A0A096NVK3_PAPAN Loading...

Arginine-hydroxylase NDUFAF5, mitochondrial

Arginine hydroxylase that mediates hydroxylation of 'Arg-111' of NDUFS7 and is involved in the assembly of mitochondrial NADH:ubiquinone oxidoreductase complex (complex I, MT-ND1) at early stages. May also have methyltransferase activity.

AlphaFold DB , UniProt , Accession A0A096NVK3, Species PAPAN (Papio anubis, Olive baboon), Gene NDUFAF5, Length 345 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	31.7	Very low	238 Å²	238	154.7 Å²	154.7	100%	1.172	85%	0.846	S	S	*	*				0	125.9	0	-69.3	173.9	179.2	0	0	106.6
2	L	31.4	Very low	31.3	Very low	165 Å²	165	161.7 Å²	161.7	86%	0.864	85%	0.85	S	S	*	*			cis	-161.6	141.6	4.4	-112.7	145.4	0	0	0	105.4
3	R	34.3	Very low	31.1	Very low	228 Å²	228	167.9 Å²	167.9	86%	0.86	86%	0.855	S	S	*	*			trans	-73.2	166.3	162.5	-70.9	-175.9	171.3	-163.7	-1.1	109.9
4	P	42.7	Very low	31	Very low	124 Å²	124	165.4 Å²	165.4	81%	0.805	86%	0.855	S	S	*	*				-141.9	153.9	94.5	22.9	-0.9	0	0	0	112
5	A	31.2	Very low	30.7	Very low	99 Å²	99	171.1 Å²	171.1	82%	0.818	86%	0.862	S	S	*	*			cis	92.6	120.4	41	0	0	0	0	0	115.2
6	G	27.9	Very low	30.5	Very low	71 Å²	71	165.4 Å²	165.4	73%	0.732	85%	0.849	S	S	*	*			trans	111	149.2	152.1	0	0	0	0	0	116.2
7	L	27	Very low	30.3	Very low	158 Å²	158	161.8 Å²	161.8	83%	0.827	85%	0.85	S	S	*	*			cis	175.4	160.7	-16.3	-126.5	149.2	0	0	0	106.2
8	W	27.1	Very low	30.1	Very low	228 Å²	228	165.7 Å²	165.7	86%	0.864	85%	0.852	S	S	*	*			trans	108.2	155.3	159.6	-69.7	13	0	0	0	118.8
9	P	39.5	Very low	30	Very low	112 Å²	112	164.8 Å²	164.8	73%	0.727	86%	0.855	S	S	*	*			cis	-140.9	178.2	-43.6	39.8	-22.4	0	0	0	114.6
10	L	28.6	Very low	29.8	Very low	165 Å²	165	162.1 Å²	162.1	86%	0.864	85%	0.85	S	S	*	*			trans	-64.2	151.5	174	-72.7	123.8	0	0	0	116.3
11	C	25.9	Very low	29.8	Very low	114 Å²	114	159 Å²	159	77%	0.77	85%	0.848	S	S	*	*			trans	-165.1	114.2	139	-97.5	0	0	0	0	109.2
12	R	27.8	Very low	29.7	Very low	238 Å²	238	156.7 Å²	156.7	90%	0.898	83%	0.834	S	S	*	*				108.9	121	81.3	-90.9	-168.6	-177.5	-127.5	1.6	110.9
13	R	28.3	Very low	29.8	Very low	243 Å²	243	156.8 Å²	156.8	92%	0.917	84%	0.835	S	S	*	*			trans	-76.7	163.9	171.2	-70.2	-178.3	170.7	-162.8	-2.7	111.8
14	P	29.8	Very low	29.8	Very low	132 Å²	132	151.6 Å²	151.6	86%	0.857	83%	0.832	S	S	*	*			trans	-121.3	166.9	133.8	10.4	10.3	0	0	0	114.2
15	W	26	Very low	29.1	Very low	251 Å²	251	149 Å²	149	95%	0.951	83%	0.827	S	S	*	*			trans	-84.2	158.4	-163.7	-161.4	-66.6	0	0	0	114.2
16	A	27.3	Very low	29	Very low	80 Å²	80	156 Å²	156	66%	0.661	83%	0.832	S	S	*	*			trans	-57	158.6	-175.2	0	0	0	0	0	119.5
17	A	26.9	Very low	29.1	Very low	105 Å²	105	164 Å²	164	87%	0.868	84%	0.84	S	S	*	*			trans	-123.4	125.4	142.2	0	0	0	0	0	109
18	R	26.7	Very low	29.3	Very low	231 Å²	231	164.3 Å²	164.3	87%	0.872	84%	0.837	S	S	*	*			trans	-81.4	135.6	175.2	-88.5	179.5	178.2	-147	-0.5	110.1
19	V	28.5	Very low	29.4	Very low	150 Å²	150	161.4 Å²	161.4	91%	0.909	84%	0.837	S	S	*	*			trans	-139.1	129	144.8	-177.7	0	0	0	0	107.4
20	S	27.3	Very low	28.9	Very low	109 Å²	109	161.6 Å²	161.6	76%	0.762	84%	0.836	S	S	*	*			trans	-81.5	136.8	-174.7	-52.5	0	0	0	0	111.5
21	A	29.8	Very low	29.1	Very low	97 Å²	97	159.3 Å²	159.3	80%	0.802	83%	0.834	S	S	*	*			trans	-153.8	110.5	158.4	0	0	0	0	0	110
22	E	28.9	Very low	29.3	Very low	191 Å²	191	157.2 Å²	157.2	89%	0.893	83%	0.832	S	S	*	*			trans	22.1	126.6	149	-64.2	175	160.8	0	0	120.5	P24	E22-P24 WeakPolarHBondContact O-CD 3.26Å
23	N	35.2	Very low	29.8	Very low	166 Å²	166	152.9 Å²	152.9	89%	0.888	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-76.9	121.9	175.5	-130.5	4.8	0	0	0	110.9
24	P	33.4	Very low	30.2	Very low	120 Å²	120	146 Å²	146	78%	0.779	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-95.8	116.4	159.8	7.6	12.7	0	0	0	109	E22	E22-P24 WeakPolarHBondContact O-CD 3.26Å
25	G	28.1	Very low	30.5	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-54.3	141.2	-177	0	0	0	0	0	114.5	R27	G25-R27 PolarHBondContact O-N 3Å
26	R	30.2	Very low	31.2	Very low	247 Å²	247	146 Å²	146	93%	0.932	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-48.4	117.5	157.2	-85.5	177.4	166.7	-160.1	-3.4	109.1	E28	R26-E28 PolarHBondContact O-N 3.4Å
27	R	28.9	Very low	31.8	Very low	238 Å²	238	146 Å²	146	90%	0.898	83%	0.828	S	S	*	*			trans	-85	104	160.8	-81.1	-177.7	175.2	178.2	-1.4	108.1	G25 I29	G25-R27 PolarHBondContact O-N 3Å; R27-I29 PolarHBondContact O-N 3.21Å
28	E	30.5	Very low	32	Very low	165 Å²	165	146.2 Å²	146.2	77%	0.771	82%	0.822	S	S	*	*			trans	-62.3	124.7	155.6	-77.5	174.5	154.9	0	0	108.1	R26 T30	R26-E28 PolarHBondContact O-N 3.4Å; E28-T30 VanDerWaalsContact C-N 3.3Å; E28-T30 PolarHBondContact O-N 2.91Å; E28-T30 VanDerWaalsContact O-N 3.08Å
29	I	29	Very low	32.6	Very low	168 Å²	168	142.4 Å²	142.4	86%	0.862	83%	0.825	S	S	*	*			trans	-79.4	89.7	169.6	-60.2	174.3	0	0	0	105.7	R27 S31	R27-I29 PolarHBondContact O-N 3.21Å; I29-S31 PolarHBondContact O-N 3.01Å
30	T	29.8	Very low	33.3	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	81%	0.81	S	S	*	*			trans	-64.5	127.7	168.5	50.6	0	0	0	0	109.1	E28 G32	E28-T30 VanDerWaalsContact C-N 3.3Å; E28-T30 PolarHBondContact O-N 2.91Å; E28-T30 VanDerWaalsContact O-N 3.08Å; T30-G32 PolarHBondContact O-N 3.17Å; T30-G32 VanDerWaalsContact O-N 3.11Å
31	S	33.7	Very low	34.1	Very low	117 Å²	117	141.9 Å²	141.9	82%	0.818	81%	0.814	S	S	*	*			trans	-50.5	109	171.6	39	0	0	0	0	111.4	I29 V33	I29-S31 PolarHBondContact O-N 3.01Å; S31-V33 PolarHBondContact O-N 3.37Å
32	G	29.6	Very low	35.1	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.1	121.9	172.7	0	0	0	0	0	110.8	T30 S34	T30-G32 PolarHBondContact O-N 3.17Å; T30-G32 VanDerWaalsContact O-N 3.11Å; G32-S34 PolarHBondContact O-N 3.43Å
33	V	37.8	Very low	36.5	Very low	147 Å²	147	141.6 Å²	141.6	89%	0.891	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-61.9	122.3	166.6	173.1	0	0	0	0	108.8	S31	S31-V33 PolarHBondContact O-N 3.37Å
34	S	37.3	Very low	38.3	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.7	146.7	174.5	-60.7	0	0	0	0	111.8	G32	G32-S34 PolarHBondContact O-N 3.43Å
35	P	36.5	Very low	40.8	Very low	127 Å²	127	139 Å²	139	83%	0.825	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.7	140.7	-178.8	-4.4	19.2	0	0	0	111.3
36	R	40.8	Very low	43.8	Very low	257 Å²	257	138.9 Å²	138.9	97%	0.97	76%	0.758	S	S	*	*	S	Bend	trans	-75.4	119.4	166.3	-67.2	-176.2	-172.8	-149.3	1.7	108.5
37	G	39.2	Very low	46.9	Very low	80 Å²	80	127.5 Å²	127.5	83%	0.825	72%	0.715	S	S	*	*			trans	148.2	66.9	170.6	0	0	0	0	0	114.9
38	S	31.6	Very low	50	Low	108 Å²	108	117.6 Å²	117.6	76%	0.755	68%	0.68	S	S	*	*			trans	-169.6	107	154.2	172.8	0	0	0	0	107	S40	S38-S40 PolarHBondContact O-N 2.9Å
39	T	39.6	Very low	53	Low	152 Å²	152	110.9 Å²	110.9	93%	0.933	65%	0.647	S	S	*	*			trans	-76.5	65.2	167.7	40.2	0	0	0	0	109
40	S	41.7	Very low	56.2	Low	83 Å²	83	107 Å²	107	58%	0.58	63%	0.628	S	S	*	*			trans	-66.5	129.9	146.3	167.4	0	0	0	0	105.7	S38 R42	S38-S40 PolarHBondContact O-N 2.9Å; S40-R42 VanDerWaalsContact C-N 3.27Å; S40-R42 PolarHBondContact O-N 3.09Å
41	L	45.5	Very low	59.3	Low	164 Å²	164	102.8 Å²	102.8	86%	0.859	60%	0.601	S	S	*	*			trans	-52.1	98.8	167.5	-80.8	155.8	0	0	0	106.4	A43	L41-A43 PolarHBondContact O-N 3.03Å
42	R	49.5	Very low	62.2	Low	228 Å²	228	97.3 Å²	97.3	86%	0.86	56%	0.563	S	S	*	*			trans	-56	119.7	172.1	-83.6	-178	173.6	179.5	-3.5	105	S40 L44	S40-R42 VanDerWaalsContact C-N 3.27Å; S40-R42 PolarHBondContact O-N 3.09Å; R42-L44 PolarHBondContact O-N 3.31Å
43	A	59.6	Low	65.4	Low	54 Å²	54	98.7 Å²	98.7	45%	0.446	55%	0.546	S	S	.	.			trans	-43.3	118.9	167.1	0	0	0	0	0	107	L41 N45 D166	L41-A43 PolarHBondContact O-N 3.03Å; A43-N45 PolarHBondContact O-N 2.91Å; A43-D166 HydrophobicContact CB-CB 4.15Å
44	L	72	Confident	68.2	Low	131 Å²	131	98.2 Å²	98.2	69%	0.686	53%	0.532	S	S	*	.			trans	-64.4	109.8	179.1	-79	162.1	0	0	0	105.7	R42 I46	R42-L44 PolarHBondContact O-N 3.31Å; L44-I46 VanDerWaalsContact C-N 3.28Å; L44-I46 HydrophobicContact CB-CD1 4.28Å; L44-I46 HydrophobicContact CB-CG1 4.06Å; L44-I46 PolarHBondContact O-N 3.2Å
45	N	86.9	Confident	71	Confident	102 Å²	102	94.8 Å²	94.8	55%	0.545	51%	0.505	S	S	.	.			trans	-77.7	86.7	176.6	-170.2	5.3	0	0	0	107.8	A43 F47 W268	A43-N45 PolarHBondContact O-N 2.91Å; N45-F47 PolarHBondContact OD1-O 3.25Å; N45-F47 VanDerWaalsContact OD1-O 3.12Å; N45-W268 PolarHBondContact ND2-NE1 3.25Å; N45-W268 VanDerWaalsContact O-CD1 3.31Å; N45-W268 PolarHBondContact OD1-NE1 3.31Å
46	I	91.1	Very high	73.8	Confident	65 Å²	65	89.8 Å²	89.8	33%	0.333	47%	0.47	S	S	.	.			trans	-84.3	-43.1	-178.2	-62.4	166.3	0	0	0	109.5	L44 N165 P218 S267 W268	L44-I46 VanDerWaalsContact C-N 3.28Å; L44-I46 HydrophobicContact CB-CD1 4.28Å; L44-I46 HydrophobicContact CB-CG1 4.06Å; L44-I46 PolarHBondContact O-N 3.2Å; I46-N165 PolarHBondContact N-OD1 3.1Å; I46-P218 HydrophobicContact CG2-CG 3.58Å; I46-S267 CarbonylContact O-C 3.53Å; I46-S267 VanDerWaalsContact O-CA 3.28Å; I46-S267 WeakPolarHBondContact O-CA 3.25Å; I46-W268 PolarHBondContact O-N 3.21Å
47	F	94.5	Very high	76.4	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.035	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-107.5	131.9	-170.8	-55.4	-58.5	0	0	0	112.6	N45 R49 H162 W163 N165 P218 W268	N45-F47 PolarHBondContact OD1-O 3.25Å; N45-F47 VanDerWaalsContact OD1-O 3.12Å; F47-R49 PolarHBondContact O-N 2.95Å; F47-R49 VanDerWaalsContact O-N 3.1Å; F47-H162 WeakPolarHBondContact CE2-O 3.48Å; F47-H162 WeakPolarHBondContact CZ-O 3.48Å; F47-W163 AromaticContact CD1-CE3 3.97Å; F47-W163 HydrophobicContact CD1-CE3 3.97Å; F47-W163 HydrophobicContact CD1-CZ3 4.14Å; F47-W163 HydrophobicContact CE1-CE3 4.11Å; F47-W163 HydrophobicContact CE1-CZ3 4.19Å; F47-W163 HydrophobicContact CG-CE3 4.38Å; F47-N165 PolarHBondContact N-OD1 3.18Å; F47-N165 PolarHBondContact O-ND2 3.16Å; F47-P218 HydrophobicContact CE1-CG 4.16Å; F47-P218 HydrophobicContact CZ-CG 4.28Å; F47-W268 PolarHBondContact O-NE1 3.48Å
48	D	94.6	Very high	79.1	Confident	30 Å²	30	80.1 Å²	80.1	16%	0.16	41%	0.411	C	S	.	.			trans	-74.3	94.2	165.2	-177.7	-12.4	0	0	0	109.2	D50 L51 K52 C266 W268	D48-D50 VanDerWaalsContact C-N 3.26Å; D48-D50 PolarHBondContact O-N 3.11Å; D48-D50 WeakPolarHBondContact OD1-CB 3.47Å; D48-D50 PolarHBondContact OD1-N 2.75Å; D48-D50 VanDerWaalsContact OD1-N 3.09Å; D48-L51 HydrophobicContact CB-CB 3.83Å; D48-L51 HydrophobicContact CB-CD2 4.5Å; D48-L51 WeakPolarHBondContact O-CB 3.47Å; D48-L51 PolarHBondContact O-N 3.19Å; D48-L51 PolarHBondContact OD1-N 3.28Å; D48-L51 WeakPolarHBondContact OD2-CB 3.35Å; D48-K52 PolarHBondContact O-N 3.44Å; D48-C266 WeakPolarHBondContact CB-O 3.27Å; D48-C266 PolarHBondContact N-O 3.49Å; D48-W268 HydrophobicContact CB-CD2 4.05Å; D48-W268 HydrophobicContact CB-CE3 4.35Å; D48-W268 HydrophobicContact CB-CH2 4.04Å; D48-W268 HydrophobicContact CB-CZ2 3.72Å; D48-W268 HydrophobicContact CB-CZ3 4.34Å
49	R	93.6	Very high	82.1	Confident	23 Å²	23	75.5 Å²	75.5	9%	0.087	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-32.5	179.6	-65.1	-66.3	-61.5	163	3.5	112.6	F47 K52 R53 D141 E142 W163	F47-R49 PolarHBondContact O-N 2.95Å; F47-R49 VanDerWaalsContact O-N 3.1Å; R49-K52 PolarHBondContact O-N 3.11Å; R49-R53 WeakPolarHBondContact O-CB 3.34Å; R49-R53 PolarHBondContact O-N 3.36Å; R49-D141 IonicContact CZ-OD1 3.57Å; R49-D141 IonicContact NE-OD1 3.96Å; R49-D141 IonicContact NE-OD2 2.88Å; R49-D141 IonicContact NH2-OD1 3.19Å; R49-D141 PolarHBondContact NH2-OD1 3.03Å; R49-D141 IonicContact NH2-OD2 2.98Å; R49-E142 IonicContact CZ-OE1 2.79Å; R49-E142 IonicContact CZ-OE2 2.8Å; R49-E142 IonicContact NH1-OE1 2.66Å; R49-E142 PolarHBondContact NH1-OE1 3.04Å; R49-E142 IonicContact NH2-OE1 2.74Å; R49-E142 PolarHBondContact NH2-OE1 2.98Å; R49-E142 IonicContact NH2-OE2 2.89Å; R49-E142 PolarHBondContact NH2-OE2 3.47Å; R49-W163 WeakPolarHBondContact CD-O 3.23Å; R49-W163 PolarHBondContact NH1-O 3.06Å
50	D	94.6	Very high	84.6	Confident	86 Å²	86	68.5 Å²	68.5	46%	0.46	34%	0.337	S	S	.	.	H	α-helix	trans	-68.7	-40.8	176.5	-84.8	-29.5	0	0	0	111.6	D48 R53 K54	D48-D50 VanDerWaalsContact C-N 3.26Å; D48-D50 PolarHBondContact O-N 3.11Å; D48-D50 WeakPolarHBondContact OD1-CB 3.47Å; D48-D50 PolarHBondContact OD1-N 2.75Å; D48-D50 VanDerWaalsContact OD1-N 3.09Å; D50-R53 IonicContact OD1-CZ 3.7Å; D50-R53 IonicContact OD1-NE 2.84Å; D50-R53 IonicContact OD1-NH2 3.41Å; D50-R53 PolarHBondContact OD1-NH2 3.12Å; D50-K54 VanDerWaalsContact O-CG 3.31Å; D50-K54 WeakPolarHBondContact O-CG 3.19Å; D50-K54 PolarHBondContact O-N 3.28Å
51	L	95.1	Very high	87	Confident	28 Å²	28	72.6 Å²	72.6	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-64.4	-44.8	172.5	177.6	61.3	0	0	0	111.4	D48 R53 K54 Q55 C266 R270	D48-L51 HydrophobicContact CB-CB 3.83Å; D48-L51 HydrophobicContact CB-CD2 4.5Å; D48-L51 WeakPolarHBondContact O-CB 3.47Å; D48-L51 PolarHBondContact O-N 3.19Å; D48-L51 PolarHBondContact OD1-N 3.28Å; D48-L51 WeakPolarHBondContact OD2-CB 3.35Å; L51-R53 VanDerWaalsContact C-N 3.32Å; L51-R53 PolarHBondContact O-N 3.22Å; L51-K54 WeakPolarHBondContact O-CA 3.48Å; L51-K54 WeakPolarHBondContact O-CB 3.27Å; L51-K54 PolarHBondContact O-N 3.33Å; L51-Q55 HydrophobicContact CD1-CG 4.35Å; L51-Q55 HydrophobicContact CG-CG 4.48Å; L51-Q55 WeakPolarHBondContact O-CG 3.44Å; L51-Q55 PolarHBondContact O-N 2.85Å; L51-C266 HydrophobicContact CB-CB 4.48Å; L51-C266 HydrophobicContact CD2-CB 4.11Å; L51-C266 HydrophobicContact CG-CB 4.23Å; L51-R270 VanDerWaalsContact CD2-NE 3.25Å; L51-R270 VanDerWaalsContact CD2-NH2 3.32Å
52	K	95.8	Very high	89.2	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-43.5	177.7	-174.1	61.6	-174.1	-174.9	0	111.6	D48 R49 K54 Q55 K56 W163 G262 E263 C266	D48-K52 PolarHBondContact O-N 3.44Å; R49-K52 PolarHBondContact O-N 3.11Å; K52-K54 VanDerWaalsContact C-N 3.32Å; K52-K54 PolarHBondContact O-N 3.04Å; K52-Q55 PolarHBondContact O-N 2.87Å; K52-K56 HydrophobicContact CG-CD 4.49Å; K52-K56 WeakPolarHBondContact O-CG 3.24Å; K52-K56 PolarHBondContact O-N 2.91Å; K52-W163 HydrophobicContact CD-CD2 3.88Å; K52-W163 HydrophobicContact CD-CE3 4.21Å; K52-W163 HydrophobicContact CD-CG 4.11Å; K52-W163 VanDerWaalsContact CE-CD1 3.45Å; K52-W163 VanDerWaalsContact CE-NE1 3.31Å; K52-W163 HydrophobicContact CG-CB 4.44Å; K52-W163 HydrophobicContact CG-CD2 4.46Å; K52-W163 HydrophobicContact CG-CG 4.32Å; K52-W163 VanDerWaalsContact NZ-CZ2 3.32Å; K52-G262 PolarHBondContact NZ-O 3.09Å; K52-E263 IonicContact NZ-OE1 2.79Å; K52-E263 PolarHBondContact NZ-OE1 2.99Å; K52-E263 IonicContact NZ-OE2 2.83Å; K52-C266 HydrophobicContact CB-CB 4.18Å
53	R	96.3	Very high	91	Very high	99 Å²	99	62.2 Å²	62.2	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-43.1	172.1	177.8	178	60.2	168.7	-4	112	R49 D50 L51 N57 I120	R49-R53 WeakPolarHBondContact O-CB 3.34Å; R49-R53 PolarHBondContact O-N 3.36Å; D50-R53 IonicContact OD1-CZ 3.7Å; D50-R53 IonicContact OD1-NE 2.84Å; D50-R53 IonicContact OD1-NH2 3.41Å; D50-R53 PolarHBondContact OD1-NH2 3.12Å; L51-R53 VanDerWaalsContact C-N 3.32Å; L51-R53 PolarHBondContact O-N 3.22Å; R53-N57 VanDerWaalsContact O-CB 3.24Å; R53-N57 WeakPolarHBondContact O-CB 3.42Å; R53-N57 PolarHBondContact O-N 3.19Å; R53-N57 PolarHBondContact O-ND2 2.69Å; R53-N57 VanDerWaalsContact O-ND2 3.11Å; R53-I120 HydrophobicContact CB-CD1 4.18Å; R53-I120 HydrophobicContact CB-CG1 4.21Å; R53-I120 HydrophobicContact CB-CG2 4.3Å; R53-I120 WeakPolarHBondContact CD-O 3.48Å; R53-I120 HydrophobicContact CG-CG1 4.21Å; R53-I120 WeakPolarHBondContact CG-O 3.21Å
54	K	96.4	Very high	92.3	Very high	136 Å²	136	65.8 Å²	65.8	59%	0.591	31%	0.314	S	S	*	.	H	α-helix	trans	-64.7	-42.4	176.4	-72.9	168	-173.2	168.2	0	112	D50 L51 K52 N57 W58	D50-K54 VanDerWaalsContact O-CG 3.31Å; D50-K54 WeakPolarHBondContact O-CG 3.19Å; D50-K54 PolarHBondContact O-N 3.28Å; L51-K54 WeakPolarHBondContact O-CA 3.48Å; L51-K54 WeakPolarHBondContact O-CB 3.27Å; L51-K54 PolarHBondContact O-N 3.33Å; K52-K54 VanDerWaalsContact C-N 3.32Å; K52-K54 PolarHBondContact O-N 3.04Å; K54-N57 PolarHBondContact O-N 3.21Å; K54-W58 VanDerWaalsContact O-CB 3.29Å; K54-W58 WeakPolarHBondContact O-CB 3.08Å; K54-W58 PolarHBondContact O-N 2.84Å
55	Q	95.6	Very high	92.5	Very high	28 Å²	28	60.8 Å²	60.8	13%	0.131	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-51.4	177.3	-71.9	165.7	-22.6	0	0	111.2	L51 K52 N57 W58 A59 S264 N265	L51-Q55 HydrophobicContact CD1-CG 4.35Å; L51-Q55 HydrophobicContact CG-CG 4.48Å; L51-Q55 WeakPolarHBondContact O-CG 3.44Å; L51-Q55 PolarHBondContact O-N 2.85Å; K52-Q55 PolarHBondContact O-N 2.87Å; Q55-N57 VanDerWaalsContact C-N 3.33Å; Q55-N57 PolarHBondContact O-N 3.32Å; Q55-W58 PolarHBondContact O-N 2.86Å; Q55-W58 VanDerWaalsContact O-N 3.15Å; Q55-A59 WeakPolarHBondContact O-CB 3.37Å; Q55-A59 PolarHBondContact O-N 3.34Å; Q55-S264 PolarHBondContact NE2-O 3.32Å; Q55-S264 PolarHBondContact OE1-O 2.94Å; Q55-N265 PolarHBondContact NE2-O 3.35Å
56	K	95.4	Very high	92.5	Very high	21 Å²	21	59.8 Å²	59.8	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-42.7	176.5	-67	-176.8	86.2	-175.2	0	111.9	K52 W58 A59 A60 D119 I120 A121	K52-K56 HydrophobicContact CG-CD 4.49Å; K52-K56 WeakPolarHBondContact O-CG 3.24Å; K52-K56 PolarHBondContact O-N 2.91Å; K56-W58 VanDerWaalsContact C-N 3.34Å; K56-W58 PolarHBondContact O-N 3.44Å; K56-A59 PolarHBondContact O-N 3.44Å; K56-A60 WeakPolarHBondContact O-CB 3.41Å; K56-A60 PolarHBondContact O-N 3.02Å; K56-D119 WeakPolarHBondContact CE-OD1 3.26Å; K56-D119 IonicContact NZ-OD1 3.91Å; K56-D119 PolarHBondContact NZ-OD1 3.19Å; K56-D119 IonicContact NZ-OD2 3.92Å; K56-D119 PolarHBondContact NZ-OD2 3.49Å; K56-I120 HydrophobicContact CD-CG2 4.33Å; K56-A121 HydrophobicContact CB-CB 3.52Å; K56-A121 HydrophobicContact CD-CB 4.45Å
57	N	95.7	Very high	92.5	Very high	28 Å²	28	61.5 Å²	61.5	15%	0.15	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-33.9	176.6	-87.8	-40.8	0	0	0	113.6	R53 K54 Q55 R61 E122 N123	R53-N57 VanDerWaalsContact O-CB 3.24Å; R53-N57 WeakPolarHBondContact O-CB 3.42Å; R53-N57 PolarHBondContact O-N 3.19Å; R53-N57 PolarHBondContact O-ND2 2.69Å; R53-N57 VanDerWaalsContact O-ND2 3.11Å; K54-N57 PolarHBondContact O-N 3.21Å; Q55-N57 VanDerWaalsContact C-N 3.33Å; Q55-N57 PolarHBondContact O-N 3.32Å; N57-R61 WeakPolarHBondContact O-CG 3.24Å; N57-R61 PolarHBondContact O-N 3.25Å; N57-E122 PolarHBondContact OD1-N 3.21Å; N57-N123 WeakPolarHBondContact CB-ND2 3.47Å; N57-N123 PolarHBondContact O-ND2 3.04Å; N57-N123 WeakPolarHBondContact OD1-CB 3.42Å; N57-N123 PolarHBondContact OD1-N 2.99Å; N57-N123 PolarHBondContact OD1-ND2 3.35Å; N57-N123 VanDerWaalsContact OD1-ND2 3.14Å
58	W	95.1	Very high	92.3	Very high	107 Å²	107	61.9 Å²	61.9	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-72.7	-44.3	176.8	176.1	91.4	0	0	0	111.1	K54 Q55 K56 A60 R61 Q62 Q259	K54-W58 VanDerWaalsContact O-CB 3.29Å; K54-W58 WeakPolarHBondContact O-CB 3.08Å; K54-W58 PolarHBondContact O-N 2.84Å; Q55-W58 PolarHBondContact O-N 2.86Å; Q55-W58 VanDerWaalsContact O-N 3.15Å; K56-W58 VanDerWaalsContact C-N 3.34Å; K56-W58 PolarHBondContact O-N 3.44Å; W58-A60 PolarHBondContact O-N 2.8Å; W58-R61 PolarHBondContact O-N 2.93Å; W58-R61 VanDerWaalsContact O-N 3.08Å; W58-Q62 VanDerWaalsContact CD2-NE2 3.34Å; W58-Q62 HydrophobicContact CE3-CG 4.37Å; W58-Q62 HydrophobicContact CH2-CG 4.1Å; W58-Q62 HydrophobicContact CZ2-CG 4.49Å; W58-Q62 VanDerWaalsContact CZ2-NE2 3.26Å; W58-Q62 HydrophobicContact CZ3-CG 4.02Å; W58-Q62 PolarHBondContact O-N 3.38Å; W58-Q62 PolarHBondContact O-NE2 2.94Å; W58-Q259 HydrophobicContact CE3-CG 4.36Å; W58-Q259 HydrophobicContact CH2-CG 3.85Å; W58-Q259 HydrophobicContact CZ3-CB 4.47Å; W58-Q259 HydrophobicContact CZ3-CG 3.64Å; W58-Q259 WeakPolarHBondContact CZ3-O 3.42Å
59	A	94.5	Very high	92.2	Very high	10 Å²	10	60.6 Å²	60.6	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-48.8	175.5	0	0	0	0	0	111.1	Q55 K56 R61 Q62 G260	Q55-A59 WeakPolarHBondContact O-CB 3.37Å; Q55-A59 PolarHBondContact O-N 3.34Å; K56-A59 PolarHBondContact O-N 3.44Å; A59-R61 PolarHBondContact O-N 2.82Å; A59-R61 VanDerWaalsContact O-N 3.11Å; A59-Q62 WeakPolarHBondContact O-CG 3.42Å; A59-Q62 PolarHBondContact O-N 3.12Å; A59-Q62 VanDerWaalsContact O-N 3.12Å; A59-G260 WeakPolarHBondContact CB-O 3.43Å
60	A	92.5	Very high	92.3	Very high	5 Å²	5	62.9 Å²	62.9	4%	0.041	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-19.6	177.9	0	0	0	0	0	114.1	K56 W58 N123 A124 N127	K56-A60 WeakPolarHBondContact O-CB 3.41Å; K56-A60 PolarHBondContact O-N 3.02Å; W58-A60 PolarHBondContact O-N 2.8Å; A60-N123 HydrophobicContact CB-CB 3.93Å; A60-A124 HydrophobicContact CB-CB 4.24Å; A60-N127 PolarHBondContact O-ND2 3.26Å
61	R	91.6	Very high	92.4	Very high	169 Å²	169	58.9 Å²	58.9	64%	0.638	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.6	179	-77.8	-177.5	179.1	169.5	11.6	114	N57 W58 A59 N123	N57-R61 WeakPolarHBondContact O-CG 3.24Å; N57-R61 PolarHBondContact O-N 3.25Å; W58-R61 PolarHBondContact O-N 2.93Å; W58-R61 VanDerWaalsContact O-N 3.08Å; A59-R61 PolarHBondContact O-N 2.82Å; A59-R61 VanDerWaalsContact O-N 3.11Å; R61-N123 HydrophobicContact CG-CB 4.24Å; R61-N123 VanDerWaalsContact NE-CG 3.27Å; R61-N123 PolarHBondContact NE-ND2 3.16Å; R61-N123 PolarHBondContact NE-OD1 2.74Å; R61-N123 PolarHBondContact NH2-ND2 2.92Å; R61-N123 VanDerWaalsContact NH2-ND2 3.17Å; R61-N123 PolarHBondContact NH2-OD1 2.76Å
62	Q	91.8	Very high	92.4	Very high	52 Å²	52	58.6 Å²	58.6	24%	0.243	27%	0.273	C	S	.	.	S	Bend	trans	-63.3	150.2	178.5	-64.3	-48	-60.1	0	0	110.7	W58 A59 E64 P65	W58-Q62 VanDerWaalsContact CD2-NE2 3.34Å; W58-Q62 HydrophobicContact CE3-CG 4.37Å; W58-Q62 HydrophobicContact CH2-CG 4.1Å; W58-Q62 HydrophobicContact CZ2-CG 4.49Å; W58-Q62 VanDerWaalsContact CZ2-NE2 3.26Å; W58-Q62 HydrophobicContact CZ3-CG 4.02Å; W58-Q62 PolarHBondContact O-N 3.38Å; W58-Q62 PolarHBondContact O-NE2 2.94Å; A59-Q62 WeakPolarHBondContact O-CG 3.42Å; A59-Q62 PolarHBondContact O-N 3.12Å; A59-Q62 VanDerWaalsContact O-N 3.12Å; Q62-E64 VanDerWaalsContact C-N 3.25Å; Q62-E64 PolarHBondContact O-N 2.95Å; Q62-P65 WeakPolarHBondContact O-CD 3.34Å
63	P	87.6	Confident	92.4	Very high	122 Å²	122	60.9 Å²	60.9	79%	0.792	28%	0.284	S	S	*	.	S	Bend	trans	-60	-34.8	179.9	-24.5	34.3	0	0	0	113.6	P65	P63-P65 VanDerWaalsContact C-CD 3.46Å; P63-P65 WeakPolarHBondContact O-CD 3.27Å
64	E	87.7	Confident	92.4	Very high	129 Å²	129	60 Å²	60	60%	0.603	28%	0.284	S	S	*	.	S	Bend	trans	-121.1	68.6	-179	-63.2	-177.8	149	0	0	110.1	Q62 T66 K67	Q62-E64 VanDerWaalsContact C-N 3.25Å; Q62-E64 PolarHBondContact O-N 2.95Å; E64-T66 PolarHBondContact O-N 2.95Å; E64-K67 HydrophobicContact CB-CB 4.23Å; E64-K67 VanDerWaalsContact O-CB 3.28Å; E64-K67 WeakPolarHBondContact O-CB 3.49Å; E64-K67 PolarHBondContact O-N 3.47Å
65	P	76.7	Confident	92.5	Very high	26 Å²	26	53.5 Å²	53.5	17%	0.169	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-67.4	-28.4	-172.4	28.2	-32.2	0	0	0	112	Q62 P63 K67 D69	Q62-P65 WeakPolarHBondContact O-CD 3.34Å; P63-P65 VanDerWaalsContact C-CD 3.46Å; P63-P65 WeakPolarHBondContact O-CD 3.27Å; P65-K67 VanDerWaalsContact C-N 3.25Å; P65-K67 PolarHBondContact O-N 3.31Å; P65-D69 VanDerWaalsContact O-CG 3.3Å
66	T	85.7	Confident	92.6	Very high	82 Å²	82	52.2 Å²	52.2	50%	0.503	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-68.9	-19.6	177.6	53.1	0	0	0	0	113.6	E64 F68 D69	E64-T66 PolarHBondContact O-N 2.95Å; T66-F68 PolarHBondContact O-N 3.36Å; T66-F68 VanDerWaalsContact O-N 3.14Å; T66-D69 PolarHBondContact O-N 3.42Å
67	K	90.5	Very high	92.7	Very high	100 Å²	100	52.7 Å²	52.7	44%	0.435	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-55	-35.4	-180	-179.6	-176.7	169.4	-165.2	0	111.9	E64 P65 E256	E64-K67 HydrophobicContact CB-CB 4.23Å; E64-K67 VanDerWaalsContact O-CB 3.28Å; E64-K67 WeakPolarHBondContact O-CB 3.49Å; E64-K67 PolarHBondContact O-N 3.47Å; P65-K67 VanDerWaalsContact C-N 3.25Å; P65-K67 PolarHBondContact O-N 3.31Å; K67-E256 IonicContact NZ-OE1 2.91Å; K67-E256 PolarHBondContact NZ-OE1 3.07Å
68	F	92.3	Very high	92.8	Very high	16 Å²	16	54 Å²	54	7%	0.07	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-105.6	2.3	-172.7	-50.5	-68	0	0	0	113	T66 E256 D257 G260 M261	T66-F68 PolarHBondContact O-N 3.36Å; T66-F68 VanDerWaalsContact O-N 3.14Å; F68-E256 HydrophobicContact CE1-CG 4.31Å; F68-E256 HydrophobicContact CZ-CG 4.32Å; F68-D257 HydrophobicContact CD1-CB 4.2Å; F68-D257 VanDerWaalsContact CD1-OD1 3.26Å; F68-D257 WeakPolarHBondContact CD1-OD1 3.44Å; F68-D257 WeakPolarHBondContact CE1-OD1 3.41Å; F68-G260 VanDerWaalsContact CD2-CA 3.47Å; F68-M261 HydrophobicContact CB-CG 4Å; F68-M261 WeakPolarHBondContact O-CE 3.48Å; F68-M261 WeakPolarHBondContact O-CG 3.36Å
69	D	92.5	Very high	92.9	Very high	4 Å²	4	49 Å²	49	2%	0.021	24%	0.239	C	C	.	.			trans	-84.4	-11.4	-170.3	-77.1	-26.5	0	0	0	113.6	P65 T66 L71 K72 E73 R100 Y102	P65-D69 VanDerWaalsContact O-CG 3.3Å; T66-D69 PolarHBondContact O-N 3.42Å; D69-L71 VanDerWaalsContact C-N 3.3Å; D69-L71 PolarHBondContact O-N 3.44Å; D69-L71 VanDerWaalsContact O-N 3.09Å; D69-K72 CarbonylContact O-C 3.58Å; D69-K72 WeakPolarHBondContact O-CA 3.47Å; D69-K72 WeakPolarHBondContact O-CB 3.5Å; D69-K72 PolarHBondContact O-N 3.43Å; D69-E73 HydrophobicContact CB-CG 4.21Å; D69-E73 WeakPolarHBondContact O-CG 3.23Å; D69-E73 PolarHBondContact O-N 3.5Å; D69-R100 IonicContact OD2-CZ 3.16Å; D69-R100 IonicContact OD2-NH1 2.58Å; D69-R100 PolarHBondContact OD2-NH1 2.87Å; D69-Y102 HydrophobicContact CB-CE1 3.75Å; D69-Y102 WeakPolarHBondContact OD1-CE1 3.36Å; D69-Y102 VanDerWaalsContact OD1-CZ 3.32Å; D69-Y102 PolarHBondContact OD1-OH 3.39Å
