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Isoform b of cAMP-dependent protein kinase catalytic subunit AlphaSync

Canonical isoform description: Essential for larval development¹. Controls the rhythmic contraction of enteric muscles probably by regulating G-protein coupled receptor aex-2-mediated calcium influx in GABAergic DVB neurons². Plays a role in the control of oocyte meiotic maturation by gonadal sheath cells³. Isoforms a and b: May play a role in the regulation of neuromuscular junctions.

AlphaFold DB , UniProt , Accession P21137-3 (canonical: P21137), Species CAEEL (Caenorhabditis elegans), Gene kin-1, Length 375 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.1	Very low	30.6	Very low	240 Å²	240	162.7 Å²	162.7	100%	1.182	83%	0.834	S	S	*	*				0	85.6	0	-173.3	-168.2	-81.2	0	0	108
2	L	28.4	Very low	31	Very low	163 Å²	163	157.5 Å²	157.5	85%	0.853	80%	0.804	S	S	*	*			cis	-151.3	127.3	0.8	-123.1	132.9	0	0	0	105.8
3	K	26.3	Very low	31.5	Very low	188 Å²	188	149.7 Å²	149.7	82%	0.817	79%	0.786	S	S	*	*			trans	-71.2	135.2	160.6	-80.1	176	174.1	176.6	0	106.6
4	F	27.6	Very low	31.9	Very low	192 Å²	192	144.9 Å²	144.9	84%	0.842	77%	0.772	S	S	*	*			trans	168.9	139	133.3	-93.6	-67.3	0	0	0	111.6
5	L	27.6	Very low	32.7	Very low	163 Å²	163	139.8 Å²	139.8	85%	0.853	75%	0.752	S	S	*	*			trans	93.2	107	160.7	-59.8	163.3	0	0	0	119.4
6	K	27.7	Very low	33.4	Very low	170 Å²	170	138.1 Å²	138.1	74%	0.739	74%	0.736	S	S	*	*			trans	-141.5	162.3	133	-105.2	-166.6	175.1	-167.5	0	108
7	P	36.1	Very low	34.2	Very low	108 Å²	108	136.6 Å²	136.6	70%	0.701	73%	0.728	S	S	*	*			cis	-137.8	167.7	-15.5	32.1	-12	0	0	0	113.8
8	K	31.4	Very low	35.1	Very low	203 Å²	203	135.5 Å²	135.5	88%	0.883	72%	0.722	S	S	*	*			trans	-127.7	127.3	149.9	-99.3	-171.3	177.3	-178.3	0	109.1
9	S	35.1	Very low	36	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	72%	0.721	S	S	*	*			trans	-87.9	113.7	-179.8	48.9	0	0	0	0	111
10	S	31.2	Very low	37.1	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	70%	0.704	S	S	*	*	S	Bend	trans	172.4	128.7	152.2	47.5	0	0	0	0	107.4
11	D	36.6	Very low	38.1	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	69%	0.693	S	S	*	*			trans	78.9	39.9	-178.3	-72.7	-13	0	0	0	120
12	E	35.4	Very low	39.6	Very low	100 Å²	100	121.2 Å²	121.2	47%	0.467	66%	0.655	S	S	.	*	H	α-helix	trans	-84.3	-1.7	173.1	-82.5	-158.9	-168.2	0	0	115.7	K16	E12-K16 IonicContact OE2-NZ 2.82Å; E12-K16 PolarHBondContact OE2-NZ 3.07Å
13	G	36.7	Very low	41.8	Very low	56 Å²	56	116.3 Å²	116.3	58%	0.577	63%	0.634	S	S	*	*	H	α-helix	trans	-73.4	-50.6	-178.1	0	0	0	0	0	114.3
14	S	37.8	Very low	44.1	Very low	83 Å²	83	109.8 Å²	109.8	58%	0.58	61%	0.608	S	S	*	*	H	α-helix	trans	-83.3	-26.9	-174.1	70.7	0	0	0	0	113.8	N18	S14-N18 WeakPolarHBondContact O-CB 3.45Å; S14-N18 PolarHBondContact O-N 3.29Å
