-E319 PolarHBondContact NZ-OE1 2.86Å; K264-E319 IonicContact NZ-OE2 2.66Å; K264-E319 PolarHBondContact NZ-OE2 3.23Å; K264-E319 VanDerWaalsContact NZ-OE2 3.12Å; L266-E319 HydrophobicContact CD2-CB 4.05Å
320	E	83.4	Confident	91.3	Very high	128 Å²	128	40.9 Å²	40.9	60%	0.598	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	133.7	171.9	-73.7	-64.3	131.4	0	0	109.7	A251 S252	A251-E320 VanDerWaalsContact C-OE2 3.26Å; S252-E320 WeakPolarHBondContact CA-OE1 3.49Å; S252-E320 WeakPolarHBondContact CB-OE1 3.27Å; S252-E320 PolarHBondContact N-OE1 3Å
321	A	88.2	Confident	91.4	Very high	14 Å²	14	41.5 Å²	41.5	12%	0.116	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	165.1	174.5	0	0	0	0	0	112.2	P201 A251 F253	P201-A321 HydrophobicContact CB-CB 3.64Å; P201-A321 HydrophobicContact CG-CB 4.4Å; A251-A321 PolarHBondContact N-O 3.25Å; A251-A321 VanDerWaalsContact N-O 3.16Å; A251-A321 PolarHBondContact O-N 2.87Å; A251-A321 VanDerWaalsContact O-N 3.11Å; F253-A321 HydrophobicContact CD2-CB 3.64Å; F253-A321 HydrophobicContact CE2-CB 3.7Å
322	V	88.6	Confident	91.3	Very high	53 Å²	53	40.9 Å²	40.9	32%	0.321	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.5	-177.1	-177.3	0	0	0	0	110.6	G202 R250	G202-V322 PolarHBondContact N-O 3.35Å; G202-V322 VanDerWaalsContact N-O 3.11Å; R250-V322 HydrophobicContact CG-CG2 4Å
323	G	86.4	Confident	91.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.6	143.8	179.7	0	0	0	0	0	111.4	P201 D246 R249	P201-G323 WeakPolarHBondContact CA-O 3.08Å; D246-G323 CarbonylContact O-C 3.55Å; D246-G323 WeakPolarHBondContact O-CA 3.22Å; R249-G323 PolarHBondContact O-N 2.82Å
324	V	88.4	Confident	91.4	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.2	173.7	-63.5	0	0	0	0	108.7	C199 R245 D246 R249 A251 F253	C199-V324 HydrophobicContact CB-CB 3.67Å; C199-V324 HydrophobicContact CB-CG1 4.2Å; R245-V324 CarbonylContact C-O 3.56Å; R245-V324 VanDerWaalsContact CA-O 3.29Å; R245-V324 WeakPolarHBondContact CA-O 3.45Å; D246-V324 HydrophobicContact CB-CG2 3.77Å; D246-V324 PolarHBondContact N-O 3.48Å; D246-V324 PolarHBondContact O-N 3.38Å; R249-V324 HydrophobicContact CB-CG1 4.4Å; R249-V324 HydrophobicContact CB-CG2 4.14Å; R249-V324 HydrophobicContact CG-CG1 4.23Å; R249-V324 HydrophobicContact CG-CG2 4.4Å; A251-V324 HydrophobicContact CB-CG1 4.11Å; F253-V324 HydrophobicContact CZ-CG1 4.2Å
325	F	92	Very high	91.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	124	-177.6	-62.4	-97.6	0	0	0	109.7	C199 F200 L216 R217 F242 R245 L247 P327	C199-F325 WeakPolarHBondContact CA-O 3.17Å; F200-F325 PolarHBondContact N-O 3.12Å; F200-F325 PolarHBondContact O-N 2.94Å; L216-F325 HydrophobicContact CB-CB 4.36Å; L216-F325 HydrophobicContact CB-CG 4.34Å; L216-F325 HydrophobicContact CD1-CB 4.41Å; R217-F325 HydrophobicContact CB-CZ 4.05Å; R217-F325 HydrophobicContact CG-CZ 4.31Å; F242-F325 HydrophobicContact CD1-CB 4.36Å; F242-F325 HydrophobicContact CD1-CD1 4.29Å; F242-F325 HydrophobicContact CE1-CB 4.41Å; F242-F325 HydrophobicContact CE1-CD1 4.09Å; R245-F325 HydrophobicContact CG-CD1 3.91Å; R245-F325 HydrophobicContact CG-CE1 3.86Å; L247-F325 HydrophobicContact CG-CZ 4.06Å; F325-P327 WeakPolarHBondContact O-CD 3.5Å
326	A	92.6	Very high	91.5	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.025	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	76.7	174.8	0	0	0	0	0	110.2	G198 F242 L243 D244	G198-A326 WeakPolarHBondContact O-CB 3.5Å; F242-A326 CarbonylContact C-O 3.56Å; F242-A326 WeakPolarHBondContact CA-O 3.41Å; L243-A326 HydrophobicContact CB-CB 4Å; L243-A326 PolarHBondContact N-O 3.46Å; D244-A326 HydrophobicContact CB-CB 4.12Å; D244-A326 PolarHBondContact O-N 3.32Å
327	P	93.6	Very high	91.5	Very high	1 Å²	1	26 Å²	26	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	135	178.5	28	-34.7	0	0	0	111.4	F200 L216 L219 V239 F242 F325 L334 C343	F200-P327 HydrophobicContact CD2-CG 4.47Å; L216-P327 HydrophobicContact CD2-CG 4.25Å; L219-P327 HydrophobicContact CD2-CB 4.21Å; V239-P327 HydrophobicContact CG1-CB 4.42Å; F242-P327 HydrophobicContact CD1-CB 4.02Å; F242-P327 HydrophobicContact CE1-CB 3.91Å; F325-P327 WeakPolarHBondContact O-CD 3.5Å; P327-L334 HydrophobicContact CB-CD2 4.28Å; P327-L334 HydrophobicContact CG-CD2 3.43Å; P327-L334 VanDerWaalsContact CG-CD2 3.43Å; P327-C343 WeakPolarHBondContact O-CB 3.48Å; P327-C343 PolarHBondContact O-SG 2.83Å
328	L	93.1	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.2	170.9	179.9	65.2	0	0	0	109.6	L240 L241 L243 C343 Y344 L360 R361	L240-L328 PolarHBondContact N-O 2.85Å; L241-L328 HydrophobicContact CD1-CB 3.74Å; L241-L328 HydrophobicContact CD1-CD2 3.88Å; L241-L328 HydrophobicContact CD1-CG 4.46Å; L241-L328 HydrophobicContact CG-CB 4.33Å; L241-L328 HydrophobicContact CG-CD2 4.16Å; L241-L328 PolarHBondContact O-N 3.1Å; L243-L328 HydrophobicContact CD2-CB 4.32Å; L243-L328 HydrophobicContact CD2-CD2 4.16Å; L243-L328 HydrophobicContact CG-CB 4.09Å; L328-C343 HydrophobicContact CD1-CB 4.14Å; L328-Y344 HydrophobicContact CD1-CE1 3.68Å; L328-L360 HydrophobicContact CD2-CD2 3.99Å; L328-R361 HydrophobicContact CD2-CG 4.19Å
329	T	94.1	Very high	92	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	164.3	172	66.2	0	0	0	0	111.2	V225 T237 P238 H331 G332 T333 L334	V225-T329 HydrophobicContact CG2-CG2 3.95Å; T237-T329 HydrophobicContact CG2-CG2 3.81Å; P238-T329 WeakPolarHBondContact O-CA 3.25Å; T329-H331 VanDerWaalsContact C-N 3.28Å; T329-H331 PolarHBondContact O-N 3.47Å; T329-G332 PolarHBondContact O-N 3.47Å; T329-G332 PolarHBondContact OG1-N 3.19Å; T329-T333 PolarHBondContact OG1-N 3.06Å; T329-T333 PolarHBondContact OG1-O 2.74Å; T329-L334 HydrophobicContact CG2-CB 4.44Å; T329-L334 HydrophobicContact CG2-CD1 4.16Å