70	Y	95	Very high	93.1	Very high	70 Å²	70	48.5 Å²	48.5	28%	0.275	24%	0.235	S	C	.	.	H	α-helix	trans	-49.1	-43.1	-172.3	58.8	-96	0	0	0	114.5	E73 E74 V246 Y248 D257 M261	Y70-E73 PolarHBondContact O-N 3.05Å; Y70-E74 WeakPolarHBondContact O-CB 3.38Å; Y70-E74 PolarHBondContact O-N 3.49Å; Y70-V246 HydrophobicContact CE2-CG1 4.01Å; Y70-V246 HydrophobicContact CE2-CG2 4.1Å; Y70-Y248 PolarHBondContact OH-OH 2.8Å; Y70-D257 VanDerWaalsContact CE1-OD2 3.28Å; Y70-D257 WeakPolarHBondContact CE1-OD2 3.48Å; Y70-D257 PolarHBondContact OH-OD2 3.27Å; Y70-M261 HydrophobicContact CE1-CE 3.73Å; Y70-M261 HydrophobicContact CE2-CE 3.72Å; Y70-M261 WeakPolarHBondContact OH-CE 3.46Å
71	L	96	Very high	93.3	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-69.3	-38.4	-179.7	-179.7	64.3	0	0	0	111.2	D69 V75 F189 I244 M261 Y301	D69-L71 VanDerWaalsContact C-N 3.3Å; D69-L71 PolarHBondContact O-N 3.44Å; D69-L71 VanDerWaalsContact O-N 3.09Å; L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 2.91Å; L71-V75 VanDerWaalsContact O-N 3.08Å; L71-F189 HydrophobicContact CD2-CE1 4.08Å; L71-F189 HydrophobicContact CD2-CZ 3.85Å; L71-I244 HydrophobicContact CD1-CB 4.26Å; L71-I244 HydrophobicContact CD1-CD1 4.09Å; L71-I244 HydrophobicContact CD1-CG2 3.94Å; L71-M261 HydrophobicContact CB-CE 4.12Å; L71-M261 HydrophobicContact CD2-SD 4.42Å; L71-Y301 HydrophobicContact CD1-CD2 4.3Å; L71-Y301 HydrophobicContact CD1-CG 4.3Å; L71-Y301 HydrophobicContact CD2-CD1 3.44Å; L71-Y301 VanDerWaalsContact CD2-CD1 3.44Å; L71-Y301 HydrophobicContact CD2-CD2 3.96Å; L71-Y301 HydrophobicContact CD2-CE1 3.52Å; L71-Y301 HydrophobicContact CD2-CE2 4.04Å; L71-Y301 HydrophobicContact CD2-CG 3.66Å
72	K	95.9	Very high	93.6	Very high	21 Å²	21	46.4 Å²	46.4	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-73.7	-34.5	179.2	-61	-175.9	-177.5	176.6	0	111.6	D69 G76 Y102 L159 M261	D69-K72 CarbonylContact O-C 3.58Å; D69-K72 WeakPolarHBondContact O-CA 3.47Å; D69-K72 WeakPolarHBondContact O-CB 3.5Å; D69-K72 PolarHBondContact O-N 3.43Å; K72-G76 WeakPolarHBondContact O-CA 3.44Å; K72-G76 PolarHBondContact O-N 2.79Å; K72-Y102 HydrophobicContact CB-CD1 3.85Å; K72-Y102 HydrophobicContact CB-CD2 3.89Å; K72-Y102 HydrophobicContact CB-CE1 4.01Å; K72-Y102 HydrophobicContact CB-CE2 4.05Å; K72-Y102 HydrophobicContact CB-CG 3.77Å; K72-Y102 HydrophobicContact CD-CD2 3.96Å; K72-Y102 HydrophobicContact CD-CE1 4.24Å; K72-Y102 HydrophobicContact CD-CE2 3.37Å; K72-Y102 HydrophobicContact CG-CE2 4.36Å; K72-L159 HydrophobicContact CG-CD1 4.24Å; K72-M261 WeakPolarHBondContact CE-O 3.48Å; K72-M261 PolarHBondContact NZ-O 3Å
73	E	95.5	Very high	93.8	Very high	50 Å²	50	44 Å²	44	23%	0.234	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-49.7	172.4	-72.7	-177.3	176.7	0	0	110.9	D69 Y70 V75 G76 S77 Y102 Y106	D69-E73 HydrophobicContact CB-CG 4.21Å; D69-E73 WeakPolarHBondContact O-CG 3.23Å; D69-E73 PolarHBondContact O-N 3.5Å; Y70-E73 PolarHBondContact O-N 3.05Å; E73-V75 PolarHBondContact O-N 3.45Å; E73-G76 PolarHBondContact O-N 3.49Å; E73-G76 VanDerWaalsContact O-N 3.16Å; E73-S77 PolarHBondContact O-N 2.93Å; E73-Y102 HydrophobicContact CG-CD1 4.18Å; E73-Y106 VanDerWaalsContact O-CE2 3.32Å; E73-Y106 WeakPolarHBondContact O-CE2 3.43Å
74	E	97.2	Very high	94.3	Very high	81 Å²	81	42 Å²	42	38%	0.379	20%	0.199	S	C	.	.	H	α-helix	trans	-57.6	-49	177	178.1	60.3	-159.2	0	0	111.7	Y70 G76 S77 R78 I244	Y70-E74 WeakPolarHBondContact O-CB 3.38Å; Y70-E74 PolarHBondContact O-N 3.49Å; E74-G76 VanDerWaalsContact C-N 3.34Å; E74-G76 PolarHBondContact O-N 3.44Å; E74-S77 PolarHBondContact O-N 3.31Å; E74-R78 WeakPolarHBondContact O-CG 3.17Å; E74-R78 PolarHBondContact O-N 3.17Å; E74-R78 VanDerWaalsContact O-N 3.11Å; E74-R78 IonicContact OE1-CZ 3.76Å; E74-R78 IonicContact OE1-NE 3.75Å; E74-R78 PolarHBondContact OE1-NE 2.92Å; E74-R78 IonicContact OE1-NH2 3.82Å; E74-R78 PolarHBondContact OE1-NH2 2.97Å; E74-I244 HydrophobicContact CG-CD1 3.81Å
75	V	97.9	Very high	94.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-35.6	177.7	178.9	0	0	0	0	111.7	L71 E73 R78 I79 L159 A187 I244 I303 Y305	L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 2.91Å; L71-V75 VanDerWaalsContact O-N 3.08Å; E73-V75 PolarHBondContact O-N 3.45Å; V75-R78 PolarHBondContact O-N 3.21Å; V75-I79 PolarHBondContact O-N 3.16Å; V75-L159 HydrophobicContact CB-CD1 4.03Å; V75-L159 HydrophobicContact CB-CG 4.27Å; V75-L159 HydrophobicContact CG1-CD1 4.27Å; V75-L159 HydrophobicContact CG1-CD2 4.18Å; V75-L159 HydrophobicContact CG1-CG 3.94Å; V75-L159 HydrophobicContact CG2-CD1 4Å; V75-L159 HydrophobicContact CG2-CG 4.47Å; V75-A187 HydrophobicContact CG1-CB 3.54Å; V75-I244 HydrophobicContact CG2-CD1 4.08Å; V75-I303 HydrophobicContact CG1-CG2 4.39Å; V75-I303 HydrophobicContact CG2-CD1 3.44Å; V75-I303 VanDerWaalsContact CG2-CD1 3.44Å; V75-I303 HydrophobicContact CG2-CG1 4.35Å; V75-Y305 HydrophobicContact CG1-CE1 4.14Å
76	G	97.5	Very high	95.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-43.9	174.4	0	0	0	0	0	112.5	K72 E73 E74 I79 A80	K72-G76 WeakPolarHBondContact O-CA 3.44Å; K72-G76 PolarHBondContact O-N 2.79Å; E73-G76 PolarHBondContact O-N 3.49Å; E73-G76 VanDerWaalsContact O-N 3.16Å; E74-G76 VanDerWaalsContact C-N 3.34Å; E74-G76 PolarHBondContact O-N 3.44Å; G76-I79 PolarHBondContact O-N 3.25Å; G76-A80 PolarHBondContact O-N 3.43Å
77	S	97.4	Very high	95.8	Very high	32 Å²	32	44.3 Å²	44.3	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-46.1	174.4	-169.7	0	0	0	0	111.3	E73 E74 I79 A80 D81	E73-S77 PolarHBondContact O-N 2.93Å; E74-S77 PolarHBondContact O-N 3.31Å; S77-I79 VanDerWaalsContact C-N 3.26Å; S77-I79 PolarHBondContact O-N 3.22Å; S77-A80 WeakPolarHBondContact O-CA 3.09Å; S77-A80 WeakPolarHBondContact O-CB 3.15Å; S77-A80 PolarHBondContact O-N 2.84Å; S77-D81 PolarHBondContact O-N 3.38Å
78	R	97.9	Very high	96	Very high	56 Å²	56	42.9 Å²	42.9	21%	0.211	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-27.1	178.6	-69.5	179.4	-172.3	-166.8	10.3	113.7	E74 V75 R82 D242 Y305	E74-R78 WeakPolarHBondContact O-CG 3.17Å; E74-R78 PolarHBondContact O-N 3.17Å; E74-R78 VanDerWaalsContact O-N 3.11Å; E74-R78 IonicContact OE1-CZ 3.76Å; E74-R78 IonicContact OE1-NE 3.75Å; E74-R78 PolarHBondContact OE1-NE 2.92Å; E74-R78 IonicContact OE1-NH2 3.82Å; E74-R78 PolarHBondContact OE1-NH2 2.97Å; V75-R78 PolarHBondContact O-N 3.21Å; R78-R82 WeakPolarHBondContact O-CG 3.23Å; R78-R82 PolarHBondContact O-NH1 2.8Å; R78-D242 IonicContact CZ-OD2 3.97Å; R78-D242 VanDerWaalsContact NH1-CG 3.27Å; R78-D242 IonicContact NH1-OD1 3.73Å; R78-D242 IonicContact NH1-OD2 2.82Å; R78-D242 PolarHBondContact NH1-OD2 3.45Å; R78-Y305 HydrophobicContact CB-CE1 4.06Å; R78-Y305 WeakPolarHBondContact CD-OH 3.26Å
79	I	98.1	Very high	96.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73.1	-44.4	169.3	-71.5	-168.9	0	0	0	110.6	V75 G76 S77 D81 R82 V83 I103 V156 S157 I185 A187 Y305	V75-I79 PolarHBondContact O-N 3.16Å; G76-I79 PolarHBondContact O-N 3.25Å; S77-I79 VanDerWaalsContact C-N 3.26Å; S77-I79 PolarHBondContact O-N 3.22Å; I79-D81 VanDerWaalsContact C-N 3.29Å; I79-D81 PolarHBondContact O-N 3.47Å; I79-R82 WeakPolarHBondContact O-CB 3.5Å; I79-R82 PolarHBondContact O-N 3.21Å; I79-R82 VanDerWaalsContact O-N 3.14Å; I79-V83 WeakPolarHBondContact O-CG2 3.34Å; I79-V83 PolarHBondContact O-N 3.23Å; I79-I103 HydrophobicContact CD1-CD1 4.16Å; I79-I103 HydrophobicContact CG2-CD1 4.08Å; I79-I103 HydrophobicContact CG2-CG1 4.4Å; I79-I103 HydrophobicContact CG2-CG2 4Å; I79-V156 HydrophobicContact CG2-CB 4.2Å; I79-V156 HydrophobicContact CG2-CG1 4.15Å; I79-S157 WeakPolarHBondContact CD1-O 3.37Å; I79-I185 HydrophobicContact CG2-CG2 4.05Å; I79-A187 HydrophobicContact CD1-CB 3.7Å; I79-A187 HydrophobicContact CG1-CB 4.13Å; I79-Y305 HydrophobicContact CG1-CE1 4.31Å
80	A	97.4	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-40.8	178.4	0	0	0	0	0	111.7	G76 S77 R82 V83 Y84 L107	G76-A80 PolarHBondContact O-N 3.43Å; S77-A80 WeakPolarHBondContact O-CA 3.09Å; S77-A80 WeakPolarHBondContact O-CB 3.15Å; S77-A80 PolarHBondContact O-N 2.84Å; A80-R82 VanDerWaalsContact C-N 3.32Å; A80-R82 PolarHBondContact O-N 2.8Å; A80-V83 WeakPolarHBondContact O-CA 3.43Å; A80-V83 VanDerWaalsContact O-CB 3.32Å; A80-V83 WeakPolarHBondContact O-CB 3.33Å; A80-V83 PolarHBondContact O-N 2.89Å; A80-Y84 HydrophobicContact CB-CE2 4.22Å; A80-Y84 WeakPolarHBondContact O-CD2 3.3Å; A80-Y84 PolarHBondContact O-N 3.1Å; A80-L107 HydrophobicContact CB-CD2 3.96Å; A80-L107 HydrophobicContact CB-CG 4.45Å
81	D	97.1	Very high	96.5	Very high	86 Å²	86	45.5 Å²	45.5	46%	0.46	24%	0.242	S	C	.	.	H	α-helix	trans	-56.1	-45.4	173.7	-68.3	-22.4	0	0	0	111.8	S77 I79 V83 Y84 D85	S77-D81 PolarHBondContact O-N 3.38Å; I79-D81 VanDerWaalsContact C-N 3.29Å; I79-D81 PolarHBondContact O-N 3.47Å; D81-V83 VanDerWaalsContact C-N 3.27Å; D81-V83 PolarHBondContact O-N 3.2Å; D81-Y84 CarbonylContact O-C 3.6Å; D81-Y84 WeakPolarHBondContact O-CA 3.5Å; D81-Y84 WeakPolarHBondContact O-CB 3.37Å; D81-Y84 PolarHBondContact O-N 3.39Å; D81-D85 PolarHBondContact O-N 2.8Å
82	R	97.2	Very high	96.6	Very high	45 Å²	45	47.1 Å²	47.1	17%	0.17	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-27.9	175.9	-71.9	171.6	169.4	74.8	-0.4	113.4	R78 I79 A80 I185 D240 I307	R78-R82 WeakPolarHBondContact O-CG 3.23Å; R78-R82 PolarHBondContact O-NH1 2.8Å; I79-R82 WeakPolarHBondContact O-CB 3.5Å; I79-R82 PolarHBondContact O-N 3.21Å; I79-R82 VanDerWaalsContact O-N 3.14Å; A80-R82 VanDerWaalsContact C-N 3.32Å; A80-R82 PolarHBondContact O-N 2.8Å; R82-I185 HydrophobicContact CB-CD1 4.31Å; R82-I185 HydrophobicContact CB-CG2 4.13Å; R82-D240 IonicContact NH2-OD2 2.78Å; R82-I307 HydrophobicContact CB-CD1 4.44Å; R82-I307 HydrophobicContact CG-CD1 4.49Å
83	V	97.6	Very high	96.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.4	-42.7	171.1	175.5	0	0	0	0	109.7	I79 A80 D81 D85 I86 F90 L107 T111 I112 L154 V156 I185	I79-V83 WeakPolarHBondContact O-CG2 3.34Å; I79-V83 PolarHBondContact O-N 3.23Å; A80-V83 WeakPolarHBondContact O-CA 3.43Å; A80-V83 VanDerWaalsContact O-CB 3.32Å; A80-V83 WeakPolarHBondContact O-CB 3.33Å; A80-V83 PolarHBondContact O-N 2.89Å; D81-V83 VanDerWaalsContact C-N 3.27Å; D81-V83 PolarHBondContact O-N 3.2Å; V83-D85 VanDerWaalsContact C-N 3.34Å; V83-D85 PolarHBondContact O-N 2.96Å; V83-I86 PolarHBondContact O-N 2.85Å; V83-F90 HydrophobicContact CG1-CD2 4.24Å; V83-F90 HydrophobicContact CG1-CE2 3.95Å; V83-L107 HydrophobicContact CB-CD2 4.1Å; V83-L107 HydrophobicContact CG1-CD2 4.02Å; V83-L107 HydrophobicContact CG2-CD2 4.29Å; V83-T111 HydrophobicContact CG1-CG2 4.06Å; V83-I112 HydrophobicContact CG1-CD1 4.29Å; V83-L154 HydrophobicContact CG1-CD2 3.86Å; V83-L154 HydrophobicContact CG2-CD1 4.48Å; V83-L154 HydrophobicContact CG2-CD2 4.05Å; V83-V156 HydrophobicContact CG2-CG1 3.96Å; V83-I185 HydrophobicContact CG2-CD1 3.83Å
84	Y	97.1	Very high	96.9	Very high	82 Å²	82	43.7 Å²	43.7	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-70.9	-25.1	179.4	-64.6	-51.8	0	0	0	114.1	A80 D81 I86 Y106 L107 N108 T111	A80-Y84 HydrophobicContact CB-CE2 4.22Å; A80-Y84 WeakPolarHBondContact O-CD2 3.3Å; A80-Y84 PolarHBondContact O-N 3.1Å; D81-Y84 CarbonylContact O-C 3.6Å; D81-Y84 WeakPolarHBondContact O-CA 3.5Å; D81-Y84 WeakPolarHBondContact O-CB 3.37Å; D81-Y84 PolarHBondContact O-N 3.39Å; Y84-I86 PolarHBondContact O-N 3.09Å; Y84-Y106 WeakPolarHBondContact CE2-O 3.27Å; Y84-Y106 PolarHBondContact OH-O 3.23Å; Y84-L107 VanDerWaalsContact OH-CA 3.24Å; Y84-L107 WeakPolarHBondContact OH-CA 3.32Å; Y84-N108 VanDerWaalsContact CE1-ND2 3.32Å; Y84-N108 WeakPolarHBondContact CE1-ND2 3.44Å; Y84-N108 PolarHBondContact OH-N 2.89Å; Y84-N108 VanDerWaalsContact OH-N 3.12Å; Y84-N108 PolarHBondContact OH-ND2 3.41Å; Y84-T111 HydrophobicContact CD1-CG2 4.2Å; Y84-T111 HydrophobicContact CE1-CG2 4.2Å; Y84-T111 WeakPolarHBondContact CE1-OG1 3.38Å
85	D	95.5	Very high	96.9	Very high	128 Å²	128	40 Å²	40	68%	0.684	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-18.1	171.7	-73.3	-27.5	0	0	0	112.9	D81 V83 P87	D81-D85 PolarHBondContact O-N 2.8Å; V83-D85 VanDerWaalsContact C-N 3.34Å; V83-D85 PolarHBondContact O-N 2.96Å; D85-P87 WeakPolarHBondContact O-CD 3.24Å
86	I	95.3	Very high	96.9	Very high	21 Å²	21	40 Å²	40	11%	0.108	22%	0.218	C	C	.	.	S	Bend	trans	-91.7	110.8	175.8	-51.1	176.7	0	0	0	108.2	V83 Y84 R88 F90 V183 I185 W309	V83-I86 PolarHBondContact O-N 2.85Å; Y84-I86 PolarHBondContact O-N 3.09Å; I86-R88 HydrophobicContact CG2-CG 3.82Å; I86-R88 PolarHBondContact O-N 2.76Å; I86-F90 HydrophobicContact CB-CE2 4.49Å; I86-F90 HydrophobicContact CB-CZ 4.15Å; I86-F90 HydrophobicContact CD1-CZ 4.06Å; I86-F90 HydrophobicContact CG2-CZ 4Å; I86-V183 HydrophobicContact CD1-CB 4.38Å; I86-V183 HydrophobicContact CD1-CG1 3.81Å; I86-V183 HydrophobicContact CD1-CG2 4.01Å; I86-I185 HydrophobicContact CD1-CD1 3.98Å; I86-W309 HydrophobicContact CD1-CH2 4.06Å; I86-W309 HydrophobicContact CD1-CZ2 3.81Å; I86-W309 HydrophobicContact CG1-CZ2 4.3Å; I86-W309 HydrophobicContact CG2-CH2 3.78Å; I86-W309 HydrophobicContact CG2-CZ2 4.34Å
87	P	91.8	Very high	96.8	Very high	135 Å²	135	40.3 Å²	40.3	88%	0.877	22%	0.221	S	C	*	.			trans	-79	57.6	-172.1	34.3	-38	0	0	0	112.3	D85	D85-P87 WeakPolarHBondContact O-CD 3.24Å
88	R	92.9	Very high	96.7	Very high	71 Å²	71	38.9 Å²	38.9	27%	0.268	21%	0.211	S	C	.	.	S	Bend	trans	-150.2	154.6	176.2	76.3	-169.4	-179.5	167.9	-0.3	111.2	I86 F90 D181 W309	I86-R88 HydrophobicContact CG2-CG 3.82Å; I86-R88 PolarHBondContact O-N 2.76Å; R88-F90 HydrophobicContact CG-CE1 4.1Å; R88-F90 HydrophobicContact CG-CE2 4.2Å; R88-F90 HydrophobicContact CG-CZ 3.87Å; R88-D181 VanDerWaalsContact CZ-O 3.27Å; R88-D181 PolarHBondContact NH1-O 3.31Å; R88-D181 IonicContact NH1-OD1 2.78Å; R88-D181 IonicContact NH1-OD2 3.2Å; R88-D181 PolarHBondContact NH1-OD2 2.79Å; R88-D181 PolarHBondContact NH2-O 3.34Å; R88-W309 VanDerWaalsContact CZ-CZ3 3.42Å
89	A	95.6	Very high	96.5	Very high	62 Å²	62	36.5 Å²	36.5	51%	0.512	20%	0.204	S	C	.	.			trans	-84.4	151.2	168.9	0	0	0	0	0	111.1	T111	A89-T111 CarbonylContact C-O 3.17Å; A89-T111 WeakPolarHBondContact CA-O 3.39Å
90	F	97.7	Very high	96.2	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	100.5	178	-59.9	-82.1	0	0	0	109.3	V83 I86 R88 L92 T111 I112 G113 D153 L154 V183	V83-F90 HydrophobicContact CG1-CD2 4.24Å; V83-F90 HydrophobicContact CG1-CE2 3.95Å; I86-F90 HydrophobicContact CB-CE2 4.49Å; I86-F90 HydrophobicContact CB-CZ 4.15Å; I86-F90 HydrophobicContact CD1-CZ 4.06Å; I86-F90 HydrophobicContact CG2-CZ 4Å; R88-F90 HydrophobicContact CG-CE1 4.1Å; R88-F90 HydrophobicContact CG-CE2 4.2Å; R88-F90 HydrophobicContact CG-CZ 3.87Å; F90-L92 VanDerWaalsContact C-N 3.28Å; F90-L92 PolarHBondContact O-N 2.97Å; F90-T111 HydrophobicContact CD2-CG2 4.15Å; F90-T111 PolarHBondContact N-O 2.86Å; F90-I112 HydrophobicContact CB-CD1 3.89Å; F90-I112 HydrophobicContact CD2-CD1 3.96Å; F90-I112 HydrophobicContact CG-CD1 4.33Å; F90-I112 WeakPolarHBondContact O-CA 3.37Å; F90-G113 PolarHBondContact O-N 2.87Å; F90-D153 HydrophobicContact CB-CB 4.33Å; F90-D153 HydrophobicContact CD1-CB 3.99Å; F90-L154 HydrophobicContact CB-CB 4.02Å; F90-L154 HydrophobicContact CB-CD2 4.47Å; F90-L154 HydrophobicContact CD1-CB 3.54Å; F90-L154 HydrophobicContact CD2-CB 4.44Å; F90-L154 HydrophobicContact CD2-CD2 4Å; F90-L154 HydrophobicContact CE1-CB 3.99Å; F90-L154 HydrophobicContact CE1-CD1 4.49Å; F90-L154 HydrophobicContact CE2-CD2 4.34Å; F90-L154 HydrophobicContact CG-CB 3.75Å; F90-L154 HydrophobicContact CG-CD2 4.1Å; F90-V183 HydrophobicContact CE1-CG1 3.59Å; F90-V183 HydrophobicContact CZ-CG1 3.83Å
91	P	97.8	Very high	96	Very high	82 Å²	82	37.8 Å²	37.8	53%	0.532	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	-39.3	-179.6	-28.1	35.8	0	0	0	113.5	G113 K114	P91-G113 CarbonylContact O-C 3.59Å; P91-K114 PolarHBondContact O-N 2.86Å
92	L	98.2	Very high	95.9	Very high	36 Å²	36	34.5 Å²	34.5	19%	0.188	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	118.2	178.2	-156.6	68.6	0	0	0	111.3	F90 K114 F116 T151 F152 D153 L154	F90-L92 VanDerWaalsContact C-N 3.28Å; F90-L92 PolarHBondContact O-N 2.97Å; L92-K114 HydrophobicContact CD1-CB 3.92Å; L92-K114 HydrophobicContact CD1-CD 4.15Å; L92-K114 HydrophobicContact CD1-CG 4.14Å; L92-F116 HydrophobicContact CD1-CD2 3.88Å; L92-F116 HydrophobicContact CD1-CE2 3.49Å; L92-F116 VanDerWaalsContact CD1-CE2 3.49Å; L92-F116 HydrophobicContact CG-CD2 4.36Å; L92-F116 HydrophobicContact CG-CE2 4.28Å; L92-T151 HydrophobicContact CD2-CG2 3.8Å; L92-T151 WeakPolarHBondContact CD2-O 3.28Å; L92-F152 HydrophobicContact CB-CD1 4.36Å; L92-F152 HydrophobicContact CD2-CD1 3.79Å; L92-F152 HydrophobicContact CD2-CE1 3.85Å; L92-F152 HydrophobicContact CG-CD1 3.69Å; L92-F152 HydrophobicContact CG-CE1 3.89Å; L92-D153 PolarHBondContact N-OD2 3.1Å; L92-D153 PolarHBondContact O-N 3.32Å; L92-L154 PolarHBondContact O-N 2.78Å
93	A	98.4	Very high	95.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.2	177.4	0	0	0	0	0	112	I112 K114 L115 F116 L154	A93-I112 HydrophobicContact CB-CD1 4.22Å; A93-I112 HydrophobicContact CB-CG2 3.78Å; A93-K114 PolarHBondContact N-O 2.86Å; A93-L115 HydrophobicContact CB-CD1 3.74Å; A93-F116 PolarHBondContact O-N 3.04Å; A93-L154 CarbonylContact C-O 3.56Å; A93-L154 VanDerWaalsContact CA-O 3.27Å; A93-L154 WeakPolarHBondContact CA-O 3.4Å; A93-L154 HydrophobicContact CB-CB 4.03Å; A93-L154 HydrophobicContact CB-CD2 4.09Å; A93-L154 HydrophobicContact CB-CG 4.29Å
94	L	98.4	Very high	95.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.7	174.6	178.8	66.8	0	0	0	110	L96 F116 V118 F147 F152 L154 V155 V156 I177	L94-L96 HydrophobicContact CD1-CD2 4.24Å; L94-L96 HydrophobicContact CD2-CD1 4.28Å; L94-L96 HydrophobicContact CD2-CD2 3.55Å; L94-L96 HydrophobicContact CD2-CG 3.81Å; L94-L96 HydrophobicContact CG-CD2 3.83Å; L94-L96 HydrophobicContact CG-CG 3.95Å; L94-F116 CarbonylContact C-O 3.57Å; L94-F116 WeakPolarHBondContact CA-O 3.36Å; L94-F116 HydrophobicContact CD1-CB 3.71Å; L94-V118 HydrophobicContact CD1-CB 4.48Å; L94-V118 HydrophobicContact CD1-CG2 3.67Å; L94-F147 HydrophobicContact CD1-CE2 3.75Å; L94-F147 HydrophobicContact CD1-CZ 3.78Å; L94-F147 HydrophobicContact CD2-CD2 4.07Å; L94-F147 HydrophobicContact CD2-CE2 3.77Å; L94-F147 HydrophobicContact CG-CE2 4.45Å; L94-F152 HydrophobicContact CB-CD1 3.73Å; L94-F152 HydrophobicContact CB-CD2 4.16Å; L94-F152 HydrophobicContact CB-CE1 3.83Å; L94-F152 HydrophobicContact CB-CE2 4.24Å; L94-F152 HydrophobicContact CB-CG 3.91Å; L94-F152 HydrophobicContact CB-CZ 4.08Å; L94-F152 HydrophobicContact CD1-CE1 4.39Å; L94-F152 HydrophobicContact CD1-CE2 4.49Å; L94-F152 HydrophobicContact CD1-CZ 4.07Å; L94-F152 HydrophobicContact CD2-CD2 4.11Å; L94-F152 HydrophobicContact CD2-CE2 3.9Å; L94-F152 HydrophobicContact CD2-CZ 4.29Å; L94-F152 HydrophobicContact CG-CE2 4.47Å; L94-F152 HydrophobicContact CG-CZ 4.39Å; L94-L154 PolarHBondContact N-O 3.3Å; L94-V155 HydrophobicContact CB-CG1 4.49Å; L94-V155 HydrophobicContact CB-CG2 4.18Å; L94-V155 HydrophobicContact CD2-CG1 4.33Å; L94-V155 HydrophobicContact CD2-CG2 4.28Å; L94-V155 CarbonylContact O-C 3.3Å; L94-V155 WeakPolarHBondContact O-CA 3.47Å; L94-V156 PolarHBondContact O-N 3.26Å; L94-I177 HydrophobicContact CD2-CD1 3.37Å
95	D	98	Very high	95.6	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.011	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	106.4	171.5	179.5	6.3	0	0	0	109	C98 L115 F116 Q117 V118 V156	D95-C98 HydrophobicContact CB-CB 4.12Å; D95-C98 WeakPolarHBondContact OD1-CA 3.2Å; D95-C98 WeakPolarHBondContact OD2-CB 3.32Å; D95-L115 HydrophobicContact CB-CD1 4.16Å; D95-F116 PolarHBondContact N-O 3Å; D95-Q117 HydrophobicContact CB-CG 4.19Å; D95-Q117 PolarHBondContact OD2-NE2 3.11Å; D95-V118 PolarHBondContact O-N 3.22Å; D95-V156 WeakPolarHBondContact CA-O 3.38Å; D95-V156 HydrophobicContact CB-CG2 3.86Å
96	L	97.2	Very high	95.6	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123	-177.4	-72.3	-178.9	0	0	0	111.5	L94 V118 L145 V155 V156 S157 I174	L94-L96 HydrophobicContact CD1-CD2 4.24Å; L94-L96 HydrophobicContact CD2-CD1 4.28Å; L94-L96 HydrophobicContact CD2-CD2 3.55Å; L94-L96 HydrophobicContact CD2-CG 3.81Å; L94-L96 HydrophobicContact CG-CD2 3.83Å; L94-L96 HydrophobicContact CG-CG 3.95Å; L96-V118 HydrophobicContact CD2-CB 4.08Å; L96-V118 HydrophobicContact CD2-CG1 4.31Å; L96-V118 HydrophobicContact CD2-CG2 4.45Å; L96-L145 HydrophobicContact CD1-CD1 3.94Å; L96-L145 HydrophobicContact CD1-CD2 4.48Å; L96-L145 HydrophobicContact CD2-CD1 4.21Å; L96-L145 HydrophobicContact CD2-CD2 3.51Å; L96-V155 HydrophobicContact CD1-CG1 3.57Å; L96-V155 HydrophobicContact CG-CG1 3.92Å; L96-V156 PolarHBondContact N-O 3.46Å; L96-S157 WeakPolarHBondContact O-CA 3.41Å; L96-S157 WeakPolarHBondContact O-CB 3.44Å; L96-S157 PolarHBondContact O-OG 3.34Å; L96-I174 HydrophobicContact CD1-CD1 3.73Å; L96-I174 HydrophobicContact CD1-CG1 3.56Å
97	G	95.5	Very high	95.7	Very high	6 Å²	6	28.8 Å²	28.8	6%	0.062	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	38.6	-174.5	0	0	0	0	0	111.8	G99 V118 D119 S160	G97-G99 PolarHBondContact O-N 2.92Å; G97-V118 VanDerWaalsContact CA-O 3.29Å; G97-V118 WeakPolarHBondContact CA-O 3.32Å; G97-V118 PolarHBondContact N-O 2.78Å; G97-D119 VanDerWaalsContact C-OD2 3.29Å; G97-S160 WeakPolarHBondContact CA-OG 3.34Å
98	C	95.4	Very high	95.8	Very high	3 Å²	3	25 Å²	25	2%	0.02	13%	0.134	C	C	.	.			trans	-59.8	-21.6	-167.5	64.4	0	0	0	0	114.2	D95 R100 G101 Q117 V118 L125	D95-C98 HydrophobicContact CB-CB 4.12Å; D95-C98 WeakPolarHBondContact OD1-CA 3.2Å; D95-C98 WeakPolarHBondContact OD2-CB 3.32Å; C98-R100 PolarHBondContact O-N 2.98Å; C98-R100 VanDerWaalsContact O-N 3.12Å; C98-G101 WeakPolarHBondContact O-CA 3.43Å; C98-G101 PolarHBondContact O-N 3.26Å; C98-Q117 HydrophobicContact CB-CB 4.06Å; C98-Q117 HydrophobicContact CB-CG 4.27Å; C98-V118 PolarHBondContact N-O 3.25Å; C98-L125 WeakPolarHBondContact SG-CD2 3.41Å
99	G	93.5	Very high	95.9	Very high	6 Å²	6	27.4 Å²	27.4	6%	0.062	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	-116.1	-171.5	0	0	0	0	0	110.2	G97 G101 D119 A124	G97-G99 PolarHBondContact O-N 2.92Å; G99-G101 VanDerWaalsContact C-N 3.34Å; G99-D119 VanDerWaalsContact CA-OD2 3.28Å; G99-D119 WeakPolarHBondContact CA-OD2 3.2Å; G99-D119 PolarHBondContact N-OD2 2.93Å; G99-A124 CarbonylContact O-C 3.58Å; G99-A124 VanDerWaalsContact O-C 3.3Å
100	R	91.6	Very high	95.8	Very high	25 Å²	25	32.1 Å²	32.1	9%	0.094	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	7.7	175.6	-60.1	178.2	64.1	-161.8	-3.1	113	D69 C98 Y102 N127 S128 L129	D69-R100 IonicContact OD2-CZ 3.16Å; D69-R100 IonicContact OD2-NH1 2.58Å; D69-R100 PolarHBondContact OD2-NH1 2.87Å; C98-R100 PolarHBondContact O-N 2.98Å; C98-R100 VanDerWaalsContact O-N 3.12Å; R100-Y102 HydrophobicContact CB-CE1 4.27Å; R100-N127 PolarHBondContact NE-O 3.05Å; R100-N127 VanDerWaalsContact NE-O 3.13Å; R100-S128 CarbonylContact O-C 3.51Å; R100-S128 VanDerWaalsContact O-CA 3.27Å; R100-S128 WeakPolarHBondContact O-CA 3.47Å; R100-L129 PolarHBondContact O-N 2.77Å
101	G	93.6	Very high	95.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.01	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	44.7	-175.7	0	0	0	0	0	113.6	C98 G99 I103 A104 Q105	C98-G101 WeakPolarHBondContact O-CA 3.43Å; C98-G101 PolarHBondContact O-N 3.26Å; G99-G101 VanDerWaalsContact C-N 3.34Å; G101-I103 PolarHBondContact O-N 3.23Å; G101-A104 PolarHBondContact O-N 2.74Å; G101-A104 VanDerWaalsContact O-N 3.15Å; G101-Q105 PolarHBondContact O-N 3.18Å
102	Y	95.1	Very high	95.8	Very high	18 Å²	18	29.2 Å²	29.2	7%	0.071	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.5	-176	-58.9	-67.9	0	0	0	113.9	D69 K72 E73 R100 Q105 Y106	D69-Y102 HydrophobicContact CB-CE1 3.75Å; D69-Y102 WeakPolarHBondContact OD1-CE1 3.36Å; D69-Y102 VanDerWaalsContact OD1-CZ 3.32Å; D69-Y102 PolarHBondContact OD1-OH 3.39Å; K72-Y102 HydrophobicContact CB-CD1 3.85Å; K72-Y102 HydrophobicContact CB-CD2 3.89Å; K72-Y102 HydrophobicContact CB-CE1 4.01Å; K72-Y102 HydrophobicContact CB-CE2 4.05Å; K72-Y102 HydrophobicContact CB-CG 3.77Å; K72-Y102 HydrophobicContact CD-CD2 3.96Å; K72-Y102 HydrophobicContact CD-CE1 4.24Å; K72-Y102 HydrophobicContact CD-CE2 3.37Å; K72-Y102 HydrophobicContact CG-CE2 4.36Å; E73-Y102 HydrophobicContact CG-CD1 4.18Å; R100-Y102 HydrophobicContact CB-CE1 4.27Å; Y102-Q105 WeakPolarHBondContact O-CG 3.33Å; Y102-Q105 PolarHBondContact O-NE2 2.99Å; Y102-Q105 VanDerWaalsContact O-NE2 3.08Å; Y102-Y106 WeakPolarHBondContact O-CD2 3.29Å; Y102-Y106 VanDerWaalsContact O-CE2 3.27Å; Y102-Y106 WeakPolarHBondContact O-CE2 3.4Å
103	I	96.8	Very high	95.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-43	174.4	-52.4	168.4	0	0	0	110.1	I79 G101 Q105 Y106 L107 V156	I79-I103 HydrophobicContact CD1-CD1 4.16Å; I79-I103 HydrophobicContact CG2-CD1 4.08Å; I79-I103 HydrophobicContact CG2-CG1 4.4Å; I79-I103 HydrophobicContact CG2-CG2 4Å; G101-I103 PolarHBondContact O-N 3.23Å; I103-Q105 PolarHBondContact O-N 2.96Å; I103-Q105 VanDerWaalsContact O-N 3.14Å; I103-Y106 PolarHBondContact O-N 3.49Å; I103-L107 HydrophobicContact CG2-CD1 3.76Å; I103-L107 HydrophobicContact CG2-CG 4.09Å; I103-L107 PolarHBondContact O-N 3.23Å; I103-V156 HydrophobicContact CD1-CB 3.86Å; I103-V156 HydrophobicContact CD1-CG2 3.58Å; I103-V156 HydrophobicContact CG2-CG2 4.3Å