15	S	43.3	Very low	46.6	Very low	68 Å²	68	107.2 Å²	107.2	48%	0.476	60%	0.597	S	S	.	*	H	α-helix	trans	-75	-33.8	-173.9	-58.7	0	0	0	0	113.4	K19	S15-K19 WeakPolarHBondContact O-CB 3.49Å; S15-K19 WeakPolarHBondContact O-CG 3.21Å; S15-K19 PolarHBondContact O-N 3.31Å
16	K	43.9	Very low	49.3	Very low	113 Å²	113	106.1 Å²	106.1	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-74.1	-44.2	177.7	-99.3	170.2	176.5	153.5	0	111.5	E12 N18 K19 N20	E12-K16 IonicContact OE2-NZ 2.82Å; E12-K16 PolarHBondContact OE2-NZ 3.07Å; K16-N18 VanDerWaalsContact C-N 3.33Å; K16-N18 PolarHBondContact O-N 3.36Å; K16-K19 PolarHBondContact O-N 3.45Å; K16-N20 VanDerWaalsContact O-CB 3.28Å; K16-N20 WeakPolarHBondContact O-CB 3.21Å; K16-N20 VanDerWaalsContact O-CG 3.23Å; K16-N20 PolarHBondContact O-N 3.25Å
17	D	47.4	Very low	52.1	Low	113 Å²	113	101 Å²	101	60%	0.604	57%	0.565	S	S	*	*	H	α-helix	trans	-64.5	-38.9	178.9	-71	-15.8	0	0	0	111.6	S21	D17-S21 WeakPolarHBondContact O-CB 3.14Å; D17-S21 PolarHBondContact O-N 2.67Å
18	N	49.4	Very low	54.6	Low	116 Å²	116	96.9 Å²	96.9	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-67.6	-40.2	173.8	-101.5	-7	0	0	0	113.4	S14 K16 S21 A22	S14-N18 WeakPolarHBondContact O-CB 3.45Å; S14-N18 PolarHBondContact O-N 3.29Å; K16-N18 VanDerWaalsContact C-N 3.33Å; K16-N18 PolarHBondContact O-N 3.36Å; N18-S21 PolarHBondContact O-OG 3.06Å; N18-A22 VanDerWaalsContact O-CB 3.3Å; N18-A22 WeakPolarHBondContact O-CB 3.42Å; N18-A22 PolarHBondContact O-N 2.97Å
19	K	53.1	Low	57.3	Low	160 Å²	160	90.4 Å²	90.4	70%	0.696	51%	0.512	S	S	*	.	H	α-helix	trans	-67	-40.2	176.3	-83.1	-176.9	175.5	-179.4	0	112.3	S15 K16 A22 S23	S15-K19 WeakPolarHBondContact O-CB 3.49Å; S15-K19 WeakPolarHBondContact O-CG 3.21Å; S15-K19 PolarHBondContact O-N 3.31Å; K16-K19 PolarHBondContact O-N 3.45Å; K19-A22 PolarHBondContact O-N 3.33Å; K19-S23 PolarHBondContact O-N 3.41Å
20	N	57.4	Low	60.1	Low	72 Å²	72	91.6 Å²	91.6	39%	0.385	50%	0.503	S	S	.	.	H	α-helix	trans	-68.2	-40.5	178.6	-76.3	-9.9	0	0	0	111.9	K16 S23 L24 I312	K16-N20 VanDerWaalsContact O-CB 3.28Å; K16-N20 WeakPolarHBondContact O-CB 3.21Å; K16-N20 VanDerWaalsContact O-CG 3.23Å; K16-N20 PolarHBondContact O-N 3.25Å; N20-S23 PolarHBondContact O-N 2.92Å; N20-S23 PolarHBondContact O-OG 3.11Å; N20-S23 VanDerWaalsContact O-OG 3.14Å; N20-L24 PolarHBondContact O-N 3.3Å; N20-L24 VanDerWaalsContact O-N 3.09Å; N20-I312 HydrophobicContact CB-CD1 3.64Å; N20-I312 WeakPolarHBondContact OD1-CD1 3.49Å
21	S	58.5	Low	62.9	Low	69 Å²	69	86.9 Å²	86.9	48%	0.483	47%	0.471	S	S	.	.	H	α-helix	trans	-68.8	-38.7	176.4	87	0	0	0	0	111.9	D17 N18 L24 K25	D17-S21 WeakPolarHBondContact O-CB 3.14Å; D17-S21 PolarHBondContact O-N 2.67Å; N18-S21 PolarHBondContact O-OG 3.06Å; S21-L24 PolarHBondContact O-N 3.12Å; S21-K25 WeakPolarHBondContact O-CB 3.32Å; S21-K25 PolarHBondContact O-N 3.09Å