330	A	91.6	Very high	92.3	Very high	32 Å²	32	18 Å²	18	26%	0.264	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-38.6	174.3	0	0	0	0	0	112.8	T237 P238 L240 R361	T237-A330 PolarHBondContact OG1-N 3.06Å; P238-A330 HydrophobicContact CG-CB 4.16Å; P238-A330 PolarHBondContact O-N 3.13Å; L240-A330 HydrophobicContact CD1-CB 4.26Å; L240-A330 HydrophobicContact CD2-CB 4.45Å; L240-A330 HydrophobicContact CG-CB 4.49Å; A330-R361 PolarHBondContact O-NH1 3.29Å
331	H	92.9	Very high	92.9	Very high	74 Å²	74	11.9 Å²	11.9	34%	0.343	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-12.4	177.8	-71.7	81.4	0	0	0	113.7	A227 T237 T329 T333 H354	A227-H331 HydrophobicContact CB-CB 4.4Å; T237-H331 WeakPolarHBondContact CB-ND1 3.18Å; T237-H331 PolarHBondContact OG1-N 3.24Å; T237-H331 PolarHBondContact OG1-ND1 3.3Å; T237-H331 VanDerWaalsContact OG1-ND1 3.09Å; T329-H331 VanDerWaalsContact C-N 3.28Å; T329-H331 PolarHBondContact O-N 3.47Å; H331-T333 PolarHBondContact O-N 2.99Å; H331-H354 PolarHBondContact O-CE1 3.46Å
332	G	91.6	Very high	93.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.065	C	C	.	.	S	Bend	trans	71.2	8.2	-179.3	0	0	0	0	0	114.5	T329 C343 H350	T329-G332 PolarHBondContact O-N 3.47Å; T329-G332 PolarHBondContact OG1-N 3.19Å; G332-C343 VanDerWaalsContact C-SG 3.51Å; G332-C343 WeakPolarHBondContact O-CB 3.43Å; G332-C343 PolarHBondContact O-N 2.82Å; G332-H350 PolarHBondContact O-CE1 3.45Å
333	T	94.8	Very high	93.3	Very high	7 Å²	7	9 Å²	9	4%	0.043	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	162.2	172.6	64.1	0	0	0	0	109.9	A227 A228 F274 T329 H331 A341	A227-T333 WeakPolarHBondContact CB-O 3.41Å; A228-T333 PolarHBondContact N-OG1 2.98Å; A228-T333 VanDerWaalsContact N-OG1 3.1Å; A228-T333 PolarHBondContact O-OG1 3.34Å; F274-T333 HydrophobicContact CE2-CG2 3.91Å; F274-T333 HydrophobicContact CZ-CG2 3.93Å; T329-T333 PolarHBondContact OG1-N 3.06Å; T329-T333 PolarHBondContact OG1-O 2.74Å; H331-T333 PolarHBondContact O-N 2.99Å; T333-A341 WeakPolarHBondContact CA-O 3.45Å
334	L	95.1	Very high	93.3	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.005	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	143.9	-179.2	-178.9	63.5	0	0	0	110.7	V206 V225 P327 T329 V336 A341	V206-L334 HydrophobicContact CG1-CD1 4.02Å; V206-L334 HydrophobicContact CG1-CD2 3.84Å; V206-L334 HydrophobicContact CG1-CG 4.05Å; V225-L334 HydrophobicContact CB-CD1 3.8Å; V225-L334 HydrophobicContact CG1-CD1 4.47Å; V225-L334 HydrophobicContact CG2-CD1 3.37Å; P327-L334 HydrophobicContact CB-CD2 4.28Å; P327-L334 HydrophobicContact CG-CD2 3.43Å; P327-L334 VanDerWaalsContact CG-CD2 3.43Å; T329-L334 HydrophobicContact CG2-CB 4.44Å; T329-L334 HydrophobicContact CG2-CD1 4.16Å; L334-V336 HydrophobicContact CB-CG2 4.48Å; L334-V336 HydrophobicContact CD2-CG2 3.69Å; L334-V336 HydrophobicContact CG-CG2 3.82Å; L334-A341 PolarHBondContact N-O 3.34Å; L334-A341 PolarHBondContact O-N 3.14Å
335	L	95.4	Very high	92.6	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	109.6	168.3	-71.9	173	0	0	0	110.6	L226 V234 P303 L308 V339 L340	L226-L335 HydrophobicContact CB-CD1 3.86Å; L226-L335 PolarHBondContact O-N 3.48Å; V234-L335 HydrophobicContact CG1-CD1 4.02Å; P303-L335 HydrophobicContact CB-CD1 4.43Å; P303-L335 HydrophobicContact CG-CD1 4.13Å; P303-L335 HydrophobicContact CG-CD2 4.4Å; L308-L335 HydrophobicContact CD2-CD2 4.18Å; L335-V339 WeakPolarHBondContact CA-O 3.4Å; L335-L340 HydrophobicContact CD2-CB 4.04Å; L335-L340 HydrophobicContact CD2-CD1 4.14Å
336	V	96.3	Very high	91.4	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.5	177.2	-177	0	0	0	0	108.9	F200 A204 T205 V206 L216 L265 L334 D338 V339	F200-V336 HydrophobicContact CD1-CB 4.25Å; F200-V336 HydrophobicContact CD1-CG1 3.89Å; F200-V336 HydrophobicContact CD1-CG2 4.11Å; F200-V336 HydrophobicContact CD2-CG2 4.12Å; F200-V336 HydrophobicContact CE1-CB 4.08Å; F200-V336 HydrophobicContact CE1-CG1 4.23Å; F200-V336 HydrophobicContact CE1-CG2 3.83Å; F200-V336 HydrophobicContact CE2-CG2 3.82Å; F200-V336 HydrophobicContact CG-CG1 4.24Å; F200-V336 HydrophobicContact CG-CG2 4.26Å; F200-V336 HydrophobicContact CZ-CB 4.41Å; F200-V336 HydrophobicContact CZ-CG2 3.68Å; A204-V336 HydrophobicContact CB-CG1 3.74Å; T205-V336 CarbonylContact O-C 3.51Å; T205-V336 WeakPolarHBondContact O-CA 3.45Å; V206-V336 HydrophobicContact CG1-CG2 4.19Å; L216-V336 HydrophobicContact CD1-CG1 4.5Å; L265-V336 HydrophobicContact CD1-CB 3.72Å; L265-V336 HydrophobicContact CD1-CG1 3.77Å; L265-V336 WeakPolarHBondContact CD1-O 3.34Å; L334-V336 HydrophobicContact CB-CG2 4.48Å; L334-V336 HydrophobicContact CD2-CG2 3.69Å; L334-V336 HydrophobicContact CG-CG2 3.82Å; V336-D338 PolarHBondContact O-N 2.96Å; V336-D338 VanDerWaalsContact O-N 3.1Å; V336-V339 PolarHBondContact N-O 2.81Å; V336-V339 PolarHBondContact O-N 3.49Å
337	N	95.7	Very high	90	Very high	37 Å²	37	13.2 Å²	13.2	20%	0.198	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	37.7	-171.3	-68.4	14	0	0	0	112.5	T205 K264 V339	T205-N337 PolarHBondContact N-OD1 3.07Å; T205-N337 PolarHBondContact O-N 3.16Å; T205-N337 PolarHBondContact O-OD1 3.18Å; T205-N337 PolarHBondContact OG1-OD1 2.88Å; K264-N337 VanDerWaalsContact O-CB 3.32Å; K264-N337 WeakPolarHBondContact O-CB 3.47Å; K264-N337 PolarHBondContact O-ND2 3.26Å; N337-V339 VanDerWaalsContact C-N 3.32Å; N337-V339 PolarHBondContact O-N 2.97Å