104	A	95.4	Very high	95.7	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.017	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-58.9	-29.8	-171.4	0	0	0	0	0	114.3	G101 Y106 L107 L115 T131	G101-A104 PolarHBondContact O-N 2.74Å; G101-A104 VanDerWaalsContact O-N 3.15Å; A104-Y106 PolarHBondContact O-N 3.03Å; A104-L107 PolarHBondContact O-N 3.16Å; A104-L115 HydrophobicContact CB-CD2 3.54Å; A104-T131 PolarHBondContact O-OG1 2.95Å
105	Q	93.9	Very high	95.7	Very high	65 Å²	65	33.3 Å²	33.3	30%	0.304	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-67.4	-23.1	176.5	69.7	-175.3	-45.6	0	0	113.7	G101 Y102 I103 L129	G101-Q105 PolarHBondContact O-N 3.18Å; Y102-Q105 WeakPolarHBondContact O-CG 3.33Å; Y102-Q105 PolarHBondContact O-NE2 2.99Å; Y102-Q105 VanDerWaalsContact O-NE2 3.08Å; I103-Q105 PolarHBondContact O-N 2.96Å; I103-Q105 VanDerWaalsContact O-N 3.14Å; Q105-L129 HydrophobicContact CB-CD1 4.21Å; Q105-L129 HydrophobicContact CG-CD1 4.38Å
106	Y	95.9	Very high	95.7	Very high	76 Å²	76	35 Å²	35	30%	0.298	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-100.2	-5	179.9	-58	-68.1	0	0	0	112.8	E73 Y84 Y102 I103 A104	E73-Y106 VanDerWaalsContact O-CE2 3.32Å; E73-Y106 WeakPolarHBondContact O-CE2 3.43Å; Y84-Y106 WeakPolarHBondContact CE2-O 3.27Å; Y84-Y106 PolarHBondContact OH-O 3.23Å; Y102-Y106 WeakPolarHBondContact O-CD2 3.29Å; Y102-Y106 VanDerWaalsContact O-CE2 3.27Å; Y102-Y106 WeakPolarHBondContact O-CE2 3.4Å; I103-Y106 PolarHBondContact O-N 3.49Å; A104-Y106 PolarHBondContact O-N 3.03Å
107	L	96.2	Very high	95.7	Very high	12 Å²	12	35 Å²	35	6%	0.063	17%	0.174	C	C	.	.			trans	-92.1	150.7	177.2	-65.7	174.7	0	0	0	111	A80 V83 Y84 I103 A104 I112 I133	A80-L107 HydrophobicContact CB-CD2 3.96Å; A80-L107 HydrophobicContact CB-CG 4.45Å; V83-L107 HydrophobicContact CB-CD2 4.1Å; V83-L107 HydrophobicContact CG1-CD2 4.02Å; V83-L107 HydrophobicContact CG2-CD2 4.29Å; Y84-L107 VanDerWaalsContact OH-CA 3.24Å; Y84-L107 WeakPolarHBondContact OH-CA 3.32Å; I103-L107 HydrophobicContact CG2-CD1 3.76Å; I103-L107 HydrophobicContact CG2-CG 4.09Å; I103-L107 PolarHBondContact O-N 3.23Å; A104-L107 PolarHBondContact O-N 3.16Å; L107-I112 HydrophobicContact CB-CG1 4.19Å; L107-I112 HydrophobicContact CD1-CG1 4.16Å; L107-I112 HydrophobicContact CD2-CG1 4.39Å; L107-I112 HydrophobicContact CG-CG1 4.49Å; L107-I133 HydrophobicContact CB-CD1 3.5Å
108	N	95.1	Very high	95.7	Very high	55 Å²	55	34.8 Å²	34.8	29%	0.294	17%	0.171	S	C	.	.			trans	-118.9	159.7	178.7	68.6	45.9	0	0	0	112.9	Y84 E110 T111 I112	Y84-N108 VanDerWaalsContact CE1-ND2 3.32Å; Y84-N108 WeakPolarHBondContact CE1-ND2 3.44Å; Y84-N108 PolarHBondContact OH-N 2.89Å; Y84-N108 VanDerWaalsContact OH-N 3.12Å; Y84-N108 PolarHBondContact OH-ND2 3.41Å; N108-E110 VanDerWaalsContact C-N 3.25Å; N108-E110 PolarHBondContact O-N 2.92Å; N108-E110 WeakPolarHBondContact OD1-CB 3.42Å; N108-E110 PolarHBondContact OD1-N 2.86Å; N108-T111 PolarHBondContact O-N 2.9Å; N108-T111 WeakPolarHBondContact OD1-CB 3.34Å; N108-T111 PolarHBondContact OD1-N 3.02Å; N108-T111 PolarHBondContact OD1-OG1 3.31Å; N108-I112 PolarHBondContact O-N 2.9Å
109	K	95.3	Very high	95.8	Very high	122 Å²	122	34.6 Å²	34.6	53%	0.53	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.8	-179.4	70.2	-170	172.2	-138.9	0	114.8	I112 E132	K109-I112 WeakPolarHBondContact CA-O 3.47Å; K109-E132 IonicContact NZ-OE2 2.65Å; K109-E132 PolarHBondContact NZ-OE2 2.8Å
110	E	93.7	Very high	95.9	Very high	161 Å²	161	35.1 Å²	35.1	75%	0.752	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-35.6	176	-59	-177	174	0	0	110.4	N108	N108-E110 VanDerWaalsContact C-N 3.25Å; N108-E110 PolarHBondContact O-N 2.92Å; N108-E110 WeakPolarHBondContact OD1-CB 3.42Å; N108-E110 PolarHBondContact OD1-N 2.86Å
111	T	96	Very high	96.1	Very high	21 Å²	21	33.9 Å²	33.9	13%	0.129	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-40.3	179.7	-51.5	0	0	0	0	111.2	V83 Y84 A89 F90 N108	V83-T111 HydrophobicContact CG1-CG2 4.06Å; Y84-T111 HydrophobicContact CD1-CG2 4.2Å; Y84-T111 HydrophobicContact CE1-CG2 4.2Å; Y84-T111 WeakPolarHBondContact CE1-OG1 3.38Å; A89-T111 CarbonylContact C-O 3.17Å; A89-T111 WeakPolarHBondContact CA-O 3.39Å; F90-T111 HydrophobicContact CD2-CG2 4.15Å; F90-T111 PolarHBondContact N-O 2.86Å; N108-T111 PolarHBondContact O-N 2.9Å; N108-T111 WeakPolarHBondContact OD1-CB 3.34Å; N108-T111 PolarHBondContact OD1-N 3.02Å; N108-T111 PolarHBondContact OD1-OG1 3.31Å
112	I	97.8	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.9	-177	-51.2	-58.6	0	0	0	110.7	V83 F90 A93 L107 N108 K109 L115 I133 L154	V83-I112 HydrophobicContact CG1-CD1 4.29Å; F90-I112 HydrophobicContact CB-CD1 3.89Å; F90-I112 HydrophobicContact CD2-CD1 3.96Å; F90-I112 HydrophobicContact CG-CD1 4.33Å; F90-I112 WeakPolarHBondContact O-CA 3.37Å; A93-I112 HydrophobicContact CB-CD1 4.22Å; A93-I112 HydrophobicContact CB-CG2 3.78Å; L107-I112 HydrophobicContact CB-CG1 4.19Å; L107-I112 HydrophobicContact CD1-CG1 4.16Å; L107-I112 HydrophobicContact CD2-CG1 4.39Å; L107-I112 HydrophobicContact CG-CG1 4.49Å; N108-I112 PolarHBondContact O-N 2.9Å; K109-I112 WeakPolarHBondContact CA-O 3.47Å; I112-L115 HydrophobicContact CG2-CB 4.29Å; I112-I133 HydrophobicContact CB-CD1 3.9Å; I112-I133 HydrophobicContact CB-CG1 4.42Å; I112-I133 HydrophobicContact CB-CG2 4.29Å; I112-I133 HydrophobicContact CG1-CD1 4.28Å; I112-I133 HydrophobicContact CG2-CD1 4.34Å; I112-I133 HydrophobicContact CG2-CG2 3.89Å; I112-L154 HydrophobicContact CD1-CD2 3.66Å
113	G	97.3	Very high	96.1	Very high	39 Å²	39	37.9 Å²	37.9	40%	0.402	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-47.6	179.9	0	0	0	0	0	113.4	F90 P91 P134	F90-G113 PolarHBondContact O-N 2.87Å; P91-G113 CarbonylContact O-C 3.59Å; G113-P134 WeakPolarHBondContact O-CD 3.25Å
114	K	98	Very high	95.9	Very high	83 Å²	83	38 Å²	38	36%	0.361	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	133.8	177.6	-177.1	173.7	-176.8	175.9	0	110.3	P91 L92 A93 F116 P134 V136	P91-K114 PolarHBondContact O-N 2.86Å; L92-K114 HydrophobicContact CD1-CB 3.92Å; L92-K114 HydrophobicContact CD1-CD 4.15Å; L92-K114 HydrophobicContact CD1-CG 4.14Å; A93-K114 PolarHBondContact N-O 2.86Å; K114-F116 HydrophobicContact CD-CE2 3.82Å; K114-F116 HydrophobicContact CD-CZ 4.48Å; K114-F116 HydrophobicContact CG-CD2 4.42Å; K114-F116 HydrophobicContact CG-CE2 4Å; K114-P134 WeakPolarHBondContact CA-O 3.48Å; K114-P134 WeakPolarHBondContact CG-O 3.36Å; K114-V136 VanDerWaalsContact CE-CG2 3.47Å
115	L	98	Very high	95.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.9	-178	-172.3	63.6	0	0	0	111.2	A93 D95 A104 I112 Q117 I133 P134 T135 V136	A93-L115 HydrophobicContact CB-CD1 3.74Å; D95-L115 HydrophobicContact CB-CD1 4.16Å; A104-L115 HydrophobicContact CB-CD2 3.54Å; I112-L115 HydrophobicContact CG2-CB 4.29Å; L115-Q117 HydrophobicContact CD2-CG 4.02Å; L115-Q117 HydrophobicContact CG-CG 4.06Å; L115-I133 HydrophobicContact CB-CG2 3.79Å; L115-P134 PolarHBondContact N-O 2.9Å; L115-T135 CarbonylContact O-C 3.53Å; L115-T135 VanDerWaalsContact O-CA 3.27Å; L115-T135 WeakPolarHBondContact O-CA 3.29Å; L115-V136 PolarHBondContact O-N 2.73Å
116	F	97.8	Very high	95.7	Very high	38 Å²	38	41.9 Å²	41.9	17%	0.167	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.3	168.1	-77.9	-109.4	0	0	0	108.1	L92 A93 L94 D95 K114 V136 I138 F147 F152	L92-F116 HydrophobicContact CD1-CD2 3.88Å; L92-F116 HydrophobicContact CD1-CE2 3.49Å; L92-F116 VanDerWaalsContact CD1-CE2 3.49Å; L92-F116 HydrophobicContact CG-CD2 4.36Å; L92-F116 HydrophobicContact CG-CE2 4.28Å; A93-F116 PolarHBondContact O-N 3.04Å; L94-F116 CarbonylContact C-O 3.57Å; L94-F116 WeakPolarHBondContact CA-O 3.36Å; L94-F116 HydrophobicContact CD1-CB 3.71Å; D95-F116 PolarHBondContact N-O 3Å; K114-F116 HydrophobicContact CD-CE2 3.82Å; K114-F116 HydrophobicContact CD-CZ 4.48Å; K114-F116 HydrophobicContact CG-CD2 4.42Å; K114-F116 HydrophobicContact CG-CE2 4Å; F116-V136 CarbonylContact C-O 3.59Å; F116-V136 WeakPolarHBondContact CA-O 3.08Å; F116-V136 HydrophobicContact CD1-CB 4.13Å; F116-V136 HydrophobicContact CD1-CG1 4.29Å; F116-V136 HydrophobicContact CE1-CB 4.11Å; F116-V136 HydrophobicContact CE1-CG1 4.13Å; F116-V136 HydrophobicContact CZ-CB 4.47Å; F116-V136 HydrophobicContact CZ-CG2 4.42Å; F116-I138 HydrophobicContact CD1-CD1 3.65Å; F116-I138 HydrophobicContact CE1-CD1 4.16Å; F116-F147 HydrophobicContact CD1-CE1 4.37Å; F116-F152 HydrophobicContact CB-CE1 3.92Å; F116-F152 HydrophobicContact CB-CZ 4.23Å; F116-F152 AromaticContact CD2-CE1 3.85Å; F116-F152 HydrophobicContact CD2-CE1 3.85Å; F116-F152 AromaticContact CG-CE1 3.87Å; F116-F152 HydrophobicContact CG-CE1 3.87Å; F116-F152 HydrophobicContact CG-CZ 4.19Å
117	Q	97.2	Very high	95.4	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.4	-179.6	-71.1	-163.8	-64.1	0	0	109.4	D95 C98 L115 T135 V136 S137 I138	D95-Q117 HydrophobicContact CB-CG 4.19Å; D95-Q117 PolarHBondContact OD2-NE2 3.11Å; C98-Q117 HydrophobicContact CB-CB 4.06Å; C98-Q117 HydrophobicContact CB-CG 4.27Å; L115-Q117 HydrophobicContact CD2-CG 4.02Å; L115-Q117 HydrophobicContact CG-CG 4.06Å; Q117-T135 HydrophobicContact CB-CG2 4.4Å; Q117-T135 HydrophobicContact CG-CG2 3.78Å; Q117-T135 VanDerWaalsContact OE1-CG2 3.25Å; Q117-V136 PolarHBondContact N-O 2.6Å; Q117-S137 CarbonylContact O-C 3.42Å; Q117-S137 WeakPolarHBondContact O-CA 3.49Å; Q117-I138 PolarHBondContact O-N 2.99Å
118	V	96.9	Very high	95	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.1	-178.1	173.2	0	0	0	0	109.9	L94 D95 L96 G97 C98 I138 A140 F147	L94-V118 HydrophobicContact CD1-CB 4.48Å; L94-V118 HydrophobicContact CD1-CG2 3.67Å; D95-V118 PolarHBondContact O-N 3.22Å; L96-V118 HydrophobicContact CD2-CB 4.08Å; L96-V118 HydrophobicContact CD2-CG1 4.31Å; L96-V118 HydrophobicContact CD2-CG2 4.45Å; G97-V118 VanDerWaalsContact CA-O 3.29Å; G97-V118 WeakPolarHBondContact CA-O 3.32Å; G97-V118 PolarHBondContact N-O 2.78Å; C98-V118 PolarHBondContact N-O 3.25Å; V118-I138 WeakPolarHBondContact CA-O 3.49Å; V118-I138 HydrophobicContact CG2-CB 4.04Å; V118-I138 HydrophobicContact CG2-CG2 4.4Å; V118-A140 HydrophobicContact CG1-CB 3.91Å; V118-F147 HydrophobicContact CG2-CE2 3.92Å; V118-F147 HydrophobicContact CG2-CZ 3.71Å
119	D	96.7	Very high	94.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.9	168.2	-154.3	-70.4	0	0	0	110.7	K56 G97 G99 A121 L125 I138 L139 A140	K56-D119 WeakPolarHBondContact CE-OD1 3.26Å; K56-D119 IonicContact NZ-OD1 3.91Å; K56-D119 PolarHBondContact NZ-OD1 3.19Å; K56-D119 IonicContact NZ-OD2 3.92Å; K56-D119 PolarHBondContact NZ-OD2 3.49Å; G97-D119 VanDerWaalsContact C-OD2 3.29Å; G99-D119 VanDerWaalsContact CA-OD2 3.28Å; G99-D119 WeakPolarHBondContact CA-OD2 3.2Å; G99-D119 PolarHBondContact N-OD2 2.93Å; D119-A121 VanDerWaalsContact C-N 3.26Å; D119-A121 PolarHBondContact O-N 2.75Å; D119-A121 WeakPolarHBondContact OD1-CB 3.32Å; D119-A121 PolarHBondContact OD1-N 3.4Å; D119-L125 HydrophobicContact CB-CD1 4.41Å; D119-L125 HydrophobicContact CB-CD2 3.8Å; D119-L125 HydrophobicContact CB-CG 3.94Å; D119-I138 PolarHBondContact N-O 3.14Å; D119-L139 WeakPolarHBondContact O-CD1 3.49Å; D119-A140 CarbonylContact C-O 3.59Å; D119-A140 PolarHBondContact O-N 3.37Å
120	I	95.8	Very high	94.2	Very high	16 Å²	16	46 Å²	46	8%	0.082	23%	0.234	C	C	.	.	S	Bend	trans	-72.8	-19.8	172.9	-162.4	174.8	0	0	0	112.3	R53 K56 L139 A140 D141	R53-I120 HydrophobicContact CB-CD1 4.18Å; R53-I120 HydrophobicContact CB-CG1 4.21Å; R53-I120 HydrophobicContact CB-CG2 4.3Å; R53-I120 WeakPolarHBondContact CD-O 3.48Å; R53-I120 HydrophobicContact CG-CG1 4.21Å; R53-I120 WeakPolarHBondContact CG-O 3.21Å; K56-I120 HydrophobicContact CD-CG2 4.33Å; I120-L139 WeakPolarHBondContact O-CD1 3.46Å; I120-A140 WeakPolarHBondContact CA-O 3.39Å; I120-A140 PolarHBondContact N-O 2.91Å; I120-D141 HydrophobicContact CD1-CB 4.27Å; I120-D141 WeakPolarHBondContact CD1-OD2 3.36Å
121	A	95.5	Very high	94.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.			trans	-98.8	104.9	-175.7	0	0	0	0	0	112.6	K56 D119 N123 A124 L125	K56-A121 HydrophobicContact CB-CB 3.52Å; K56-A121 HydrophobicContact CD-CB 4.45Å; D119-A121 VanDerWaalsContact C-N 3.26Å; D119-A121 PolarHBondContact O-N 2.75Å; D119-A121 WeakPolarHBondContact OD1-CB 3.32Å; D119-A121 PolarHBondContact OD1-N 3.4Å; A121-N123 VanDerWaalsContact C-N 3.34Å; A121-N123 PolarHBondContact O-N 3.42Å; A121-A124 HydrophobicContact CB-CB 3.9Å; A121-A124 WeakPolarHBondContact O-CB 3.49Å; A121-A124 PolarHBondContact O-N 2.98Å; A121-L125 PolarHBondContact O-N 2.97Å
122	E	95.1	Very high	93.9	Very high	88 Å²	88	46.2 Å²	46.2	41%	0.411	24%	0.236	S	C	.	.	H	α-helix	trans	-53.6	-43.2	179.3	-172.1	-171.2	-174.3	0	0	114	N57 A124 L125 K126 L139	N57-E122 PolarHBondContact OD1-N 3.21Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 2.73Å; E122-L125 PolarHBondContact O-N 2.97Å; E122-K126 VanDerWaalsContact CD-NZ 3.27Å; E122-K126 HydrophobicContact CG-CD 4.34Å; E122-K126 WeakPolarHBondContact O-CG 3.49Å; E122-K126 PolarHBondContact O-N 3.16Å; E122-K126 WeakPolarHBondContact OE1-CE 3.39Å; E122-K126 IonicContact OE1-NZ 2.8Å; E122-K126 PolarHBondContact OE1-NZ 3.08Å; E122-K126 IonicContact OE2-NZ 3.7Å; E122-L139 HydrophobicContact CB-CD1 4.06Å; E122-L139 HydrophobicContact CB-CD2 4.4Å
123	N	94.3	Very high	93.8	Very high	14 Å²	14	46.4 Å²	46.4	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-71.8	-27.6	-179	-55.4	-49.1	0	0	0	112.1	N57 A60 R61 A121 K126 N127	N57-N123 WeakPolarHBondContact CB-ND2 3.47Å; N57-N123 PolarHBondContact O-ND2 3.04Å; N57-N123 WeakPolarHBondContact OD1-CB 3.42Å; N57-N123 PolarHBondContact OD1-N 2.99Å; N57-N123 PolarHBondContact OD1-ND2 3.35Å; N57-N123 VanDerWaalsContact OD1-ND2 3.14Å; A60-N123 HydrophobicContact CB-CB 3.93Å; R61-N123 HydrophobicContact CG-CB 4.24Å; R61-N123 VanDerWaalsContact NE-CG 3.27Å; R61-N123 PolarHBondContact NE-ND2 3.16Å; R61-N123 PolarHBondContact NE-OD1 2.74Å; R61-N123 PolarHBondContact NH2-ND2 2.92Å; R61-N123 VanDerWaalsContact NH2-ND2 3.17Å; R61-N123 PolarHBondContact NH2-OD1 2.76Å; A121-N123 VanDerWaalsContact C-N 3.34Å; A121-N123 PolarHBondContact O-N 3.42Å; N123-K126 PolarHBondContact O-N 2.77Å; N123-N127 WeakPolarHBondContact O-CB 3.48Å; N123-N127 PolarHBondContact O-N 2.86Å; N123-N127 VanDerWaalsContact O-N 3.08Å
124	A	91.8	Very high	93.7	Very high	5 Å²	5	48.1 Å²	48.1	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-43.9	175.4	0	0	0	0	0	110.1	A60 G99 A121 E122 K126 N127 S128	A60-A124 HydrophobicContact CB-CB 4.24Å; G99-A124 CarbonylContact O-C 3.58Å; G99-A124 VanDerWaalsContact O-C 3.3Å; A121-A124 HydrophobicContact CB-CB 3.9Å; A121-A124 WeakPolarHBondContact O-CB 3.49Å; A121-A124 PolarHBondContact O-N 2.98Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 2.73Å; A124-K126 PolarHBondContact O-N 3.22Å; A124-N127 CarbonylContact O-C 3.58Å; A124-N127 PolarHBondContact O-N 2.84Å; A124-S128 PolarHBondContact O-N 2.81Å
125	L	93.9	Very high	93.7	Very high	16 Å²	16	46.5 Å²	46.5	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-37.7	174.3	-65.2	175.8	0	0	0	113.2	C98 D119 A121 E122 N127 S128 I138 L139	C98-L125 WeakPolarHBondContact SG-CD2 3.41Å; D119-L125 HydrophobicContact CB-CD1 4.41Å; D119-L125 HydrophobicContact CB-CD2 3.8Å; D119-L125 HydrophobicContact CB-CG 3.94Å; A121-L125 PolarHBondContact O-N 2.97Å; E122-L125 PolarHBondContact O-N 2.97Å; L125-N127 VanDerWaalsContact C-N 3.28Å; L125-N127 PolarHBondContact O-N 3.37Å; L125-S128 WeakPolarHBondContact O-CB 3.32Å; L125-S128 PolarHBondContact O-N 2.85Å; L125-S128 PolarHBondContact O-OG 3.03Å; L125-I138 WeakPolarHBondContact CD1-O 3.45Å; L125-L139 HydrophobicContact CD1-CB 4.17Å; L125-L139 HydrophobicContact CD1-CD1 4.28Å
126	K	92.4	Very high	93.6	Very high	131 Å²	131	49 Å²	49	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-68.6	-28.1	177.1	-74.1	176.2	-178.2	170.6	0	113	E122 N123 A124	E122-K126 VanDerWaalsContact CD-NZ 3.27Å; E122-K126 HydrophobicContact CG-CD 4.34Å; E122-K126 WeakPolarHBondContact O-CG 3.49Å; E122-K126 PolarHBondContact O-N 3.16Å; E122-K126 WeakPolarHBondContact OE1-CE 3.39Å; E122-K126 IonicContact OE1-NZ 2.8Å; E122-K126 PolarHBondContact OE1-NZ 3.08Å; E122-K126 IonicContact OE2-NZ 3.7Å; N123-K126 PolarHBondContact O-N 2.77Å; A124-K126 PolarHBondContact O-N 3.22Å
127	N	88.2	Confident	93.5	Very high	67 Å²	67	50 Å²	50	36%	0.358	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	31	-179.6	-66	-16.7	0	0	0	111.6	A60 R100 N123 A124 L125	A60-N127 PolarHBondContact O-ND2 3.26Å; R100-N127 PolarHBondContact NE-O 3.05Å; R100-N127 VanDerWaalsContact NE-O 3.13Å; N123-N127 WeakPolarHBondContact O-CB 3.48Å; N123-N127 PolarHBondContact O-N 2.86Å; N123-N127 VanDerWaalsContact O-N 3.08Å; A124-N127 CarbonylContact O-C 3.58Å; A124-N127 PolarHBondContact O-N 2.84Å; L125-N127 VanDerWaalsContact C-N 3.28Å; L125-N127 PolarHBondContact O-N 3.37Å
128	S	88.2	Confident	93.4	Very high	47 Å²	47	51.8 Å²	51.8	33%	0.329	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-64.7	142.5	176.3	59.7	0	0	0	0	111.3	R100 A124 L125	R100-S128 CarbonylContact O-C 3.51Å; R100-S128 VanDerWaalsContact O-CA 3.27Å; R100-S128 WeakPolarHBondContact O-CA 3.47Å; A124-S128 PolarHBondContact O-N 2.81Å; L125-S128 WeakPolarHBondContact O-CB 3.32Å; L125-S128 PolarHBondContact O-N 2.85Å; L125-S128 PolarHBondContact O-OG 3.03Å
129	L	87.7	Confident	93.4	Very high	45 Å²	45	56.8 Å²	56.8	24%	0.236	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-66.7	145.7	172.6	-62.3	171	0	0	0	110.2	R100 Q105	R100-L129 PolarHBondContact O-N 2.77Å; Q105-L129 HydrophobicContact CB-CD1 4.21Å; Q105-L129 HydrophobicContact CG-CD1 4.38Å
130	E	87.1	Confident	93.3	Very high	194 Å²	194	57.5 Å²	57.5	91%	0.907	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-68.7	138.7	174.6	-66.6	-174.6	173.2	0	0	110.1
131	T	90.2	Very high	93.2	Very high	41 Å²	41	58.4 Å²	58.4	25%	0.252	31%	0.311	S	S	.	.			trans	-137.4	149.1	177.3	177.4	0	0	0	0	109.5	A104 I133 T135	A104-T131 PolarHBondContact O-OG1 2.95Å; T131-I133 HydrophobicContact CG2-CB 4.48Å; T131-I133 PolarHBondContact O-N 3.42Å; T131-I133 PolarHBondContact OG1-N 3.02Å; T131-T135 VanDerWaalsContact CG2-OG1 3.32Å; T131-T135 WeakPolarHBondContact CG2-OG1 3.46Å
132	E	92.1	Very high	92.9	Very high	144 Å²	144	58.6 Å²	58.6	67%	0.673	31%	0.312	S	S	*	.	S	Bend	trans	-71.5	-15.8	174.3	-61.7	-166.9	-177.3	0	0	112.9	K109	K109-E132 IonicContact NZ-OE2 2.65Å; K109-E132 PolarHBondContact NZ-OE2 2.8Å
133	I	95.6	Very high	92.6	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	30%	0.298	C	S	.	.	S	Bend	trans	-78	132.1	-177.4	-59.3	161.7	0	0	0	109.4	L107 I112 L115 T131 T135	L107-I133 HydrophobicContact CB-CD1 3.5Å; I112-I133 HydrophobicContact CB-CD1 3.9Å; I112-I133 HydrophobicContact CB-CG1 4.42Å; I112-I133 HydrophobicContact CB-CG2 4.29Å; I112-I133 HydrophobicContact CG1-CD1 4.28Å; I112-I133 HydrophobicContact CG2-CD1 4.34Å; I112-I133 HydrophobicContact CG2-CG2 3.89Å; L115-I133 HydrophobicContact CB-CG2 3.79Å; T131-I133 HydrophobicContact CG2-CB 4.48Å; T131-I133 PolarHBondContact O-N 3.42Å; T131-I133 PolarHBondContact OG1-N 3.02Å; I133-T135 PolarHBondContact O-N 2.95Å; I133-T135 PolarHBondContact O-OG1 2.91Å
134	P	96.3	Very high	92.5	Very high	75 Å²	75	60.4 Å²	60.4	49%	0.487	32%	0.319	S	S	.	.			trans	-55	112.4	170.9	-25.2	34.4	0	0	0	111	G113 K114 L115	G113-P134 WeakPolarHBondContact O-CD 3.25Å; K114-P134 WeakPolarHBondContact CA-O 3.48Å; K114-P134 WeakPolarHBondContact CG-O 3.36Å; L115-P134 PolarHBondContact N-O 2.9Å
135	T	96.2	Very high	92.6	Very high	49 Å²	49	61 Å²	61	30%	0.301	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140.7	-168.6	-63.2	0	0	0	0	112.5	L115 Q117 T131 I133	L115-T135 CarbonylContact O-C 3.53Å; L115-T135 VanDerWaalsContact O-CA 3.27Å; L115-T135 WeakPolarHBondContact O-CA 3.29Å; Q117-T135 HydrophobicContact CB-CG2 4.4Å; Q117-T135 HydrophobicContact CG-CG2 3.78Å; Q117-T135 VanDerWaalsContact OE1-CG2 3.25Å; T131-T135 VanDerWaalsContact CG2-OG1 3.32Å; T131-T135 WeakPolarHBondContact CG2-OG1 3.46Å; I133-T135 PolarHBondContact O-N 2.95Å; I133-T135 PolarHBondContact O-OG1 2.91Å
136	V	96.1	Very high	92.6	Very high	53 Å²	53	64.1 Å²	64.1	32%	0.321	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117.6	173.9	-179.7	0	0	0	0	109.5	K114 L115 F116 Q117 I138	K114-V136 VanDerWaalsContact CE-CG2 3.47Å; L115-V136 PolarHBondContact O-N 2.73Å; F116-V136 CarbonylContact C-O 3.59Å; F116-V136 WeakPolarHBondContact CA-O 3.08Å; F116-V136 HydrophobicContact CD1-CB 4.13Å; F116-V136 HydrophobicContact CD1-CG1 4.29Å; F116-V136 HydrophobicContact CE1-CB 4.11Å; F116-V136 HydrophobicContact CE1-CG1 4.13Å; F116-V136 HydrophobicContact CZ-CB 4.47Å; F116-V136 HydrophobicContact CZ-CG2 4.42Å; Q117-V136 PolarHBondContact N-O 2.6Å; V136-I138 HydrophobicContact CG1-CG1 4.3Å
137	S	96.2	Very high	92.8	Very high	59 Å²	59	59.5 Å²	59.5	41%	0.413	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133	177.8	-51.4	0	0	0	0	111.4	Q117	Q117-S137 CarbonylContact O-C 3.42Å; Q117-S137 WeakPolarHBondContact O-CA 3.49Å
138	I	96	Very high	93.2	Very high	40 Å²	40	66.1 Å²	66.1	21%	0.205	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.7	-178.4	-62.3	179.1	0	0	0	109.3	F116 Q117 V118 D119 L125 V136 A140 P146 F147	F116-I138 HydrophobicContact CD1-CD1 3.65Å; F116-I138 HydrophobicContact CE1-CD1 4.16Å; Q117-I138 PolarHBondContact O-N 2.99Å; V118-I138 WeakPolarHBondContact CA-O 3.49Å; V118-I138 HydrophobicContact CG2-CB 4.04Å; V118-I138 HydrophobicContact CG2-CG2 4.4Å; D119-I138 PolarHBondContact N-O 3.14Å; L125-I138 WeakPolarHBondContact CD1-O 3.45Å; V136-I138 HydrophobicContact CG1-CG1 4.3Å; I138-A140 HydrophobicContact CG2-CB 4.13Å; I138-A140 PolarHBondContact O-N 3.4Å; I138-P146 HydrophobicContact CG2-CG 4.49Å; I138-F147 HydrophobicContact CD1-CE1 3.68Å; I138-F147 HydrophobicContact CD1-CZ 3.84Å
139	L	96.4	Very high	93.6	Very high	104 Å²	104	69 Å²	69	55%	0.545	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	103.8	171.7	-177.6	68.4	0	0	0	109.3	D119 I120 E122 L125	D119-L139 WeakPolarHBondContact O-CD1 3.49Å; I120-L139 WeakPolarHBondContact O-CD1 3.46Å; E122-L139 HydrophobicContact CB-CD1 4.06Å; E122-L139 HydrophobicContact CB-CD2 4.4Å; L125-L139 HydrophobicContact CD1-CB 4.17Å; L125-L139 HydrophobicContact CD1-CD1 4.28Å
140	A	94.8	Very high	94.1	Very high	16 Å²	16	69.5 Å²	69.5	13%	0.132	35%	0.354	C	S	.	.			trans	-152.2	156.3	177.5	0	0	0	0	0	111.2	V118 D119 I120 I138 P146	V118-A140 HydrophobicContact CG1-CB 3.91Å; D119-A140 CarbonylContact C-O 3.59Å; D119-A140 PolarHBondContact O-N 3.37Å; I120-A140 WeakPolarHBondContact CA-O 3.39Å; I120-A140 PolarHBondContact N-O 2.91Å; I138-A140 HydrophobicContact CG2-CB 4.13Å; I138-A140 PolarHBondContact O-N 3.4Å; A140-P146 HydrophobicContact CB-CG 4.08Å
141	D	92.8	Very high	94.6	Very high	34 Å²	34	62.1 Å²	62.1	18%	0.182	32%	0.322	C	S	.	.			trans	-81.2	132.2	172.9	-163.8	-29.5	0	0	0	109.4	R49 I120 E143 F144	R49-D141 IonicContact CZ-OD1 3.57Å; R49-D141 IonicContact NE-OD1 3.96Å; R49-D141 IonicContact NE-OD2 2.88Å; R49-D141 IonicContact NH2-OD1 3.19Å; R49-D141 PolarHBondContact NH2-OD1 3.03Å; R49-D141 IonicContact NH2-OD2 2.98Å; I120-D141 HydrophobicContact CD1-CB 4.27Å; I120-D141 WeakPolarHBondContact CD1-OD2 3.36Å; D141-E143 PolarHBondContact O-N 3.01Å; D141-E143 VanDerWaalsContact O-N 3.16Å; D141-E143 PolarHBondContact OD1-N 2.89Å; D141-E143 VanDerWaalsContact OD1-N 3.08Å; D141-F144 HydrophobicContact CB-CD2 4.26Å; D141-F144 CarbonylContact O-C 3.56Å; D141-F144 PolarHBondContact O-N 3.11Å
142	E	89.8	Confident	95	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.019	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.8	176.1	64.8	-91.8	-162.7	0	0	113.4	R49 F144 S160 V164	R49-E142 IonicContact CZ-OE1 2.79Å; R49-E142 IonicContact CZ-OE2 2.8Å; R49-E142 IonicContact NH1-OE1 2.66Å; R49-E142 PolarHBondContact NH1-OE1 3.04Å; R49-E142 IonicContact NH2-OE1 2.74Å; R49-E142 PolarHBondContact NH2-OE1 2.98Å; R49-E142 IonicContact NH2-OE2 2.89Å; R49-E142 PolarHBondContact NH2-OE2 3.47Å; E142-F144 VanDerWaalsContact C-N 3.32Å; E142-S160 PolarHBondContact OE1-OG 3.33Å; E142-V164 HydrophobicContact CG-CG1 3.37Å
143	E	89.7	Confident	95.3	Very high	25 Å²	25	54.8 Å²	54.8	12%	0.117	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-18.7	171.3	-70.5	-173.2	-177.5	0	0	113.7	D141 V164 N165 Q173	D141-E143 PolarHBondContact O-N 3.01Å; D141-E143 VanDerWaalsContact O-N 3.16Å; D141-E143 PolarHBondContact OD1-N 2.89Å; D141-E143 VanDerWaalsContact OD1-N 3.08Å; E143-V164 HydrophobicContact CG-CB 3.91Å; E143-V164 HydrophobicContact CG-CG1 3.98Å; E143-N165 WeakPolarHBondContact OE1-CB 3.49Å; E143-N165 PolarHBondContact OE1-N 2.86Å; E143-N165 PolarHBondContact OE1-ND2 3.2Å; E143-Q173 PolarHBondContact O-NE2 3.18Å; E143-Q173 PolarHBondContact O-OE1 3.3Å
144	F	91.6	Very high	95.5	Very high	116 Å²	116	54.6 Å²	54.6	51%	0.509	29%	0.285	S	S	.	.	S	Bend	trans	-138.7	77.4	-173.1	-56.9	-75.9	0	0	0	111.2	D141 E142 P146	D141-F144 HydrophobicContact CB-CD2 4.26Å; D141-F144 CarbonylContact O-C 3.56Å; D141-F144 PolarHBondContact O-N 3.11Å; E142-F144 VanDerWaalsContact C-N 3.32Å; F144-P146 WeakPolarHBondContact O-CD 3.32Å
145	L	93	Very high	95.6	Very high	17 Å²	17	51 Å²	51	9%	0.089	26%	0.262	C	S	.	.			trans	-74.7	123	-172.4	-60.7	-175.3	0	0	0	112	L96 F147 Q173 I174 I177	L96-L145 HydrophobicContact CD1-CD1 3.94Å; L96-L145 HydrophobicContact CD1-CD2 4.48Å; L96-L145 HydrophobicContact CD2-CD1 4.21Å; L96-L145 HydrophobicContact CD2-CD2 3.51Å; L145-F147 HydrophobicContact CB-CD2 4.1Å; L145-F147 PolarHBondContact O-N 3.47Å; L145-Q173 HydrophobicContact CD1-CB 4.16Å; L145-Q173 HydrophobicContact CG-CB 4.47Å; L145-Q173 VanDerWaalsContact N-OE1 3.09Å; L145-I174 HydrophobicContact CD1-CG1 4.14Å; L145-I177 HydrophobicContact CD1-CD1 3.8Å