22	A	60.9	Low	65.7	Low	46 Å²	46	85.5 Å²	85.5	38%	0.38	46%	0.455	S	S	.	.	H	α-helix	trans	-61	-45.2	174	0	0	0	0	0	111.4	N18 K19 L24 K25 E26	N18-A22 VanDerWaalsContact O-CB 3.3Å; N18-A22 WeakPolarHBondContact O-CB 3.42Å; N18-A22 PolarHBondContact O-N 2.97Å; K19-A22 PolarHBondContact O-N 3.33Å; A22-L24 PolarHBondContact O-N 2.67Å; A22-K25 PolarHBondContact O-N 3.21Å; A22-E26 WeakPolarHBondContact O-CG 3.29Å; A22-E26 PolarHBondContact O-N 3.17Å
23	S	75.2	Confident	68.5	Low	59 Å²	59	84.9 Å²	84.9	41%	0.413	45%	0.452	S	S	.	.	H	α-helix	trans	-67.1	-35.2	179.9	81	0	0	0	0	112.9	K19 N20 F27	K19-S23 PolarHBondContact O-N 3.41Å; N20-S23 PolarHBondContact O-N 2.92Å; N20-S23 PolarHBondContact O-OG 3.11Å; N20-S23 VanDerWaalsContact O-OG 3.14Å; S23-F27 WeakPolarHBondContact O-CB 3.33Å; S23-F27 PolarHBondContact O-N 3.33Å
24	L	74.9	Confident	71.3	Confident	51 Å²	51	85.6 Å²	85.6	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-69.9	-40.3	176.6	-178.1	62.5	0	0	0	111.4	N20 S21 A22 F27 L28	N20-L24 PolarHBondContact O-N 3.3Å; N20-L24 VanDerWaalsContact O-N 3.09Å; S21-L24 PolarHBondContact O-N 3.12Å; A22-L24 PolarHBondContact O-N 2.67Å; L24-F27 HydrophobicContact CD1-CD1 4.31Å; L24-F27 WeakPolarHBondContact O-CB 3.27Å; L24-F27 PolarHBondContact O-N 3.28Å; L24-L28 HydrophobicContact CD1-CG 4.48Å; L24-L28 HydrophobicContact CG-CD1 4.38Å; L24-L28 WeakPolarHBondContact O-CG 3.43Å; L24-L28 PolarHBondContact O-N 3.34Å
25	K	78.5	Confident	74.1	Confident	139 Å²	139	81.7 Å²	81.7	60%	0.604	42%	0.415	S	S	*	.	H	α-helix	trans	-63	-46.9	176.2	-173.6	-180	176	-173.8	0	111.4	S21 A22 F27 L28 D29	S21-K25 WeakPolarHBondContact O-CB 3.32Å; S21-K25 PolarHBondContact O-N 3.09Å; A22-K25 PolarHBondContact O-N 3.21Å; K25-F27 VanDerWaalsContact C-N 3.28Å; K25-F27 PolarHBondContact O-N 3.29Å; K25-L28 PolarHBondContact O-N 3Å; K25-D29 PolarHBondContact O-N 3.05Å
26	E	84.7	Confident	76.6	Confident	140 Å²	140	82.6 Å²	82.6	65%	0.654	41%	0.41	S	S	*	.	H	α-helix	trans	-58.3	-41.6	174.7	-74.4	173.7	178.7	0	0	111.8	A22 D29 K30	A22-E26 WeakPolarHBondContact O-CG 3.29Å; A22-E26 PolarHBondContact O-N 3.17Å; E26-D29 PolarHBondContact O-N 3.02Å; E26-K30 PolarHBondContact O-N 2.77Å
27	F	86.1	Confident	79.2	Confident	61 Å²	61	81.6 Å²	81.6	27%	0.268	41%	0.407	S	S	.	.	