338	D	94.3	Very high	88.7	Confident	15 Å²	15	16.5 Å²	16.5	8%	0.08	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	34.7	-174.1	-53.5	-68.7	0	0	0	114.5	R207 R213 R263 A302 P303 V336	R207-D338 WeakPolarHBondContact CD-OD1 3.5Å; R207-D338 IonicContact NH1-OD1 3.66Å; R213-D338 IonicContact CZ-OD2 3.75Å; R213-D338 IonicContact NH1-OD2 3.82Å; R213-D338 PolarHBondContact NH1-OD2 2.98Å; R213-D338 IonicContact NH2-OD1 3.37Å; R213-D338 IonicContact NH2-OD2 3.35Å; R213-D338 PolarHBondContact NH2-OD2 3.5Å; R263-D338 WeakPolarHBondContact CD-O 3.3Å; R263-D338 PolarHBondContact NH1-O 3.43Å; A302-D338 WeakPolarHBondContact CB-O 3.47Å; P303-D338 WeakPolarHBondContact CD-O 3.11Å; P303-D338 HydrophobicContact CG-CB 4Å; V336-D338 PolarHBondContact O-N 2.96Å; V336-D338 VanDerWaalsContact O-N 3.1Å
339	V	95.6	Very high	87.9	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.6	168.1	-178.4	0	0	0	0	108.4	R263 L265 V273 V300 L335 V336 N337 A341	R263-V339 HydrophobicContact CB-CG2 4.2Å; L265-V339 HydrophobicContact CB-CB 4.18Å; L265-V339 HydrophobicContact CB-CG2 4.2Å; L265-V339 HydrophobicContact CD2-CB 3.95Å; L265-V339 HydrophobicContact CD2-CG1 3.72Å; L265-V339 HydrophobicContact CG-CB 4.43Å; V273-V339 HydrophobicContact CG2-CG1 4.49Å; V300-V339 HydrophobicContact CB-CG1 4.08Å; V300-V339 HydrophobicContact CG2-CG1 3.93Å; L335-V339 WeakPolarHBondContact CA-O 3.4Å; V336-V339 PolarHBondContact N-O 2.81Å; V336-V339 PolarHBondContact O-N 3.49Å; N337-V339 VanDerWaalsContact C-N 3.32Å; N337-V339 PolarHBondContact O-N 2.97Å; V339-A341 PolarHBondContact O-N 2.93Å
340	L	95.6	Very high	87.3	Confident	7 Å²	7	19 Å²	19	4%	0.037	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	124.4	-179.4	-173.5	76.2	0	0	0	110.5	A228 F274 L301 L308 L335	A228-L340 HydrophobicContact CB-CD1 3.58Å; A228-L340 HydrophobicContact CB-CD2 4.13Å; F274-L340 HydrophobicContact CB-CD2 4.31Å; F274-L340 HydrophobicContact CD2-CB 4.45Å; F274-L340 HydrophobicContact CD2-CD2 3.34Å; F274-L340 HydrophobicContact CD2-CG 3.69Å; F274-L340 HydrophobicContact CE2-CD2 3.74Å; F274-L340 HydrophobicContact CE2-CG 4.02Å; F274-L340 HydrophobicContact CG-CD2 3.91Å; L301-L340 HydrophobicContact CB-CB 4.01Å; L301-L340 HydrophobicContact CB-CD2 4.33Å; L301-L340 HydrophobicContact CD1-CD2 4.08Å; L301-L340 PolarHBondContact O-N 2.84Å; L308-L340 HydrophobicContact CD1-CD1 4.41Å; L308-L340 HydrophobicContact CD1-CD2 3.65Å; L308-L340 HydrophobicContact CD1-CG 4.39Å; L335-L340 HydrophobicContact CD2-CB 4.04Å; L335-L340 HydrophobicContact CD2-CD1 4.14Å
341	A	95.3	Very high	87	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	156.8	172	0	0	0	0	0	110.9	F200 T333 L334 V339	F200-A341 HydrophobicContact CE1-CB 3.95Å; F200-A341 HydrophobicContact CZ-CB 3.59Å; T333-A341 WeakPolarHBondContact CA-O 3.45Å; L334-A341 PolarHBondContact N-O 3.34Å; L334-A341 PolarHBondContact O-N 3.14Å; V339-A341 PolarHBondContact O-N 2.93Å
342	S	93.6	Very high	86.6	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	152.3	169.9	-169.7	0	0	0	0	109.6	H271 L272 Y344 H350	H271-S342 PolarHBondContact CD2-O 3.13Å; H271-S342 PolarHBondContact NE2-O 3.32Å; L272-S342 PolarHBondContact O-N 3.25Å; S342-Y344 PolarHBondContact O-N 3.37Å; S342-Y344 VanDerWaalsContact O-N 3.15Å; S342-Y344 VanDerWaalsContact OG-CD2 3.29Å; S342-Y344 WeakPolarHBondContact OG-CD2 3.15Å; S342-Y344 PolarHBondContact OG-N 2.83Å; S342-H350 PolarHBondContact OG-ND1 3.46Å
343	C	91.1	Very high	86.1	Confident	5 Å²	5	26.8 Å²	26.8	3%	0.034	13%	0.129	C	C	.	.	S	Bend	trans	-75.6	11.1	167.1	-65	0	0	0	0	113.4	L243 P327 L328 G332	L243-C343 WeakPolarHBondContact CD1-O 3.44Å; P327-C343 WeakPolarHBondContact O-CB 3.48Å; P327-C343 PolarHBondContact O-SG 2.83Å; L328-C343 HydrophobicContact CD1-CB 4.14Å; G332-C343 VanDerWaalsContact C-SG 3.51Å; G332-C343 WeakPolarHBondContact O-CB 3.43Å; G332-C343 PolarHBondContact O-N 2.82Å
344	Y	85.9	Confident	85.8	Confident	6 Å²	6	28.1 Å²	28.1	2%	0.024	14%	0.135	C	C	.	.			trans	-134.5	157.4	-167.1	-47.7	-59.9	0	0	0	111	L243 L272 L328 S342 H350 A353 H354 F357	L243-Y344 HydrophobicContact CD1-CD1 4.4Å; L272-Y344 WeakPolarHBondContact CB-O 3.44Å; L272-Y344 WeakPolarHBondContact CD1-O 3.18Å; L272-Y344 WeakPolarHBondContact CG-O 3.4Å; L272-Y344 PolarHBondContact N-O 2.85Å; L328-Y344 HydrophobicContact CD1-CE1 3.68Å; S342-Y344 PolarHBondContact O-N 3.37Å; S342-Y344 VanDerWaalsContact O-N 3.15Å; S342-Y344 VanDerWaalsContact OG-CD2 3.29Å; S342-Y344 WeakPolarHBondContact OG-CD2 3.15Å; S342-Y344 PolarHBondContact OG-N 2.83Å; Y344-H350 AromaticContact CD2-ND1 3.82Å; Y344-H350 AromaticContact CE2-CE1 3.93Å; Y344-A353 HydrophobicContact CD1-CB 4.2Å; Y344-A353 HydrophobicContact CD2-CB 3.73Å; Y344-A353 HydrophobicContact CE2-CB 4.48Å; Y344-A353 HydrophobicContact CG-CB 3.59Å; Y344-H354 HydrophobicContact CE2-CB 3.74Å; Y344-H354 AromaticContact CE2-ND1 3.65Å; Y344-H354 AromaticContact CZ-ND1 3.74Å; Y344-H354 PolarHBondContact OH-ND1 3.23Å; Y344-F357 AromaticContact CD1-CD2 3.6Å; Y344-F357 HydrophobicContact CD1-CD2 3.6Å; Y344-F357 AromaticContact CD1-CE2 3.88Å; Y344-F357 HydrophobicContact CD1-CE2 3.88Å; Y344-F357 HydrophobicContact CD1-CG 4.38Å; Y344-F357 HydrophobicContact CE1-CB 3.9Å; Y344-F357 AromaticContact CE1-CD2 3.4Å; Y344-F357 HydrophobicContact CE1-CD2 3.4Å; Y344-F357 HydrophobicContact CE1-CE2 4.1Å; Y344-F357 AromaticContact CE1-CG 3.77Å; Y344-F357 HydrophobicContact CE1-CG 3.77Å
345	A	74.1	Confident	85.5	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.033	16%	0.16	C	C	.	.			trans	-156.3	1.6	-166.5	0	0	0	0	0	115.6	R195 W270 F290	R195-A345 PolarHBondContact NH2-O 3.27Å; W270-A345 CarbonylContact O-C 3.5Å; W270-A345 WeakPolarHBondContact O-CA 3.36Å; W270-A345 VanDerWaalsContact O-CB 3.22Å; W270-A345 WeakPolarHBondContact O-CB 3.2Å; F290-A345 WeakPolarHBondContact CE1-O 3.5Å