146	P	93.8	Very high	95.7	Very high	82 Å²	82	48.7 Å²	48.7	53%	0.532	25%	0.247	S	C	.	.			trans	-86.3	40.4	-174.4	36.8	-38	0	0	0	113	I138 A140 F144	I138-P146 HydrophobicContact CG2-CG 4.49Å; A140-P146 HydrophobicContact CB-CG 4.08Å; F144-P146 WeakPolarHBondContact O-CD 3.32Å
147	F	96.7	Very high	95.8	Very high	33 Å²	33	46.2 Å²	46.2	15%	0.145	23%	0.232	C	C	.	.			trans	-118.8	154.6	-175	-53.1	-69	0	0	0	112.6	L94 F116 V118 I138 L145 F152 I177	L94-F147 HydrophobicContact CD1-CE2 3.75Å; L94-F147 HydrophobicContact CD1-CZ 3.78Å; L94-F147 HydrophobicContact CD2-CD2 4.07Å; L94-F147 HydrophobicContact CD2-CE2 3.77Å; L94-F147 HydrophobicContact CG-CE2 4.45Å; F116-F147 HydrophobicContact CD1-CE1 4.37Å; V118-F147 HydrophobicContact CG2-CE2 3.92Å; V118-F147 HydrophobicContact CG2-CZ 3.71Å; I138-F147 HydrophobicContact CD1-CE1 3.68Å; I138-F147 HydrophobicContact CD1-CZ 3.84Å; L145-F147 HydrophobicContact CB-CD2 4.1Å; L145-F147 PolarHBondContact O-N 3.47Å; F147-F152 HydrophobicContact CB-CE2 3.93Å; F147-F152 AromaticContact CD1-CE2 3.76Å; F147-F152 HydrophobicContact CD1-CE2 3.76Å; F147-F152 AromaticContact CD1-CZ 3.79Å; F147-F152 HydrophobicContact CD1-CZ 3.79Å; F147-F152 AromaticContact CD2-CE2 3.83Å; F147-F152 HydrophobicContact CD2-CE2 3.83Å; F147-F152 HydrophobicContact CD2-CZ 4.37Å; F147-F152 HydrophobicContact CE1-CE2 4.19Å; F147-F152 AromaticContact CE1-CZ 3.84Å; F147-F152 HydrophobicContact CE1-CZ 3.84Å; F147-F152 HydrophobicContact CE2-CE2 4.27Å; F147-F152 HydrophobicContact CE2-CZ 4.42Å; F147-F152 AromaticContact CG-CE2 3.57Å; F147-F152 HydrophobicContact CG-CE2 3.57Å; F147-F152 HydrophobicContact CG-CZ 4.08Å; F147-F152 HydrophobicContact CZ-CE2 4.43Å; F147-F152 HydrophobicContact CZ-CZ 4.16Å; F147-I177 HydrophobicContact CB-CB 4.36Å; F147-I177 HydrophobicContact CB-CG2 3.8Å; F147-I177 HydrophobicContact CD2-CD1 4.25Å
148	R	96.9	Very high	95.8	Very high	207 Å²	207	43.9 Å²	43.9	78%	0.781	22%	0.216	S	C	*	.			trans	-80	161.4	176.3	-64.4	-179.6	-178.8	164.4	0.4	110.1	T151	R148-T151 PolarHBondContact O-OG1 2.78Å
149	E	97.6	Very high	95.9	Very high	106 Å²	106	42.4 Å²	42.4	50%	0.495	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	154	170.8	60.2	173.9	-133.6	0	0	111.7	T151 Y176	E149-T151 PolarHBondContact O-N 2.82Å; E149-T151 VanDerWaalsContact O-N 3.16Å; E149-T151 PolarHBondContact O-OG1 3.35Å; E149-Y176 VanDerWaalsContact CA-O 3.27Å; E149-Y176 WeakPolarHBondContact CA-O 3.4Å; E149-Y176 HydrophobicContact CB-CD1 4.28Å; E149-Y176 HydrophobicContact CB-CD2 4.03Å; E149-Y176 HydrophobicContact CB-CE1 3.88Å; E149-Y176 HydrophobicContact CB-CE2 3.6Å; E149-Y176 HydrophobicContact CB-CG 4.36Å; E149-Y176 HydrophobicContact CG-CE2 4.45Å
150	N	97.7	Very high	95.8	Very high	57 Å²	57	37.6 Å²	37.6	31%	0.305	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	40.3	169.1	-53.5	-46.8	0	0	0	113.7	Y176 I177 L178 K179 K310	N150-Y176 PolarHBondContact N-O 2.94Å; N150-I177 PolarHBondContact N-O 3.01Å; N150-L178 WeakPolarHBondContact CA-O 3.48Å; N150-L178 PolarHBondContact OD1-O 3.41Å; N150-K179 VanDerWaalsContact C-CG 3.46Å; N150-K179 HydrophobicContact CB-CG 4.36Å; N150-K179 WeakPolarHBondContact O-CG 3.48Å; N150-K310 PolarHBondContact OD1-NZ 3.12Å
151	T	98.2	Very high	95.8	Very high	39 Å²	39	37 Å²	37	24%	0.239	18%	0.178	C	C	.	.			trans	-94.3	-47.1	-177.7	-61.2	0	0	0	0	111.9	L92 R148 E149 I177 K179	L92-T151 HydrophobicContact CD2-CG2 3.8Å; L92-T151 WeakPolarHBondContact CD2-O 3.28Å; R148-T151 PolarHBondContact O-OG1 2.78Å; E149-T151 PolarHBondContact O-N 2.82Å; E149-T151 VanDerWaalsContact O-N 3.16Å; E149-T151 PolarHBondContact O-OG1 3.35Å; T151-I177 PolarHBondContact N-O 2.9Å; T151-K179 WeakPolarHBondContact O-CE 3.46Å
152	F	98.5	Very high	95.9	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.9	-169.8	-62.3	-79.8	0	0	0	112.8	L92 L94 F116 F147 V155 I177 L178 K179	L92-F152 HydrophobicContact CB-CD1 4.36Å; L92-F152 HydrophobicContact CD2-CD1 3.79Å; L92-F152 HydrophobicContact CD2-CE1 3.85Å; L92-F152 HydrophobicContact CG-CD1 3.69Å; L92-F152 HydrophobicContact CG-CE1 3.89Å; L94-F152 HydrophobicContact CB-CD1 3.73Å; L94-F152 HydrophobicContact CB-CD2 4.16Å; L94-F152 HydrophobicContact CB-CE1 3.83Å; L94-F152 HydrophobicContact CB-CE2 4.24Å; L94-F152 HydrophobicContact CB-CG 3.91Å; L94-F152 HydrophobicContact CB-CZ 4.08Å; L94-F152 HydrophobicContact CD1-CE1 4.39Å; L94-F152 HydrophobicContact CD1-CE2 4.49Å; L94-F152 HydrophobicContact CD1-CZ 4.07Å; L94-F152 HydrophobicContact CD2-CD2 4.11Å; L94-F152 HydrophobicContact CD2-CE2 3.9Å; L94-F152 HydrophobicContact CD2-CZ 4.29Å; L94-F152 HydrophobicContact CG-CE2 4.47Å; L94-F152 HydrophobicContact CG-CZ 4.39Å; F116-F152 HydrophobicContact CB-CE1 3.92Å; F116-F152 HydrophobicContact CB-CZ 4.23Å; F116-F152 AromaticContact CD2-CE1 3.85Å; F116-F152 HydrophobicContact CD2-CE1 3.85Å; F116-F152 AromaticContact CG-CE1 3.87Å; F116-F152 HydrophobicContact CG-CE1 3.87Å; F116-F152 HydrophobicContact CG-CZ 4.19Å; F147-F152 HydrophobicContact CB-CE2 3.93Å; F147-F152 AromaticContact CD1-CE2 3.76Å; F147-F152 HydrophobicContact CD1-CE2 3.76Å; F147-F152 AromaticContact CD1-CZ 3.79Å; F147-F152 HydrophobicContact CD1-CZ 3.79Å; F147-F152 AromaticContact CD2-CE2 3.83Å; F147-F152 HydrophobicContact CD2-CE2 3.83Å; F147-F152 HydrophobicContact CD2-CZ 4.37Å; F147-F152 HydrophobicContact CE1-CE2 4.19Å; F147-F152 AromaticContact CE1-CZ 3.84Å; F147-F152 HydrophobicContact CE1-CZ 3.84Å; F147-F152 HydrophobicContact CE2-CE2 4.27Å; F147-F152 HydrophobicContact CE2-CZ 4.42Å; F147-F152 AromaticContact CG-CE2 3.57Å; F147-F152 HydrophobicContact CG-CE2 3.57Å; F147-F152 HydrophobicContact CG-CZ 4.08Å; F147-F152 HydrophobicContact CZ-CE2 4.43Å; F147-F152 HydrophobicContact CZ-CZ 4.16Å; F152-V155 HydrophobicContact CB-CG2 4.21Å; F152-I177 HydrophobicContact CD2-CB 4.24Å; F152-I177 HydrophobicContact CD2-CD1 3.95Å; F152-I177 HydrophobicContact CD2-CG1 4.25Å; F152-I177 HydrophobicContact CE2-CD1 4.25Å; F152-I177 PolarHBondContact N-O 3.33Å; F152-L178 CarbonylContact O-C 3.52Å; F152-L178 WeakPolarHBondContact O-CA 3.48Å; F152-K179 PolarHBondContact O-N 3.48Å
153	D	98.3	Very high	96.2	Very high	30 Å²	30	35.6 Å²	35.6	16%	0.16	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-29.9	173.4	-52.9	-81.7	0	0	0	111.2	F90 L92 K179 G182 V183	F90-D153 HydrophobicContact CB-CB 4.33Å; F90-D153 HydrophobicContact CD1-CB 3.99Å; L92-D153 PolarHBondContact N-OD2 3.1Å; L92-D153 PolarHBondContact O-N 3.32Å; D153-K179 WeakPolarHBondContact OD1-CD 3.33Å; D153-K179 IonicContact OD1-NZ 2.92Å; D153-K179 PolarHBondContact OD1-NZ 3.14Å; D153-K179 IonicContact OD2-NZ 3.99Å; D153-K179 PolarHBondContact OD2-NZ 2.97Å; D153-G182 VanDerWaalsContact O-CA 3.23Å; D153-G182 WeakPolarHBondContact O-CA 3.44Å; D153-V183 PolarHBondContact O-N 3.11Å; D153-V183 VanDerWaalsContact O-N 3.09Å
154	L	98.6	Very high	96.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.6	179	172.6	66.3	0	0	0	110.2	V83 F90 L92 A93 L94 I112 V156 V183 I185	V83-L154 HydrophobicContact CG1-CD2 3.86Å; V83-L154 HydrophobicContact CG2-CD1 4.48Å; V83-L154 HydrophobicContact CG2-CD2 4.05Å; F90-L154 HydrophobicContact CB-CB 4.02Å; F90-L154 HydrophobicContact CB-CD2 4.47Å; F90-L154 HydrophobicContact CD1-CB 3.54Å; F90-L154 HydrophobicContact CD2-CB 4.44Å; F90-L154 HydrophobicContact CD2-CD2 4Å; F90-L154 HydrophobicContact CE1-CB 3.99Å; F90-L154 HydrophobicContact CE1-CD1 4.49Å; F90-L154 HydrophobicContact CE2-CD2 4.34Å; F90-L154 HydrophobicContact CG-CB 3.75Å; F90-L154 HydrophobicContact CG-CD2 4.1Å; L92-L154 PolarHBondContact O-N 2.78Å; A93-L154 CarbonylContact C-O 3.56Å; A93-L154 VanDerWaalsContact CA-O 3.27Å; A93-L154 WeakPolarHBondContact CA-O 3.4Å; A93-L154 HydrophobicContact CB-CB 4.03Å; A93-L154 HydrophobicContact CB-CD2 4.09Å; A93-L154 HydrophobicContact CB-CG 4.29Å; L94-L154 PolarHBondContact N-O 3.3Å; I112-L154 HydrophobicContact CD1-CD2 3.66Å; L154-V156 HydrophobicContact CD1-CG1 3.77Å; L154-V156 HydrophobicContact CD2-CG1 3.93Å; L154-V156 HydrophobicContact CG-CG1 3.82Å; L154-V183 WeakPolarHBondContact CA-O 3.43Å; L154-V183 HydrophobicContact CD1-CG1 3.53Å; L154-I185 HydrophobicContact CD1-CD1 4.22Å; L154-I185 HydrophobicContact CD1-CG1 4.3Å
155	V	98.6	Very high	96.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.4	164.1	179.9	0	0	0	0	108.1	L94 L96 F152 I174 I177 L178 V183 F184 I185	L94-V155 HydrophobicContact CB-CG1 4.49Å; L94-V155 HydrophobicContact CB-CG2 4.18Å; L94-V155 HydrophobicContact CD2-CG1 4.33Å; L94-V155 HydrophobicContact CD2-CG2 4.28Å; L94-V155 CarbonylContact O-C 3.3Å; L94-V155 WeakPolarHBondContact O-CA 3.47Å; L96-V155 HydrophobicContact CD1-CG1 3.57Å; L96-V155 HydrophobicContact CG-CG1 3.92Å; F152-V155 HydrophobicContact CB-CG2 4.21Å; V155-I174 HydrophobicContact CB-CG2 3.98Å; V155-I174 HydrophobicContact CG1-CG2 3.83Å; V155-I174 HydrophobicContact CG2-CG2 4.22Å; V155-I177 HydrophobicContact CG2-CD1 4.07Å; V155-I177 HydrophobicContact CG2-CG1 4.3Å; V155-L178 HydrophobicContact CB-CD2 4.27Å; V155-L178 HydrophobicContact CG2-CD2 3.63Å; V155-L178 HydrophobicContact CG2-CG 3.89Å; V155-V183 PolarHBondContact N-O 3.37Å; V155-F184 HydrophobicContact CB-CD2 4.19Å; V155-F184 HydrophobicContact CG1-CD2 4.05Å; V155-F184 CarbonylContact O-C 3.59Å; V155-F184 VanDerWaalsContact O-CA 3.29Å; V155-F184 WeakPolarHBondContact O-CA 3.49Å; V155-F184 WeakPolarHBondContact O-CD2 3.24Å; V155-I185 PolarHBondContact O-N 3.02Å
156	V	98.6	Very high	96.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.5	173.1	-60.7	0	0	0	0	110.6	I79 V83 L94 D95 L96 I103 L154 I185	I79-V156 HydrophobicContact CG2-CB 4.2Å; I79-V156 HydrophobicContact CG2-CG1 4.15Å; V83-V156 HydrophobicContact CG2-CG1 3.96Å; L94-V156 PolarHBondContact O-N 3.26Å; D95-V156 WeakPolarHBondContact CA-O 3.38Å; D95-V156 HydrophobicContact CB-CG2 3.86Å; L96-V156 PolarHBondContact N-O 3.46Å; I103-V156 HydrophobicContact CD1-CB 3.86Å; I103-V156 HydrophobicContact CD1-CG2 3.58Å; I103-V156 HydrophobicContact CG2-CG2 4.3Å; L154-V156 HydrophobicContact CD1-CG1 3.77Å; L154-V156 HydrophobicContact CD2-CG1 3.93Å; L154-V156 HydrophobicContact CG-CG1 3.82Å; V156-I185 CarbonylContact C-O 3.56Å; V156-I185 WeakPolarHBondContact CA-O 3.43Å; V156-I185 HydrophobicContact CG1-CB 4.38Å
157	S	98.1	Very high	96.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	125	170.5	-171.2	0	0	0	0	110.3	I79 L96 I185 G186 A187	I79-S157 WeakPolarHBondContact CD1-O 3.37Å; L96-S157 WeakPolarHBondContact O-CA 3.41Å; L96-S157 WeakPolarHBondContact O-CB 3.44Å; L96-S157 PolarHBondContact O-OG 3.34Å; S157-I185 PolarHBondContact N-O 3.27Å; S157-G186 CarbonylContact O-C 3.58Å; S157-G186 VanDerWaalsContact O-CA 3.32Å; S157-G186 WeakPolarHBondContact O-CA 3.23Å; S157-A187 PolarHBondContact O-N 2.63Å
158	S	97.1	Very high	96.3	Very high	10 Å²	10	28.8 Å²	28.8	7%	0.07	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.5	177.3	-174.3	0	0	0	0	110.4	S160	S158-S160 PolarHBondContact O-N 2.85Å; S158-S160 VanDerWaalsContact O-N 3.11Å
159	L	96.5	Very high	96.2	Very high	9 Å²	9	24.6 Å²	24.6	5%	0.047	12%	0.124	C	C	.	.	S	Bend	trans	50.3	40.1	170.2	-58.5	-178.6	0	0	0	114.1	K72 V75 H162 A187 F189	K72-L159 HydrophobicContact CG-CD1 4.24Å; V75-L159 HydrophobicContact CB-CD1 4.03Å; V75-L159 HydrophobicContact CB-CG 4.27Å; V75-L159 HydrophobicContact CG1-CD1 4.27Å; V75-L159 HydrophobicContact CG1-CD2 4.18Å; V75-L159 HydrophobicContact CG1-CG 3.94Å; V75-L159 HydrophobicContact CG2-CD1 4Å; V75-L159 HydrophobicContact CG2-CG 4.47Å; L159-H162 PolarHBondContact O-CE1 3.48Å; L159-A187 WeakPolarHBondContact CA-O 3.33Å; L159-A187 PolarHBondContact N-O 3.18Å; L159-F189 HydrophobicContact CD1-CE1 4.06Å; L159-F189 HydrophobicContact CD1-CZ 3.84Å; L159-F189 HydrophobicContact CD2-CD1 3.83Å; L159-F189 HydrophobicContact CD2-CE1 3.64Å; L159-F189 HydrophobicContact CD2-CE2 4.49Å; L159-F189 HydrophobicContact CD2-CG 4.32Å; L159-F189 HydrophobicContact CD2-CZ 3.99Å; L159-F189 HydrophobicContact CG-CE1 4.46Å; L159-F189 HydrophobicContact CG-CZ 4.4Å
160	S	95	Very high	96.1	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.021	10%	0.1	C	C	.	.			trans	-121.1	-39.1	178.4	-164.8	0	0	0	0	113.9	G97 E142 S158 H162 W163	G97-S160 WeakPolarHBondContact CA-OG 3.34Å; E142-S160 PolarHBondContact OE1-OG 3.33Å; S158-S160 PolarHBondContact O-N 2.85Å; S158-S160 VanDerWaalsContact O-N 3.11Å; S160-H162 PolarHBondContact O-N 2.82Å; S160-H162 VanDerWaalsContact O-N 3.16Å; S160-W163 WeakPolarHBondContact O-CB 3.37Å; S160-W163 PolarHBondContact O-N 3.2Å
161	L	95.6	Very high	96.1	Very high	3 Å²	3	17 Å²	17	2%	0.016	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-67.5	-17.1	-171.2	-65	178.2	0	0	0	114.1	W163 V164 L167 L171 I174 F184	L161-W163 PolarHBondContact O-N 2.78Å; L161-W163 VanDerWaalsContact O-N 3.16Å; L161-V164 VanDerWaalsContact O-CG2 3.25Å; L161-V164 WeakPolarHBondContact O-CG2 3.46Å; L161-V164 PolarHBondContact O-N 2.98Å; L161-L167 HydrophobicContact CB-CD1 4.08Å; L161-L171 HydrophobicContact CD1-CD2 4.45Å; L161-I174 HydrophobicContact CD1-CD1 4.27Å; L161-I174 HydrophobicContact CD2-CD1 4.39Å; L161-F184 HydrophobicContact CD1-CE2 4.31Å; L161-F184 HydrophobicContact CD1-CZ 3.64Å
162	H	95.1	Very high	96	Very high	5 Å²	5	19.1 Å²	19.1	2%	0.023	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-68.7	-6.5	171.9	54.2	-91.3	0	0	0	114	F47 L159 S160 M188 F189 F219 E263	F47-H162 WeakPolarHBondContact CE2-O 3.48Å; F47-H162 WeakPolarHBondContact CZ-O 3.48Å; L159-H162 PolarHBondContact O-CE1 3.48Å; S160-H162 PolarHBondContact O-N 2.82Å; S160-H162 VanDerWaalsContact O-N 3.16Å; H162-M188 HydrophobicContact CB-CB 4.26Å; H162-M188 HydrophobicContact CB-CE 4.07Å; H162-F189 AromaticContact CD2-CD2 3.82Å; H162-F189 AromaticContact CE1-CD2 3.31Å; H162-F189 WeakPolarHBondContact CE1-CD2 3.5Å; H162-F189 AromaticContact CE1-CE2 3.79Å; H162-F189 AromaticContact CE1-CG 3.91Å; H162-F189 PolarHBondContact ND1-N 3.48Å; H162-F189 AromaticContact NE2-CD2 3.17Å; H162-F189 WeakPolarHBondContact NE2-CD2 3.46Å; H162-F189 AromaticContact NE2-CE2 3.67Å; H162-F219 HydrophobicContact CB-CD1 4.07Å; H162-F219 HydrophobicContact CB-CE1 4.45Å; H162-F219 AromaticContact CD2-CE1 3.83Å; H162-E263 IonicContact CD2-OE2 2.6Å; H162-E263 IonicContact CE1-OE2 2.65Å; H162-E263 IonicContact NE2-OE2 4Å; H162-E263 PolarHBondContact NE2-OE2 2.88Å
163	W	94.6	Very high	95.9	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.015	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-102.6	6.4	177.2	-64	113.5	0	0	0	114.5	F47 R49 K52 S160 L161 S217 E263 C266	F47-W163 AromaticContact CD1-CE3 3.97Å; F47-W163 HydrophobicContact CD1-CE3 3.97Å; F47-W163 HydrophobicContact CD1-CZ3 4.14Å; F47-W163 HydrophobicContact CE1-CE3 4.11Å; F47-W163 HydrophobicContact CE1-CZ3 4.19Å; F47-W163 HydrophobicContact CG-CE3 4.38Å; R49-W163 WeakPolarHBondContact CD-O 3.23Å; R49-W163 PolarHBondContact NH1-O 3.06Å; K52-W163 HydrophobicContact CD-CD2 3.88Å; K52-W163 HydrophobicContact CD-CE3 4.21Å; K52-W163 HydrophobicContact CD-CG 4.11Å; K52-W163 VanDerWaalsContact CE-CD1 3.45Å; K52-W163 VanDerWaalsContact CE-NE1 3.31Å; K52-W163 HydrophobicContact CG-CB 4.44Å; K52-W163 HydrophobicContact CG-CD2 4.46Å; K52-W163 HydrophobicContact CG-CG 4.32Å; K52-W163 VanDerWaalsContact NZ-CZ2 3.32Å; S160-W163 WeakPolarHBondContact O-CB 3.37Å; S160-W163 PolarHBondContact O-N 3.2Å; L161-W163 PolarHBondContact O-N 2.78Å; L161-W163 VanDerWaalsContact O-N 3.16Å; W163-S217 WeakPolarHBondContact CH2-OG 3.46Å; W163-S217 WeakPolarHBondContact CZ3-OG 3.27Å; W163-E263 VanDerWaalsContact CE2-OE2 3.29Å; W163-E263 VanDerWaalsContact CZ2-OE2 3.28Å; W163-E263 WeakPolarHBondContact CZ2-OE2 3.47Å; W163-E263 PolarHBondContact NE1-OE1 3.35Å; W163-E263 PolarHBondContact NE1-OE2 2.87Å; W163-C266 HydrophobicContact CZ3-CB 4.33Å; W163-C266 WeakPolarHBondContact CZ3-SG 3.41Å
164	V	93.7	Very high	95.9	Very high	8 Å²	8	19.3 Å²	19.3	5%	0.048	9%	0.093	C	C	.	.			trans	-91.4	140.9	176.7	-55	0	0	0	0	111.5	E142 E143 L161 L167 A170	E142-V164 HydrophobicContact CG-CG1 3.37Å; E143-V164 HydrophobicContact CG-CB 3.91Å; E143-V164 HydrophobicContact CG-CG1 3.98Å; L161-V164 VanDerWaalsContact O-CG2 3.25Å; L161-V164 WeakPolarHBondContact O-CG2 3.46Å; L161-V164 PolarHBondContact O-N 2.98Å; V164-L167 HydrophobicContact CG2-CB 3.84Å; V164-L167 HydrophobicContact CG2-CD1 3.76Å; V164-L167 HydrophobicContact CG2-CG 4.42Å; V164-A170 HydrophobicContact CG2-CB 4.13Å
165	N	93.9	Very high	95.9	Very high	23 Å²	23	21 Å²	21	12%	0.123	10%	0.101	C	C	.	.	S	Bend	trans	-77.8	-34.3	178.4	-70.1	-69.5	0	0	0	112.5	I46 F47 E143	I46-N165 PolarHBondContact N-OD1 3.1Å; F47-N165 PolarHBondContact N-OD1 3.18Å; F47-N165 PolarHBondContact O-ND2 3.16Å; E143-N165 WeakPolarHBondContact OE1-CB 3.49Å; E143-N165 PolarHBondContact OE1-N 2.86Å; E143-N165 PolarHBondContact OE1-ND2 3.2Å
166	D	92.8	Very high	95.9	Very high	44 Å²	44	26.5 Å²	26.5	24%	0.235	12%	0.123	C	C	.	.			trans	-117.7	69.6	179.5	-165.1	-13.6	0	0	0	110.3	A43 P168 R169 A170	A43-D166 HydrophobicContact CB-CB 4.15Å; D166-P168 VanDerWaalsContact C-CD 3.46Å; D166-P168 WeakPolarHBondContact OD1-CD 3.48Å; D166-R169 HydrophobicContact CB-CB 4.09Å; D166-R169 PolarHBondContact O-N 2.79Å; D166-R169 VanDerWaalsContact OD1-CB 3.24Å; D166-R169 WeakPolarHBondContact OD1-CB 3.35Å; D166-R169 PolarHBondContact OD1-N 3.11Å; D166-R169 VanDerWaalsContact OD1-N 3.11Å; D166-R169 VanDerWaalsContact OD2-CB 3.3Å; D166-R169 WeakPolarHBondContact OD2-CB 3.17Å; D166-R169 WeakPolarHBondContact OD2-CD 3.43Å; D166-A170 PolarHBondContact O-N 2.76Å
167	L	93.3	Very high	95.8	Very high	15 Å²	15	26.6 Å²	26.6	8%	0.079	12%	0.123	C	C	.	.	H	α-helix	trans	-54.7	-44	176.8	-176.1	61.2	0	0	0	113.4	L161 V164 R169 A170 L171 M188 L225 L228	L161-L167 HydrophobicContact CB-CD1 4.08Å; V164-L167 HydrophobicContact CG2-CB 3.84Å; V164-L167 HydrophobicContact CG2-CD1 3.76Å; V164-L167 HydrophobicContact CG2-CG 4.42Å; L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 2.86Å; L167-A170 PolarHBondContact O-N 2.86Å; L167-L171 HydrophobicContact CD1-CD1 4.4Å; L167-L171 HydrophobicContact CD1-CG 4.19Å; L167-L171 HydrophobicContact CG-CD1 4.25Å; L167-L171 HydrophobicContact CG-CG 4.47Å; L167-L171 WeakPolarHBondContact O-CG 3.29Å; L167-L171 PolarHBondContact O-N 2.92Å; L167-M188 HydrophobicContact CD2-CE 4.41Å; L167-M188 HydrophobicContact CD2-SD 4.45Å; L167-L225 HydrophobicContact CD2-CD2 4.33Å; L167-L228 HydrophobicContact CD2-CD1 3.86Å; L167-L228 HydrophobicContact CG-CD1 4.37Å
168	P	93.7	Very high	95.8	Very high	40 Å²	40	26.6 Å²	26.6	26%	0.26	12%	0.123	S	C	.	.	H	α-helix	trans	-54.6	-48.6	174.9	-19	25.5	0	0	0	112.5	D166 L171 E172 L228	D166-P168 VanDerWaalsContact C-CD 3.46Å; D166-P168 WeakPolarHBondContact OD1-CD 3.48Å; P168-L171 PolarHBondContact O-N 3.04Å; P168-E172 WeakPolarHBondContact O-CG 3.27Å; P168-E172 PolarHBondContact O-N 3.45Å; P168-L228 HydrophobicContact CB-CD2 4.18Å; P168-L228 HydrophobicContact CG-CD2 3.71Å
169	R	94.6	Very high	95.9	Very high	120 Å²	120	29 Å²	29	45%	0.453	13%	0.132	S	C	.	.	H	α-helix	trans	-69.4	-33.4	-179.9	-173.4	-179.4	173.9	175.2	-1.3	113	D166 L167 E172 Q173	D166-R169 HydrophobicContact CB-CB 4.09Å; D166-R169 PolarHBondContact O-N 2.79Å; D166-R169 VanDerWaalsContact OD1-CB 3.24Å; D166-R169 WeakPolarHBondContact OD1-CB 3.35Å; D166-R169 PolarHBondContact OD1-N 3.11Å; D166-R169 VanDerWaalsContact OD1-N 3.11Å; D166-R169 VanDerWaalsContact OD2-CB 3.3Å; D166-R169 WeakPolarHBondContact OD2-CB 3.17Å; D166-R169 WeakPolarHBondContact OD2-CD 3.43Å; L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 2.86Å; R169-E172 PolarHBondContact O-N 3.05Å; R169-Q173 WeakPolarHBondContact O-CG 3.27Å; R169-Q173 PolarHBondContact O-N 2.83Å; R169-Q173 PolarHBondContact O-NE2 2.79Å
170	A	95.7	Very high	95.9	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-45.7	173.4	0	0	0	0	0	110.6	V164 D166 L167 Q173 I174	V164-A170 HydrophobicContact CG2-CB 4.13Å; D166-A170 PolarHBondContact O-N 2.76Å; L167-A170 PolarHBondContact O-N 2.86Å; A170-Q173 PolarHBondContact O-N 3.48Å; A170-I174 VanDerWaalsContact O-CG1 3.32Å; A170-I174 WeakPolarHBondContact O-CG1 3.4Å; A170-I174 PolarHBondContact O-N 3.05Å
171	L	96.8	Very high	95.9	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-64	-40.5	175.9	-66.6	174.2	0	0	0	112.4	L161 L167 P168 Q173 I174 H175 F184 L228 L229 A232 F234	L161-L171 HydrophobicContact CD1-CD2 4.45Å; L167-L171 HydrophobicContact CD1-CD1 4.4Å; L167-L171 HydrophobicContact CD1-CG 4.19Å; L167-L171 HydrophobicContact CG-CD1 4.25Å; L167-L171 HydrophobicContact CG-CG 4.47Å; L167-L171 WeakPolarHBondContact O-CG 3.29Å; L167-L171 PolarHBondContact O-N 2.92Å; P168-L171 PolarHBondContact O-N 3.04Å; L171-Q173 VanDerWaalsContact C-N 3.32Å; L171-Q173 PolarHBondContact O-N 2.92Å; L171-I174 HydrophobicContact CD2-CD1 4.37Å; L171-I174 PolarHBondContact O-N 2.83Å; L171-H175 WeakPolarHBondContact O-CB 3.44Å; L171-H175 PolarHBondContact O-N 3.17Å; L171-F184 HydrophobicContact CD2-CE1 3.89Å; L171-F184 HydrophobicContact CD2-CZ 4.35Å; L171-L228 HydrophobicContact CD1-CB 3.87Å; L171-L229 HydrophobicContact CD1-CD2 4.18Å; L171-L229 HydrophobicContact CD1-CG 4.5Å; L171-L229 HydrophobicContact CD2-CD2 4Å; L171-A232 HydrophobicContact CB-CB 3.68Å; L171-F234 HydrophobicContact CB-CE2 4.35Å
172	E	96.8	Very high	96	Very high	84 Å²	84	33.3 Å²	33.3	39%	0.393	16%	0.16	S	C	.	.	H	α-helix	trans	-59.9	-40.7	173.5	-75.3	172.9	-170.2	0	0	111.8	P168 R169 H175 Y176 A232	P168-E172 WeakPolarHBondContact O-CG 3.27Å; P168-E172 PolarHBondContact O-N 3.45Å; R169-E172 PolarHBondContact O-N 3.05Å; E172-H175 PolarHBondContact O-N 3.13Å; E172-Y176 WeakPolarHBondContact O-CB 3.41Å; E172-Y176 PolarHBondContact O-N 2.91Å; E172-A232 HydrophobicContact CG-CB 4.13Å
173	Q	97.3	Very high	96.1	Very high	34 Å²	34	33.1 Å²	33.1	16%	0.159	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-41.5	175.4	-76.6	174.6	91.4	0	0	112.1	E143 L145 R169 A170 L171 H175 Y176 I177	E143-Q173 PolarHBondContact O-NE2 3.18Å; E143-Q173 PolarHBondContact O-OE1 3.3Å; L145-Q173 HydrophobicContact CD1-CB 4.16Å; L145-Q173 HydrophobicContact CG-CB 4.47Å; L145-Q173 VanDerWaalsContact N-OE1 3.09Å; R169-Q173 WeakPolarHBondContact O-CG 3.27Å; R169-Q173 PolarHBondContact O-N 2.83Å; R169-Q173 PolarHBondContact O-NE2 2.79Å; A170-Q173 PolarHBondContact O-N 3.48Å; L171-Q173 VanDerWaalsContact C-N 3.32Å; L171-Q173 PolarHBondContact O-N 2.92Å; Q173-H175 VanDerWaalsContact C-N 3.33Å; Q173-H175 PolarHBondContact O-N 3.02Å; Q173-Y176 WeakPolarHBondContact O-CB 3.45Å; Q173-Y176 PolarHBondContact O-N 2.83Å; Q173-I177 WeakPolarHBondContact O-CG1 3.4Å; Q173-I177 WeakPolarHBondContact O-CG2 3.35Å; Q173-I177 PolarHBondContact O-N 2.8Å
174	I	98	Very high	96.3	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-59.3	-46.6	174.5	-67	166.8	0	0	0	110.2	L96 L145 V155 L161 A170 L171 Y176 I177 L178 F184 F234	L96-I174 HydrophobicContact CD1-CD1 3.73Å; L96-I174 HydrophobicContact CD1-CG1 3.56Å; L145-I174 HydrophobicContact CD1-CG1 4.14Å; V155-I174 HydrophobicContact CB-CG2 3.98Å; V155-I174 HydrophobicContact CG1-CG2 3.83Å; V155-I174 HydrophobicContact CG2-CG2 4.22Å; L161-I174 HydrophobicContact CD1-CD1 4.27Å; L161-I174 HydrophobicContact CD2-CD1 4.39Å; A170-I174 VanDerWaalsContact O-CG1 3.32Å; A170-I174 WeakPolarHBondContact O-CG1 3.4Å; A170-I174 PolarHBondContact O-N 3.05Å; L171-I174 HydrophobicContact CD2-CD1 4.37Å; L171-I174 PolarHBondContact O-N 2.83Å; I174-Y176 VanDerWaalsContact C-N 3.34Å; I174-Y176 PolarHBondContact O-N 3.3Å; I174-I177 WeakPolarHBondContact O-CG1 3.31Å; I174-I177 PolarHBondContact O-N 2.92Å; I174-L178 HydrophobicContact CG2-CD1 4.29Å; I174-L178 WeakPolarHBondContact O-CG 3.4Å; I174-L178 PolarHBondContact O-N 2.83Å; I174-F184 HydrophobicContact CD1-CE2 4.09Å; I174-F184 HydrophobicContact CD1-CZ 4.29Å; I174-F184 HydrophobicContact CG2-CB 4.07Å; I174-F184 HydrophobicContact CG2-CD2 3.74Å; I174-F184 HydrophobicContact CG2-CE2 4.37Å; I174-F184 HydrophobicContact CG2-CG 3.88Å; I174-F234 HydrophobicContact CB-CZ 4.32Å; I174-F234 HydrophobicContact CG2-CZ 3.92Å
175	H	97.9	Very high	96.5	Very high	37 Å²	37	32.5 Å²	32.5	17%	0.171	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-39.6	175.9	179.4	-96.8	0	0	0	112.4	L171 E172 Q173 I177 L178 A232 G233 F234 K310	L171-H175 WeakPolarHBondContact O-CB 3.44Å; L171-H175 PolarHBondContact O-N 3.17Å; E172-H175 PolarHBondContact O-N 3.13Å; Q173-H175 VanDerWaalsContact C-N 3.33Å; Q173-H175 PolarHBondContact O-N 3.02Å; H175-I177 PolarHBondContact O-N 3.04Å; H175-L178 PolarHBondContact O-N 3.16Å; H175-A232 VanDerWaalsContact CG-O 3.31Å; H175-A232 PolarHBondContact ND1-O 2.86Å; H175-G233 PolarHBondContact NE2-O 3.02Å; H175-F234 HydrophobicContact CB-CD2 4.44Å; H175-F234 HydrophobicContact CB-CE1 4.18Å; H175-F234 HydrophobicContact CB-CE2 3.88Å; H175-F234 HydrophobicContact CB-CZ 3.74Å; H175-K310 WeakPolarHBondContact O-CD 3.29Å; H175-K310 PolarHBondContact O-NZ 3.28Å
176	Y	97.8	Very high	96.7	Very high	114 Å²	114	31.4 Å²	31.4	45%	0.447	15%	0.15	S	C	.	.	H	α-helix	trans	-60.6	-46.1	177.9	174.5	-100.6	0	0	0	112.2	E149 N150 E172 Q173 I174 L178 K310	E149-Y176 VanDerWaalsContact CA-O 3.27Å; E149-Y176 WeakPolarHBondContact CA-O 3.4Å; E149-Y176 HydrophobicContact CB-CD1 4.28Å; E149-Y176 HydrophobicContact CB-CD2 4.03Å; E149-Y176 HydrophobicContact CB-CE1 3.88Å; E149-Y176 HydrophobicContact CB-CE2 3.6Å; E149-Y176 HydrophobicContact CB-CG 4.36Å; E149-Y176 HydrophobicContact CG-CE2 4.45Å; N150-Y176 PolarHBondContact N-O 2.94Å; E172-Y176 WeakPolarHBondContact O-CB 3.41Å; E172-Y176 PolarHBondContact O-N 2.91Å; Q173-Y176 WeakPolarHBondContact O-CB 3.45Å; Q173-Y176 PolarHBondContact O-N 2.83Å; I174-Y176 VanDerWaalsContact C-N 3.34Å; I174-Y176 PolarHBondContact O-N 3.3Å; Y176-L178 PolarHBondContact O-N 3.32Å; Y176-K310 PolarHBondContact O-NZ 3.31Å