H	α-helix	trans	-60	-49.3	173.9	170.8	-94.7	0	0	0	111.9	S23 L24 K25 D29 K30 A31 F109 Y315	S23-F27 WeakPolarHBondContact O-CB 3.33Å; S23-F27 PolarHBondContact O-N 3.33Å; L24-F27 HydrophobicContact CD1-CD1 4.31Å; L24-F27 WeakPolarHBondContact O-CB 3.27Å; L24-F27 PolarHBondContact O-N 3.28Å; K25-F27 VanDerWaalsContact C-N 3.28Å; K25-F27 PolarHBondContact O-N 3.29Å; F27-D29 VanDerWaalsContact C-N 3.33Å; F27-D29 PolarHBondContact O-N 2.83Å; F27-K30 PolarHBondContact O-N 3.14Å; F27-A31 HydrophobicContact CE1-CB 4.43Å; F27-A31 HydrophobicContact CZ-CB 4.4Å; F27-A31 VanDerWaalsContact O-CB 3.32Å; F27-A31 WeakPolarHBondContact O-CB 3.34Å; F27-A31 PolarHBondContact O-N 2.67Å; F27-F109 HydrophobicContact CE1-CD2 4.23Å; F27-F109 AromaticContact CE1-CE2 3.85Å; F27-F109 HydrophobicContact CE1-CE2 3.85Å; F27-F109 HydrophobicContact CZ-CD2 4.23Å; F27-F109 HydrophobicContact CZ-CE2 4.19Å; F27-Y315 HydrophobicContact CE1-CE2 4.3Å; F27-Y315 WeakPolarHBondContact CE2-OH 3.41Å; F27-Y315 HydrophobicContact CZ-CE2 4.11Å; F27-Y315 AromaticContact CZ-CZ 3.9Å; F27-Y315 WeakPolarHBondContact CZ-OH 3.49Å
28	L	88.1	Confident	81.5	Confident	22 Å²	22	80.8 Å²	80.8	12%	0.115	40%	0.396	C	S	.	.	H	α-helix	trans	-64.9	-36.5	-179.9	-70.3	176	0	0	0	112.3	L24 K25 A31 R32 E164 Y165	L24-L28 HydrophobicContact CD1-CG 4.48Å; L24-L28 HydrophobicContact CG-CD1 4.38Å; L24-L28 WeakPolarHBondContact O-CG 3.43Å; L24-L28 PolarHBondContact O-N 3.34Å; K25-L28 PolarHBondContact O-N 3Å; L28-A31 PolarHBondContact O-N 3.01Å; L28-R32 WeakPolarHBondContact O-CB 3.44Å; L28-R32 PolarHBondContact O-N 3.34Å; L28-E164 HydrophobicContact CD1-CG 4.2Å; L28-Y165 HydrophobicContact CD2-CD2 4.4Å
29	D	90.1	Very high	83.7	Confident	68 Å²	68	76.7 Å²	76.7	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-67.8	-41.9	176.7	-73.8	-29.2	0	0	0	111.3	K25 E26 F27 R32 E33	K25-D29 PolarHBondContact O-N 3.05Å; E26-D29 PolarHBondContact O-N 3.02Å; F27-D29 VanDerWaalsContact C-N 3.33Å; F27-D29 PolarHBondContact O-N 2.83Å; D29-R32 PolarHBondContact O-N 3.34Å; D29-R32 IonicContact OD1-CZ 3.8Å; D29-R32 IonicContact OD1-NH1 2.8Å; D29-R32 PolarHBondContact OD1-NH1 3.45Å; D29-E33 PolarHBondContact O-N 3.1Å
30	K	92.1	Very high	85.7	Confident	138 Å²	138	74 Å²	74	60%	0.6	36%	0.362	S	S	*	.	H	α-helix	trans	-61.6	-46.8	171.6	-177.6	-179.6	176.5	-176.1	0	111.4	E26 F27 R32 E33 D34	E26-K30 PolarHBondContact O-N 2.77Å; F27-K30 PolarHBondContact O-N 3.14Å; K30-R32 PolarHBondContact O-N 3.13Å; K30-E33 PolarHBondContact O-N 3.34Å; K30-E33 VanDerWaalsContact O-N 3.08Å; K30-D34 PolarHBondContact O-N 3.49Å
31	A	91.8	Very high	87.5	Confident	10 Å²	10	75.8 Å²	75.8	8%	0.083	37%	0.371	C	S	.	.	H	α-helix	trans	-65.2	-28.9	-178.2	0	0	0	0	0	112.3	F27 L28 F35 Y165	F27-A31 HydrophobicContact CE1-CB 4.43Å; F27-A31 HydrophobicContact CZ-CB 4.4Å; F27-A31 VanDerWaalsContact O-CB 3.32Å; F27-A31 WeakPolarHBondContact O-CB 3.34Å; F27-A31 PolarHBondContact O-N 2.67Å; L28-A31 PolarHBondContact O-N 3.01Å; A31-F35 WeakPolarHBondContact O-CB 3.47Å; A31-F35 PolarHBondContact O-N 3.4Å; A31-Y165 HydrophobicContact CB-CD2 4.38Å; A31-Y165 HydrophobicContact CB-CE2 3.81Å