346	V	66.3	Low	85.1	Confident	17 Å²	17	36.5 Å²	36.5	10%	0.103	18%	0.175	C	C	.	.	S	Bend	trans	-104.9	-22.7	-172.9	172.8	0	0	0	0	113	L192 R195 Y388	L192-V346 HydrophobicContact CD2-CG1 3.28Å; R195-V346 HydrophobicContact CB-CG2 4.37Å; R195-V346 VanDerWaalsContact CZ-CA 3.47Å; R195-V346 PolarHBondContact NH1-O 2.69Å; R195-V346 PolarHBondContact NH2-O 3.4Å; V346-Y388 HydrophobicContact CB-CD1 4.47Å; V346-Y388 HydrophobicContact CB-CE1 3.81Å; V346-Y388 HydrophobicContact CG1-CD1 4.06Å; V346-Y388 HydrophobicContact CG1-CE1 3.9Å; V346-Y388 HydrophobicContact CG2-CD1 4.11Å; V346-Y388 HydrophobicContact CG2-CE1 3.27Å; V346-Y388 HydrophobicContact CG2-CE2 4.25Å; V346-Y388 VanDerWaalsContact CG2-OH 3.26Å; V346-Y388 WeakPolarHBondContact CG2-OH 3.4Å
347	L	63.3	Low	84.7	Confident	69 Å²	69	37 Å²	37	36%	0.361	18%	0.177	S	C	.	.	S	Bend	trans	-124.9	137.2	172.7	-65.2	171.1	0	0	0	106.7	L272 S349 W352	L272-L347 WeakPolarHBondContact CD1-O 3.49Å; L347-S349 PolarHBondContact O-N 2.72Å; L347-W352 HydrophobicContact CD1-CB 4.28Å
348	E	66.8	Low	84.5	Confident	70 Å²	70	37.1 Å²	37.1	33%	0.327	18%	0.183	S	C	.	.	S	Bend	trans	-74.5	39.7	170.9	-151.3	169.3	-161.2	0	0	111.2	L272 P288 F290 R293	L272-E348 HydrophobicContact CD2-CB 4.5Å; L272-E348 HydrophobicContact CD2-CG 4.11Å; P288-E348 WeakPolarHBondContact O-CG 3.19Å; F290-E348 HydrophobicContact CD2-CB 4.34Å; F290-E348 HydrophobicContact CD2-CG 4.04Å; F290-E348 HydrophobicContact CE2-CB 3.67Å; F290-E348 HydrophobicContact CE2-CG 3.88Å; F290-E348 HydrophobicContact CZ-CB 3.82Å; F290-E348 HydrophobicContact CZ-CG 4.28Å; F290-E348 PolarHBondContact N-OE1 3.39Å; R293-E348 IonicContact CZ-OE1 2.83Å; R293-E348 IonicContact CZ-OE2 3.91Å; R293-E348 IonicContact NE-OE1 2.57Å; R293-E348 IonicContact NH1-OE1 3.23Å; R293-E348 PolarHBondContact NH1-OE1 2.91Å; R293-E348 IonicContact NH1-OE2 3.8Å; R293-E348 PolarHBondContact NH1-OE2 2.88Å; R293-E348 IonicContact NH2-OE2 3.19Å
349	S	76.7	Confident	84.3	Confident	33 Å²	33	39.5 Å²	39.5	23%	0.231	20%	0.199	C	C	.	.			trans	-145.5	102.1	175.5	-178.7	0	0	0	0	107.7	L347 Q351 W352 A353	L347-S349 PolarHBondContact O-N 2.72Å; S349-Q351 PolarHBondContact O-N 3.17Å; S349-W352 PolarHBondContact O-N 3.18Å; S349-W352 PolarHBondContact OG-N 2.59Å; S349-A353 PolarHBondContact O-N 3.18Å; S349-A353 VanDerWaalsContact O-N 3.09Å
350	H	81.7	Confident	83.9	Confident	18 Å²	18	39.7 Å²	39.7	8%	0.083	20%	0.2	C	C	.	.	H	α-helix	trans	-54.2	-43	173.9	173	84.8	0	0	0	111	F274 P288 G332 S342 Y344 A353 H354	F274-H350 HydrophobicContact CE1-CB 4.4Å; F274-H350 HydrophobicContact CZ-CB 4.41Å; F274-H350 AromaticContact CZ-ND1 3.85Å; P288-H350 HydrophobicContact CB-CB 4.06Å; P288-H350 HydrophobicContact CG-CB 4.06Å; G332-H350 PolarHBondContact O-CE1 3.45Å; S342-H350 PolarHBondContact OG-ND1 3.46Å; Y344-H350 AromaticContact CD2-ND1 3.82Å; Y344-H350 AromaticContact CE2-CE1 3.93Å; H350-A353 PolarHBondContact O-N 2.92Å; H350-H354 WeakPolarHBondContact O-CB 3.35Å; H350-H354 PolarHBondContact O-N 3.22Å
351	Q	84.5	Confident	83.7	Confident	103 Å²	103	41.6 Å²	41.6	48%	0.481	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-46.1	-176.9	-64.6	-62.2	-20.2	0	0	112.6	S349 H354 R355	S349-Q351 PolarHBondContact O-N 3.17Å; Q351-H354 PolarHBondContact O-N 3.15Å; Q351-R355 VanDerWaalsContact O-CG 3.31Å; Q351-R355 WeakPolarHBondContact O-CG 3.25Å; Q351-R355 PolarHBondContact O-N 2.71Å
352	W	84.3	Confident	83.3	Confident	161 Å²	161	46.4 Å²	46.4	61%	0.61	23%	0.232	S	C	*	.	H	α-helix	trans	-67.2	-42.9	177.8	-76.1	119.2	0	0	0	112.1	L347 S349 H354 R355 A356	L347-W352 HydrophobicContact CD1-CB 4.28Å; S349-W352 PolarHBondContact O-N 3.18Å; S349-W352 PolarHBondContact OG-N 2.59Å; W352-H354 VanDerWaalsContact C-N 3.33Å; W352-H354 PolarHBondContact O-N 3.43Å; W352-R355 PolarHBondContact O-N 3.48Å; W352-A356 WeakPolarHBondContact O-CB 3.45Å; W352-A356 PolarHBondContact O-N 3.29Å
353	A	82.4	Confident	82.9	Confident	6 Å²	6	50.4 Å²	50.4	5%	0.05	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-44.9	174.3	0	0	0	0	0	111.2	Y344 S349 H350 R355 A356 F357	Y344-A353 HydrophobicContact CD1-CB 4.2Å; Y344-A353 HydrophobicContact CD2-CB 3.73Å; Y344-A353 HydrophobicContact CE2-CB 4.48Å; Y344-A353 HydrophobicContact CG-CB 3.59Å; S349-A353 PolarHBondContact O-N 3.18Å; S349-A353 VanDerWaalsContact O-N 3.09Å; H350-A353 PolarHBondContact O-N 2.92Å; A353-R355 VanDerWaalsContact C-N 3.32Å; A353-R355 PolarHBondContact O-N 2.9Å; A353-A356 WeakPolarHBondContact O-CB 3.5Å; A353-A356 PolarHBondContact O-N 3.39Å; A353-A356 VanDerWaalsContact O-N 3.15Å; A353-F357 VanDerWaalsContact O-CD2 3.29Å; A353-F357 WeakPolarHBondContact O-CD2 3.37Å; A353-F357 PolarHBondContact O-N 3.11Å
354	H	87.3	Confident	82.5	Confident	36 Å²	36	51.6 Å²	51.6	17%	0.167	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-40.2	178.9	-166.6	68.1	0	0	0	112.5	H331 Y344 H350 Q351 W352 F357 A358 R361	H331-H354 PolarHBondContact O-CE1 3.46Å; Y344-H354 HydrophobicContact CE2-CB 3.74Å; Y344-H354 AromaticContact CE2-ND1 3.65Å; Y344-H354 AromaticContact CZ-ND1 3.74Å; Y344-H354 PolarHBondContact OH-ND1 3.23Å; H350-H354 WeakPolarHBondContact O-CB 3.35Å; H350-H354 PolarHBondContact O-N 3.22Å; Q351-H354 PolarHBondContact O-N 3.15Å; W352-H354 VanDerWaalsContact C-N 3.33Å; W352-H354 PolarHBondContact O-N 3.43Å; H354-F357 PolarHBondContact O-N 3.26Å; H354-A358 PolarHBondContact O-N 3.34Å; H354-A358 VanDerWaalsContact O-N 3.11Å; H354-R361 PolarHBondContact CD2-NH2 3.48Å; H354-R361 PolarHBondContact CE1-NH1 3.26Å; H354-R361 PolarHBondContact CE1-NH2 3.22Å; H354-R361 VanDerWaalsContact CE1-NH2 3.29Å; H354-R361 PolarHBondContact ND1-NH2 3.09Å; H354-R361 PolarHBondContact NE2-NH1 2.81Å; H354-R361 PolarHBondContact NE2-NH2 2.68Å; H354-R361 PolarHBondContact O-NH2 3.48Å