177	I	98.2	Very high	96.9	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-77.6	-18.3	-176.3	66.9	172.6	0	0	0	113.8	L94 L145 F147 N150 T151 F152 V155 Q173 I174 H175	L94-I177 HydrophobicContact CD2-CD1 3.37Å; L145-I177 HydrophobicContact CD1-CD1 3.8Å; F147-I177 HydrophobicContact CB-CB 4.36Å; F147-I177 HydrophobicContact CB-CG2 3.8Å; F147-I177 HydrophobicContact CD2-CD1 4.25Å; N150-I177 PolarHBondContact N-O 3.01Å; T151-I177 PolarHBondContact N-O 2.9Å; F152-I177 HydrophobicContact CD2-CB 4.24Å; F152-I177 HydrophobicContact CD2-CD1 3.95Å; F152-I177 HydrophobicContact CD2-CG1 4.25Å; F152-I177 HydrophobicContact CE2-CD1 4.25Å; F152-I177 PolarHBondContact N-O 3.33Å; V155-I177 HydrophobicContact CG2-CD1 4.07Å; V155-I177 HydrophobicContact CG2-CG1 4.3Å; Q173-I177 WeakPolarHBondContact O-CG1 3.4Å; Q173-I177 WeakPolarHBondContact O-CG2 3.35Å; Q173-I177 PolarHBondContact O-N 2.8Å; I174-I177 WeakPolarHBondContact O-CG1 3.31Å; I174-I177 PolarHBondContact O-N 2.92Å; H175-I177 PolarHBondContact O-N 3.04Å
178	L	98.4	Very high	97.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	141.6	174	-80.6	168.9	0	0	0	110.8	N150 F152 V155 I174 H175 Y176 F184 F234 K310	N150-L178 WeakPolarHBondContact CA-O 3.48Å; N150-L178 PolarHBondContact OD1-O 3.41Å; F152-L178 CarbonylContact O-C 3.52Å; F152-L178 WeakPolarHBondContact O-CA 3.48Å; V155-L178 HydrophobicContact CB-CD2 4.27Å; V155-L178 HydrophobicContact CG2-CD2 3.63Å; V155-L178 HydrophobicContact CG2-CG 3.89Å; I174-L178 HydrophobicContact CG2-CD1 4.29Å; I174-L178 WeakPolarHBondContact O-CG 3.4Å; I174-L178 PolarHBondContact O-N 2.83Å; H175-L178 PolarHBondContact O-N 3.16Å; Y176-L178 PolarHBondContact O-N 3.32Å; L178-F184 HydrophobicContact CD1-CB 4.03Å; L178-F234 HydrophobicContact CD1-CE1 3.7Å; L178-F234 HydrophobicContact CD1-CZ 4.37Å; L178-K310 HydrophobicContact CB-CB 4.26Å; L178-K310 HydrophobicContact CB-CD 3.93Å; L178-K310 WeakPolarHBondContact O-CD 3.1Å; L178-K310 WeakPolarHBondContact O-CE 3.35Å; L178-K310 PolarHBondContact O-NZ 2.78Å
179	K	98.1	Very high	97.2	Very high	60 Å²	60	27 Å²	27	26%	0.261	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	158.6	166.9	-73.8	166.8	178.7	167.2	0	110.6	N150 T151 F152 D153 D181 G182 K310	N150-K179 VanDerWaalsContact C-CG 3.46Å; N150-K179 HydrophobicContact CB-CG 4.36Å; N150-K179 WeakPolarHBondContact O-CG 3.48Å; T151-K179 WeakPolarHBondContact O-CE 3.46Å; F152-K179 PolarHBondContact O-N 3.48Å; D153-K179 WeakPolarHBondContact OD1-CD 3.33Å; D153-K179 IonicContact OD1-NZ 2.92Å; D153-K179 PolarHBondContact OD1-NZ 3.14Å; D153-K179 IonicContact OD2-NZ 3.99Å; D153-K179 PolarHBondContact OD2-NZ 2.97Å; K179-D181 PolarHBondContact O-N 3.01Å; K179-G182 WeakPolarHBondContact O-CA 3.46Å; K179-G182 PolarHBondContact O-N 3.31Å; K179-K310 WeakPolarHBondContact O-CD 3.05Å
180	P	96.5	Very high	97.3	Very high	64 Å²	64	21.3 Å²	21.3	42%	0.416	10%	0.102	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	136.8	164.8	-21.1	33	0	0	0	109.9	G182 H312	P180-G182 PolarHBondContact O-N 3.45Å; P180-H312 HydrophobicContact CB-CB 3.97Å; P180-H312 VanDerWaalsContact CB-CD2 3.41Å; P180-H312 WeakPolarHBondContact CB-CD2 3.15Å
181	D	95.1	Very high	97.1	Very high	41 Å²	41	22 Å²	22	22%	0.219	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.2	8.8	-171.9	-157.8	41.5	0	0	0	115.4	R88 K179 K310 H312 Q315	R88-D181 VanDerWaalsContact CZ-O 3.27Å; R88-D181 PolarHBondContact NH1-O 3.31Å; R88-D181 IonicContact NH1-OD1 2.78Å; R88-D181 IonicContact NH1-OD2 3.2Å; R88-D181 PolarHBondContact NH1-OD2 2.79Å; R88-D181 PolarHBondContact NH2-O 3.34Å; K179-D181 PolarHBondContact O-N 3.01Å; D181-K310 WeakPolarHBondContact CA-O 3.28Å; D181-K310 PolarHBondContact N-O 2.92Å; D181-K310 VanDerWaalsContact N-O 3.12Å; D181-H312 HydrophobicContact CB-CB 3.77Å; D181-Q315 WeakPolarHBondContact OD1-CG 3.35Å; D181-Q315 PolarHBondContact OD1-NE2 3.11Å
182	G	97.3	Very high	96.9	Very high	2 Å²	2	26 Å²	26	2%	0.021	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	154.3	171.4	0	0	0	0	0	112	D153 K179 P180 K310	D153-G182 VanDerWaalsContact O-CA 3.23Å; D153-G182 WeakPolarHBondContact O-CA 3.44Å; K179-G182 WeakPolarHBondContact O-CA 3.46Å; K179-G182 PolarHBondContact O-N 3.31Å; P180-G182 PolarHBondContact O-N 3.45Å; G182-K310 PolarHBondContact O-N 3.45Å
183	V	97.8	Very high	96.9	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139.4	-176.1	66.9	0	0	0	0	111.6	I86 F90 D153 L154 V155 I185 I307 W309	I86-V183 HydrophobicContact CD1-CB 4.38Å; I86-V183 HydrophobicContact CD1-CG1 3.81Å; I86-V183 HydrophobicContact CD1-CG2 4.01Å; F90-V183 HydrophobicContact CE1-CG1 3.59Å; F90-V183 HydrophobicContact CZ-CG1 3.83Å; D153-V183 PolarHBondContact O-N 3.11Å; D153-V183 VanDerWaalsContact O-N 3.09Å; L154-V183 WeakPolarHBondContact CA-O 3.43Å; L154-V183 HydrophobicContact CD1-CG1 3.53Å; V155-V183 PolarHBondContact N-O 3.37Å; V183-I185 HydrophobicContact CG2-CG1 4.14Å; V183-I307 HydrophobicContact CG2-CG2 3.8Å; V183-W309 HydrophobicContact CB-CD2 4.02Å; V183-W309 HydrophobicContact CB-CE3 4Å; V183-W309 HydrophobicContact CB-CH2 4.22Å; V183-W309 HydrophobicContact CB-CZ2 4.21Å; V183-W309 HydrophobicContact CB-CZ3 4.15Å; V183-W309 HydrophobicContact CG2-CD2 3.86Å; V183-W309 HydrophobicContact CG2-CE3 4.35Å; V183-W309 HydrophobicContact CG2-CG 4.29Å; V183-W309 HydrophobicContact CG2-CH2 4.36Å; V183-W309 HydrophobicContact CG2-CZ2 3.84Å
184	F	98.5	Very high	96.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.1	167.8	169.7	-123.7	0	0	0	109.5	V155 L161 L171 I174 L178 L229 F234 M306 I307 G308	V155-F184 HydrophobicContact CB-CD2 4.19Å; V155-F184 HydrophobicContact CG1-CD2 4.05Å; V155-F184 CarbonylContact O-C 3.59Å; V155-F184 VanDerWaalsContact O-CA 3.29Å; V155-F184 WeakPolarHBondContact O-CA 3.49Å; V155-F184 WeakPolarHBondContact O-CD2 3.24Å; L161-F184 HydrophobicContact CD1-CE2 4.31Å; L161-F184 HydrophobicContact CD1-CZ 3.64Å; L171-F184 HydrophobicContact CD2-CE1 3.89Å; L171-F184 HydrophobicContact CD2-CZ 4.35Å; I174-F184 HydrophobicContact CD1-CE2 4.09Å; I174-F184 HydrophobicContact CD1-CZ 4.29Å; I174-F184 HydrophobicContact CG2-CB 4.07Å; I174-F184 HydrophobicContact CG2-CD2 3.74Å; I174-F184 HydrophobicContact CG2-CE2 4.37Å; I174-F184 HydrophobicContact CG2-CG 3.88Å; L178-F184 HydrophobicContact CD1-CB 4.03Å; F184-L229 HydrophobicContact CD1-CD2 4.22Å; F184-L229 HydrophobicContact CE1-CD2 4.17Å; F184-F234 HydrophobicContact CB-CD1 4.44Å; F184-F234 HydrophobicContact CB-CE1 3.56Å; F184-F234 HydrophobicContact CB-CZ 3.9Å; F184-F234 HydrophobicContact CD1-CE1 4.37Å; F184-F234 HydrophobicContact CD1-CZ 4.07Å; F184-F234 HydrophobicContact CG-CE1 4.32Å; F184-F234 HydrophobicContact CG-CZ 4.2Å; F184-M306 HydrophobicContact CD1-CG 4.47Å; F184-M306 HydrophobicContact CE1-CG 3.69Å; F184-M306 HydrophobicContact CE1-SD 3.69Å; F184-M306 HydrophobicContact CZ-CG 4.2Å; F184-M306 HydrophobicContact CZ-SD 4.13Å; F184-I307 WeakPolarHBondContact O-CA 3.37Å; F184-G308 PolarHBondContact N-O 2.88Å; F184-G308 PolarHBondContact O-N 3.5Å
185	I	98.4	Very high	96.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.2	172.9	-53.7	-179.2	0	0	0	108.6	I79 R82 V83 I86 L154 V155 V156 S157 V183 M306 I307	I79-I185 HydrophobicContact CG2-CG2 4.05Å; R82-I185 HydrophobicContact CB-CD1 4.31Å; R82-I185 HydrophobicContact CB-CG2 4.13Å; V83-I185 HydrophobicContact CG2-CD1 3.83Å; I86-I185 HydrophobicContact CD1-CD1 3.98Å; L154-I185 HydrophobicContact CD1-CD1 4.22Å; L154-I185 HydrophobicContact CD1-CG1 4.3Å; V155-I185 PolarHBondContact O-N 3.02Å; V156-I185 CarbonylContact C-O 3.56Å; V156-I185 WeakPolarHBondContact CA-O 3.43Å; V156-I185 HydrophobicContact CG1-CB 4.38Å; S157-I185 PolarHBondContact N-O 3.27Å; V183-I185 HydrophobicContact CG2-CG1 4.14Å; I185-M306 CarbonylContact C-O 3.54Å; I185-M306 WeakPolarHBondContact CA-O 3.45Å; I185-I307 HydrophobicContact CG1-CG1 4.34Å; I185-I307 HydrophobicContact CG1-CG2 4.45Å; I185-I307 HydrophobicContact CG2-CG1 4.35Å
186	G	97.6	Very high	96.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	150.4	-176.7	0	0	0	0	0	112.8	S157 Y305 M306	S157-G186 CarbonylContact O-C 3.58Å; S157-G186 VanDerWaalsContact O-CA 3.32Å; S157-G186 WeakPolarHBondContact O-CA 3.23Å; G186-Y305 CarbonylContact O-C 3.54Å; G186-Y305 WeakPolarHBondContact O-CA 3.25Å; G186-M306 PolarHBondContact N-O 2.86Å; G186-M306 PolarHBondContact O-N 3.47Å
187	A	97.8	Very high	96.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.4	161.2	0	0	0	0	0	110.3	V75 I79 S157 L159 I303 Y304 Y305	V75-A187 HydrophobicContact CG1-CB 3.54Å; I79-A187 HydrophobicContact CD1-CB 3.7Å; I79-A187 HydrophobicContact CG1-CB 4.13Å; S157-A187 PolarHBondContact O-N 2.63Å; L159-A187 WeakPolarHBondContact CA-O 3.33Å; L159-A187 PolarHBondContact N-O 3.18Å; A187-I303 HydrophobicContact CB-CG2 4.02Å; A187-Y304 VanDerWaalsContact CA-O 3.26Å; A187-Y304 WeakPolarHBondContact CA-O 3.44Å; A187-Y305 HydrophobicContact CB-CD1 3.85Å; A187-Y305 HydrophobicContact CB-CE1 3.77Å
188	M	96.3	Very high	96.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.8	175.2	65.8	178.9	-83.3	0	0	111.6	H162 L167 T220 L225 I303 Y304 M306	H162-M188 HydrophobicContact CB-CB 4.26Å; H162-M188 HydrophobicContact CB-CE 4.07Å; L167-M188 HydrophobicContact CD2-CE 4.41Å; L167-M188 HydrophobicContact CD2-SD 4.45Å; M188-T220 WeakPolarHBondContact CE-OG1 3.32Å; M188-L225 HydrophobicContact CE-CD2 4.44Å; M188-L225 HydrophobicContact SD-CD1 4.28Å; M188-L225 HydrophobicContact SD-CD2 3.72Å; M188-I303 WeakPolarHBondContact O-CA 3.12Å; M188-Y304 HydrophobicContact CG-CD2 4.46Å; M188-Y304 PolarHBondContact N-O 3.12Å; M188-Y304 PolarHBondContact O-N 2.74Å; M188-M306 HydrophobicContact CG-CE 3.59Å; M188-M306 HydrophobicContact SD-CE 3.64Å
189	F	96.9	Very high	96.6	Very high	6 Å²	6	23 Å²	23	3%	0.026	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	139.2	173.2	-68.7	-43.3	0	0	0	112.1	L71 L159 H162 T193 F219 E263 Y301 Q302 I303	L71-F189 HydrophobicContact CD2-CE1 4.08Å; L71-F189 HydrophobicContact CD2-CZ 3.85Å; L159-F189 HydrophobicContact CD1-CE1 4.06Å; L159-F189 HydrophobicContact CD1-CZ 3.84Å; L159-F189 HydrophobicContact CD2-CD1 3.83Å; L159-F189 HydrophobicContact CD2-CE1 3.64Å; L159-F189 HydrophobicContact CD2-CE2 4.49Å; L159-F189 HydrophobicContact CD2-CG 4.32Å; L159-F189 HydrophobicContact CD2-CZ 3.99Å; L159-F189 HydrophobicContact CG-CE1 4.46Å; L159-F189 HydrophobicContact CG-CZ 4.4Å; H162-F189 AromaticContact CD2-CD2 3.82Å; H162-F189 AromaticContact CE1-CD2 3.31Å; H162-F189 WeakPolarHBondContact CE1-CD2 3.5Å; H162-F189 AromaticContact CE1-CE2 3.79Å; H162-F189 AromaticContact CE1-CG 3.91Å; H162-F189 PolarHBondContact ND1-N 3.48Å; H162-F189 AromaticContact NE2-CD2 3.17Å; H162-F189 WeakPolarHBondContact NE2-CD2 3.46Å; H162-F189 AromaticContact NE2-CE2 3.67Å; F189-T193 HydrophobicContact CB-CG2 4.18Å; F189-T193 HydrophobicContact CD1-CG2 4.06Å; F189-T193 HydrophobicContact CD2-CG2 4.4Å; F189-T193 HydrophobicContact CG-CG2 3.98Å; F189-F219 HydrophobicContact CB-CD1 3.76Å; F189-F219 HydrophobicContact CB-CE1 3.68Å; F189-F219 HydrophobicContact CB-CG 4.32Å; F189-F219 HydrophobicContact CB-CZ 4.18Å; F189-F219 HydrophobicContact CD2-CE1 4.11Å; F189-F219 HydrophobicContact CD2-CZ 4.36Å; F189-F219 HydrophobicContact CG-CE1 4.37Å; F189-E263 HydrophobicContact CE2-CG 4.22Å; F189-Y301 AromaticContact CE1-CD1 3.85Å; F189-Y301 HydrophobicContact CE1-CD1 3.85Å; F189-Y301 HydrophobicContact CE1-CG 4.42Å; F189-Y301 HydrophobicContact CZ-CD1 4.04Å; F189-Q302 CarbonylContact C-O 3.6Å; F189-Q302 WeakPolarHBondContact CA-O 3.28Å; F189-I303 HydrophobicContact CD1-CG1 4.2Å; F189-I303 HydrophobicContact CE1-CG1 4.32Å
190	G	95.2	Very high	96.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-96.7	171.7	176.9	0	0	0	0	0	113.9	D192 T193 F219 Q302	G190-D192 PolarHBondContact O-N 3.5Å; G190-D192 VanDerWaalsContact O-N 3.13Å; G190-T193 PolarHBondContact N-OG1 2.93Å; G190-T193 VanDerWaalsContact O-CB 3.27Å; G190-T193 WeakPolarHBondContact O-CB 3.48Å; G190-T193 PolarHBondContact O-N 3.17Å; G190-T193 PolarHBondContact O-OG1 3.09Å; G190-F219 VanDerWaalsContact C-CB 3.49Å; G190-F219 WeakPolarHBondContact O-CB 3.47Å; G190-F219 WeakPolarHBondContact O-CD2 3.36Å; G190-F219 WeakPolarHBondContact O-CG 3.28Å; G190-Q302 PolarHBondContact N-O 3.22Å
191	G	92	Very high	96.6	Very high	17 Å²	17	17.3 Å²	17.3	18%	0.175	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-37.1	-174.9	0	0	0	0	0	115.2	T193 R198 T220 Y304	G191-T193 VanDerWaalsContact C-N 3.3Å; G191-T193 PolarHBondContact O-N 3.31Å; G191-R198 PolarHBondContact O-NH1 2.79Å; G191-R198 PolarHBondContact O-NH2 2.85Å; G191-T220 PolarHBondContact N-O 2.8Å; G191-Y304 PolarHBondContact N-OH 2.84Å
192	D	93.4	Very high	96.6	Very high	83 Å²	83	18.1 Å²	18.1	44%	0.444	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	0.9	-174.3	-58.5	-37.8	0	0	0	113.4	G190 L194 Y195 Q302	G190-D192 PolarHBondContact O-N 3.5Å; G190-D192 VanDerWaalsContact O-N 3.13Å; D192-L194 PolarHBondContact O-N 3.08Å; D192-Y195 WeakPolarHBondContact O-CD1 3.36Å; D192-Y195 PolarHBondContact O-N 2.66Å; D192-Q302 HydrophobicContact CB-CB 4.18Å; D192-Q302 PolarHBondContact OD2-NE2 3.43Å; D192-Q302 PolarHBondContact OD2-OE1 3.44Å
193	T	96.9	Very high	96.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	127.8	175.8	-59.6	0	0	0	0	111.6	F189 G190 G191 Y195 R198 F219 T300 Y301 Q302	F189-T193 HydrophobicContact CB-CG2 4.18Å; F189-T193 HydrophobicContact CD1-CG2 4.06Å; F189-T193 HydrophobicContact CD2-CG2 4.4Å; F189-T193 HydrophobicContact CG-CG2 3.98Å; G190-T193 PolarHBondContact N-OG1 2.93Å; G190-T193 VanDerWaalsContact O-CB 3.27Å; G190-T193 WeakPolarHBondContact O-CB 3.48Å; G190-T193 PolarHBondContact O-N 3.17Å; G190-T193 PolarHBondContact O-OG1 3.09Å; G191-T193 VanDerWaalsContact C-N 3.3Å; G191-T193 PolarHBondContact O-N 3.31Å; T193-Y195 VanDerWaalsContact C-N 3.27Å; T193-Y195 PolarHBondContact O-N 2.79Å; T193-R198 PolarHBondContact O-NH2 3.38Å; T193-F219 HydrophobicContact CG2-CE2 3.88Å; T193-F219 HydrophobicContact CG2-CZ 4.1Å; T193-T300 CarbonylContact C-O 3.5Å; T193-T300 WeakPolarHBondContact CA-O 3.39Å; T193-Y301 HydrophobicContact CG2-CD1 3.9Å; T193-Q302 PolarHBondContact OG1-N 2.93Å; T193-Q302 PolarHBondContact OG1-O 3.23Å
194	L	97	Very high	96.5	Very high	9 Å²	9	22.3 Å²	22.3	5%	0.047	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	31.7	179.3	-58.3	170.8	0	0	0	113.6	D192 E196 L197 R198 I216 L254 L258 A299 T300 Y301	D192-L194 PolarHBondContact O-N 3.08Å; L194-E196 PolarHBondContact O-N 2.9Å; L194-L197 HydrophobicContact CB-CB 4.45Å; L194-L197 PolarHBondContact O-N 3.39Å; L194-R198 WeakPolarHBondContact O-CB 3.43Å; L194-R198 PolarHBondContact O-N 3.44Å; L194-I216 HydrophobicContact CB-CD1 3.64Å; L194-I216 HydrophobicContact CB-CG1 4.36Å; L194-I216 HydrophobicContact CD1-CD1 4.45Å; L194-I216 HydrophobicContact CD1-CG1 4.37Å; L194-I216 VanDerWaalsContact O-CD1 3.29Å; L194-I216 WeakPolarHBondContact O-CD1 3.45Å; L194-L254 HydrophobicContact CD2-CD1 4.18Å; L194-L254 HydrophobicContact CD2-CD2 4.49Å; L194-L258 HydrophobicContact CD1-CD1 3.72Å; L194-L258 HydrophobicContact CD1-CD2 3.78Å; L194-L258 HydrophobicContact CD1-CG 4.42Å; L194-L258 HydrophobicContact CD2-CD1 4.36Å; L194-L258 HydrophobicContact CD2-CD2 4.41Å; L194-A299 HydrophobicContact CD2-CB 3.89Å; L194-T300 PolarHBondContact N-O 3.37Å; L194-Y301 HydrophobicContact CD2-CD1 4.4Å; L194-Y301 HydrophobicContact CD2-CE1 3.77Å; L194-Y301 HydrophobicContact CG-CE1 4.25Å
195	Y	96.6	Very high	96.4	Very high	92 Å²	92	22.5 Å²	22.5	36%	0.361	11%	0.113	S	C	.	.	H	α-helix	trans	-59.9	-33.3	-178.1	79.6	-89.2	0	0	0	112	D192 T193 R198 C199 Y290 T300	D192-Y195 WeakPolarHBondContact O-CD1 3.36Å; D192-Y195 PolarHBondContact O-N 2.66Å; T193-Y195 VanDerWaalsContact C-N 3.27Å; T193-Y195 PolarHBondContact O-N 2.79Å; Y195-R198 WeakPolarHBondContact O-CB 3.45Å; Y195-R198 PolarHBondContact O-N 3.17Å; Y195-C199 WeakPolarHBondContact O-CB 3.41Å; Y195-C199 PolarHBondContact O-N 3.16Å; Y195-C199 PolarHBondContact O-SG 3.5Å; Y195-Y290 AromaticContact CE2-CE1 3.97Å; Y195-Y290 HydrophobicContact CE2-CE1 3.97Å; Y195-T300 HydrophobicContact CE1-CG2 4.28Å
196	E	97.9	Very high	96.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-49.4	178.9	-54.8	91.5	155.2	0	0	111.4	L194 R198 S200 Y286 Y290 T300	L194-E196 PolarHBondContact O-N 2.9Å; E196-R198 VanDerWaalsContact C-N 3.34Å; E196-R198 PolarHBondContact O-N 3.15Å; E196-S200 WeakPolarHBondContact O-CB 3.26Å; E196-S200 PolarHBondContact O-N 2.84Å; E196-S200 PolarHBondContact O-OG 2.78Å; E196-Y286 HydrophobicContact CB-CD2 4.27Å; E196-Y286 HydrophobicContact CB-CE2 3.41Å; E196-Y286 VanDerWaalsContact CB-CE2 3.41Å; E196-Y286 HydrophobicContact CG-CE2 4.36Å; E196-Y290 HydrophobicContact CB-CD1 4.14Å; E196-Y290 HydrophobicContact CB-CD2 3.83Å; E196-Y290 HydrophobicContact CB-CE1 4.28Å; E196-Y290 HydrophobicContact CB-CE2 3.98Å; E196-Y290 HydrophobicContact CB-CG 3.92Å; E196-Y290 HydrophobicContact CG-CD1 3.72Å; E196-Y290 HydrophobicContact CG-CD2 4.32Å; E196-Y290 HydrophobicContact CG-CE1 3.98Å; E196-Y290 HydrophobicContact CG-CG 3.9Å; E196-T300 VanDerWaalsContact OE1-CB 3.28Å; E196-T300 WeakPolarHBondContact OE1-CB 3.42Å; E196-T300 PolarHBondContact OE1-N 3.48Å; E196-T300 PolarHBondContact OE1-OG1 3.08Å; E196-T300 PolarHBondContact OE2-N 2.72Å
197	L	97.2	Very high	96.1	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-41.6	175.2	178.4	61.9	0	0	0	111.2	L194 S200 L201 I216 M251 L254 L258 Y286	L194-L197 HydrophobicContact CB-CB 4.45Å; L194-L197 PolarHBondContact O-N 3.39Å; L197-S200 PolarHBondContact O-N 3.34Å; L197-L201 HydrophobicContact CD1-CD1 3.76Å; L197-L201 HydrophobicContact CD1-CG 4.13Å; L197-L201 HydrophobicContact CG-CD1 3.87Å; L197-L201 WeakPolarHBondContact O-CB 3.22Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.71Å; L197-I216 HydrophobicContact CB-CD1 4Å; L197-I216 HydrophobicContact CD2-CD1 4.12Å; L197-I216 HydrophobicContact CG-CD1 3.97Å; L197-M251 HydrophobicContact CD1-CG 3.61Å; L197-M251 HydrophobicContact CD1-SD 3.91Å; L197-L254 HydrophobicContact CB-CD2 4.12Å; L197-L254 HydrophobicContact CD1-CD2 4.49Å; L197-L254 HydrophobicContact CD2-CD2 3.92Å; L197-L254 HydrophobicContact CD2-CG 4.36Å; L197-L254 HydrophobicContact CG-CD2 4.4Å; L197-L258 HydrophobicContact CD2-CD1 3.77Å; L197-Y286 HydrophobicContact CB-CE1 3.74Å; L197-Y286 HydrophobicContact CD1-CD1 4.13Å; L197-Y286 HydrophobicContact CD1-CE1 3.88Å; L197-Y286 HydrophobicContact CG-CE1 4.41Å
198	R	96.1	Very high	96	Very high	62 Å²	62	38.2 Å²	38.2	23%	0.234	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-54.2	179.4	-165	-176.3	-57.6	170.1	7.5	111.4	G191 T193 L194 Y195 E196 S200 L201 Q202 I216	G191-R198 PolarHBondContact O-NH1 2.79Å; G191-R198 PolarHBondContact O-NH2 2.85Å; T193-R198 PolarHBondContact O-NH2 3.38Å; L194-R198 WeakPolarHBondContact O-CB 3.43Å; L194-R198 PolarHBondContact O-N 3.44Å; Y195-R198 WeakPolarHBondContact O-CB 3.45Å; Y195-R198 PolarHBondContact O-N 3.17Å; E196-R198 VanDerWaalsContact C-N 3.34Å; E196-R198 PolarHBondContact O-N 3.15Å; R198-S200 VanDerWaalsContact C-N 3.32Å; R198-S200 PolarHBondContact O-N 2.91Å; R198-L201 PolarHBondContact O-N 3.29Å; R198-Q202 WeakPolarHBondContact O-CB 3.48Å; R198-Q202 VanDerWaalsContact O-CG 3.23Å; R198-Q202 WeakPolarHBondContact O-CG 3.46Å; R198-Q202 PolarHBondContact O-N 2.77Å; R198-I216 HydrophobicContact CB-CD1 3.52Å; R198-I216 HydrophobicContact CG-CD1 4.18Å; R198-I216 VanDerWaalsContact N-CD1 3.34Å
199	C	96.6	Very high	95.9	Very high	41 Å²	41	41.6 Å²	41.6	28%	0.277	20%	0.201	S	C	.	.	H	α-helix	trans	-61.5	-43	179.9	-71.6	0	0	0	0	110.9	Y195 L201 Q202 L203 Y290	Y195-C199 WeakPolarHBondContact O-CB 3.41Å; Y195-C199 PolarHBondContact O-N 3.16Å; Y195-C199 PolarHBondContact O-SG 3.5Å; C199-L201 PolarHBondContact O-N 2.86Å; C199-Q202 PolarHBondContact O-N 3.29Å; C199-L203 WeakPolarHBondContact O-CB 3.41Å; C199-L203 VanDerWaalsContact O-CG 3.27Å; C199-L203 WeakPolarHBondContact O-CG 3.41Å; C199-L203 PolarHBondContact O-N 2.83Å; C199-Y290 WeakPolarHBondContact CB-OH 3.47Å
200	S	97.5	Very high	95.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-44.3	-179.3	-57.1	0	0	0	0	112.6	E196 L197 R198 A204 Y286	E196-S200 WeakPolarHBondContact O-CB 3.26Å; E196-S200 PolarHBondContact O-N 2.84Å; E196-S200 PolarHBondContact O-OG 2.78Å; L197-S200 PolarHBondContact O-N 3.34Å; R198-S200 VanDerWaalsContact C-N 3.32Å; R198-S200 PolarHBondContact O-N 2.91Å; S200-A204 WeakPolarHBondContact O-CB 3.28Å; S200-A204 PolarHBondContact O-N 2.67Å; S200-A204 VanDerWaalsContact O-N 3.12Å; S200-Y286 WeakPolarHBondContact OG-CA 3.02Å; S200-Y286 WeakPolarHBondContact OG-CB 2.91Å
201	L	96.2	Very high	95.4	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-66.8	-42.3	176	-73.9	166.6	0	0	0	112.1	L197 R198 C199 A204 E205 H215 L274 A282	L197-L201 HydrophobicContact CD1-CD1 3.76Å; L197-L201 HydrophobicContact CD1-CG 4.13Å; L197-L201 HydrophobicContact CG-CD1 3.87Å; L197-L201 WeakPolarHBondContact O-CB 3.22Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.71Å; R198-L201 PolarHBondContact O-N 3.29Å; C199-L201 PolarHBondContact O-N 2.86Å; L201-A204 PolarHBondContact O-N 2.81Å; L201-E205 WeakPolarHBondContact O-CB 3.28Å; L201-E205 PolarHBondContact O-N 2.65Å; L201-H215 HydrophobicContact CD1-CB 3.62Å; L201-L274 HydrophobicContact CD2-CD1 4.48Å; L201-L274 HydrophobicContact CD2-CD2 3.73Å; L201-A282 HydrophobicContact CD2-CB 3.73Å; L201-A282 HydrophobicContact CG-CB 4.31Å
202	Q	95.5	Very high	95.4	Very high	57 Å²	57	51.4 Å²	51.4	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-63.9	-44.1	179.6	-75.5	176.1	-16.4	0	0	112.3	R198 C199 T206 F212	R198-Q202 WeakPolarHBondContact O-CB 3.48Å; R198-Q202 VanDerWaalsContact O-CG 3.23Å; R198-Q202 WeakPolarHBondContact O-CG 3.46Å; R198-Q202 PolarHBondContact O-N 2.77Å; C199-Q202 PolarHBondContact O-N 3.29Å; Q202-T206 VanDerWaalsContact O-CB 3.29Å; Q202-T206 WeakPolarHBondContact O-CB 3.11Å; Q202-T206 PolarHBondContact O-N 3.5Å; Q202-T206 PolarHBondContact O-OG1 3.31Å; Q202-F212 HydrophobicContact CB-CD2 4.49Å; Q202-F212 HydrophobicContact CB-CG 4.43Å; Q202-F212 HydrophobicContact CG-CB 4.48Å; Q202-F212 HydrophobicContact CG-CD2 3.74Å; Q202-F212 HydrophobicContact CG-CE2 4.19Å; Q202-F212 HydrophobicContact CG-CG 4.15Å
203	L	96.3	Very high	95.3	Very high	90 Å²	90	48.1 Å²	48.1	47%	0.471	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-47.2	177.9	-72.2	171.7	0	0	0	111.2	C199 T206 E207 V285 M289	C199-L203 WeakPolarHBondContact O-CB 3.41Å; C199-L203 VanDerWaalsContact O-CG 3.27Å; C199-L203 WeakPolarHBondContact O-CG 3.41Å; C199-L203 PolarHBondContact O-N 2.83Å; L203-T206 PolarHBondContact O-N 2.92Å; L203-E207 WeakPolarHBondContact O-CB 3.23Å; L203-E207 PolarHBondContact O-N 3.26Å; L203-V285 HydrophobicContact CB-CG1 4.27Å; L203-V285 HydrophobicContact CD1-CG1 3.94Å; L203-M289 HydrophobicContact CD1-CE 4.33Å; L203-M289 HydrophobicContact CD1-SD 3.59Å; L203-M289 VanDerWaalsContact CD1-SD 3.59Å
204	A	96.7	Very high	95	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.4	-43.5	179.5	0	0	0	0	0	112.6	S200 L201 E207 R208 T278 A281 A282	S200-A204 WeakPolarHBondContact O-CB 3.28Å; S200-A204 PolarHBondContact O-N 2.67Å; S200-A204 VanDerWaalsContact O-N 3.12Å; L201-A204 PolarHBondContact O-N 2.81Å; A204-E207 PolarHBondContact O-N 3.36Å; A204-R208 VanDerWaalsContact O-CB 3.3Å; A204-R208 WeakPolarHBondContact O-CB 3.36Å; A204-R208 WeakPolarHBondContact O-CG 3.35Å; A204-R208 PolarHBondContact O-N 3.12Å; A204-T278 HydrophobicContact CB-CG2 4.35Å; A204-A281 HydrophobicContact CB-CB 3.88Å; A204-A282 HydrophobicContact CB-CB 3.68Å; A204-A282 VanDerWaalsContact CB-N 3.32Å
205	E	95.3	Very high	94.8	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.019	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-39.2	178.8	-157.5	171.5	-149.7	0	0	111	L201 E207 R208 E209 G210 G211 F212 S213 H215 K271 T278	L201-E205 WeakPolarHBondContact O-CB 3.28Å; L201-E205 PolarHBondContact O-N 2.65Å; E205-E207 PolarHBondContact O-N 3.02Å; E205-R208 PolarHBondContact O-N 3.26Å; E205-E209 HydrophobicContact CG-CB 4.24Å; E205-E209 HydrophobicContact CG-CG 4.22Å; E205-E209 WeakPolarHBondContact O-CA 3.44Å; E205-E209 WeakPolarHBondContact O-CB 3.41Å; E205-E209 PolarHBondContact O-N 2.89Å; E205-G210 PolarHBondContact O-N 2.81Å; E205-G211 CarbonylContact C-O 3.41Å; E205-G211 WeakPolarHBondContact CG-O 3.38Å; E205-F212 HydrophobicContact CB-CB 4.21Å; E205-F212 VanDerWaalsContact OE2-CA 3.27Å; E205-F212 WeakPolarHBondContact OE2-CA 3.44Å; E205-S213 PolarHBondContact OE2-N 3.46Å; E205-H215 IonicContact OE1-CE1 3.62Å; E205-H215 IonicContact OE1-NE2 2.64Å; E205-H215 IonicContact OE2-CD2 3.77Å; E205-H215 IonicContact OE2-CE1 3.57Å; E205-H215 IonicContact OE2-NE2 2.77Å; E205-H215 PolarHBondContact OE2-NE2 3.33Å; E205-K271 VanDerWaalsContact OE1-CD 3.25Å; E205-K271 WeakPolarHBondContact OE1-CD 3.4Å; E205-K271 IonicContact OE1-NZ 3.9Å; E205-K271 PolarHBondContact OE1-NZ 3.43Å; E205-T278 HydrophobicContact CB-CG2 3.88Å; E205-T278 HydrophobicContact CG-CG2 4.1Å