32	R	94.2	Very high	89.2	Confident	111 Å²	111	74.7 Å²	74.7	42%	0.419	36%	0.362	S	S	.	.	H	α-helix	trans	-67.2	-41.3	171.3	-169.9	-174.2	-65.7	124.5	6.5	112.4	L28 D29 K30 K36 S168 L169	L28-R32 WeakPolarHBondContact O-CB 3.44Å; L28-R32 PolarHBondContact O-N 3.34Å; D29-R32 PolarHBondContact O-N 3.34Å; D29-R32 IonicContact OD1-CZ 3.8Å; D29-R32 IonicContact OD1-NH1 2.8Å; D29-R32 PolarHBondContact OD1-NH1 3.45Å; K30-R32 PolarHBondContact O-N 3.13Å; R32-K36 WeakPolarHBondContact O-CB 3.47Å; R32-K36 PolarHBondContact O-N 2.79Å; R32-S168 PolarHBondContact NE-O 3.09Å; R32-S168 PolarHBondContact NH2-O 3.29Å; R32-L169 HydrophobicContact CB-CD2 4.02Å; R32-L169 HydrophobicContact CG-CD2 4.16Å
33	E	95.2	Very high	90.7	Very high	88 Å²	88	75 Å²	75	41%	0.411	37%	0.365	S	S	.	.	H	α-helix	trans	-67.6	-46.6	176.2	-174	56.2	-149.3	0	0	111	D29 K30 F35 K36 Q37	D29-E33 PolarHBondContact O-N 3.1Å; K30-E33 PolarHBondContact O-N 3.34Å; K30-E33 VanDerWaalsContact O-N 3.08Å; E33-F35 VanDerWaalsContact C-N 3.32Å; E33-F35 PolarHBondContact O-N 2.78Å; E33-K36 WeakPolarHBondContact O-CB 3.44Å; E33-K36 PolarHBondContact O-N 2.81Å; E33-K36 VanDerWaalsContact O-N 3.08Å; E33-Q37 WeakPolarHBondContact O-CG 3.49Å; E33-Q37 PolarHBondContact O-N 3.09Å; E33-Q37 PolarHBondContact OE1-NE2 3.5Å
34	D	95.5	Very high	91.6	Very high	70 Å²	70	76.4 Å²	76.4	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-58.5	-44.4	176.4	-69.7	-21	0	0	0	111.1	K30 Q37 R38	K30-D34 PolarHBondContact O-N 3.49Å; D34-Q37 PolarHBondContact O-N 2.91Å; D34-R38 WeakPolarHBondContact O-CG 3.28Å; D34-R38 PolarHBondContact O-N 2.83Å; D34-R38 VanDerWaalsContact O-N 3.14Å
35	F	96.7	Very high	92.5	Very high	2 Å²	2	78.1 Å²	78.1	1%	0.009	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-45.9	173.6	171.8	-97.2	0	0	0	111.8	A31 E33 Q37 R38 W39 A106 I107 L169 L171	A31-F35 WeakPolarHBondContact O-CB 3.47Å; A31-F35 PolarHBondContact O-N 3.4Å; E33-F35 VanDerWaalsContact C-N 3.32Å; E33-F35 PolarHBondContact O-N 2.78Å; F35-Q37 VanDerWaalsContact C-N 3.35Å; F35-Q37 PolarHBondContact O-N 2.76Å; F35-R38 PolarHBondContact O-N 2.83Å; F35-W39 HydrophobicContact CD1-CB 4.47Å; F35-W39 HydrophobicContact CE1-CB 4.17Å; F35-W39 HydrophobicContact CE1-CD2 4.33Å; F35-W39 HydrophobicContact CE1-CE3 4.36Å; F35-W39 HydrophobicContact CE1-CG 4.25Å; F35-W39 AromaticContact CE2-CE3 3.92Å; F35-W39 HydrophobicContact CE2-CE3 3.92Å; F35-W39 HydrophobicContact CZ-CB 4.26Å; F35-W39 AromaticContact CZ-CD2 3.89Å; F35-W39 HydrophobicContact CZ-CD2 3.89Å; F35-W39 AromaticContact CZ-CE3 3.5Å; F35-W39 HydrophobicContact CZ-CE3 3.5Å; F35-W39 HydrophobicContact CZ-CG 4.23Å; F35-W39 HydrophobicContact CZ-CZ3 4.18Å; F35-W39 WeakPolarHBondContact O-CB 3.42Å; F35-W39 PolarHBondContact O-N 3.2Å; F35-A106 HydrophobicContact CD2-CB 3.61Å; F35-A106 WeakPolarHBondContact CD2-O 3.46Å; F35-A106 