355	R	88.8	Confident	82.2	Confident	140 Å²	140	55.2 Å²	55.2	53%	0.528	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-44.6	172.6	-72.3	174.6	-172.1	161.1	1.4	112.1	Q351 W352 A353 F357 A358	Q351-R355 VanDerWaalsContact O-CG 3.31Å; Q351-R355 WeakPolarHBondContact O-CG 3.25Å; Q351-R355 PolarHBondContact O-N 2.71Å; W352-R355 PolarHBondContact O-N 3.48Å; A353-R355 VanDerWaalsContact C-N 3.32Å; A353-R355 PolarHBondContact O-N 2.9Å; R355-F357 PolarHBondContact O-N 3.15Å; R355-A358 WeakPolarHBondContact O-CB 3.3Å; R355-A358 PolarHBondContact O-N 2.96Å
356	A	86.8	Confident	82.5	Confident	37 Å²	37	60.7 Å²	60.7	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-34	177.9	0	0	0	0	0	112.2	W352 A353 P359 Y383 L387	W352-A356 WeakPolarHBondContact O-CB 3.45Å; W352-A356 PolarHBondContact O-N 3.29Å; A353-A356 WeakPolarHBondContact O-CB 3.5Å; A353-A356 PolarHBondContact O-N 3.39Å; A353-A356 VanDerWaalsContact O-N 3.15Å; A356-P359 WeakPolarHBondContact O-CD 3.4Å; A356-Y383 PolarHBondContact O-OH 3.47Å; A356-Y383 VanDerWaalsContact O-OH 3.06Å; A356-L387 HydrophobicContact CB-CD1 4.13Å
357	F	89.3	Confident	82.4	Confident	12 Å²	12	60.5 Å²	60.5	5%	0.053	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	2.6	174.7	-75	-80.8	0	0	0	114.3	L243 Y344 A353 H354 R355 L360 R361 Y383 L387	L243-F357 HydrophobicContact CD1-CE1 4.22Å; L243-F357 HydrophobicContact CD1-CZ 4.11Å; L243-F357 HydrophobicContact CD2-CD1 3.98Å; L243-F357 HydrophobicContact CD2-CE1 3.44Å; L243-F357 VanDerWaalsContact CD2-CE1 3.44Å; L243-F357 HydrophobicContact CD2-CZ 4.08Å; L243-F357 HydrophobicContact CG-CE1 4.48Å; Y344-F357 AromaticContact CD1-CD2 3.6Å; Y344-F357 HydrophobicContact CD1-CD2 3.6Å; Y344-F357 AromaticContact CD1-CE2 3.88Å; Y344-F357 HydrophobicContact CD1-CE2 3.88Å; Y344-F357 HydrophobicContact CD1-CG 4.38Å; Y344-F357 HydrophobicContact CE1-CB 3.9Å; Y344-F357 AromaticContact CE1-CD2 3.4Å; Y344-F357 HydrophobicContact CE1-CD2 3.4Å; Y344-F357 HydrophobicContact CE1-CE2 4.1Å; Y344-F357 AromaticContact CE1-CG 3.77Å; Y344-F357 HydrophobicContact CE1-CG 3.77Å; A353-F357 VanDerWaalsContact O-CD2 3.29Å; A353-F357 WeakPolarHBondContact O-CD2 3.37Å; A353-F357 PolarHBondContact O-N 3.11Å; H354-F357 PolarHBondContact O-N 3.26Å; R355-F357 PolarHBondContact O-N 3.15Å; F357-L360 HydrophobicContact CD1-CD2 4.01Å; F357-L360 HydrophobicContact CE1-CD2 4.44Å; F357-L360 PolarHBondContact O-N 3.48Å; F357-R361 WeakPolarHBondContact O-CG 3.41Å; F357-R361 PolarHBondContact O-N 2.69Å; F357-Y383 AromaticContact CD1-CD1 3.79Å; F357-Y383 HydrophobicContact CD1-CD1 3.79Å; F357-Y383 AromaticContact CD1-CE1 3.91Å; F357-Y383 HydrophobicContact CD1-CE1 3.91Å; F357-Y383 AromaticContact CE1-CD1 3.81Å; F357-Y383 HydrophobicContact CE1-CD1 3.81Å; F357-Y383 HydrophobicContact CE1-CE1 4.26Å; F357-L387 HydrophobicContact CD1-CD1 4.21Å; F357-L387 HydrophobicContact CD2-CD1 4.27Å; F357-L387 HydrophobicContact CE1-CD1 3.91Å; F357-L387 HydrophobicContact CE2-CD1 3.97Å; F357-L387 HydrophobicContact CG-CD1 4.38Å; F357-L387 HydrophobicContact CZ-CD1 3.79Å
358	A	91	Very high	81.9	Confident	38 Å²	38	62.3 Å²	62.3	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-41.3	178.3	0	0	0	0	0	113.5	H354 R355 L360 R361 L362	H354-A358 PolarHBondContact O-N 3.34Å; H354-A358 VanDerWaalsContact O-N 3.11Å; R355-A358 WeakPolarHBondContact O-CB 3.3Å; R355-A358 PolarHBondContact O-N 2.96Å; A358-L360 VanDerWaalsContact C-N 3.34Å; A358-L360 PolarHBondContact O-N 2.79Å; A358-R361 PolarHBondContact O-N 2.85Å; A358-L362 WeakPolarHBondContact O-CB 3.47Å; A358-L362 PolarHBondContact O-N 2.74Å
359	P	90.9	Very high	81.1	Confident	65 Å²	65	66.4 Å²	66.4	42%	0.422	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-42.9	176.5	-23.9	34.9	0	0	0	112.3	A356 R361 L362 L363	A356-P359 WeakPolarHBondContact O-CD 3.4Å; P359-R361 PolarHBondContact O-N 2.96Å; P359-L362 PolarHBondContact O-N 2.93Å; P359-L363 WeakPolarHBondContact O-CB 3.44Å; P359-L363 VanDerWaalsContact O-CG 3.28Å; P359-L363 WeakPolarHBondContact O-CG 3.05Å; P359-L363 PolarHBondContact O-N 2.81Å
360	L	87.3	Confident	79.7	Confident	6 Å²	6	70 Å²	70	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-42.2	177.1	-175.9	64.1	0	0	0	111.6	L241 L243 L328 F357 A358 L363 H364 Y383	L241-L360 HydrophobicContact CD1-CD2 4.38Å; L241-L360 HydrophobicContact CD2-CD1 4.06Å; L241-L360 HydrophobicContact CD2-CD2 3.77Å; L241-L360 HydrophobicContact CD2-CG 4.05Å; L243-L360 HydrophobicContact CD2-CD2 4.38Å; L328-L360 HydrophobicContact CD2-CD2 3.99Å; F357-L360 HydrophobicContact CD1-CD2 4.01Å; F357-L360 HydrophobicContact CE1-CD2 4.44Å; F357-L360 PolarHBondContact O-N 3.48Å; A358-L360 VanDerWaalsContact C-N 3.34Å; A358-L360 PolarHBondContact O-N 2.79Å; L360-L363 PolarHBondContact O-N 2.97Å; L360-H364 PolarHBondContact O-CD2 3.22Å; L360-H364 PolarHBondContact O-N 2.99Å; L360-Y383 HydrophobicContact CB-CD1 3.88Å; L360-Y383 HydrophobicContact CB-CE1 3.84Å; L360-Y383 HydrophobicContact CB-CG 4.33Å; L360-Y383 HydrophobicContact CD1-CG 4.37Å; L360-Y383 HydrophobicContact CD2-CD1 3.76Å; L360-Y383 HydrophobicContact CD2-CE1 4.49Å; L360-Y383 HydrophobicContact CD2-CG 4.13Å; L360-Y383 HydrophobicContact CG-CD1 4.31Å
361	R	89.9	Confident	77.8	Confident	47 Å²	47	75.3 Å²	75.3	18%	0.177	42%	0.419	C	S	.	.	H	α-helix	trans	-66.2	-40.8	176.9	-69.1	-175	-67	136.7	-2.9	112.1	L240 L328 A330 H354 F357 A358 P359 H364 A365	L240-R361 HydrophobicContact CD1-CB 4.16Å; L240-R361 HydrophobicContact CD1-CG 3.73Å; L328-R361 HydrophobicContact CD2-CG 4.19Å; A330-R361 PolarHBondContact O-NH1 3.29Å; H354-R361 PolarHBondContact CD2-NH2 3.48Å; H354-R361 PolarHBondContact CE1-NH1 3.26Å; H354-R361 PolarHBondContact CE1-NH2 3.22Å; H354-R361 VanDerWaalsContact CE1-NH2 3.29Å; H354-R361 PolarHBondContact ND1-NH2 3.09Å; H354-R361 PolarHBondContact NE2-NH1 2.81Å; H354-R361 PolarHBondContact NE2-NH2 2.68Å; H354-R361 PolarHBondContact O-NH2 3.48Å; F357-R361 WeakPolarHBondContact O-CG 3.41Å; F357-R361 PolarHBondContact O-N 2.69Å; A358-R361 PolarHBondContact O-N 2.85Å; P359-R361 PolarHBondContact O-N 2.96Å; R361-H364 PolarHBondContact O-N 3.29Å; R361-A365 WeakPolarHBondContact O-CB 3.37Å; R361-A365 PolarHBondContact O-N 2.88Å