206	T	95.5	Very high	94.6	Very high	69 Å²	69	47.7 Å²	47.7	42%	0.423	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-44.4	176.3	-58.9	0	0	0	0	111.5	Q202 L203 G210 G211	Q202-T206 VanDerWaalsContact O-CB 3.29Å; Q202-T206 WeakPolarHBondContact O-CB 3.11Å; Q202-T206 PolarHBondContact O-N 3.5Å; Q202-T206 PolarHBondContact O-OG1 3.31Å; L203-T206 PolarHBondContact O-N 2.92Å; T206-G210 WeakPolarHBondContact O-CA 3.5Å; T206-G210 PolarHBondContact O-N 2.78Å; T206-G210 VanDerWaalsContact O-N 3.14Å; T206-G211 WeakPolarHBondContact CA-O 3.29Å; T206-G211 PolarHBondContact N-O 2.99Å
207	E	95.4	Very high	94.2	Very high	122 Å²	122	47.9 Å²	47.9	57%	0.57	26%	0.259	S	S	*	.	H	α-helix	trans	-66	-44.7	178	-171	-151.9	165.3	0	0	112.1	L203 A204 E205	L203-E207 WeakPolarHBondContact O-CB 3.23Å; L203-E207 PolarHBondContact O-N 3.26Å; A204-E207 PolarHBondContact O-N 3.36Å; E205-E207 PolarHBondContact O-N 3.02Å
208	R	95.1	Very high	93.9	Very high	140 Å²	140	50.5 Å²	50.5	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-86.7	-32.1	-170	-61.6	-68.1	158.1	175.4	-6.7	113.7	A204 E205 A281	A204-R208 VanDerWaalsContact O-CB 3.3Å; A204-R208 WeakPolarHBondContact O-CB 3.36Å; A204-R208 WeakPolarHBondContact O-CG 3.35Å; A204-R208 PolarHBondContact O-N 3.12Å; E205-R208 PolarHBondContact O-N 3.26Å; R208-A281 HydrophobicContact CG-CB 4.08Å
209	E	93.7	Very high	93.7	Very high	70 Å²	70	49.2 Å²	49.2	33%	0.327	27%	0.272	S	S	.	.	H	α-helix	trans	-123	-6.8	-168.9	-52.8	-168.5	-148.5	0	0	113.2	E205 G211 K271 H275 T278	E205-E209 HydrophobicContact CG-CB 4.24Å; E205-E209 HydrophobicContact CG-CG 4.22Å; E205-E209 WeakPolarHBondContact O-CA 3.44Å; E205-E209 WeakPolarHBondContact O-CB 3.41Å; E205-E209 PolarHBondContact O-N 2.89Å; E209-G211 VanDerWaalsContact C-N 3.34Å; E209-K271 IonicContact OE1-NZ 3.57Å; E209-K271 PolarHBondContact OE1-NZ 2.57Å; E209-K271 VanDerWaalsContact OE1-NZ 3.16Å; E209-K271 IonicContact OE2-NZ 3.64Å; E209-K271 PolarHBondContact OE2-NZ 2.64Å; E209-H275 IonicContact OE1-CG 3.72Å; E209-H275 IonicContact OE1-ND1 3.69Å; E209-T278 PolarHBondContact OE1-OG1 3.43Å
210	G	92	Very high	93.3	Very high	72 Å²	72	49 Å²	49	74%	0.742	27%	0.27	S	S	*	.	S	Bend	trans	77.1	17.5	177.4	0	0	0	0	0	114.5	E205 T206	E205-G210 PolarHBondContact O-N 2.81Å; T206-G210 WeakPolarHBondContact O-CA 3.5Å; T206-G210 PolarHBondContact O-N 2.78Å; T206-G210 VanDerWaalsContact O-N 3.14Å
211	G	91	Very high	92.8	Very high	34 Å²	34	51 Å²	51	35%	0.351	29%	0.287	S	S	.	.	S	Bend	trans	-173.9	-178.1	176.5	0	0	0	0	0	110.8	E205 T206 E209	E205-G211 CarbonylContact C-O 3.41Å; E205-G211 WeakPolarHBondContact CG-O 3.38Å; T206-G211 WeakPolarHBondContact CA-O 3.29Å; T206-G211 PolarHBondContact N-O 2.99Å; E209-G211 VanDerWaalsContact C-N 3.34Å
212	F	91.9	Very high	92.1	Very high	123 Å²	123	53.1 Å²	53.1	54%	0.539	30%	0.3	S	S	.	.			trans	-143.4	157.9	175.6	73	-89.8	0	0	0	112.7	Q202 E205	Q202-F212 HydrophobicContact CB-CD2 4.49Å; Q202-F212 HydrophobicContact CB-CG 4.43Å; Q202-F212 HydrophobicContact CG-CB 4.48Å; Q202-F212 HydrophobicContact CG-CD2 3.74Å; Q202-F212 HydrophobicContact CG-CE2 4.19Å; Q202-F212 HydrophobicContact CG-CG 4.15Å; E205-F212 HydrophobicContact CB-CB 4.21Å; E205-F212 VanDerWaalsContact OE2-CA 3.27Å; E205-F212 WeakPolarHBondContact OE2-CA 3.44Å
213	S	91	Very high	91.5	Very high	15 Å²	15	56.7 Å²	56.7	11%	0.105	32%	0.321	C	S	.	.			trans	-115.7	152.5	172.5	171.8	0	0	0	0	110.3	E205 H215 K271	E205-S213 PolarHBondContact OE2-N 3.46Å; S213-H215 PolarHBondContact O-CD2 3.42Å; S213-H215 PolarHBondContact O-N 3.22Å; S213-H215 VanDerWaalsContact O-N 3.15Å; S213-H215 PolarHBondContact O-NE2 2.77Å; S213-K271 WeakPolarHBondContact OG-CB 3.27Å; S213-K271 PolarHBondContact OG-N 3.03Å
214	P	90.7	Very high	91	Very high	36 Å²	36	56.6 Å²	56.6	23%	0.234	32%	0.321	C	S	.	.			trans	-66.4	114.8	168.7	27.1	-33.2	0	0	0	110.1	N265 N269	P214-N265 PolarHBondContact O-ND2 2.69Å; P214-N269 WeakPolarHBondContact CG-OD1 3.4Å
215	H	91.8	Very high	90.7	Very high	39 Å²	39	56.6 Å²	56.6	18%	0.181	32%	0.321	C	S	.	.			trans	-98.2	-17.6	173.7	-65.1	-63.9	0	0	0	113	L201 E205 S213 N265 L274	L201-H215 HydrophobicContact CD1-CB 3.62Å; E205-H215 IonicContact OE1-CE1 3.62Å; E205-H215 IonicContact OE1-NE2 2.64Å; E205-H215 IonicContact OE2-CD2 3.77Å; E205-H215 IonicContact OE2-CE1 3.57Å; E205-H215 IonicContact OE2-NE2 2.77Å; E205-H215 PolarHBondContact OE2-NE2 3.33Å; S213-H215 PolarHBondContact O-CD2 3.42Å; S213-H215 PolarHBondContact O-N 3.22Å; S213-H215 VanDerWaalsContact O-N 3.15Å; S213-H215 PolarHBondContact O-NE2 2.77Å; H215-N265 VanDerWaalsContact C-ND2 3.33Å; H215-N265 WeakPolarHBondContact O-CB 3.47Å; H215-N265 PolarHBondContact O-ND2 3.03Å; H215-L274 WeakPolarHBondContact CE1-CD1 3.32Å
216	I	92.3	Very high	90.5	Very high	17 Å²	17	57.8 Å²	57.8	9%	0.087	33%	0.334	C	S	.	.	S	Bend	trans	-113.9	140	170.8	-71.3	154.9	0	0	0	107.8	L194 L197 R198 F219	L194-I216 HydrophobicContact CB-CD1 3.64Å; L194-I216 HydrophobicContact CB-CG1 4.36Å; L194-I216 HydrophobicContact CD1-CD1 4.45Å; L194-I216 HydrophobicContact CD1-CG1 4.37Å; L194-I216 VanDerWaalsContact O-CD1 3.29Å; L194-I216 WeakPolarHBondContact O-CD1 3.45Å; L197-I216 HydrophobicContact CB-CD1 4Å; L197-I216 HydrophobicContact CD2-CD1 4.12Å; L197-I216 HydrophobicContact CG-CD1 3.97Å; R198-I216 HydrophobicContact CB-CD1 3.52Å; R198-I216 HydrophobicContact CG-CD1 4.18Å; R198-I216 VanDerWaalsContact N-CD1 3.34Å; I216-F219 HydrophobicContact CG2-CE2 3.71Å; I216-F219 HydrophobicContact CG2-CZ 4.28Å
217	S	91.2	Very high	90.3	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.021	35%	0.347	C	S	.	.			trans	-61.5	144.2	178.3	-64.7	0	0	0	0	111.8	W163 F219 N265	W163-S217 WeakPolarHBondContact CH2-OG 3.46Å; W163-S217 WeakPolarHBondContact CZ3-OG 3.27Å; S217-F219 WeakPolarHBondContact O-CD2 3.49Å; S217-F219 WeakPolarHBondContact O-CE2 3.48Å; S217-N265 PolarHBondContact OG-OD1 3.47Å
218	P	90.7	Very high	90.2	Very high	61 Å²	61	57.5 Å²	57.5	40%	0.396	33%	0.329	S	S	.	.			trans	-64.8	138.5	170.1	29.1	-34.9	0	0	0	110.1	I46 F47 S267	I46-P218 HydrophobicContact CG2-CG 3.58Å; F47-P218 HydrophobicContact CE1-CG 4.16Å; F47-P218 HydrophobicContact CZ-CG 4.28Å; P218-S267 WeakPolarHBondContact CD-OG 3.2Å
219	F	92.1	Very high	90.2	Very high	34 Å²	34	50.9 Å²	50.9	15%	0.149	30%	0.303	C	S	.	.			trans	-115.1	156.7	174.4	-58.6	-66.6	0	0	0	110.3	H162 F189 G190 T193 I216 S217	H162-F219 HydrophobicContact CB-CD1 4.07Å; H162-F219 HydrophobicContact CB-CE1 4.45Å; H162-F219 AromaticContact CD2-CE1 3.83Å; F189-F219 HydrophobicContact CB-CD1 3.76Å; F189-F219 HydrophobicContact CB-CE1 3.68Å; F189-F219 HydrophobicContact CB-CG 4.32Å; F189-F219 HydrophobicContact CB-CZ 4.18Å; F189-F219 HydrophobicContact CD2-CE1 4.11Å; F189-F219 HydrophobicContact CD2-CZ 4.36Å; F189-F219 HydrophobicContact CG-CE1 4.37Å; G190-F219 VanDerWaalsContact C-CB 3.49Å; G190-F219 WeakPolarHBondContact O-CB 3.47Å; G190-F219 WeakPolarHBondContact O-CD2 3.36Å; G190-F219 WeakPolarHBondContact O-CG 3.28Å; T193-F219 HydrophobicContact CG2-CE2 3.88Å; T193-F219 HydrophobicContact CG2-CZ 4.1Å; I216-F219 HydrophobicContact CG2-CE2 3.71Å; I216-F219 HydrophobicContact CG2-CZ 4.28Å; S217-F219 WeakPolarHBondContact O-CD2 3.49Å; S217-F219 WeakPolarHBondContact O-CE2 3.48Å
220	T	86.9	Confident	90.3	Very high	36 Å²	36	49.3 Å²	49.3	22%	0.221	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-69.5	151	176.5	-52.3	0	0	0	0	110.3	M188 G191 D224 L225 L228 Y304	M188-T220 WeakPolarHBondContact CE-OG1 3.32Å; G191-T220 PolarHBondContact N-O 2.8Å; T220-D224 HydrophobicContact CG2-CB 4.07Å; T220-L225 HydrophobicContact CG2-CD2 4.12Å; T220-L225 HydrophobicContact CG2-CG 4.35Å; T220-L228 HydrophobicContact CG2-CD1 4.43Å; T220-Y304 VanDerWaalsContact O-CE2 3.29Å; T220-Y304 WeakPolarHBondContact O-CE2 3.33Å
221	A	86.9	Confident	90.4	Very high	44 Å²	44	54.6 Å²	54.6	36%	0.364	30%	0.304	S	S	.	.			trans	-89.5	148	171.5	0	0	0	0	0	111.2	N223 D224	A221-N223 VanDerWaalsContact C-N 3.25Å; A221-N223 PolarHBondContact O-N 3.08Å; A221-D224 PolarHBondContact O-N 3.08Å; A221-D224 VanDerWaalsContact O-N 3.1Å
222	V	83	Confident	90.7	Very high	50 Å²	50	53.3 Å²	53.3	30%	0.303	29%	0.29	S	S	.	.	H	α-helix	trans	-54.9	-38.4	-177.9	67.2	0	0	0	0	113.4	D224 L225 V239 Y304	V222-D224 PolarHBondContact O-N 2.86Å; V222-L225 PolarHBondContact O-N 3.24Å; V222-L225 VanDerWaalsContact O-N 3.16Å; V222-V239 HydrophobicContact CG2-CG1 4.06Å; V222-Y304 HydrophobicContact CB-CD1 4.34Å; V222-Y304 HydrophobicContact CB-CE1 3.78Å; V222-Y304 HydrophobicContact CB-CE2 4.14Å; V222-Y304 HydrophobicContact CG2-CD1 4.34Å; V222-Y304 HydrophobicContact CG2-CE1 4.22Å; V222-Y304 PolarHBondContact N-OH 2.89Å
223	N	82.4	Confident	90.8	Very high	131 Å²	131	49.2 Å²	49.2	70%	0.701	28%	0.282	S	S	*	.	H	α-helix	trans	-62.5	-27.7	-177.4	-68.2	-23.5	0	0	0	112.8	A221 H227	A221-N223 VanDerWaalsContact C-N 3.25Å; A221-N223 PolarHBondContact O-N 3.08Å; N223-H227 PolarHBondContact O-CD2 3.29Å
224	D	86.2	Confident	91.1	Very high	88 Å²	88	49 Å²	49	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-80.2	-29	-178.9	-61.8	-37.4	0	0	0	111.5	T220 A221 V222 G226 H227 L228	T220-D224 HydrophobicContact CG2-CB 4.07Å; A221-D224 PolarHBondContact O-N 3.08Å; A221-D224 VanDerWaalsContact O-N 3.1Å; V222-D224 PolarHBondContact O-N 2.86Å; D224-G226 PolarHBondContact O-N 3.49Å; D224-H227 PolarHBondContact O-N 3.36Å; D224-L228 HydrophobicContact CB-CD1 4.48Å; D224-L228 VanDerWaalsContact O-CG 3.23Å; D224-L228 WeakPolarHBondContact O-CG 3.43Å; D224-L228 PolarHBondContact O-N 3.15Å
225	L	90.1	Very high	91.2	Very high	1 Å²	1	49 Å²	49	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-43.8	-173.6	-75.2	-177.7	0	0	0	113.6	L167 M188 T220 V222 H227 L228 L229 V239 Y304 M306	L167-L225 HydrophobicContact CD2-CD2 4.33Å; M188-L225 HydrophobicContact CE-CD2 4.44Å; M188-L225 HydrophobicContact SD-CD1 4.28Å; M188-L225 HydrophobicContact SD-CD2 3.72Å; T220-L225 HydrophobicContact CG2-CD2 4.12Å; T220-L225 HydrophobicContact CG2-CG 4.35Å; V222-L225 PolarHBondContact O-N 3.24Å; V222-L225 VanDerWaalsContact O-N 3.16Å; L225-H227 VanDerWaalsContact C-N 3.29Å; L225-H227 PolarHBondContact O-N 3.27Å; L225-L228 HydrophobicContact CD2-CD1 4.46Å; L225-L228 PolarHBondContact O-N 3.4Å; L225-L229 WeakPolarHBondContact O-CB 3.38Å; L225-L229 WeakPolarHBondContact O-CG 3.32Å; L225-L229 PolarHBondContact O-N 3.39Å; L225-V239 HydrophobicContact CD1-CG1 4.4Å; L225-Y304 HydrophobicContact CD1-CD2 3.35Å; L225-Y304 HydrophobicContact CD1-CE2 4.22Å; L225-Y304 HydrophobicContact CD1-CG 3.74Å; L225-Y304 HydrophobicContact CG-CD2 4.36Å; L225-M306 HydrophobicContact CD1-CE 3.84Å; L225-M306 HydrophobicContact CD2-CE 4.19Å
226	G	90.5	Very high	91.2	Very high	29 Å²	29	51.6 Å²	51.6	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-60.4	-41.5	178.1	0	0	0	0	0	112	D224 G230	D224-G226 PolarHBondContact O-N 3.49Å; G226-G230 PolarHBondContact O-N 2.55Å
227	H	91.4	Very high	91.3	Very high	152 Å²	152	53.9 Å²	53.9	70%	0.704	31%	0.308	S	S	*	.	H	α-helix	trans	-67.2	-40	175.9	-70.4	-58.3	0	0	0	112.5	N223 D224 L225 R231	N223-H227 PolarHBondContact O-CD2 3.29Å; D224-H227 PolarHBondContact O-N 3.36Å; L225-H227 VanDerWaalsContact C-N 3.29Å; L225-H227 PolarHBondContact O-N 3.27Å; H227-R231 VanDerWaalsContact O-CB 3.27Å; H227-R231 WeakPolarHBondContact O-CB 3.4Å; H227-R231 PolarHBondContact O-N 2.99Å
228	L	93.9	Very high	91.5	Very high	33 Å²	33	56.5 Å²	56.5	17%	0.173	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-46.5	177.6	-71.3	174.4	0	0	0	112	L167 P168 L171 T220 D224 L225 R231 A232	L167-L228 HydrophobicContact CD2-CD1 3.86Å; L167-L228 HydrophobicContact CG-CD1 4.37Å; P168-L228 HydrophobicContact CB-CD2 4.18Å; P168-L228 HydrophobicContact CG-CD2 3.71Å; L171-L228 HydrophobicContact CD1-CB 3.87Å; T220-L228 HydrophobicContact CG2-CD1 4.43Å; D224-L228 HydrophobicContact CB-CD1 4.48Å; D224-L228 VanDerWaalsContact O-CG 3.23Å; D224-L228 WeakPolarHBondContact O-CG 3.43Å; D224-L228 PolarHBondContact O-N 3.15Å; L225-L228 HydrophobicContact CD2-CD1 4.46Å; L225-L228 PolarHBondContact O-N 3.4Å; L228-R231 PolarHBondContact O-N 3.43Å; L228-A232 WeakPolarHBondContact O-CB 3.43Å; L228-A232 PolarHBondContact O-N 3.4Å
229	L	95.4	Very high	91.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-45	176.8	-70.9	165.6	0	0	0	111.6	L171 F184 L225 R231 A232 G233 F234 L237 V239 M306	L171-L229 HydrophobicContact CD1-CD2 4.18Å; L171-L229 HydrophobicContact CD1-CG 4.5Å; L171-L229 HydrophobicContact CD2-CD2 4Å; F184-L229 HydrophobicContact CD1-CD2 4.22Å; F184-L229 HydrophobicContact CE1-CD2 4.17Å; L225-L229 WeakPolarHBondContact O-CB 3.38Å; L225-L229 WeakPolarHBondContact O-CG 3.32Å; L225-L229 PolarHBondContact O-N 3.39Å; L229-R231 VanDerWaalsContact C-N 3.33Å; L229-R231 PolarHBondContact O-N 2.94Å; L229-A232 PolarHBondContact O-N 3.02Å; L229-G233 PolarHBondContact O-N 3.42Å; L229-F234 HydrophobicContact CB-CD2 4.44Å; L229-F234 HydrophobicContact CD2-CD2 3.87Å; L229-F234 HydrophobicContact CD2-CE2 4.16Å; L229-F234 WeakPolarHBondContact O-CD2 3.41Å; L229-F234 PolarHBondContact O-N 3.4Å; L229-L237 HydrophobicContact CB-CD1 3.93Å; L229-L237 HydrophobicContact CB-CD2 3.88Å; L229-V239 HydrophobicContact CD1-CG2 3.92Å; L229-M306 HydrophobicContact CD1-CB 3.89Å; L229-M306 HydrophobicContact CD1-SD 4.45Å; L229-M306 HydrophobicContact CD2-SD 4.36Å
230	G	94.6	Very high	91.8	Very high	38 Å²	38	57.5 Å²	57.5	39%	0.392	33%	0.329	S	S	.	.	H	α-helix	trans	-62.2	-39.8	176.5	0	0	0	0	0	112.6	G226 G233	G226-G230 PolarHBondContact O-N 2.55Å; G230-G233 PolarHBondContact O-N 3.06Å
231	R	95.1	Very high	92.2	Very high	183 Å²	183	59.1 Å²	59.1	69%	0.691	34%	0.339	S	S	*	.	H	α-helix	trans	-66.4	-35.9	175.7	-179.6	175.9	173.1	159.3	-0.1	112.6	H227 L228 L229 G233	H227-R231 VanDerWaalsContact O-CB 3.27Å; H227-R231 WeakPolarHBondContact O-CB 3.4Å; H227-R231 PolarHBondContact O-N 2.99Å; L228-R231 PolarHBondContact O-N 3.43Å; L229-R231 VanDerWaalsContact C-N 3.33Å; L229-R231 PolarHBondContact O-N 2.94Å; R231-G233 PolarHBondContact O-N 2.79Å
232	A	95.9	Very high	92.6	Very high	7 Å²	7	59.7 Å²	59.7	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-69.5	-11.5	176	0	0	0	0	0	113.5	L171 E172 H175 L228 L229 F234	L171-A232 HydrophobicContact CB-CB 3.68Å; E172-A232 HydrophobicContact CG-CB 4.13Å; H175-A232 VanDerWaalsContact CG-O 3.31Å; H175-A232 PolarHBondContact ND1-O 2.86Å; L228-A232 WeakPolarHBondContact O-CB 3.43Å; L228-A232 PolarHBondContact O-N 3.4Å; L229-A232 PolarHBondContact O-N 3.02Å; A232-F234 HydrophobicContact CB-CD2 3.89Å; A232-F234 HydrophobicContact CB-CE2 3.97Å
233	G	95.4	Very high	93.3	Very high	36 Å²	36	62.9 Å²	62.9	37%	0.371	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.7	5.1	175.6	0	0	0	0	0	114.7	H175 L229 G230 R231	H175-G233 PolarHBondContact NE2-O 3.02Å; L229-G233 PolarHBondContact O-N 3.42Å; G230-G233 PolarHBondContact O-N 3.06Å; R231-G233 PolarHBondContact O-N 2.79Å
234	F	96.9	Very high	94	Very high	10 Å²	10	57.7 Å²	57.7	4%	0.044	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.6	176.2	-67	-80.2	0	0	0	111.6	L171 I174 H175 L178 F184 L229 A232 L237 W309	L171-F234 HydrophobicContact CB-CE2 4.35Å; I174-F234 HydrophobicContact CB-CZ 4.32Å; I174-F234 HydrophobicContact CG2-CZ 3.92Å; H175-F234 HydrophobicContact CB-CD2 4.44Å; H175-F234 HydrophobicContact CB-CE1 4.18Å; H175-F234 HydrophobicContact CB-CE2 3.88Å; H175-F234 HydrophobicContact CB-CZ 3.74Å; L178-F234 HydrophobicContact CD1-CE1 3.7Å; L178-F234 HydrophobicContact CD1-CZ 4.37Å; F184-F234 HydrophobicContact CB-CD1 4.44Å; F184-F234 HydrophobicContact CB-CE1 3.56Å; F184-F234 HydrophobicContact CB-CZ 3.9Å; F184-F234 HydrophobicContact CD1-CE1 4.37Å; F184-F234 HydrophobicContact CD1-CZ 4.07Å; F184-F234 HydrophobicContact CG-CE1 4.32Å; F184-F234 HydrophobicContact CG-CZ 4.2Å; L229-F234 HydrophobicContact CB-CD2 4.44Å; L229-F234 HydrophobicContact CD2-CD2 3.87Å; L229-F234 HydrophobicContact CD2-CE2 4.16Å; L229-F234 WeakPolarHBondContact O-CD2 3.41Å; L229-F234 PolarHBondContact O-N 3.4Å; A232-F234 HydrophobicContact CB-CD2 3.89Å; A232-F234 HydrophobicContact CB-CE2 3.97Å; F234-L237 HydrophobicContact CB-CD2 3.44Å; F234-L237 VanDerWaalsContact CB-CD2 3.44Å; F234-W309 CarbonylContact C-O 3.56Å; F234-W309 VanDerWaalsContact CA-O 3.24Å; F234-W309 WeakPolarHBondContact CA-O 3.33Å
235	N	93.1	Very high	94.5	Very high	37 Å²	37	58.7 Å²	58.7	20%	0.198	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	172.2	170.2	73	-31.5	0	0	0	111.2	L237 W309 Y311 Q315	N235-L237 PolarHBondContact O-N 3.11Å; N235-W309 PolarHBondContact N-O 3.31Å; N235-W309 PolarHBondContact O-N 2.65Å; N235-W309 VanDerWaalsContact OD1-CB 3.24Å; N235-W309 WeakPolarHBondContact OD1-CB 3.43Å; N235-W309 PolarHBondContact OD1-O 3.23Å; N235-Y311 PolarHBondContact OD1-N 3.14Å; N235-Q315 PolarHBondContact ND2-OE1 3.46Å
236	T	92	Very high	94.8	Very high	93 Å²	93	60 Å²	60	57%	0.571	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.1	58.4	-179.9	-50.3	0	0	0	0	111.1
237	L	94.3	Very high	95.2	Very high	66 Å²	66	62.3 Å²	62.3	35%	0.346	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.7	-173.9	-54.1	-178.8	0	0	0	110.4	L229 F234 N235 I307	L229-L237 HydrophobicContact CB-CD1 3.93Å; L229-L237 HydrophobicContact CB-CD2 3.88Å; F234-L237 HydrophobicContact CB-CD2 3.44Å; F234-L237 VanDerWaalsContact CB-CD2 3.44Å; N235-L237 PolarHBondContact O-N 3.11Å; L237-I307 WeakPolarHBondContact CA-O 3.45Å
238	T	94.5	Very high	95.5	Very high	58 Å²	58	55.6 Å²	55.6	36%	0.356	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.6	165.1	-54.7	0	0	0	0	107.7	M306 I307	T238-M306 CarbonylContact O-C 3.53Å; T238-M306 WeakPolarHBondContact O-CA 3.49Å; T238-I307 PolarHBondContact N-O 2.99Å; T238-I307 PolarHBondContact O-N 2.8Å
239	V	95.1	Very high	95.6	Very high	46 Å²	46	59.1 Å²	59.1	28%	0.279	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.1	173	-179.8	0	0	0	0	107.2	V222 L225 L229 Y305	V222-V239 HydrophobicContact CG2-CG1 4.06Å; L225-V239 HydrophobicContact CD1-CG1 4.4Å; L229-V239 HydrophobicContact CD1-CG2 3.92Å; V239-Y305 CarbonylContact C-O 3.57Å; V239-Y305 WeakPolarHBondContact CA-O 3.31Å
240	D	94.3	Very high	95.7	Very high	70 Å²	70	59.9 Å²	59.9	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149.6	178.1	-52.9	-47.4	0	0	0	109.3	R82 Y304 Y305	R82-D240 IonicContact NH2-OD2 2.78Å; D240-Y304 WeakPolarHBondContact O-CA 3.31Å; D240-Y305 PolarHBondContact N-O 3.4Å; D240-Y305 PolarHBondContact O-N 3.38Å
241	T	95.4	Very high	95.8	Very high	70 Å²	70	58.2 Å²	58.2	43%	0.429	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137	173.7	-58.5	0	0	0	0	109	Q302 I303 Y304	T241-Q302 HydrophobicContact CG2-CG 3.72Å; T241-I303 WeakPolarHBondContact CA-O 3.48Å; T241-Y304 HydrophobicContact CG2-CD1 3.86Å; T241-Y304 HydrophobicContact CG2-CE1 3.72Å; T241-Y304 WeakPolarHBondContact OG1-CD1 3.21Å
242	D	95.6	Very high	95.9	Very high	56 Å²	56	54 Å²	54	30%	0.299	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.9	177.9	-155.5	-17.3	0	0	0	109.4	R78 Q302 I303 Y305	R78-D242 IonicContact CZ-OD2 3.97Å; R78-D242 VanDerWaalsContact NH1-CG 3.27Å; R78-D242 IonicContact NH1-OD1 3.73Å; R78-D242 IonicContact NH1-OD2 2.82Å; R78-D242 PolarHBondContact NH1-OD2 3.45Å; D242-Q302 CarbonylContact O-C 3Å; D242-Q302 WeakPolarHBondContact O-CA 3.35Å; D242-I303 PolarHBondContact N-O 3.49Å; D242-I303 PolarHBondContact O-N 2.94Å; D242-Y305 HydrophobicContact CB-CD2 4.17Å; D242-Y305 HydrophobicContact CB-CE2 3.72Å
243	E	96.3	Very high	96	Very high	117 Å²	117	57.3 Å²	57.3	55%	0.547	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.1	179.4	-70.1	-177.1	179.7	0	0	109.5	Y301 Q302	E243-Y301 WeakPolarHBondContact CA-O 3.17Å; E243-Q302 HydrophobicContact CG-CG 4.42Å
244	I	97.6	Very high	96	Very high	21 Å²	21	55.6 Å²	55.6	11%	0.108	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119	172.4	-60.5	179.9	0	0	0	107.3	L71 E74 V75 V246 Y301 I303	L71-I244 HydrophobicContact CD1-CB 4.26Å; L71-I244 HydrophobicContact CD1-CD1 4.09Å; L71-I244 HydrophobicContact CD1-CG2 3.94Å; E74-I244 HydrophobicContact CG-CD1 3.81Å; V75-I244 HydrophobicContact CG2-CD1 4.08Å; I244-V246 HydrophobicContact CG2-CG2 4.21Å; I244-Y301 PolarHBondContact N-O 2.89Å; I244-Y301 WeakPolarHBondContact O-CB 3.46Å; I244-Y301 WeakPolarHBondContact O-CD2 3.39Å; I244-Y301 PolarHBondContact O-N 3.37Å; I244-I303 HydrophobicContact CB-CD1 4.29Å; I244-I303 HydrophobicContact CD1-CD1 3.4Å; I244-I303 VanDerWaalsContact CD1-CD1 3.4Å; I244-I303 HydrophobicContact CG1-CD1 3.76Å
245	Q	97.1	Very high	96	Very high	109 Å²	109	58 Å²	58	51%	0.509	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.9	174.5	-167.8	178.4	45.9	0	0	109.7	P298	Q245-P298 HydrophobicContact CG-CB 3.76Å
246	V	97.3	Very high	96.1	Very high	29 Å²	29	60.5 Å²	60.5	18%	0.176	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.5	175.2	-174.5	0	0	0	0	108.2	Y70 I244 Y248 A299 Y301	Y70-V246 HydrophobicContact CE2-CG1 4.01Å; Y70-V246 HydrophobicContact CE2-CG2 4.1Å; I244-V246 HydrophobicContact CG2-CG2 4.21Å; V246-Y248 HydrophobicContact CB-CE2 3.69Å; V246-Y248 HydrophobicContact CG1-CD2 4.42Å; V246-Y248 HydrophobicContact CG1-CE1 4.25Å; V246-Y248 HydrophobicContact CG1-CE2 3.63Å; V246-Y248 WeakPolarHBondContact O-CD2 3.4Å; V246-Y248 VanDerWaalsContact O-CE2 3.29Å; V246-Y248 WeakPolarHBondContact O-CE2 3.37Å; V246-A299 PolarHBondContact N-O 3.08Å; V246-A299 PolarHBondContact O-N 3.43Å; V246-Y301 HydrophobicContact CB-CE2 4.08Å; V246-Y301 HydrophobicContact CG2-CD2 4.1Å; V246-Y301 HydrophobicContact CG2-CE2 3.83Å
247	N	97.4	Very high	96.3	Very high	78 Å²	78	57.1 Å²	57.1	42%	0.417	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.7	-178.1	-68.1	-39.5	0	0	0	110.6	N292 P298	N247-N292 PolarHBondContact OD1-ND2 2.97Å; N247-P298 WeakPolarHBondContact OD1-CA 3.4Å
248	Y	97.6	Very high	96.4	Very high	11 Å²	11	54.6 Å²	54.6	4%	0.043	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.7	-177.5	-62	-92.5	0	0	0	111	Y70 V246 G250 E253 L254 D257 S296 V297 A299 Y301	Y70-Y248 PolarHBondContact OH-OH 2.8Å; V246-Y248 HydrophobicContact CB-CE2 3.69Å; V246-Y248 HydrophobicContact CG1-CD2 4.42Å; V246-Y248 HydrophobicContact CG1-CE1 4.25Å; V246-Y248 HydrophobicContact CG1-CE2 3.63Å; V246-Y248 WeakPolarHBondContact O-CD2 3.4Å; V246-Y248 VanDerWaalsContact O-CE2 3.29Å; V246-Y248 WeakPolarHBondContact O-CE2 3.37Å; Y248-G250 PolarHBondContact O-N 3.18Å; Y248-E253 HydrophobicContact CD1-CB 4.47Å; Y248-L254 HydrophobicContact CD1-CB 4.06Å; Y248-L254 HydrophobicContact CD2-CB 4.01Å; Y248-L254 HydrophobicContact CD2-CD1 4.06Å; Y248-L254 HydrophobicContact CD2-CG 4.47Å; Y248-L254 HydrophobicContact CE1-CB 4.35Å; Y248-L254 HydrophobicContact CE1-CD1 4.21Å; Y248-L254 HydrophobicContact CE2-CB 4.32Å; Y248-L254 HydrophobicContact CE2-CD1 3.54Å; Y248-L254 HydrophobicContact CE2-CG 4.41Å; Y248-L254 HydrophobicContact CG-CB 3.87Å; Y248-D257 HydrophobicContact CE1-CB 3.97Å; Y248-D257 WeakPolarHBondContact CE1-OD2 3.27Å; Y248-S296 CarbonylContact O-C 3.49Å; Y248-S296 VanDerWaalsContact O-CA 3.27Å; Y248-S296 WeakPolarHBondContact O-CA 3.36Å; Y248-S296 WeakPolarHBondContact O-CB 3.36Å; Y248-V297 PolarHBondContact N-O 2.98Å; Y248-V297 PolarHBondContact O-N 3.11Å; Y248-A299 HydrophobicContact CD2-CB 3.99Å; Y248-A299 HydrophobicContact CE2-CB 3.54Å; Y248-Y301 PolarHBondContact OH-OH 3.15Å; Y248-Y301 VanDerWaalsContact OH-OH 3.04Å
249	P	97.4	Very high	96.4	Very high	107 Å²	107	56.3 Å²	56.3	70%	0.695	29%	0.293	S	S	*	.	S	Bend	trans	-59.2	-29	171.2	-24.7	35	0	0	0	113.3	E253	P249-E253 HydrophobicContact CB-CG 4.26Å; P249-E253 HydrophobicContact CG-CG 4.21Å
250	G	97	Very high	96.4	Very high	15 Å²	15	54.3 Å²	54.3	16%	0.155	28%	0.282	C	S	.	.	S	Bend	trans	-173.4	178.7	-178.1	0	0	0	0	0	112.9	Y248 F252 E253 L254	Y248-G250 PolarHBondContact O-N 3.18Å; G250-F252 VanDerWaalsContact C-N 3.29Å; G250-F252 PolarHBondContact O-N 3.2Å; G250-E253 WeakPolarHBondContact CA-OE2 3.39Å; G250-E253 PolarHBondContact N-OE2 3.45Å; G250-L254 PolarHBondContact O-N 2.79Å
251	M	97.1	Very high	96.4	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.02	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-34.3	-178.6	-174.1	-178	81.6	0	0	112.7	L197 L254 M255 M279 A282 A283 Y286	L197-M251 HydrophobicContact CD1-CG 3.61Å; L197-M251 HydrophobicContact CD1-SD 3.91Å; M251-L254 PolarHBondContact O-N 2.77Å; M251-M255 HydrophobicContact CE-SD 4.02Å; M251-M255 HydrophobicContact CG-SD 4.23Å; M251-M255 VanDerWaalsContact O-CG 3.31Å; M251-M255 WeakPolarHBondContact O-CG 3.14Å; M251-M255 PolarHBondContact O-N 3.21Å; M251-M279 VanDerWaalsContact CE-O 3.25Å; M251-M279 WeakPolarHBondContact CE-O 3.41Å; M251-A282 HydrophobicContact CE-CB 4.01Å; M251-A282 HydrophobicContact SD-CB 3.73Å; M251-A283 HydrophobicContact CB-CB 4.23Å; M251-A283 HydrophobicContact CE-CB 3.94Å; M251-A283 HydrophobicContact SD-CB 4.34Å; M251-Y286 HydrophobicContact CB-CD1 3.89Å; M251-Y286 HydrophobicContact CG-CD1 3.77Å; M251-Y286 HydrophobicContact CG-CE1 4.27Å; M251-Y286 HydrophobicContact SD-CD1 4.22Å
252	F	97.3	Very high	96.3	Very high	94 Å²	94	47.8 Å²	47.8	41%	0.412	25%	0.245	S	C	.	.	H	α-helix	trans	-72.7	-37.9	-174.6	-63.1	-69	0	0	0	111.8	G250 M255 E256 M279 L280 A283	G250-F252 VanDerWaalsContact C-N 3.29Å; G250-F252 PolarHBondContact O-N 3.2Å; F252-M255 PolarHBondContact O-N 3.41Å; F252-E256 PolarHBondContact O-N 3.22Å; F252-M279 HydrophobicContact CE1-CB 4.17Å; F252-M279 HydrophobicContact CZ-CB 4.42Å; F252-L280 HydrophobicContact CZ-CD2 4.26Å; F252-A283 HydrophobicContact CE2-CB 3.89Å; F252-A283 HydrophobicContact CZ-CB 4.16Å