HydrophobicContact CE2-CB 3.55Å; F35-A106 HydrophobicContact CZ-CB 4.49Å; F35-I107 HydrophobicContact CD2-CG2 4.18Å; F35-I107 HydrophobicContact CE2-CG2 4.11Å; F35-L169 HydrophobicContact CB-CD1 4.03Å; F35-L169 HydrophobicContact CB-CD2 3.7Å; F35-L169 HydrophobicContact CB-CG 4.43Å; F35-L169 HydrophobicContact CD1-CB 4.11Å; F35-L169 HydrophobicContact CD1-CD1 4.38Å; F35-L169 HydrophobicContact CD1-CD2 3.98Å; F35-L169 HydrophobicContact CD1-CG 4.38Å; F35-L169 HydrophobicContact CD2-CD1 3.67Å; F35-L169 HydrophobicContact CD2-CG 4.49Å; F35-L169 HydrophobicContact CE1-CB 4.15Å; F35-L169 HydrophobicContact CE2-CD1 4.23Å; F35-L169 HydrophobicContact CG-CB 4.32Å; F35-L169 HydrophobicContact CG-CD1 3.76Å; F35-L169 HydrophobicContact CG-CD2 3.84Å; F35-L169 HydrophobicContact CG-CG 4.18Å; F35-L169 HydrophobicContact CZ-CB 4.42Å; F35-L171 HydrophobicContact CE2-CD1 3.81Å; F35-L171 HydrophobicContact CZ-CD1 4.03Å; F35-L171 HydrophobicContact CZ-CD2 4.37Å; F35-L171 HydrophobicContact CZ-CG 4.31Å
36	K	96	Very high	93.4	Very high	86 Å²	86	74.5 Å²	74.5	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-45.6	-179.2	-174.8	-173.8	171.9	-164.4	0	111	R32 E33 R38 W39 E40	R32-K36 WeakPolarHBondContact O-CB 3.47Å; R32-K36 PolarHBondContact O-N 2.79Å; E33-K36 WeakPolarHBondContact O-CB 3.44Å; E33-K36 PolarHBondContact O-N 2.81Å; E33-K36 VanDerWaalsContact O-N 3.08Å; K36-R38 PolarHBondContact O-N 3.42Å; K36-W39 PolarHBondContact O-N 3.13Å; K36-E40 WeakPolarHBondContact CE-OE1 3.44Å; K36-E40 HydrophobicContact CG-CG 4.38Å; K36-E40 WeakPolarHBondContact CG-OE1 3.33Å; K36-E40 WeakPolarHBondContact O-CB 3.47Å; K36-E40 WeakPolarHBondContact O-CG 3.35Å; K36-E40 PolarHBondContact O-N 2.77Å
37	Q	96.5	Very high	94.1	Very high	93 Å²	93	68.7 Å²	68.7	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-48.7	177.4	-68.9	-64.2	-27.4	0	0	111.8	E33 D34 F35 W39 N41	E33-Q37 WeakPolarHBondContact O-CG 3.49Å; E33-Q37 PolarHBondContact O-N 3.09Å; E33-Q37 PolarHBondContact OE1-NE2 3.5Å; D34-Q37 PolarHBondContact O-N 2.91Å; F35-Q37 VanDerWaalsContact C-N 3.35Å; F35-Q37 PolarHBondContact O-N 2.76Å; Q37-W39 VanDerWaalsContact C-N 3.35Å; Q37-W39 PolarHBondContact O-N 3.45Å; Q37-N41 WeakPolarHBondContact O-CB 2.91Å; Q37-N41 PolarHBondContact O-N 3.04Å; Q37-N41 PolarHBondContact O-ND2 3.38Å; Q37-N41 VanDerWaalsContact O-ND2 3.15Å
38	R	96.4	Very high	94.6	Very high	96 Å²	96	68.5 Å²	68.5	36%	0.362	35%	0.346	S	S	.	.	H	α-helix	trans	-69.4	-30.2	178.1	-63.2	179.8	-167	-179.9	8.1	113	D34 F35 K36 N41 Q105 A106 D108	D34-R38 WeakPolarHBondContact O-CG 3.28Å; D34-R38 PolarHBondContact O-N 2.83Å; D34-R38 VanDerWaalsContact O-N 3.14Å; F35-R38 PolarHBondContact O-N 2.83Å; K36-R38 PolarHBondContact O-N 3.42Å; R38-N41 CarbonylContact O-C 3.57Å; R38-Q105 WeakPolarHBondContact CD-O 3.37Å; R38-A106 HydrophobicContact CB-CB 4.01Å; R38-D108 IonicContact CZ-OD2 2.87Å; R38-D108 IonicContact NH1-OD2 3.78Å; R38-D108 PolarHBondContact NH1-OD2 2.63Å; R38-D108 IonicContact NH2-OD2 2.83Å; R38-D108 PolarHBondContact NH2-OD2 3.04Å; R38-D108 VanDerWaalsContact NH2-OD2 3.14Å