362	L	87.7	Confident	75.9	Confident	101 Å²	101	73.1 Å²	73.1	53%	0.529	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-44.6	175.2	-179.5	63.2	0	0	0	111.1	A358 P359 H364 A365 L366	A358-L362 WeakPolarHBondContact O-CB 3.47Å; A358-L362 PolarHBondContact O-N 2.74Å; P359-L362 PolarHBondContact O-N 2.93Å; L362-H364 VanDerWaalsContact C-N 3.27Å; L362-H364 PolarHBondContact O-N 2.81Å; L362-A365 PolarHBondContact O-N 3.24Å; L362-A365 VanDerWaalsContact O-N 3.08Å; L362-L366 HydrophobicContact CD1-CD1 3.81Å; L362-L366 HydrophobicContact CD1-CD2 4.41Å; L362-L366 HydrophobicContact CD1-CG 3.88Å; L362-L366 HydrophobicContact CD2-CD1 4.28Å; L362-L366 HydrophobicContact CG-CD1 3.69Å; L362-L366 HydrophobicContact CG-CG 4.16Å; L362-L366 WeakPolarHBondContact O-CB 3.35Å; L362-L366 VanDerWaalsContact O-CG 3.3Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 3.01Å
363	L	85.2	Confident	74	Confident	85 Å²	85	69 Å²	69	45%	0.445	43%	0.432	S	S	.	.	H	α-helix	trans	-59	-38.5	174.3	-73	171.4	0	0	0	112	P359 L360 G367	P359-L363 WeakPolarHBondContact O-CB 3.44Å; P359-L363 VanDerWaalsContact O-CG 3.28Å; P359-L363 WeakPolarHBondContact O-CG 3.05Å; P359-L363 PolarHBondContact O-N 2.81Å; L360-L363 PolarHBondContact O-N 2.97Å; L363-G367 WeakPolarHBondContact O-CA 3.11Å; L363-G367 PolarHBondContact O-N 3.14Å
364	H	82.4	Confident	72.7	Confident	29 Å²	29	73.8 Å²	73.8	13%	0.134	47%	0.471	C	S	.	.	H	α-helix	trans	-70.1	-32.8	174	-90	-97.5	0	0	0	113.5	L240 L241 L360 R361 L362	L240-H364 HydrophobicContact CD1-CB 4.46Å; L240-H364 HydrophobicContact CD2-CB 4.37Å; L240-H364 PolarHBondContact O-CE1 3.08Å; L240-H364 PolarHBondContact O-ND1 3.39Å; L241-H364 WeakPolarHBondContact CD2-NE2 3.48Å; L360-H364 PolarHBondContact O-CD2 3.22Å; L360-H364 PolarHBondContact O-N 2.99Å; R361-H364 PolarHBondContact O-N 3.29Å; L362-H364 VanDerWaalsContact C-N 3.27Å; L362-H364 PolarHBondContact O-N 2.81Å
365	A	80.8	Confident	71.2	Confident	83 Å²	83	76.8 Å²	76.8	69%	0.686	50%	0.502	S	S	*	.	H	α-helix	trans	-73.5	-38.7	176.5	0	0	0	0	0	112.5	R361 L362	R361-A365 WeakPolarHBondContact O-CB 3.37Å; R361-A365 PolarHBondContact O-N 2.88Å; L362-A365 PolarHBondContact O-N 3.24Å; L362-A365 VanDerWaalsContact O-N 3.08Å
366	L	80.1	Confident	70.2	Confident	119 Å²	119	72.5 Å²	72.5	62%	0.623	49%	0.488	S	S	*	.	H	α-helix	trans	-81.1	-25.2	176.8	-63.4	175.3	0	0	0	112.4	L362 A368	L362-L366 HydrophobicContact CD1-CD1 3.81Å; L362-L366 HydrophobicContact CD1-CD2 4.41Å; L362-L366 HydrophobicContact CD1-CG 3.88Å; L362-L366 HydrophobicContact CD2-CD1 4.28Å; L362-L366 HydrophobicContact CG-CD1 3.69Å; L362-L366 HydrophobicContact CG-CG 4.16Å; L362-L366 WeakPolarHBondContact O-CB 3.35Å; L362-L366 VanDerWaalsContact O-CG 3.3Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 3.01Å; L366-A368 PolarHBondContact O-N 3.35Å
367	G	63.5	Low	69.4	Low	12 Å²	12	76 Å²	76	12%	0.124	51%	0.507	C	S	.	.			trans	-101.3	60.1	-162.1	0	0	0	0	0	115.3	L363 L369	L363-G367 WeakPolarHBondContact O-CA 3.11Å; L363-G367 PolarHBondContact O-N 3.14Å; G367-L369 PolarHBondContact O-N 2.89Å
368	A	52.8	Low	69.1	Low	108 Å²	108	80 Å²	80	89%	0.893	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	15	139.3	0	0	0	0	0	113	L366	L366-A368 PolarHBondContact O-N 3.35Å
369	L	49	Very low	68.6	Low	156 Å²	156	79.1 Å²	79.1	82%	0.817	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.2	8.4	-168.7	-79.5	162.6	0	0	0	114.4	G367	G367-L369 PolarHBondContact O-N 2.89Å
370	L	49.1	Very low	68.1	Low	107 Å²	107	77.7 Å²	77.7	56%	0.56	52%	0.516	S	S	*	.	S	Bend	trans	-86.6	122.7	166.2	-77.4	170.4	0	0	0	109.4	G372	L370-G372 PolarHBondContact O-N 3.48Å
371	P	40.1	Very low	68	Low	130 Å²	130	79 Å²	79	84%	0.844	52%	0.522	S	S	*	.			trans	-67.8	119.6	172.8	28.3	-30.1	0	0	0	108.4
372	G	44.9	Very low	67.7	Low	58 Å²	58	83.9 Å²	83.9	60%	0.598	54%	0.541	S	S	*	.			trans	174.7	79.5	-179.7	0	0	0	0	0	111.8	L370	L370-G372 PolarHBondContact O-N 3.48Å
373	G	45.2	Very low	67.5	Low	75 Å²	75	80.4 Å²	80.4	77%	0.773	52%	0.52	S	S	*	.			trans	-60.8	166.4	168	0	0	0	0	0	113.1
374	A	53.8	Low	67.4	Low	106 Å²	106	76.3 Å²	76.3	88%	0.876	50%	0.499	S	S	*	.	S	Bend	trans	-18	133.9	-178.8	0	0	0	0	0	118.6
375	A	56.5	Low	67.2	Low	98 Å²	98	80.9 Å²	80.9	81%	0.81	52%	0.515	S	S	*	.			trans	79.3	113.4	172.1	0	0	0	0	0	116.4
376	Q	67.3	Low	67.2	Low	51 Å²	51	80.6 Å²	80.6	24%	0.238	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-67.8	140.3	166.3	-80.7	-174.4	-53	0	0	110.6	F242	F242-Q376 VanDerWaalsContact CD2-OE1 3.24Å; F242-Q376 PolarHBondContact O-NE2 2.92Å; F242-Q376 PolarHBondContact O-OE1 3.31Å
377	P	70.9	Confident	67.2	Low	109 Å²	109	76.6 Å²	76.6	71%	0.708	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-63	150.4	175.4	26.1	-33	0	0	0	111.3
378	T	82	Confident	67.7	Low	96 Å²	96	77 Å²	77	59%	0.589	48%	0.479	S	S	*	.	S	Bend	trans	-60.4	136.2	175.5	-56.2	0	0	0	0	111.3	R245 D246	R245-T378 CarbonylContact O-C 3.46Å; R245-T378 VanDerWaalsContact O-CA 3.3Å; R245-T378 WeakPolarHBondContact O-CA 3.45Å; D246-T378 HydrophobicContact CB-CG2 3.85Å
379	G	80.4	Confident	68.5	Low	20 Å²	20	79.8 Å²	79.8	21%	0.206	47%	0.466	C	S	.	.	S	Bend	trans	96.9	-166.3	177.4	0	0	0	0	0	113.8	D244 R245	D244-G379 WeakPolarHBondContact OD1-CA 3.43Å; R245-G379 PolarHBondContact N-O 2.86Å; R245-G379 PolarHBondContact O-N 3.31Å