253	E	97.1	Very high	96.3	Very high	76 Å²	76	46.1 Å²	46.1	36%	0.355	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-43.2	174.5	-64.7	72.3	-161	0	0	110.5	Y248 P249 G250 M255 E256 D257	Y248-E253 HydrophobicContact CD1-CB 4.47Å; P249-E253 HydrophobicContact CB-CG 4.26Å; P249-E253 HydrophobicContact CG-CG 4.21Å; G250-E253 WeakPolarHBondContact CA-OE2 3.39Å; G250-E253 PolarHBondContact N-OE2 3.45Å; E253-M255 VanDerWaalsContact C-N 3.34Å; E253-M255 PolarHBondContact O-N 2.95Å; E253-E256 PolarHBondContact O-N 3.2Å; E253-D257 PolarHBondContact O-N 3.28Å
254	L	96.9	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-45	171.6	169.3	61.6	0	0	0	111.8	L194 L197 Y248 G250 M251 E256 D257 L258 Y286 A299	L194-L254 HydrophobicContact CD2-CD1 4.18Å; L194-L254 HydrophobicContact CD2-CD2 4.49Å; L197-L254 HydrophobicContact CB-CD2 4.12Å; L197-L254 HydrophobicContact CD1-CD2 4.49Å; L197-L254 HydrophobicContact CD2-CD2 3.92Å; L197-L254 HydrophobicContact CD2-CG 4.36Å; L197-L254 HydrophobicContact CG-CD2 4.4Å; Y248-L254 HydrophobicContact CD1-CB 4.06Å; Y248-L254 HydrophobicContact CD2-CB 4.01Å; Y248-L254 HydrophobicContact CD2-CD1 4.06Å; Y248-L254 HydrophobicContact CD2-CG 4.47Å; Y248-L254 HydrophobicContact CE1-CB 4.35Å; Y248-L254 HydrophobicContact CE1-CD1 4.21Å; Y248-L254 HydrophobicContact CE2-CB 4.32Å; Y248-L254 HydrophobicContact CE2-CD1 3.54Å; Y248-L254 HydrophobicContact CE2-CG 4.41Å; Y248-L254 HydrophobicContact CG-CB 3.87Å; G250-L254 PolarHBondContact O-N 2.79Å; M251-L254 PolarHBondContact O-N 2.77Å; L254-E256 PolarHBondContact O-N 3.27Å; L254-D257 PolarHBondContact O-N 3Å; L254-L258 HydrophobicContact CD1-CD1 3.99Å; L254-L258 HydrophobicContact CD1-CG 3.98Å; L254-L258 HydrophobicContact CG-CD1 4.09Å; L254-L258 HydrophobicContact CG-CG 4.48Å; L254-L258 VanDerWaalsContact O-CG 3.32Å; L254-L258 WeakPolarHBondContact O-CG 3.24Å; L254-L258 PolarHBondContact O-N 3.4Å; L254-Y286 HydrophobicContact CD2-CE1 3.84Å; L254-Y286 WeakPolarHBondContact CD2-OH 3.29Å; L254-A299 HydrophobicContact CD1-CB 3.64Å; L254-A299 HydrophobicContact CD2-CB 3.75Å; L254-A299 HydrophobicContact CG-CB 4.33Å
255	M	95.9	Very high	96.1	Very high	61 Å²	61	42.3 Å²	42.3	30%	0.3	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-36.9	179.2	-72.1	178.5	69.7	0	0	112.6	M251 F252 E253 Q259	M251-M255 HydrophobicContact CE-SD 4.02Å; M251-M255 HydrophobicContact CG-SD 4.23Å; M251-M255 VanDerWaalsContact O-CG 3.31Å; M251-M255 WeakPolarHBondContact O-CG 3.14Å; M251-M255 PolarHBondContact O-N 3.21Å; F252-M255 PolarHBondContact O-N 3.41Å; E253-M255 VanDerWaalsContact C-N 3.34Å; E253-M255 PolarHBondContact O-N 2.95Å; M255-Q259 WeakPolarHBondContact O-CB 3.4Å; M255-Q259 PolarHBondContact O-N 2.86Å
256	E	95.4	Very high	95.9	Very high	90 Å²	90	37.1 Å²	37.1	42%	0.421	20%	0.197	S	C	.	.	H	α-helix	trans	-60.3	-47.8	171.9	-175.1	-172.4	153.7	0	0	110.3	K67 F68 F252 E253 L254 L258 Q259 G260	K67-E256 IonicContact NZ-OE1 2.91Å; K67-E256 PolarHBondContact NZ-OE1 3.07Å; F68-E256 HydrophobicContact CE1-CG 4.31Å; F68-E256 HydrophobicContact CZ-CG 4.32Å; F252-E256 PolarHBondContact O-N 3.22Å; E253-E256 PolarHBondContact O-N 3.2Å; L254-E256 PolarHBondContact O-N 3.27Å; E256-L258 PolarHBondContact O-N 3.14Å; E256-Q259 WeakPolarHBondContact O-CB 3.47Å; E256-Q259 PolarHBondContact O-N 3.03Å; E256-Q259 VanDerWaalsContact O-N 3.16Å; E256-G260 PolarHBondContact O-N 2.99Å
257	D	95.8	Very high	95.7	Very high	21 Å²	21	35.7 Å²	35.7	11%	0.112	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-45.2	179.2	-88.5	30.4	0	0	0	112.1	F68 Y70 Y248 E253 L254 Q259 G260 M261	F68-D257 HydrophobicContact CD1-CB 4.2Å; F68-D257 VanDerWaalsContact CD1-OD1 3.26Å; F68-D257 WeakPolarHBondContact CD1-OD1 3.44Å; F68-D257 WeakPolarHBondContact CE1-OD1 3.41Å; Y70-D257 VanDerWaalsContact CE1-OD2 3.28Å; Y70-D257 WeakPolarHBondContact CE1-OD2 3.48Å; Y70-D257 PolarHBondContact OH-OD2 3.27Å; Y248-D257 HydrophobicContact CE1-CB 3.97Å; Y248-D257 WeakPolarHBondContact CE1-OD2 3.27Å; E253-D257 PolarHBondContact O-N 3.28Å; L254-D257 PolarHBondContact O-N 3Å; D257-Q259 VanDerWaalsContact C-N 3.26Å; D257-Q259 PolarHBondContact O-N 3.38Å; D257-G260 CarbonylContact O-C 3.48Å; D257-G260 PolarHBondContact O-N 3.45Å; D257-G260 VanDerWaalsContact O-N 3.15Å; D257-M261 HydrophobicContact CB-CE 4.38Å; D257-M261 WeakPolarHBondContact O-CB 3.29Å; D257-M261 VanDerWaalsContact O-CG 3.23Å; D257-M261 WeakPolarHBondContact O-CG 3.41Å; D257-M261 PolarHBondContact O-N 3.37Å
258	L	95.6	Very high	95.4	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.073	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-35.4	175.4	-69.5	172.5	0	0	0	112.2	L194 L197 L254 E256 G262 E263 S264 Y301	L194-L258 HydrophobicContact CD1-CD1 3.72Å; L194-L258 HydrophobicContact CD1-CD2 3.78Å; L194-L258 HydrophobicContact CD1-CG 4.42Å; L194-L258 HydrophobicContact CD2-CD1 4.36Å; L194-L258 HydrophobicContact CD2-CD2 4.41Å; L197-L258 HydrophobicContact CD2-CD1 3.77Å; L254-L258 HydrophobicContact CD1-CD1 3.99Å; L254-L258 HydrophobicContact CD1-CG 3.98Å; L254-L258 HydrophobicContact CG-CD1 4.09Å; L254-L258 HydrophobicContact CG-CG 4.48Å; L254-L258 VanDerWaalsContact O-CG 3.32Å; L254-L258 WeakPolarHBondContact O-CG 3.24Å; L254-L258 PolarHBondContact O-N 3.4Å; E256-L258 PolarHBondContact O-N 3.14Å; L258-G262 PolarHBondContact O-N 2.94Å; L258-E263 HydrophobicContact CD2-CB 4.38Å; L258-E263 PolarHBondContact O-N 2.93Å; L258-S264 PolarHBondContact O-N 3.47Å; L258-Y301 HydrophobicContact CD2-CE1 4.21Å
259	Q	94.8	Very high	95.1	Very high	93 Å²	93	43.4 Å²	43.4	44%	0.435	22%	0.22	S	C	.	.	H	α-helix	trans	-68.8	-45.5	173.9	-165.7	-173.6	5.4	0	0	111.2	W58 M255 E256 D257 M261 G262 S264	W58-Q259 HydrophobicContact CE3-CG 4.36Å; W58-Q259 HydrophobicContact CH2-CG 3.85Å; W58-Q259 HydrophobicContact CZ3-CB 4.47Å; W58-Q259 HydrophobicContact CZ3-CG 3.64Å; W58-Q259 WeakPolarHBondContact CZ3-O 3.42Å; M255-Q259 WeakPolarHBondContact O-CB 3.4Å; M255-Q259 PolarHBondContact O-N 2.86Å; E256-Q259 WeakPolarHBondContact O-CB 3.47Å; E256-Q259 PolarHBondContact O-N 3.03Å; E256-Q259 VanDerWaalsContact O-N 3.16Å; D257-Q259 VanDerWaalsContact C-N 3.26Å; D257-Q259 PolarHBondContact O-N 3.38Å; Q259-M261 VanDerWaalsContact C-N 3.35Å; Q259-M261 PolarHBondContact O-N 3.46Å; Q259-G262 WeakPolarHBondContact O-CA 3.43Å; Q259-G262 PolarHBondContact O-N 3.49Å; Q259-S264 WeakPolarHBondContact CA-OG 3.44Å
260	G	95.1	Very high	94.7	Very high	5 Å²	5	42.7 Å²	42.7	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-36.8	177.8	0	0	0	0	0	113.4	A59 F68 E256 D257 G262	A59-G260 WeakPolarHBondContact CB-O 3.43Å; F68-G260 VanDerWaalsContact CD2-CA 3.47Å; E256-G260 PolarHBondContact O-N 2.99Å; D257-G260 CarbonylContact O-C 3.48Å; D257-G260 PolarHBondContact O-N 3.45Å; D257-G260 VanDerWaalsContact O-N 3.15Å; G260-G262 PolarHBondContact O-N 3.12Å
261	M	94.3	Very high	94.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.4	170.6	-70.4	173.9	-169.8	0	0	112.4	F68 Y70 L71 K72 D257 Q259 E263	F68-M261 HydrophobicContact CB-CG 4Å; F68-M261 WeakPolarHBondContact O-CE 3.48Å; F68-M261 WeakPolarHBondContact O-CG 3.36Å; Y70-M261 HydrophobicContact CE1-CE 3.73Å; Y70-M261 HydrophobicContact CE2-CE 3.72Å; Y70-M261 WeakPolarHBondContact OH-CE 3.46Å; L71-M261 HydrophobicContact CB-CE 4.12Å; L71-M261 HydrophobicContact CD2-SD 4.42Å; K72-M261 WeakPolarHBondContact CE-O 3.48Å; K72-M261 PolarHBondContact NZ-O 3Å; D257-M261 HydrophobicContact CB-CE 4.38Å; D257-M261 WeakPolarHBondContact O-CB 3.29Å; D257-M261 VanDerWaalsContact O-CG 3.23Å; D257-M261 WeakPolarHBondContact O-CG 3.41Å; D257-M261 PolarHBondContact O-N 3.37Å; Q259-M261 VanDerWaalsContact C-N 3.35Å; Q259-M261 PolarHBondContact O-N 3.46Å; M261-E263 HydrophobicContact CB-CB 4.2Å; M261-E263 HydrophobicContact CB-CG 3.97Å; M261-E263 PolarHBondContact O-N 3.33Å
262	G	94.6	Very high	93.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	17.4	-169.5	0	0	0	0	0	113.4	K52 L258 Q259 G260 S264	K52-G262 PolarHBondContact NZ-O 3.09Å; L258-G262 PolarHBondContact O-N 2.94Å; Q259-G262 WeakPolarHBondContact O-CA 3.43Å; Q259-G262 PolarHBondContact O-N 3.49Å; G260-G262 PolarHBondContact O-N 3.12Å; G262-S264 VanDerWaalsContact C-N 3.3Å
263	E	95.2	Very high	93	Very high	21 Å²	21	50.4 Å²	50.4	10%	0.098	25%	0.253	C	S	.	.			trans	-91	15.4	179.7	-69.6	-56.3	109.9	0	0	113.4	K52 H162 W163 F189 L258 M261	K52-E263 IonicContact NZ-OE1 2.79Å; K52-E263 PolarHBondContact NZ-OE1 2.99Å; K52-E263 IonicContact NZ-OE2 2.83Å; H162-E263 IonicContact CD2-OE2 2.6Å; H162-E263 IonicContact CE1-OE2 2.65Å; H162-E263 IonicContact NE2-OE2 4Å; H162-E263 PolarHBondContact NE2-OE2 2.88Å; W163-E263 VanDerWaalsContact CE2-OE2 3.29Å; W163-E263 VanDerWaalsContact CZ2-OE2 3.28Å; W163-E263 WeakPolarHBondContact CZ2-OE2 3.47Å; W163-E263 PolarHBondContact NE1-OE1 3.35Å; W163-E263 PolarHBondContact NE1-OE2 2.87Å; F189-E263 HydrophobicContact CE2-CG 4.22Å; L258-E263 HydrophobicContact CD2-CB 4.38Å; L258-E263 PolarHBondContact O-N 2.93Å; M261-E263 HydrophobicContact CB-CB 4.2Å; M261-E263 HydrophobicContact CB-CG 3.97Å; M261-E263 PolarHBondContact O-N 3.33Å
264	S	94.1	Very high	92.5	Very high	35 Å²	35	48.6 Å²	48.6	25%	0.245	25%	0.246	C	C	.	.			trans	-58.6	148.4	171.7	-61.2	0	0	0	0	112.4	Q55 L258 Q259 G262 C266	Q55-S264 PolarHBondContact NE2-O 3.32Å; Q55-S264 PolarHBondContact OE1-O 2.94Å; L258-S264 PolarHBondContact O-N 3.47Å; Q259-S264 WeakPolarHBondContact CA-OG 3.44Å; G262-S264 VanDerWaalsContact C-N 3.3Å; S264-C266 PolarHBondContact O-N 3.35Å
265	N	94.4	Very high	92.3	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.123	27%	0.269	C	S	.	.			trans	-57.3	131	178.3	179.9	12.2	0	0	0	112.2	Q55 P214 H215 S217 S267	Q55-N265 PolarHBondContact NE2-O 3.35Å; P214-N265 PolarHBondContact O-ND2 2.69Å; H215-N265 VanDerWaalsContact C-ND2 3.33Å; H215-N265 WeakPolarHBondContact O-CB 3.47Å; H215-N265 PolarHBondContact O-ND2 3.03Å; S217-N265 PolarHBondContact OG-OD1 3.47Å; N265-S267 VanDerWaalsContact OD1-CB 3.26Å; N265-S267 WeakPolarHBondContact OD1-CB 3.33Å; N265-S267 PolarHBondContact OD1-N 3.49Å; N265-S267 PolarHBondContact OD1-OG 3.43Å
266	C	93.7	Very high	92.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.			trans	-121.8	15.7	176.3	73.5	0	0	0	0	113.2	D48 L51 K52 W163 S264	D48-C266 WeakPolarHBondContact CB-O 3.27Å; D48-C266 PolarHBondContact N-O 3.49Å; L51-C266 HydrophobicContact CB-CB 4.48Å; L51-C266 HydrophobicContact CD2-CB 4.11Å; L51-C266 HydrophobicContact CG-CB 4.23Å; K52-C266 HydrophobicContact CB-CB 4.18Å; W163-C266 HydrophobicContact CZ3-CB 4.33Å; W163-C266 WeakPolarHBondContact CZ3-SG 3.41Å; S264-C266 PolarHBondContact O-N 3.35Å
267	S	93.5	Very high	92.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-65.1	141.5	-179.9	-49.4	0	0	0	0	111.9	I46 P218 N265 N269 R270	I46-S267 CarbonylContact O-C 3.53Å; I46-S267 VanDerWaalsContact O-CA 3.28Å; I46-S267 WeakPolarHBondContact O-CA 3.25Å; P218-S267 WeakPolarHBondContact CD-OG 3.2Å; N265-S267 VanDerWaalsContact OD1-CB 3.26Å; N265-S267 WeakPolarHBondContact OD1-CB 3.33Å; N265-S267 PolarHBondContact OD1-N 3.49Å; N265-S267 PolarHBondContact OD1-OG 3.43Å; S267-N269 VanDerWaalsContact C-N 3.26Å; S267-N269 VanDerWaalsContact CB-OD1 3.23Å; S267-N269 WeakPolarHBondContact CB-OD1 3.36Å; S267-N269 PolarHBondContact O-N 3.48Å; S267-R270 VanDerWaalsContact O-CB 3.28Å; S267-R270 WeakPolarHBondContact O-CB 3.32Å; S267-R270 WeakPolarHBondContact O-CD 3.12Å; S267-R270 WeakPolarHBondContact O-CG 3.23Å; S267-R270 PolarHBondContact O-N 3Å; S267-R270 VanDerWaalsContact O-N 3.17Å
268	W	91.7	Very high	92.2	Very high	140 Å²	140	59.2 Å²	59.2	53%	0.53	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.8	179.1	-78.7	108	0	0	0	113.7	N45 I46 F47 D48 R270	N45-W268 PolarHBondContact ND2-NE1 3.25Å; N45-W268 VanDerWaalsContact O-CD1 3.31Å; N45-W268 PolarHBondContact OD1-NE1 3.31Å; I46-W268 PolarHBondContact O-N 3.21Å; F47-W268 PolarHBondContact O-NE1 3.48Å; D48-W268 HydrophobicContact CB-CD2 4.05Å; D48-W268 HydrophobicContact CB-CE3 4.35Å; D48-W268 HydrophobicContact CB-CH2 4.04Å; D48-W268 HydrophobicContact CB-CZ2 3.72Å; D48-W268 HydrophobicContact CB-CZ3 4.34Å; W268-R270 VanDerWaalsContact C-N 3.26Å; W268-R270 PolarHBondContact O-N 3.41Å
269	N	89.9	Confident	92.2	Very high	111 Å²	111	60.9 Å²	60.9	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	9.9	179.1	65.2	-10.2	0	0	0	113.6	P214 S267	P214-N269 WeakPolarHBondContact CG-OD1 3.4Å; S267-N269 VanDerWaalsContact C-N 3.26Å; S267-N269 VanDerWaalsContact CB-OD1 3.23Å; S267-N269 WeakPolarHBondContact CB-OD1 3.36Å; S267-N269 PolarHBondContact O-N 3.48Å
270	R	89	Confident	92.3	Very high	92 Å²	92	60.2 Å²	60.2	35%	0.347	30%	0.297	S	S	.	.			trans	-71	148	178	77.9	-171.6	-178.7	82.9	1	111.5	L51 S267 W268	L51-R270 VanDerWaalsContact CD2-NE 3.25Å; L51-R270 VanDerWaalsContact CD2-NH2 3.32Å; S267-R270 VanDerWaalsContact O-CB 3.28Å; S267-R270 WeakPolarHBondContact O-CB 3.32Å; S267-R270 WeakPolarHBondContact O-CD 3.12Å; S267-R270 WeakPolarHBondContact O-CG 3.23Å; S267-R270 PolarHBondContact O-N 3Å; S267-R270 VanDerWaalsContact O-N 3.17Å; W268-R270 VanDerWaalsContact C-N 3.26Å; W268-R270 PolarHBondContact O-N 3.41Å
271	K	87.6	Confident	92.5	Very high	58 Å²	58	60.6 Å²	60.6	25%	0.252	30%	0.3	S	S	.	.			trans	-73.7	135.2	165.3	-164.6	178	178.5	-176.4	0	109.9	E205 E209 S213 L273	E205-K271 VanDerWaalsContact OE1-CD 3.25Å; E205-K271 WeakPolarHBondContact OE1-CD 3.4Å; E205-K271 IonicContact OE1-NZ 3.9Å; E205-K271 PolarHBondContact OE1-NZ 3.43Å; E209-K271 IonicContact OE1-NZ 3.57Å; E209-K271 PolarHBondContact OE1-NZ 2.57Å; E209-K271 VanDerWaalsContact OE1-NZ 3.16Å; E209-K271 IonicContact OE2-NZ 3.64Å; E209-K271 PolarHBondContact OE2-NZ 2.64Å; S213-K271 WeakPolarHBondContact OG-CB 3.27Å; S213-K271 PolarHBondContact OG-N 3.03Å; K271-L273 VanDerWaalsContact CD-O 3.29Å; K271-L273 WeakPolarHBondContact CD-O 3.37Å; K271-L273 VanDerWaalsContact CE-O 3.23Å; K271-L273 WeakPolarHBondContact CE-O 3.35Å; K271-L273 VanDerWaalsContact CG-O 3.32Å; K271-L273 WeakPolarHBondContact CG-O 3.4Å
272	A	82.1	Confident	92.6	Very high	81 Å²	81	60.5 Å²	60.5	67%	0.669	30%	0.299	S	S	*	.	S	Bend	trans	-74.5	-26.9	-177.8	0	0	0	0	0	113.3
273	L	85.6	Confident	92.8	Very high	135 Å²	135	61.5 Å²	61.5	71%	0.707	31%	0.307	S	S	*	.			trans	-133.8	133	-173.2	-65.5	169.6	0	0	0	109.9	K271	K271-L273 VanDerWaalsContact CD-O 3.29Å; K271-L273 WeakPolarHBondContact CD-O 3.37Å; K271-L273 VanDerWaalsContact CE-O 3.23Å; K271-L273 WeakPolarHBondContact CE-O 3.35Å; K271-L273 VanDerWaalsContact CG-O 3.32Å; K271-L273 WeakPolarHBondContact CG-O 3.4Å
274	L	87.4	Confident	92.9	Very high	39 Å²	39	63 Å²	63	20%	0.204	32%	0.323	C	S	.	.			trans	-103.1	126.6	171.7	-164.6	68	0	0	0	108.5	L201 H215 T278 M279	L201-L274 HydrophobicContact CD2-CD1 4.48Å; L201-L274 HydrophobicContact CD2-CD2 3.73Å; H215-L274 WeakPolarHBondContact CE1-CD1 3.32Å; L274-T278 HydrophobicContact CD1-CG2 4.15Å; L274-M279 HydrophobicContact CB-CG 4.22Å; L274-M279 HydrophobicContact CB-SD 4.43Å; L274-M279 HydrophobicContact CD2-CG 3.26Å; L274-M279 HydrophobicContact CD2-SD 4.04Å; L274-M279 HydrophobicContact CG-CG 3.63Å; L274-M279 HydrophobicContact CG-SD 4.44Å
275	H	92.5	Very high	93.1	Very high	104 Å²	104	62.7 Å²	62.7	48%	0.481	32%	0.32	S	S	.	.			trans	-69.4	144.8	-178.7	-70.5	-175	0	0	0	110.6	E209 D277 T278 M279	E209-H275 IonicContact OE1-CG 3.72Å; E209-H275 IonicContact OE1-ND1 3.69Å; H275-D277 VanDerWaalsContact C-N 3.29Å; H275-D277 PolarHBondContact O-N 3.13Å; H275-T278 WeakPolarHBondContact O-CB 3.29Å; H275-T278 PolarHBondContact O-N 3.43Å; H275-T278 VanDerWaalsContact O-N 3.16Å; H275-M279 PolarHBondContact O-N 2.69Å
276	R	94.3	Very high	93.3	Very high	179 Å²	179	61.7 Å²	61.7	68%	0.675	31%	0.314	S	S	*	.	H	α-helix	trans	-57.8	-42	-179.3	-176.7	175.5	179	-100.4	2	112.4	T278 M279 L280	R276-T278 VanDerWaalsContact C-N 3.34Å; R276-M279 HydrophobicContact CB-CE 4.34Å; R276-M279 WeakPolarHBondContact O-CB 3.37Å; R276-M279 PolarHBondContact O-N 2.6Å; R276-L280 HydrophobicContact CG-CD1 4.26Å; R276-L280 WeakPolarHBondContact O-CG 3.21Å; R276-L280 PolarHBondContact O-N 2.79Å
277	D	95.5	Very high	93.4	Very high	109 Å²	109	69 Å²	69	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-66.3	-39.3	-180	-62.5	-14.2	0	0	0	111.2	H275 L280 A281	H275-D277 VanDerWaalsContact C-N 3.29Å; H275-D277 PolarHBondContact O-N 3.13Å; D277-L280 PolarHBondContact O-N 3.22Å; D277-A281 WeakPolarHBondContact O-CB 3.42Å; D277-A281 PolarHBondContact O-N 2.92Å
278	T	95.6	Very high	93.6	Very high	2 Å²	2	75.4 Å²	75.4	1%	0.012	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-41.6	173.5	-51.7	0	0	0	0	111.6	A204 E205 E209 L274 H275 R276 A281 A282	A204-T278 HydrophobicContact CB-CG2 4.35Å; E205-T278 HydrophobicContact CB-CG2 3.88Å; E205-T278 HydrophobicContact CG-CG2 4.1Å; E209-T278 PolarHBondContact OE1-OG1 3.43Å; L274-T278 HydrophobicContact CD1-CG2 4.15Å; H275-T278 WeakPolarHBondContact O-CB 3.29Å; H275-T278 PolarHBondContact O-N 3.43Å; H275-T278 VanDerWaalsContact O-N 3.16Å; R276-T278 VanDerWaalsContact C-N 3.34Å; T278-A281 PolarHBondContact O-N 3.39Å; T278-A282 VanDerWaalsContact O-CB 3.29Å; T278-A282 WeakPolarHBondContact O-CB 3.2Å; T278-A282 PolarHBondContact O-N 2.95Å
279	M	95.8	Very high	93.9	Very high	50 Å²	50	73.7 Å²	73.7	25%	0.246	37%	0.371	C	S	.	.	H	α-helix	trans	-61.7	-45.3	175	-75.1	-172	-67.6	0	0	112.4	M251 F252 L274 H275 R276 A282 A283	M251-M279 VanDerWaalsContact CE-O 3.25Å; M251-M279 WeakPolarHBondContact CE-O 3.41Å; F252-M279 HydrophobicContact CE1-CB 4.17Å; F252-M279 HydrophobicContact CZ-CB 4.42Å; L274-M279 HydrophobicContact CB-CG 4.22Å; L274-M279 HydrophobicContact CB-SD 4.43Å; L274-M279 HydrophobicContact CD2-CG 3.26Å; L274-M279 HydrophobicContact CD2-SD 4.04Å; L274-M279 HydrophobicContact CG-CG 3.63Å; L274-M279 HydrophobicContact CG-SD 4.44Å; H275-M279 PolarHBondContact O-N 2.69Å; R276-M279 HydrophobicContact CB-CE 4.34Å; R276-M279 WeakPolarHBondContact O-CB 3.37Å; R276-M279 PolarHBondContact O-N 2.6Å; M279-A282 PolarHBondContact O-N 3.27Å; M279-A283 WeakPolarHBondContact O-CB 3.46Å; M279-A283 PolarHBondContact O-N 2.91Å
280	L	97.4	Very high	94.2	Very high	79 Å²	79	70.5 Å²	70.5	41%	0.414	35%	0.351	S	S	.	.	H	α-helix	trans	-67.1	-39.5	179.6	-67.5	173.4	0	0	0	111.6	F252 R276 D277 A283 A284	F252-L280 HydrophobicContact CZ-CD2 4.26Å; R276-L280 HydrophobicContact CG-CD1 4.26Å; R276-L280 WeakPolarHBondContact O-CG 3.21Å; R276-L280 PolarHBondContact O-N 2.79Å; D277-L280 PolarHBondContact O-N 3.22Å; L280-A283 PolarHBondContact O-N 2.99Å; L280-A284 PolarHBondContact O-N 3.04Å; L280-A284 VanDerWaalsContact O-N 3.11Å
281	A	97.6	Very high	94.6	Very high	12 Å²	12	73 Å²	73	10%	0.099	36%	0.361	C	S	.	.	H	α-helix	trans	-63.2	-45.6	173.5	0	0	0	0	0	111.4	A204 R208 D277 T278 A283 A284 V285	A204-A281 HydrophobicContact CB-CB 3.88Å; R208-A281 HydrophobicContact CG-CB 4.08Å; D277-A281 WeakPolarHBondContact O-CB 3.42Å; D277-A281 PolarHBondContact O-N 2.92Å; T278-A281 PolarHBondContact O-N 3.39Å; A281-A283 PolarHBondContact O-N 2.69Å; A281-A284 WeakPolarHBondContact O-CB 3.46Å; A281-A284 PolarHBondContact O-N 2.55Å; A281-A284 VanDerWaalsContact O-N 3.15Å; A281-V285 WeakPolarHBondContact O-CG2 3.29Å; A281-V285 PolarHBondContact O-N 3.09Å
282	A	97.6	Very high	95	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-42.3	177.5	0	0	0	0	0	112	L201 A204 M251 T278 M279 A284 V285 Y286	L201-A282 HydrophobicContact CD2-CB 3.73Å; L201-A282 HydrophobicContact CG-CB 4.31Å; A204-A282 HydrophobicContact CB-CB 3.68Å; A204-A282 VanDerWaalsContact CB-N 3.32Å; M251-A282 HydrophobicContact CE-CB 4.01Å; M251-A282 HydrophobicContact SD-CB 3.73Å; T278-A282 VanDerWaalsContact O-CB 3.29Å; T278-A282 WeakPolarHBondContact O-CB 3.2Å; T278-A282 PolarHBondContact O-N 2.95Å; M279-A282 PolarHBondContact O-N 3.27Å; A282-A284 VanDerWaalsContact C-N 3.3Å; A282-A284 PolarHBondContact O-N 3.38Å; A282-V285 PolarHBondContact O-N 2.8Å; A282-Y286 WeakPolarHBondContact O-CB 2.96Å; A282-Y286 PolarHBondContact O-N 2.84Å
283	A	97.9	Very high	95.6	Very high	21 Å²	21	78.7 Å²	78.7	17%	0.174	38%	0.376	C	S	.	.	H	α-helix	trans	-61.3	-39.2	175.5	0	0	0	0	0	112.1	M251 F252 M279 L280 A281 R287	M251-A283 HydrophobicContact CB-CB 4.23Å; M251-A283 HydrophobicContact CE-CB 3.94Å; M251-A283 HydrophobicContact SD-CB 4.34Å; F252-A283 HydrophobicContact CE2-CB 3.89Å; F252-A283 HydrophobicContact CZ-CB 4.16Å; M279-A283 WeakPolarHBondContact O-CB 3.46Å; M279-A283 PolarHBondContact O-N 2.91Å; L280-A283 PolarHBondContact O-N 2.99Å; A281-A283 PolarHBondContact O-N 2.69Å; A283-R287 WeakPolarHBondContact O-CB 3.22Å; A283-R287 PolarHBondContact O-N 3.07Å; A283-R287 VanDerWaalsContact O-N 3.11Å
284	A	97.8	Very high	96	Very high	52 Å²	52	78.1 Å²	78.1	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-67.7	-44.5	176.2	0	0	0	0	0	112	L280 A281 A282 R287 E288	L280-A284 PolarHBondContact O-N 3.04Å; L280-A284 VanDerWaalsContact O-N 3.11Å; A281-A284 WeakPolarHBondContact O-CB 3.46Å; A281-A284 PolarHBondContact O-N 2.55Å; A281-A284 VanDerWaalsContact O-N 3.15Å; A282-A284 VanDerWaalsContact C-N 3.3Å; A282-A284 PolarHBondContact O-N 3.38Å; A284-R287 PolarHBondContact O-N 3.17Å; A284-E288 WeakPolarHBondContact O-CB 3.23Å; A284-E288 PolarHBondContact O-N 3Å
285	V	97.9	Very high	96.3	Very high	30 Å²	30	78.3 Å²	78.3	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-60	-47.5	175.7	172.1	0	0	0	0	110.7	L203 A281 A282 R287 E288 M289	L203-V285 HydrophobicContact CB-CG1 4.27Å; L203-V285 HydrophobicContact CD1-CG1 3.94Å; A281-V285 WeakPolarHBondContact O-CG2 3.29Å; A281-V285 PolarHBondContact O-N 3.09Å; A282-V285 PolarHBondContact O-N 2.8Å; V285-R287 PolarHBondContact O-N 2.7Å; V285-E288 PolarHBondContact O-N 2.58Å; V285-M289 HydrophobicContact CG1-CG 4.22Å; V285-M289 HydrophobicContact CG1-SD 3.66Å; V285-M289 WeakPolarHBondContact O-CB 3.15Å; V285-M289 WeakPolarHBondContact O-CG 3.3Å; V285-M289 PolarHBondContact O-N 3.16Å
286	Y	98.1	Very high	96.5	Very high	1 Å²	1	74 Å²	74	0%	0.004	37%	0.367	C	S	.	.	H	α-helix	trans	-57.6	-51.1	180	-158.4	155.7	0	0	0	110.6	E196 L197 S200 M251 L254 A282 E288 M289 Y290 V297 P298	E196-Y286 HydrophobicContact CB-CD2 4.27Å; E196-Y286 HydrophobicContact CB-CE2 3.41Å; E196-Y286 VanDerWaalsContact CB-CE2 3.41Å; E196-Y286 HydrophobicContact CG-CE2 4.36Å; L197-Y286 HydrophobicContact CB-CE1 3.74Å; L197-Y286 HydrophobicContact CD1-CD1 4.13Å; L197-Y286 HydrophobicContact CD1-CE1 3.88Å; L197-Y286 HydrophobicContact CG-CE1 4.41Å; S200-Y286 WeakPolarHBondContact OG-CA 3.02Å; S200-Y286 WeakPolarHBondContact OG-CB 2.91Å; M251-Y286 HydrophobicContact CB-CD1 3.89Å; M251-Y286 HydrophobicContact CG-CD1 3.77Å; M251-Y286 HydrophobicContact CG-CE1 4.27Å; M251-Y286 HydrophobicContact SD-CD1 4.22Å; L254-Y286 HydrophobicContact CD2-CE1 3.84Å; L254-Y286 WeakPolarHBondContact CD2-OH 3.29Å; A282-Y286 WeakPolarHBondContact O-CB 2.96Å; A282-Y286 PolarHBondContact O-N 2.84Å; Y286-E288 VanDerWaalsContact C-N 3.33Å; Y286-E288 PolarHBondContact O-N 3.15Å; Y286-M289 PolarHBondContact O-N 2.86Å; Y286-Y290 AromaticContact CD2-CD2 3.62Å; Y286-Y290 HydrophobicContact CD2-CD2 3.62Å; Y286-Y290 HydrophobicContact CD2-CG 4.21Å; Y286-Y290 HydrophobicContact CE2-CD2 4.02Å; Y286-Y290 HydrophobicContact CE2-CG 4.33Å; Y286-Y290 HydrophobicContact CG-CD2 4.49Å; Y286-Y290 PolarHBondContact O-N 3.46Å; Y286-V297 HydrophobicContact CD2-CB 3.99Å; Y286-V297 HydrophobicContact CD2-CG1 4.18Å; Y286-V297 HydrophobicContact CE2-CB 3.87Å; Y286-V297 HydrophobicContact CE2-CG2 4.31Å; Y286-P298 WeakPolarHBondContact CE2-O 3.25Å; Y286-P298 PolarHBondContact OH-O 2.89Å
287	R	97.3	Very high	96.7	Very high	153 Å²	153	65.7 Å²	65.7	58%	0.577	34%	0.335	S	S	*	.	H	α-helix	trans	-62.5	-39.3	179.3	-170.3	178.7	67.4	174.5	1	112.3	A283 A284 V285 R291 V297	A283-R287 WeakPolarHBondContact O-CB 3.22Å; A283-R287 PolarHBondContact O-N 3.07Å; A283-R287 VanDerWaalsContact O-N 3.11Å; A284-R287 PolarHBondContact O-N 3.17Å; V285-R287 PolarHBondContact O-N 2.7Å; R287-R291 HydrophobicContact CG-CB 4.25Å; R287-R291 WeakPolarHBondContact O-CB 3.42Å; R287-R291 VanDerWaalsContact O-CD 3.29Å; R287-R291 WeakPolarHBondContact O-CD 3.37Å; R287-R291 WeakPolarHBondContact O-CG 3.36Å; R287-R291 PolarHBondContact O-N 3.49Å; R287-V297 HydrophobicContact CB-CG1 4.5Å
288	E	97.1	Very high	96.8	Very high	135 Å²	135	60.8 Å²	60.8	63%	0.631	31%	0.31	S	S	*	.	H	α-helix	trans	-73.3	-38.2	-178.1	-168.9	59	-160.6	0	0	112.4	A284 V285 Y286 R291	A284-E288 WeakPolarHBondContact O-CB 3.23Å; A284-E288 PolarHBondContact O-N 3Å; V285-E288 PolarHBondContact O-N 2.58Å; Y286-E288 VanDerWaalsContact C-N 3.33Å; Y286-E288 PolarHBondContact O-N 3.15Å; E288-R291 IonicContact OE2-NH1 3.76Å
289	M	96.9	Very high	96.9	Very high	105 Å²	105	60.7 Å²	60.7	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-81.2	-34.8	-176.5	-69.4	-172	68.6	0	0	113.7	L203 V285 Y286	L203-M289 HydrophobicContact CD1-CE 4.33Å; L203-M289 HydrophobicContact CD1-SD 3.59Å; L203-M289 VanDerWaalsContact CD1-SD 3.59Å; V285-M289 HydrophobicContact CG1-CG 4.22Å; V285-M289 HydrophobicContact CG1-SD 3.66Å; V285-M289 WeakPolarHBondContact O-CB 3.15Å; V285-M289 WeakPolarHBondContact O-CG 3.3Å; V285-M289 PolarHBondContact O-N 3.16Å; Y286-M289 PolarHBondContact O-N 2.86Å