39	W	95.9	Very high	95	Very high	30 Å²	30	68.3 Å²	68.3	11%	0.114	35%	0.345	C	S	.	.	H	α-helix	trans	-74.2	-38.5	178.9	-179.4	-87.6	0	0	0	113	F35 K36 Q37 R102 I103 A106 R199	F35-W39 HydrophobicContact CD1-CB 4.47Å; F35-W39 HydrophobicContact CE1-CB 4.17Å; F35-W39 HydrophobicContact CE1-CD2 4.33Å; F35-W39 HydrophobicContact CE1-CE3 4.36Å; F35-W39 HydrophobicContact CE1-CG 4.25Å; F35-W39 AromaticContact CE2-CE3 3.92Å; F35-W39 HydrophobicContact CE2-CE3 3.92Å; F35-W39 HydrophobicContact CZ-CB 4.26Å; F35-W39 AromaticContact CZ-CD2 3.89Å; F35-W39 HydrophobicContact CZ-CD2 3.89Å; F35-W39 AromaticContact CZ-CE3 3.5Å; F35-W39 HydrophobicContact CZ-CE3 3.5Å; F35-W39 HydrophobicContact CZ-CG 4.23Å; F35-W39 HydrophobicContact CZ-CZ3 4.18Å; F35-W39 WeakPolarHBondContact O-CB 3.42Å; F35-W39 PolarHBondContact O-N 3.2Å; K36-W39 PolarHBondContact O-N 3.13Å; Q37-W39 VanDerWaalsContact C-N 3.35Å; Q37-W39 PolarHBondContact O-N 3.45Å; W39-R102 HydrophobicContact CD2-CG 4.35Å; W39-R102 HydrophobicContact CE3-CG 3.89Å; W39-R102 HydrophobicContact CH2-CB 4.44Å; W39-R102 HydrophobicContact CH2-CG 3.93Å; W39-R102 HydrophobicContact CZ2-CG 4.37Å; W39-R102 HydrophobicContact CZ3-CB 4.2Å; W39-R102 HydrophobicContact CZ3-CG 3.67Å; W39-R102 PolarHBondContact O-NE 2.97Å; W39-R102 PolarHBondContact O-NH2 2.89Å; W39-I103 HydrophobicContact CH2-CG1 4.14Å; W39-I103 HydrophobicContact CZ3-CB 4.49Å; W39-I103 HydrophobicContact CZ3-CG1 3.66Å; W39-A106 HydrophobicContact CB-CB 4.29Å; W39-A106 HydrophobicContact CE3-CB 4.17Å; W39-R199 HydrophobicContact CH2-CB 4.31Å; W39-R199 HydrophobicContact CZ2-CB 4.37Å; W39-R199 VanDerWaalsContact NE1-NH1 3.17Å
40	E	95.6	Very high	95.3	Very high	103 Å²	103	70.8 Å²	70.8	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-80.5	-30	178.4	-70.5	176	179.4	0	0	111.7	K36 P42	K36-E40 WeakPolarHBondContact CE-OE1 3.44Å; K36-E40 HydrophobicContact CG-CG 4.38Å; K36-E40 WeakPolarHBondContact CG-OE1 3.33Å; K36-E40 WeakPolarHBondContact O-CB 3.47Å; K36-E40 WeakPolarHBondContact O-CG 3.35Å; K36-E40 PolarHBondContact O-N 2.77Å; E40-P42 VanDerWaalsContact C-CD 3.48Å; E40-P42 VanDerWaalsContact O-CD 3.29Å; E40-P42 WeakPolarHBondContact O-CD 3.42Å
41	N	95.1	Very high	95.6	Very high	110 Å²	110	67.1 Å²	67.1	59%	0.588	35%	0.345	S	S	*	.	S	Bend	trans	-120.5	72.6	179	-54.2	-77.6	0	0	0	110.8	Q37 R38 A43	Q37-N41 WeakPolarHBondContact O-CB 2.91Å; Q37-N41 PolarHBondContact O-N 3.04Å; Q37-N41 PolarHBondContact O-ND2 3.38Å; Q37-N41 VanDerWaalsContact O-ND2 3.15Å; R38-N41 CarbonylContact O-C 3.57Å; N41-A43 PolarHBondContact O-N 2.7Å