380	M	81.6	Confident	69.7	Low	36 Å²	36	75.8 Å²	75.8	18%	0.177	45%	0.445	C	S	.	.			trans	-71.3	135.4	-170.6	-171.5	-177.9	-64.7	0	0	112.5	L243 D244 R385 Y388	L243-M380 WeakPolarHBondContact O-CA 3.2Å; D244-M380 PolarHBondContact OD1-N 3.48Å; D244-M380 VanDerWaalsContact OD1-N 3.14Å; M380-R385 HydrophobicContact CB-CG 4.17Å; M380-R385 HydrophobicContact CG-CG 3.9Å; M380-R385 VanDerWaalsContact O-CZ 3.24Å; M380-R385 PolarHBondContact O-NE 2.88Å; M380-R385 PolarHBondContact O-NH2 3.12Å; M380-R385 HydrophobicContact SD-CG 3.68Å; M380-Y388 HydrophobicContact CE-CD2 3.99Å; M380-Y388 HydrophobicContact CE-CE2 3.57Å; M380-Y388 HydrophobicContact SD-CD2 3.51Å; M380-Y388 VanDerWaalsContact SD-CD2 3.51Å; M380-Y388 HydrophobicContact SD-CE2 3.37Å; M380-Y388 WeakPolarHBondContact SD-CE2 3.37Å
381	H	84.1	Confident	70.6	Confident	33 Å²	33	71.7 Å²	71.7	15%	0.153	43%	0.427	C	S	.	.			trans	-61.6	142.3	176.3	-168.4	-99.4	0	0	0	111.6	L243 Y383 S384 R385	L243-H381 WeakPolarHBondContact O-CB 3.46Å; L243-H381 PolarHBondContact O-N 3.34Å; H381-Y383 VanDerWaalsContact C-N 3.26Å; H381-Y383 PolarHBondContact ND1-N 3.1Å; H381-Y383 PolarHBondContact O-N 3.43Å; H381-S384 WeakPolarHBondContact O-CB 3.16Å; H381-S384 PolarHBondContact O-N 2.87Å; H381-S384 VanDerWaalsContact O-N 3.11Å; H381-R385 PolarHBondContact O-N 2.78Å; H381-R385 VanDerWaalsContact O-N 3.12Å
382	W	83.6	Confident	71.6	Confident	150 Å²	150	68.5 Å²	68.5	57%	0.568	40%	0.401	S	S	*	.	H	α-helix	trans	-57.5	-38.1	-174.5	70.1	-94.6	0	0	0	112.8	R385 L386	W382-R385 WeakPolarHBondContact O-CB 3.31Å; W382-R385 PolarHBondContact O-N 3.38Å; W382-L386 HydrophobicContact CZ3-CD2 4.13Å; W382-L386 PolarHBondContact O-N 3.29Å
383	Y	84.3	Confident	72.5	Confident	27 Å²	27	72.9 Å²	72.9	11%	0.106	41%	0.406	C	S	.	.	H	α-helix	trans	-67	-38.9	-179.2	-169.2	-101.3	0	0	0	111.6	A356 F357 L360 H381 R385 L386 L387	A356-Y383 PolarHBondContact O-OH 3.47Å; A356-Y383 VanDerWaalsContact O-OH 3.06Å; F357-Y383 AromaticContact CD1-CD1 3.79Å; F357-Y383 HydrophobicContact CD1-CD1 3.79Å; F357-Y383 AromaticContact CD1-CE1 3.91Å; F357-Y383 HydrophobicContact CD1-CE1 3.91Å; F357-Y383 AromaticContact CE1-CD1 3.81Å; F357-Y383 HydrophobicContact CE1-CD1 3.81Å; F357-Y383 HydrophobicContact CE1-CE1 4.26Å; L360-Y383 HydrophobicContact CB-CD1 3.88Å; L360-Y383 HydrophobicContact CB-CE1 3.84Å; L360-Y383 HydrophobicContact CB-CG 4.33Å; L360-Y383 HydrophobicContact CD1-CG 4.37Å; L360-Y383 HydrophobicContact CD2-CD1 3.76Å; L360-Y383 HydrophobicContact CD2-CE1 4.49Å; L360-Y383 HydrophobicContact CD2-CG 4.13Å; L360-Y383 HydrophobicContact CG-CD1 4.31Å; H381-Y383 VanDerWaalsContact C-N 3.26Å; H381-Y383 PolarHBondContact ND1-N 3.1Å; H381-Y383 PolarHBondContact O-N 3.43Å; Y383-R385 VanDerWaalsContact C-N 3.35Å; Y383-L386 PolarHBondContact O-N 2.98Å; Y383-L387 HydrophobicContact CD1-CD1 3.85Å; Y383-L387 HydrophobicContact CD1-CG 4.2Å; Y383-L387 HydrophobicContact CE1-CD1 3.47Å; Y383-L387 VanDerWaalsContact CE1-CD1 3.47Å; Y383-L387 HydrophobicContact CE1-CD2 4.41Å; Y383-L387 HydrophobicContact CE1-CG 3.91Å; Y383-L387 WeakPolarHBondContact O-CG 3.44Å; Y383-L387 PolarHBondContact O-N 2.74Å
384	S	82.4	Confident	73.1	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-62.1	-44.5	173.1	-48.4	0	0	0	0	110.6	L243 H381 L386 L387 Y388	L243-S384 WeakPolarHBondContact CD2-OG 3.4Å; H381-S384 WeakPolarHBondContact O-CB 3.16Å; H381-S384 PolarHBondContact O-N 2.87Å; H381-S384 VanDerWaalsContact O-N 3.11Å; S384-L386 VanDerWaalsContact C-N 3.32Å; S384-L386 PolarHBondContact O-N 3.37Å; S384-L387 PolarHBondContact O-N 3.06Å; S384-Y388 WeakPolarHBondContact O-CB 3.49Å; S384-Y388 WeakPolarHBondContact O-CD1 3.4Å; S384-Y388 WeakPolarHBondContact O-CD2 3.31Å; S384-Y388 PolarHBondContact O-N 3.01Å
385	R	78.6	Confident	73	Confident	124 Å²	124	77.4 Å²	77.4	47%	0.468	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-41.6	176.8	-62.4	-178.6	-163.9	-171.1	1.4	112	M380 H381 W382 Y383 Y388 R389	M380-R385 HydrophobicContact CB-CG 4.17Å; M380-R385 HydrophobicContact CG-CG 3.9Å; M380-R385 VanDerWaalsContact O-CZ 3.24Å; M380-R385 PolarHBondContact O-NE 2.88Å; M380-R385 PolarHBondContact O-NH2 3.12Å; M380-R385 HydrophobicContact SD-CG 3.68Å; H381-R385 PolarHBondContact O-N 2.78Å; H381-R385 VanDerWaalsContact O-N 3.12Å; W382-R385 WeakPolarHBondContact O-CB 3.31Å; W382-R385 PolarHBondContact O-N 3.38Å; Y383-R385 VanDerWaalsContact C-N 3.35Å; R385-Y388 PolarHBondContact O-N 2.96Å; R385-R389 WeakPolarHBondContact O-CG 3.48Å; R385-R389 PolarHBondContact O-N 3.02Å
386	L	81.4	Confident	72.1	Confident	77 Å²	77	78.1 Å²	78.1	40%	0.403	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-51.1	176.9	176.8	65.3	0	0	0	111.1	W382 Y383 S384 Y388 R389 L390	W382-L386 HydrophobicContact CZ3-CD2 4.13Å; W382-L386 PolarHBondContact O-N 3.29Å; Y383-L386 PolarHBondContact O-N 2.98Å; S384-L386 VanDerWaalsContact C-N 3.32Å; S384-L386 PolarHBondContact O-N 3.37Å; L386-Y388 PolarHBondContact O-N 2.97Å; L386-R389 PolarHBondContact O-N 3.22Å; L386-L390 HydrophobicContact CD1-CD1 4.28Å; L386-L390 HydrophobicContact CD1-CG 4.4Å; L386-L390 HydrophobicContact CG-CD1 4.15Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 2.81Å
387	L	80.1	Confident	72.4	Confident	35 Å²	35	79.5 Å²	79.5	18%	0.183	42%	0.421	C	S	.	.	H	α-helix	trans	-59.8	-36.6	178	-73.6	-177.6	0	0	0	112.1	A356 F357 Y383 S384 L390 A391	A356-L387 HydrophobicContact CB-CD1 4.13Å; F357-L387 HydrophobicContact CD1-CD1 4.21Å; F357-L387 HydrophobicContact CD2-CD1 4.27Å; F357-L387 HydrophobicContact CE1-CD1 3.91Å; F357-L387 HydrophobicContact CE2-CD1 3.97Å; F357-L387 HydrophobicContact CG-CD1 4.38Å; F357-L387 HydrophobicContact CZ-CD1 3.79Å; Y383-L387 HydrophobicContact CD1-CD1 3.85Å; Y383-L387 HydrophobicContact CD1-CG 4.2Å; Y383-L387 HydrophobicContact CE1-CD1 3.47Å; Y383-L387 VanDerWaalsContact CE1-CD1 3.47Å; Y383-L387 HydrophobicContact CE1-CD2 4.41Å; Y383-L387 HydrophobicContact CE1-CG 3.91Å; Y383-L387 WeakPolarHBondContact O-CG 3.44Å; Y383-L387 PolarHBondContact O-N 2.74Å; S384-L387 PolarHBondContact O-N 3.06Å; L387-L390 PolarHBondContact O-N 2.76Å; L387-A391 VanDerWaalsContact O-CB 3.29Å; L387-A391 WeakPolarHBondContact O-CB 3.49Å; L387-A391 PolarHBondContact O-N 2.98Å