290	Y	97.5	Very high	97	Very high	43 Å²	43	58.7 Å²	58.7	17%	0.169	30%	0.3	C	S	.	.	H	α-helix	trans	-127	0.8	-165.2	-52.8	-74.9	0	0	0	114.9	Y195 E196 C199 Y286 N292 P298	Y195-Y290 AromaticContact CE2-CE1 3.97Å; Y195-Y290 HydrophobicContact CE2-CE1 3.97Å; E196-Y290 HydrophobicContact CB-CD1 4.14Å; E196-Y290 HydrophobicContact CB-CD2 3.83Å; E196-Y290 HydrophobicContact CB-CE1 4.28Å; E196-Y290 HydrophobicContact CB-CE2 3.98Å; E196-Y290 HydrophobicContact CB-CG 3.92Å; E196-Y290 HydrophobicContact CG-CD1 3.72Å; E196-Y290 HydrophobicContact CG-CD2 4.32Å; E196-Y290 HydrophobicContact CG-CE1 3.98Å; E196-Y290 HydrophobicContact CG-CG 3.9Å; C199-Y290 WeakPolarHBondContact CB-OH 3.47Å; Y286-Y290 AromaticContact CD2-CD2 3.62Å; Y286-Y290 HydrophobicContact CD2-CD2 3.62Å; Y286-Y290 HydrophobicContact CD2-CG 4.21Å; Y286-Y290 HydrophobicContact CE2-CD2 4.02Å; Y286-Y290 HydrophobicContact CE2-CG 4.33Å; Y286-Y290 HydrophobicContact CG-CD2 4.49Å; Y286-Y290 PolarHBondContact O-N 3.46Å; Y290-N292 PolarHBondContact O-N 2.85Å; Y290-P298 WeakPolarHBondContact O-CD 3.29Å
291	R	96.9	Very high	97.1	Very high	145 Å²	145	55 Å²	55	55%	0.547	28%	0.28	S	S	.	.			trans	-58	138	-178.7	67.5	-174.3	-144.2	-141.8	2.4	112	R287 E288 S296	R287-R291 HydrophobicContact CG-CB 4.25Å; R287-R291 WeakPolarHBondContact O-CB 3.42Å; R287-R291 VanDerWaalsContact O-CD 3.29Å; R287-R291 WeakPolarHBondContact O-CD 3.37Å; R287-R291 WeakPolarHBondContact O-CG 3.36Å; R287-R291 PolarHBondContact O-N 3.49Å; E288-R291 IonicContact OE2-NH1 3.76Å; R291-S296 CarbonylContact C-O 3.55Å; R291-S296 WeakPolarHBondContact CA-O 3.4Å
292	N	96.3	Very high	97	Very high	48 Å²	48	55 Å²	55	26%	0.257	28%	0.278	S	S	.	.			trans	-76.5	169.6	169	-65.4	-38.7	0	0	0	110.8	N247 Y290 D294 G295 S296	N247-N292 PolarHBondContact OD1-ND2 2.97Å; Y290-N292 PolarHBondContact O-N 2.85Å; N292-D294 VanDerWaalsContact CB-OD1 3.22Å; N292-D294 WeakPolarHBondContact CB-OD1 3.46Å; N292-D294 PolarHBondContact O-N 3.25Å; N292-G295 PolarHBondContact O-N 2.84Å; N292-S296 PolarHBondContact N-O 3.16Å; N292-S296 PolarHBondContact ND2-OG 3.42Å
293	E	94.6	Very high	97	Very high	211 Å²	211	55 Å²	55	99%	0.986	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.3	178.7	-62.8	-173.4	162.4	0	0	113	G295	E293-G295 PolarHBondContact O-N 3.49Å
294	D	94.8	Very high	97	Very high	123 Å²	123	54.3 Å²	54.3	66%	0.658	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.5	177.3	69	-7.4	0	0	0	113.7	N292 S296	N292-D294 VanDerWaalsContact CB-OD1 3.22Å; N292-D294 WeakPolarHBondContact CB-OD1 3.46Å; N292-D294 PolarHBondContact O-N 3.25Å; D294-S296 VanDerWaalsContact OD1-CB 3.32Å; D294-S296 WeakPolarHBondContact OD1-CB 3.32Å; D294-S296 PolarHBondContact OD1-N 3.32Å; D294-S296 PolarHBondContact OD1-OG 3.03Å; D294-S296 PolarHBondContact OD2-OG 3.12Å
295	G	93.5	Very high	97	Very high	43 Å²	43	51.9 Å²	51.9	44%	0.443	25%	0.251	S	S	.	.	S	Bend	trans	87.4	-2.4	-179.1	0	0	0	0	0	115.1	N292 E293	N292-G295 PolarHBondContact O-N 2.84Å; E293-G295 PolarHBondContact O-N 3.49Å
296	S	97.2	Very high	96.9	Very high	14 Å²	14	50.5 Å²	50.5	10%	0.098	24%	0.243	C	C	.	.			trans	-72.6	162.1	171.8	68.1	0	0	0	0	111.8	Y248 R291 N292 D294	Y248-S296 CarbonylContact O-C 3.49Å; Y248-S296 VanDerWaalsContact O-CA 3.27Å; Y248-S296 WeakPolarHBondContact O-CA 3.36Å; Y248-S296 WeakPolarHBondContact O-CB 3.36Å; R291-S296 CarbonylContact C-O 3.55Å; R291-S296 WeakPolarHBondContact CA-O 3.4Å; N292-S296 PolarHBondContact N-O 3.16Å; N292-S296 PolarHBondContact ND2-OG 3.42Å; D294-S296 VanDerWaalsContact OD1-CB 3.32Å; D294-S296 WeakPolarHBondContact OD1-CB 3.32Å; D294-S296 PolarHBondContact OD1-N 3.32Å; D294-S296 PolarHBondContact OD1-OG 3.03Å; D294-S296 PolarHBondContact OD2-OG 3.12Å
297	V	97.7	Very high	96.9	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.3	171.1	-63.6	0	0	0	0	110.2	Y248 Y286 R287	Y248-V297 PolarHBondContact N-O 2.98Å; Y248-V297 PolarHBondContact O-N 3.11Å; Y286-V297 HydrophobicContact CD2-CB 3.99Å; Y286-V297 HydrophobicContact CD2-CG1 4.18Å; Y286-V297 HydrophobicContact CE2-CB 3.87Å; Y286-V297 HydrophobicContact CE2-CG2 4.31Å; R287-V297 HydrophobicContact CB-CG1 4.5Å
298	P	98	Very high	96.9	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.039	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	145.8	178.8	31.1	-33.2	0	0	0	111.7	Q245 N247 Y286 Y290	Q245-P298 HydrophobicContact CG-CB 3.76Å; N247-P298 WeakPolarHBondContact OD1-CA 3.4Å; Y286-P298 WeakPolarHBondContact CE2-O 3.25Å; Y286-P298 PolarHBondContact OH-O 2.89Å; Y290-P298 WeakPolarHBondContact O-CD 3.29Å
299	A	98	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.5	160.3	0	0	0	0	0	108.9	L194 V246 Y248 L254 Y301	L194-A299 HydrophobicContact CD2-CB 3.89Å; V246-A299 PolarHBondContact N-O 3.08Å; V246-A299 PolarHBondContact O-N 3.43Å; Y248-A299 HydrophobicContact CD2-CB 3.99Å; Y248-A299 HydrophobicContact CE2-CB 3.54Å; L254-A299 HydrophobicContact CD1-CB 3.64Å; L254-A299 HydrophobicContact CD2-CB 3.75Å; L254-A299 HydrophobicContact CG-CB 4.33Å; A299-Y301 HydrophobicContact CB-CE2 4.09Å
300	T	97.9	Very high	96.9	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.055	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.6	-179.5	-61.5	0	0	0	0	110.5	T193 L194 Y195 E196	T193-T300 CarbonylContact C-O 3.5Å; T193-T300 WeakPolarHBondContact CA-O 3.39Å; L194-T300 PolarHBondContact N-O 3.37Å; Y195-T300 HydrophobicContact CE1-CG2 4.28Å; E196-T300 VanDerWaalsContact OE1-CB 3.28Å; E196-T300 WeakPolarHBondContact OE1-CB 3.42Å; E196-T300 PolarHBondContact OE1-N 3.48Å; E196-T300 PolarHBondContact OE1-OG1 3.08Å; E196-T300 PolarHBondContact OE2-N 2.72Å
301	Y	97.6	Very high	96.7	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	105.3	173.3	-59.3	-88.6	0	0	0	108.8	L71 F189 T193 L194 E243 I244 V246 Y248 L258 A299	L71-Y301 HydrophobicContact CD1-CD2 4.3Å; L71-Y301 HydrophobicContact CD1-CG 4.3Å; L71-Y301 HydrophobicContact CD2-CD1 3.44Å; L71-Y301 VanDerWaalsContact CD2-CD1 3.44Å; L71-Y301 HydrophobicContact CD2-CD2 3.96Å; L71-Y301 HydrophobicContact CD2-CE1 3.52Å; L71-Y301 HydrophobicContact CD2-CE2 4.04Å; L71-Y301 HydrophobicContact CD2-CG 3.66Å; F189-Y301 AromaticContact CE1-CD1 3.85Å; F189-Y301 HydrophobicContact CE1-CD1 3.85Å; F189-Y301 HydrophobicContact CE1-CG 4.42Å; F189-Y301 HydrophobicContact CZ-CD1 4.04Å; T193-Y301 HydrophobicContact CG2-CD1 3.9Å; L194-Y301 HydrophobicContact CD2-CD1 4.4Å; L194-Y301 HydrophobicContact CD2-CE1 3.77Å; L194-Y301 HydrophobicContact CG-CE1 4.25Å; E243-Y301 WeakPolarHBondContact CA-O 3.17Å; I244-Y301 PolarHBondContact N-O 2.89Å; I244-Y301 WeakPolarHBondContact O-CB 3.46Å; I244-Y301 WeakPolarHBondContact O-CD2 3.39Å; I244-Y301 PolarHBondContact O-N 3.37Å; V246-Y301 HydrophobicContact CB-CE2 4.08Å; V246-Y301 HydrophobicContact CG2-CD2 4.1Å; V246-Y301 HydrophobicContact CG2-CE2 3.83Å; Y248-Y301 PolarHBondContact OH-OH 3.15Å; Y248-Y301 VanDerWaalsContact OH-OH 3.04Å; L258-Y301 HydrophobicContact CD2-CE1 4.21Å; A299-Y301 HydrophobicContact CB-CE2 4.09Å
302	Q	97.3	Very high	96.4	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.056	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	124	173.2	-173.6	179.6	70.1	0	0	108.3	F189 G190 D192 T193 T241 D242 E243 Y304	F189-Q302 CarbonylContact C-O 3.6Å; F189-Q302 WeakPolarHBondContact CA-O 3.28Å; G190-Q302 PolarHBondContact N-O 3.22Å; D192-Q302 HydrophobicContact CB-CB 4.18Å; D192-Q302 PolarHBondContact OD2-NE2 3.43Å; D192-Q302 PolarHBondContact OD2-OE1 3.44Å; T193-Q302 PolarHBondContact OG1-N 2.93Å; T193-Q302 PolarHBondContact OG1-O 3.23Å; T241-Q302 HydrophobicContact CG2-CG 3.72Å; D242-Q302 CarbonylContact O-C 3Å; D242-Q302 WeakPolarHBondContact O-CA 3.35Å; E243-Q302 HydrophobicContact CG-CG 4.42Å; Q302-Y304 HydrophobicContact CG-CD1 4.43Å; Q302-Y304 HydrophobicContact CG-CE1 3.8Å; Q302-Y304 PolarHBondContact OE1-OH 3.3Å
303	I	97.6	Very high	96	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126	-176.1	-61.7	152.3	0	0	0	108.5	V75 A187 M188 F189 T241 D242 I244 Y305	V75-I303 HydrophobicContact CG1-CG2 4.39Å; V75-I303 HydrophobicContact CG2-CD1 3.44Å; V75-I303 VanDerWaalsContact CG2-CD1 3.44Å; V75-I303 HydrophobicContact CG2-CG1 4.35Å; A187-I303 HydrophobicContact CB-CG2 4.02Å; M188-I303 WeakPolarHBondContact O-CA 3.12Å; F189-I303 HydrophobicContact CD1-CG1 4.2Å; F189-I303 HydrophobicContact CE1-CG1 4.32Å; T241-I303 WeakPolarHBondContact CA-O 3.48Å; D242-I303 PolarHBondContact N-O 3.49Å; D242-I303 PolarHBondContact O-N 2.94Å; I244-I303 HydrophobicContact CB-CD1 4.29Å; I244-I303 HydrophobicContact CD1-CD1 3.4Å; I244-I303 VanDerWaalsContact CD1-CD1 3.4Å; I244-I303 HydrophobicContact CG1-CD1 3.76Å; I303-Y305 HydrophobicContact CB-CE2 4.19Å; I303-Y305 HydrophobicContact CG2-CD2 4.14Å; I303-Y305 HydrophobicContact CG2-CE1 4.16Å; I303-Y305 HydrophobicContact CG2-CE2 3.64Å
304	Y	96.9	Very high	95.5	Very high	6 Å²	6	35.9 Å²	35.9	2%	0.024	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.7	170.8	-58	-30.8	0	0	0	109.2	A187 M188 G191 T220 V222 L225 D240 T241 Q302	A187-Y304 VanDerWaalsContact CA-O 3.26Å; A187-Y304 WeakPolarHBondContact CA-O 3.44Å; M188-Y304 HydrophobicContact CG-CD2 4.46Å; M188-Y304 PolarHBondContact N-O 3.12Å; M188-Y304 PolarHBondContact O-N 2.74Å; G191-Y304 PolarHBondContact N-OH 2.84Å; T220-Y304 VanDerWaalsContact O-CE2 3.29Å; T220-Y304 WeakPolarHBondContact O-CE2 3.33Å; V222-Y304 HydrophobicContact CB-CD1 4.34Å; V222-Y304 HydrophobicContact CB-CE1 3.78Å; V222-Y304 HydrophobicContact CB-CE2 4.14Å; V222-Y304 HydrophobicContact CG2-CD1 4.34Å; V222-Y304 HydrophobicContact CG2-CE1 4.22Å; V222-Y304 PolarHBondContact N-OH 2.89Å; L225-Y304 HydrophobicContact CD1-CD2 3.35Å; L225-Y304 HydrophobicContact CD1-CE2 4.22Å; L225-Y304 HydrophobicContact CD1-CG 3.74Å; L225-Y304 HydrophobicContact CG-CD2 4.36Å; D240-Y304 WeakPolarHBondContact O-CA 3.31Å; T241-Y304 HydrophobicContact CG2-CD1 3.86Å; T241-Y304 HydrophobicContact CG2-CE1 3.72Å; T241-Y304 WeakPolarHBondContact OG1-CD1 3.21Å; Q302-Y304 HydrophobicContact CG-CD1 4.43Å; Q302-Y304 HydrophobicContact CG-CE1 3.8Å; Q302-Y304 PolarHBondContact OE1-OH 3.3Å
305	Y	97.6	Very high	95	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.1	168.7	-66.1	-81.5	0	0	0	109	V75 R78 I79 G186 A187 V239 D240 D242 I303	V75-Y305 HydrophobicContact CG1-CE1 4.14Å; R78-Y305 HydrophobicContact CB-CE1 4.06Å; R78-Y305 WeakPolarHBondContact CD-OH 3.26Å; I79-Y305 HydrophobicContact CG1-CE1 4.31Å; G186-Y305 CarbonylContact O-C 3.54Å; G186-Y305 WeakPolarHBondContact O-CA 3.25Å; A187-Y305 HydrophobicContact CB-CD1 3.85Å; A187-Y305 HydrophobicContact CB-CE1 3.77Å; V239-Y305 CarbonylContact C-O 3.57Å; V239-Y305 WeakPolarHBondContact CA-O 3.31Å; D240-Y305 PolarHBondContact N-O 3.4Å; D240-Y305 PolarHBondContact O-N 3.38Å; D242-Y305 HydrophobicContact CB-CD2 4.17Å; D242-Y305 HydrophobicContact CB-CE2 3.72Å; I303-Y305 HydrophobicContact CB-CE2 4.19Å; I303-Y305 HydrophobicContact CG2-CD2 4.14Å; I303-Y305 HydrophobicContact CG2-CE1 4.16Å; I303-Y305 HydrophobicContact CG2-CE2 3.64Å
306	M	96.5	Very high	94.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.3	178.7	61.4	-162.2	78.9	0	0	111.1	F184 I185 G186 M188 L225 L229 T238	F184-M306 HydrophobicContact CD1-CG 4.47Å; F184-M306 HydrophobicContact CE1-CG 3.69Å; F184-M306 HydrophobicContact CE1-SD 3.69Å; F184-M306 HydrophobicContact CZ-CG 4.2Å; F184-M306 HydrophobicContact CZ-SD 4.13Å; I185-M306 CarbonylContact C-O 3.54Å; I185-M306 WeakPolarHBondContact CA-O 3.45Å; G186-M306 PolarHBondContact N-O 2.86Å; G186-M306 PolarHBondContact O-N 3.47Å; M188-M306 HydrophobicContact CG-CE 3.59Å; M188-M306 HydrophobicContact SD-CE 3.64Å; L225-M306 HydrophobicContact CD1-CE 3.84Å; L225-M306 HydrophobicContact CD2-CE 4.19Å; L229-M306 HydrophobicContact CD1-CB 3.89Å; L229-M306 HydrophobicContact CD1-SD 4.45Å; L229-M306 HydrophobicContact CD2-SD 4.36Å; T238-M306 CarbonylContact O-C 3.53Å; T238-M306 WeakPolarHBondContact O-CA 3.49Å
307	I	97.4	Very high	93.1	Very high	27 Å²	27	42.4 Å²	42.4	14%	0.138	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.7	170.5	-55.4	178.3	0	0	0	107.3	R82 V183 F184 I185 L237 T238	R82-I307 HydrophobicContact CB-CD1 4.44Å; R82-I307 HydrophobicContact CG-CD1 4.49Å; V183-I307 HydrophobicContact CG2-CG2 3.8Å; F184-I307 WeakPolarHBondContact O-CA 3.37Å; I185-I307 HydrophobicContact CG1-CG1 4.34Å; I185-I307 HydrophobicContact CG1-CG2 4.45Å; I185-I307 HydrophobicContact CG2-CG1 4.35Å; L237-I307 WeakPolarHBondContact CA-O 3.45Å; T238-I307 PolarHBondContact N-O 2.99Å; T238-I307 PolarHBondContact O-N 2.8Å
308	G	96.9	Very high	91.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	135	177.5	0	0	0	0	0	110.7	F184	F184-G308 PolarHBondContact N-O 2.88Å; F184-G308 PolarHBondContact O-N 3.5Å
309	W	97.1	Very high	90.4	Very high	44 Å²	44	51.6 Å²	51.6	17%	0.167	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	148.1	-179.4	-66.1	76.5	0	0	0	110.5	I86 R88 V183 F234 N235	I86-W309 HydrophobicContact CD1-CH2 4.06Å; I86-W309 HydrophobicContact CD1-CZ2 3.81Å; I86-W309 HydrophobicContact CG1-CZ2 4.3Å; I86-W309 HydrophobicContact CG2-CH2 3.78Å; I86-W309 HydrophobicContact CG2-CZ2 4.34Å; R88-W309 VanDerWaalsContact CZ-CZ3 3.42Å; V183-W309 HydrophobicContact CB-CD2 4.02Å; V183-W309 HydrophobicContact CB-CE3 4Å; V183-W309 HydrophobicContact CB-CH2 4.22Å; V183-W309 HydrophobicContact CB-CZ2 4.21Å; V183-W309 HydrophobicContact CB-CZ3 4.15Å; V183-W309 HydrophobicContact CG2-CD2 3.86Å; V183-W309 HydrophobicContact CG2-CE3 4.35Å; V183-W309 HydrophobicContact CG2-CG 4.29Å; V183-W309 HydrophobicContact CG2-CH2 4.36Å; V183-W309 HydrophobicContact CG2-CZ2 3.84Å; F234-W309 CarbonylContact C-O 3.56Å; F234-W309 VanDerWaalsContact CA-O 3.24Å; F234-W309 WeakPolarHBondContact CA-O 3.33Å; N235-W309 PolarHBondContact N-O 3.31Å; N235-W309 PolarHBondContact O-N 2.65Å; N235-W309 VanDerWaalsContact OD1-CB 3.24Å; N235-W309 WeakPolarHBondContact OD1-CB 3.43Å; N235-W309 PolarHBondContact OD1-O 3.23Å
310	K	96.9	Very high	89.2	Confident	27 Å²	27	59.7 Å²	59.7	12%	0.117	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.4	164.5	-178.4	160.5	-173.8	175.5	0	108.4	N150 H175 Y176 L178 K179 D181 G182 H312 Q315	N150-K310 PolarHBondContact OD1-NZ 3.12Å; H175-K310 WeakPolarHBondContact O-CD 3.29Å; H175-K310 PolarHBondContact O-NZ 3.28Å; Y176-K310 PolarHBondContact O-NZ 3.31Å; L178-K310 HydrophobicContact CB-CB 4.26Å; L178-K310 HydrophobicContact CB-CD 3.93Å; L178-K310 WeakPolarHBondContact O-CD 3.1Å; L178-K310 WeakPolarHBondContact O-CE 3.35Å; L178-K310 PolarHBondContact O-NZ 2.78Å; K179-K310 WeakPolarHBondContact O-CD 3.05Å; D181-K310 WeakPolarHBondContact CA-O 3.28Å; D181-K310 PolarHBondContact N-O 2.92Å; D181-K310 VanDerWaalsContact N-O 3.12Å; G182-K310 PolarHBondContact O-N 3.45Å; K310-H312 PolarHBondContact O-N 3.15Å; K310-Q315 PolarHBondContact O-NE2 3.37Å
311	Y	93.8	Very high	87.5	Confident	129 Å²	129	71.8 Å²	71.8	51%	0.506	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-55.6	137.4	-176.8	178	-99.1	0	0	0	112.3	N235 E313	N235-Y311 PolarHBondContact OD1-N 3.14Å; Y311-E313 HydrophobicContact CE1-CG 4.43Å
312	H	92	Very high	86.3	Confident	77 Å²	77	75.4 Å²	75.4	36%	0.356	40%	0.396	S	S	.	.			trans	-149	150.3	166	-174.7	-110	0	0	0	110.2	P180 D181 K310 S314 Q315	P180-H312 HydrophobicContact CB-CB 3.97Å; P180-H312 VanDerWaalsContact CB-CD2 3.41Å; P180-H312 WeakPolarHBondContact CB-CD2 3.15Å; D181-H312 HydrophobicContact CB-CB 3.77Å; K310-H312 PolarHBondContact O-N 3.15Å; H312-S314 VanDerWaalsContact ND1-CB 3.34Å; H312-S314 WeakPolarHBondContact ND1-CB 3.32Å; H312-S314 PolarHBondContact ND1-N 2.97Å; H312-S314 PolarHBondContact ND1-OG 3.34Å; H312-S314 PolarHBondContact O-N 2.8Å; H312-Q315 WeakPolarHBondContact O-CB 3.35Å; H312-Q315 WeakPolarHBondContact O-CG 3.27Å; H312-Q315 PolarHBondContact O-N 3.5Å; H312-Q315 VanDerWaalsContact O-N 3.11Å
313	E	87.2	Confident	85.1	Confident	150 Å²	150	77.9 Å²	77.9	70%	0.701	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.2	-175.6	-62.8	-174.2	168.7	0	0	113.6	Y311 Q315	Y311-E313 HydrophobicContact CE1-CG 4.43Å; E313-Q315 PolarHBondContact O-N 2.97Å
314	S	84.6	Confident	83.7	Confident	80 Å²	80	82.1 Å²	82.1	56%	0.559	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-10.7	177.1	70.4	0	0	0	0	114	H312	H312-S314 VanDerWaalsContact ND1-CB 3.34Å; H312-S314 WeakPolarHBondContact ND1-CB 3.32Å; H312-S314 PolarHBondContact ND1-N 2.97Å; H312-S314 PolarHBondContact ND1-OG 3.34Å; H312-S314 PolarHBondContact O-N 2.8Å
315	Q	84.3	Confident	82.6	Confident	30 Å²	30	88.2 Å²	88.2	14%	0.14	49%	0.488	C	S	.	.	S	Bend	trans	-68.4	141.5	-178.8	-71.9	173.2	-17.1	0	0	111	D181 N235 K310 H312 E313 R317	D181-Q315 WeakPolarHBondContact OD1-CG 3.35Å; D181-Q315 PolarHBondContact OD1-NE2 3.11Å; N235-Q315 PolarHBondContact ND2-OE1 3.46Å; K310-Q315 PolarHBondContact O-NE2 3.37Å; H312-Q315 WeakPolarHBondContact O-CB 3.35Å; H312-Q315 WeakPolarHBondContact O-CG 3.27Å; H312-Q315 PolarHBondContact O-N 3.5Å; H312-Q315 VanDerWaalsContact O-N 3.11Å; E313-Q315 PolarHBondContact O-N 2.97Å; Q315-R317 PolarHBondContact O-N 3.45Å; Q315-R317 VanDerWaalsContact O-N 3.11Å
316	A	76.2	Confident	81.4	Confident	99 Å²	99	91.3 Å²	91.3	82%	0.818	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-58.9	118.6	176	0	0	0	0	0	109.5
317	R	73.3	Confident	80.4	Confident	188 Å²	188	94.9 Å²	94.9	71%	0.709	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-75.6	136.1	174.6	-65.6	-175.9	-176.4	-175.6	-0.2	108.7	Q315 A319	Q315-R317 PolarHBondContact O-N 3.45Å; Q315-R317 VanDerWaalsContact O-N 3.11Å; R317-A319 PolarHBondContact O-N 3.21Å
318	P	69.9	Low	78.9	Confident	124 Å²	124	102.4 Å²	102.4	81%	0.805	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-52.6	136.5	168.9	-23.3	32.6	0	0	0	109.5
319	A	69.6	Low	77.8	Confident	77 Å²	77	105.8 Å²	105.8	64%	0.636	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.6	149.7	174.9	0	0	0	0	0	109.9	R317 R321 S323	R317-A319 PolarHBondContact O-N 3.21Å; A319-R321 PolarHBondContact O-N 3.14Å; A319-S323 VanDerWaalsContact CB-OG 3.26Å; A319-S323 WeakPolarHBondContact CB-OG 3.39Å
320	E	73	Confident	76.6	Confident	170 Å²	170	107.6 Å²	107.6	79%	0.794	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-57.8	137.4	-179.1	-68.2	-169.7	166	0	0	110.8	G322 S323	E320-G322 PolarHBondContact O-N 2.83Å; E320-S323 VanDerWaalsContact O-CB 3.25Å; E320-S323 WeakPolarHBondContact O-CB 3.49Å; E320-S323 PolarHBondContact O-N 3.24Å; E320-S323 PolarHBondContact O-OG 3.05Å
321	R	61.7	Low	75.2	Confident	264 Å²	264	111 Å²	111	100%	0.996	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	115.4	-179	-171.5	178	-176.9	179.8	1.5	109.5	A319	A319-R321 PolarHBondContact O-N 3.14Å
322	G	71.6	Confident	74	Confident	76 Å²	76	108.8 Å²	108.8	78%	0.784	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	105	-0.9	-175.9	0	0	0	0	0	114.9	E320 A324	E320-G322 PolarHBondContact O-N 2.83Å; G322-A324 PolarHBondContact O-N 2.79Å
323	S	72.3	Confident	72.8	Confident	64 Å²	64	111.4 Å²	111.4	45%	0.448	66%	0.655	S	S	.	*			trans	-77.1	8.2	174.8	73.7	0	0	0	0	114.2	A319 E320 T325	A319-S323 VanDerWaalsContact CB-OG 3.26Å; A319-S323 WeakPolarHBondContact CB-OG 3.39Å; E320-S323 VanDerWaalsContact O-CB 3.25Å; E320-S323 WeakPolarHBondContact O-CB 3.49Å; E320-S323 PolarHBondContact O-N 3.24Å; E320-S323 PolarHBondContact O-OG 3.05Å; S323-T325 PolarHBondContact O-N 3.43Å; S323-T325 VanDerWaalsContact O-N 3.17Å
324	A	70.1	Confident	71.6	Confident	89 Å²	89	107 Å²	107	74%	0.736	64%	0.636	S	S	*	*			trans	-71.8	108.1	179.5	0	0	0	0	0	109.4	G322	G322-A324 PolarHBondContact O-N 2.79Å
325	T	73.6	Confident	70.4	Confident	134 Å²	134	110.2 Å²	110.2	82%	0.822	65%	0.647	S	S	*	*			trans	-87.3	-10.2	-178.3	44.4	0	0	0	0	113.8	S323	S323-T325 PolarHBondContact O-N 3.43Å; S323-T325 VanDerWaalsContact O-N 3.17Å
326	V	72.1	Confident	69.2	Low	66 Å²	66	115.8 Å²	115.8	40%	0.4	68%	0.678	S	S	.	*	S	Bend	trans	-133.7	133	-175.1	-173.9	0	0	0	0	109.8	E330	V326-E330 HydrophobicContact CG1-CB 4.06Å
327	S	74.6	Confident	68.2	Low	78 Å²	78	116.2 Å²	116.2	55%	0.545	67%	0.666	S	S	.	*			trans	-83.5	147.1	175.8	174.7	0	0	0	0	111.2	G329 E330	S327-G329 PolarHBondContact O-N 3.29Å; S327-G329 VanDerWaalsContact O-N 3.09Å; S327-G329 PolarHBondContact OG-N 2.62Å; S327-E330 WeakPolarHBondContact O-CB 3.33Å; S327-E330 PolarHBondContact O-N 3.29Å
328	F	65.5	Low	67.1	Low	184 Å²	184	113.6 Å²	113.6	81%	0.807	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-55.4	-26.7	174.4	-87	-86.5	0	0	0	113.3	E330 L331	F328-E330 PolarHBondContact O-N 3.16Å; F328-L331 HydrophobicContact CD1-CD1 3.83Å; F328-L331 WeakPolarHBondContact O-CD1 3.34Å; F328-L331 VanDerWaalsContact O-CG 3.23Å; F328-L331 WeakPolarHBondContact O-CG 3.47Å; F328-L331 PolarHBondContact O-N 2.95Å
329	G	75.4	Confident	66.1	Low	72 Å²	72	113.5 Å²	113.5	74%	0.742	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-70.1	-13.8	175	0	0	0	0	0	114.5	S327	S327-G329 PolarHBondContact O-N 3.29Å; S327-G329 VanDerWaalsContact O-N 3.09Å; S327-G329 PolarHBondContact OG-N 2.62Å
330	E	71.2	Confident	65	Low	82 Å²	82	119 Å²	119	38%	0.383	68%	0.675	S	S	.	*	G	3₁₀ helix	trans	-99.8	3.5	-178.4	-59.8	-171.8	141.9	0	0	113.1	V326 S327 F328 G332 K333	V326-E330 HydrophobicContact CG1-CB 4.06Å; S327-E330 WeakPolarHBondContact O-CB 3.33Å; S327-E330 PolarHBondContact O-N 3.29Å; F328-E330 PolarHBondContact O-N 3.16Å; E330-G332 PolarHBondContact O-N 3.27Å; E330-G332 VanDerWaalsContact O-N 3.12Å; E330-K333 PolarHBondContact O-N 2.93Å
331	L	67.4	Low	63.4	Low	99 Å²	99	114.2 Å²	114.2	52%	0.518	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-53.1	-35.7	179.5	-74.1	173.7	0	0	0	112.7	F328 K333 I334	F328-L331 HydrophobicContact CD1-CD1 3.83Å; F328-L331 WeakPolarHBondContact O-CD1 3.34Å; F328-L331 VanDerWaalsContact O-CG 3.23Å; F328-L331 WeakPolarHBondContact O-CG 3.47Å; F328-L331 PolarHBondContact O-N 2.95Å; L331-K333 PolarHBondContact O-N 3.38Å; L331-I334 HydrophobicContact CB-CD1 4.33Å; L331-I334 HydrophobicContact CD2-CD1 3.4Å; L331-I334 HydrophobicContact CG-CD1 4.38Å; L331-I334 WeakPolarHBondContact O-CB 3.2Å; L331-I334 WeakPolarHBondContact O-CG1 3.28Å; L331-I334 PolarHBondContact O-N 3.33Å
332	G	69	Low	62.3	Low	82 Å²	82	111.2 Å²	111.2	85%	0.845	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-67.9	-12.4	176.6	0	0	0	0	0	115.1	E330	E330-G332 PolarHBondContact O-N 3.27Å; E330-G332 VanDerWaalsContact O-N 3.12Å
333	K	65.4	Low	60.7	Low	131 Å²	131	117.5 Å²	117.5	57%	0.57	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-105.7	0.5	179.6	-61.3	179.5	-175	172.4	0	113.2	E330 L331 N335 N336	E330-K333 PolarHBondContact O-N 2.93Å; L331-K333 PolarHBondContact O-N 3.38Å; K333-N335 PolarHBondContact O-N 2.93Å; K333-N336 WeakPolarHBondContact O-CB 3.2Å; K333-N336 PolarHBondContact O-N 3.01Å
334	I	62	Low	59.1	Low	59 Å²	59	119.9 Å²	119.9	30%	0.303	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-58.6	-32.2	-175.1	-75.2	178.1	0	0	0	113	L331 N336 L337 M338	L331-I334 HydrophobicContact CB-CD1 4.33Å; L331-I334 HydrophobicContact CD2-CD1 3.4Å; L331-I334 HydrophobicContact CG-CD1 4.38Å; L331-I334 WeakPolarHBondContact O-CB 3.2Å; L331-I334 WeakPolarHBondContact O-CG1 3.28Å; L331-I334 PolarHBondContact O-N 3.33Å; I334-N336 PolarHBondContact O-N 3.33Å; I334-N336 VanDerWaalsContact O-N 3.09Å; I334-L337 PolarHBondContact O-N 3.11Å; I334-M338 HydrophobicContact CG2-CE 4.26Å
335	N	59.2	Low	57.4	Low	147 Å²	147	128.3 Å²	128.3	79%	0.786	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-60.6	-20.5	175.9	-78.1	-10.5	0	0	0	113.6	K333	K333-N335 PolarHBondContact O-N 2.93Å
336	N	59.8	Low	56.6	Low	146 Å²	146	128.1 Å²	128.1	78%	0.781	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-94.3	-8.7	177.9	-65.2	-23.5	0	0	0	113.6	K333 I334	K333-N336 WeakPolarHBondContact O-CB 3.2Å; K333-N336 PolarHBondContact O-N 3.01Å; I334-N336 PolarHBondContact O-N 3.33Å; I334-N336 VanDerWaalsContact O-N 3.09Å
337	L	55.2	Low	55.8	Low	108 Å²	108	131.3 Å²	131.3	57%	0.565	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-9.8	-174.5	-74.8	160.9	0	0	0	113.4	I334	I334-L337 PolarHBondContact O-N 3.11Å
338	M	49.7	Very low	54.7	Low	133 Å²	133	134.3 Å²	134.3	66%	0.655	73%	0.732	S	S	*	*	S	Bend	trans	-78.2	121.6	173.1	-65.6	-112.4	-159.6	0	0	109.8	I334 Q340	I334-M338 HydrophobicContact CG2-CE 4.26Å; M338-Q340 PolarHBondContact O-N 2.91Å
339	P	49.5	Very low	54.1	Low	122 Å²	122	131.4 Å²	131.4	79%	0.792	73%	0.728	S	S	*	*			trans	-64	121.8	170.7	-5.5	17.9	0	0	0	108.3	G341	P339-G341 PolarHBondContact O-N 3.4Å
340	Q	46.7	Very low	52.8	Low	194 Å²	194	135.1 Å²	135.1	91%	0.907	73%	0.727	S	S	*	*			trans	-61.9	105.1	169.4	-71	-147.3	-2.7	0	0	108.6	M338 K342	M338-Q340 PolarHBondContact O-N 2.91Å; Q340-K342 PolarHBondContact O-N 3.29Å
341	G	39.8	Very low	51.5	Low	68 Å²	68	138.6 Å²	138.6	70%	0.701	75%	0.75	S	S	*	*			trans	-53.9	125.2	173.6	0	0	0	0	0	109.8	P339 K343	P339-G341 PolarHBondContact O-N 3.4Å; G341-K343 PolarHBondContact O-N 3.19Å; G341-K343 VanDerWaalsContact O-N 3.1Å
342	K	38.8	Very low	50.4	Low	202 Å²	202	141.4 Å²	141.4	88%	0.878	77%	0.766	S	S	*	*			trans	-50.1	115.4	173.4	-76.5	177.1	174.7	177.4	0	109.5	Q340 S344	Q340-K342 PolarHBondContact O-N 3.29Å; K342-S344 PolarHBondContact O-N 3.18Å
343	K	37.7	Very low	49	Very low	207 Å²	207	146 Å²	146	90%	0.9	76%	0.76	S	S	*	*			trans	-67.4	107.7	159.1	-73.7	-177.5	176.9	-179.4	0	107.4	G341	G341-K343 PolarHBondContact O-N 3.19Å; G341-K343 VanDerWaalsContact O-N 3.1Å
344	S	37.3	Very low	47.6	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	78%	0.776	S	S	*	*			trans	-79.7	131.5	162.7	-66.3	0	0	0	0	108.6	K342	K342-S344 PolarHBondContact O-N 3.18Å
345	Q	35.4	Very low	46.3	Very low	266 Å²	266	155.3 Å²	155.3	100%	1.243	82%	0.819	S	S	*	*			trans	-65.8	0	172.7	-72.1	177.1	-28.3	0	0	112.3

Retrieved 345 of 345 residues in 866.4 ms (Link to these results)

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