388	Y	72.4	Confident	72.4	Confident	22 Å²	22	77.9 Å²	77.9	9%	0.086	41%	0.406	C	S	.	.	H	α-helix	trans	-69.3	-41.5	177.8	-62.5	-12.7	0	0	0	112.1	G197 V346 M380 S384 R385 L386 L390 A391 E392	G197-Y388 WeakPolarHBondContact CA-OH 3.35Å; V346-Y388 HydrophobicContact CB-CD1 4.47Å; V346-Y388 HydrophobicContact CB-CE1 3.81Å; V346-Y388 HydrophobicContact CG1-CD1 4.06Å; V346-Y388 HydrophobicContact CG1-CE1 3.9Å; V346-Y388 HydrophobicContact CG2-CD1 4.11Å; V346-Y388 HydrophobicContact CG2-CE1 3.27Å; V346-Y388 HydrophobicContact CG2-CE2 4.25Å; V346-Y388 VanDerWaalsContact CG2-OH 3.26Å; V346-Y388 WeakPolarHBondContact CG2-OH 3.4Å; M380-Y388 HydrophobicContact CE-CD2 3.99Å; M380-Y388 HydrophobicContact CE-CE2 3.57Å; M380-Y388 HydrophobicContact SD-CD2 3.51Å; M380-Y388 VanDerWaalsContact SD-CD2 3.51Å; M380-Y388 HydrophobicContact SD-CE2 3.37Å; M380-Y388 WeakPolarHBondContact SD-CE2 3.37Å; S384-Y388 WeakPolarHBondContact O-CB 3.49Å; S384-Y388 WeakPolarHBondContact O-CD1 3.4Å; S384-Y388 WeakPolarHBondContact O-CD2 3.31Å; S384-Y388 PolarHBondContact O-N 3.01Å; R385-Y388 PolarHBondContact O-N 2.96Å; L386-Y388 PolarHBondContact O-N 2.97Å; Y388-L390 PolarHBondContact O-N 2.82Å; Y388-A391 PolarHBondContact O-N 2.74Å; Y388-E392 WeakPolarHBondContact O-CG 3.41Å; Y388-E392 PolarHBondContact O-N 2.73Å
389	R	71.7	Confident	71.9	Confident	165 Å²	165	76.9 Å²	76.9	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-60.9	-44.6	173.2	-73.1	178.3	-174.7	-178.8	-0.2	112	R385 L386 A391 E392 E393	R385-R389 WeakPolarHBondContact O-CG 3.48Å; R385-R389 PolarHBondContact O-N 3.02Å; L386-R389 PolarHBondContact O-N 3.22Å; R389-A391 VanDerWaalsContact C-N 3.34Å; R389-A391 PolarHBondContact O-N 3.44Å; R389-E392 WeakPolarHBondContact O-CB 3.5Å; R389-E392 PolarHBondContact O-N 2.88Å; R389-E393 WeakPolarHBondContact O-CG 3.12Å; R389-E393 PolarHBondContact O-N 2.89Å
390	L	73.9	Confident	71.4	Confident	72 Å²	72	80.2 Å²	80.2	38%	0.377	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-39.7	177.1	-69.1	173.1	0	0	0	111.9	L386 L387 Y388 E392 E393 L394	L386-L390 HydrophobicContact CD1-CD1 4.28Å; L386-L390 HydrophobicContact CD1-CG 4.4Å; L386-L390 HydrophobicContact CG-CD1 4.15Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 2.81Å; L387-L390 PolarHBondContact O-N 2.76Å; Y388-L390 PolarHBondContact O-N 2.82Å; L390-E392 VanDerWaalsContact C-N 3.35Å; L390-E393 PolarHBondContact O-N 2.74Å; L390-L394 VanDerWaalsContact O-CB 3.3Å; L390-L394 WeakPolarHBondContact O-CB 3.35Å; L390-L394 VanDerWaalsContact O-CG 3.27Å; L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 2.86Å
391	A	66.4	Low	70.8	Confident	21 Å²	21	83 Å²	83	17%	0.174	42%	0.422	C	S	.	.	H	α-helix	trans	-65.4	-38.1	174.8	0	0	0	0	0	111.9	L192 L387 Y388 R389 E393 L395	L192-A391 HydrophobicContact CD1-CB 3.86Å; L387-A391 VanDerWaalsContact O-CB 3.29Å; L387-A391 WeakPolarHBondContact O-CB 3.49Å; L387-A391 PolarHBondContact O-N 2.98Å; Y388-A391 PolarHBondContact O-N 2.74Å; R389-A391 VanDerWaalsContact C-N 3.34Å; R389-A391 PolarHBondContact O-N 3.44Å; A391-E393 VanDerWaalsContact C-N 3.34Å; A391-L395 HydrophobicContact CB-CD1 4.32Å; A391-L395 VanDerWaalsContact O-CB 3.23Å; A391-L395 WeakPolarHBondContact O-CB 3.29Å; A391-L395 PolarHBondContact O-N 3.02Å
392	E	62.2	Low	69.9	Low	64 Å²	64	86.3 Å²	86.3	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-38.4	173.7	-76.2	178.1	168.8	0	0	112	L192 A193 Y388 R389 L390 G396	L192-E392 HydrophobicContact CB-CG 3.51Å; L192-E392 WeakPolarHBondContact CB-OE1 3.47Å; L192-E392 HydrophobicContact CD1-CB 4.2Å; L192-E392 HydrophobicContact CD1-CG 3.4Å; L192-E392 HydrophobicContact CG-CG 4.04Å; A193-E392 PolarHBondContact N-OE1 2.89Å; A193-E392 VanDerWaalsContact N-OE1 3.13Å; Y388-E392 WeakPolarHBondContact O-CG 3.41Å; Y388-E392 PolarHBondContact O-N 2.73Å; R389-E392 WeakPolarHBondContact O-CB 3.5Å; R389-E392 PolarHBondContact O-N 2.88Å; L390-E392 VanDerWaalsContact C-N 3.35Å; E392-G396 PolarHBondContact O-N 3.47Å
393	E	63.5	Low	68.9	Low	150 Å²	150	81.8 Å²	81.8	70%	0.701	43%	0.43	S	S	*	.	H	α-helix	trans	-76.5	-33.2	179.3	-72.3	175.1	-174.2	0	0	113.4	R389 L390 A391	R389-E393 WeakPolarHBondContact O-CG 3.12Å; R389-E393 PolarHBondContact O-N 2.89Å; L390-E393 PolarHBondContact O-N 2.74Å; A391-E393 VanDerWaalsContact C-N 3.34Å
394	L	58.3	Low	67.7	Low	142 Å²	142	86 Å²	86	74%	0.743	46%	0.455	S	S	*	.	H	α-helix	trans	-91.9	-28.3	-175.3	-70.2	169.4	0	0	0	114.2	L390	L390-L394 VanDerWaalsContact O-CB 3.3Å; L390-L394 WeakPolarHBondContact O-CB 3.35Å; L390-L394 VanDerWaalsContact O-CG 3.27Å; L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 2.86Å
395	L	51.2	Low	66.5	Low	133 Å²	133	93.2 Å²	93.2	70%	0.696	49%	0.493	S	S	*	.			trans	-103.3	5.7	179.1	-58	170	0	0	0	112.3	A391	A391-L395 HydrophobicContact CB-CD1 4.32Å; A391-L395 VanDerWaalsContact O-CB 3.23Å; A391-L395 WeakPolarHBondContact O-CB 3.29Å; A391-L395 PolarHBondContact O-N 3.02Å
396	G	38.3	Very low	65.4	Low	113 Å²	113	90.4 Å²	90.4	100%	1.165	50%	0.496	S	S	*	.			trans	-81	0	178.7	0	0	0	0	0	113.2	E392	E392-G396 PolarHBondContact O-N 3.47Å

Retrieved 396 of 396 residues in 548.5 ms (Link to these results)

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