42	P	93	Very high	95.9	Very high	45 Å²	45	66.8 Å²	66.8	29%	0.292	34%	0.341	S	S	.	.			trans	-65.6	126	-176.8	29.6	-37.1	0	0	0	111.3	E40	E40-P42 VanDerWaalsContact C-CD 3.48Å; E40-P42 VanDerWaalsContact O-CD 3.29Å; E40-P42 WeakPolarHBondContact O-CD 3.42Å
43	A	93.6	Very high	96.1	Very high	54 Å²	54	65.1 Å²	65.1	45%	0.446	34%	0.341	S	S	.	.			trans	-68.9	137.6	173.6	0	0	0	0	0	110.3	N41 T46 K101 Q105	N41-A43 PolarHBondContact O-N 2.7Å; A43-T46 HydrophobicContact CB-CG2 3.8Å; A43-K101 PolarHBondContact O-NZ 3.47Å; A43-Q105 PolarHBondContact O-OE1 3.16Å
44	Q	93.2	Very high	96.1	Very high	87 Å²	87	63.9 Å²	63.9	41%	0.407	33%	0.332	S	S	.	.			trans	-128	149.5	-179.6	-66.1	-175.5	-34.2	0	0	110.3	T46 V373 E374	Q44-T46 VanDerWaalsContact C-N 3.33Å; Q44-T46 PolarHBondContact O-N 3.05Å; Q44-V373 PolarHBondContact NE2-O 2.93Å; Q44-E374 VanDerWaalsContact NE2-CA 3.32Å; Q44-E374 PolarHBondContact NE2-O 3Å
45	N	95.3	Very high	96	Very high	88 Å²	88	64 Å²	64	47%	0.471	33%	0.332	S	S	.	.			trans	46.5	53.5	175.9	-59	-45.8	0	0	0	113.1	A47 S118	N45-A47 PolarHBondContact O-N 3.5Å; N45-S118 WeakPolarHBondContact CA-O 3.44Å; N45-S118 PolarHBondContact N-O 2.84Å
46	T	97.4	Very high	95.8	Very high	63 Å²	63	66.7 Å²	66.7	39%	0.387	34%	0.344	S	S	.	.			trans	-81.1	-2	-175.8	54	0	0	0	0	113.8	A43 Q44 F117 S118	A43-T46 HydrophobicContact CB-CG2 3.8Å; Q44-T46 VanDerWaalsContact C-N 3.33Å; Q44-T46 PolarHBondContact O-N 3.05Å; T46-F117 VanDerWaalsContact OG1-CA 3.29Å; T46-F117 WeakPolarHBondContact OG1-CA 3.21Å; T46-S118 PolarHBondContact N-O 2.8Å; T46-S118 PolarHBondContact OG1-N 3.13Å; T46-S118 PolarHBondContact OG1-O 2.99Å
47	A	98	Very high	95.6	Very high	17 Å²	17	62.8 Å²	62.8	14%	0.14	33%	0.328	C	S	.	.			trans	-160	-176.6	172.6	0	0	0	0	0	109.4	N45 F52 F117 F119	N45-A47 PolarHBondContact O-N 3.5Å; A47-F52 HydrophobicContact CB-CE2 3.76Å; A47-F52 HydrophobicContact CB-CZ 4Å; A47-F117 HydrophobicContact CB-CB 3.92Å; A47-F117 HydrophobicContact CB-CD1 3.92Å; A47-F117 HydrophobicContact CB-CG 4.03Å; A47-F119 HydrophobicContact CB-CD1 3.9Å; A47-F119 HydrophobicContact CB-CE1 4.12Å; A47-F119 WeakPolarHBondContact O-CB 3.38Å; A47-F119 VanDerWaalsContact O-CG 3.29Å; A47-F119 WeakPolarHBondContact O-CG 3.48Å
48	C	97.4	Very high	95.2	Very high	57 Å²	57	59 Å²	59	39%	0.385	31%	0.31	S	S	.	.			trans	-134.2	169.1	167.6	71.9	0	0	0	0	111.2	D50 D51 F52	C48-D50 PolarHBondContact O-N 2.89Å; C48-D51 PolarHBondContact N-OD2 2.87Å; C48-D51 WeakPolarHBondContact O-CB 3.28Å; C48-D51 PolarHBondContact O-N 3.4Å; C48-D51 PolarHBondContact SG-OD2 3.2Å; C48-F52 VanDerWaalsContact O-CD2 3.27Å; C48-F52 WeakPolarHBondContact O-CD2 3.41Å; C48-F52 WeakPolarHBondContact O-CE2 3.42Å
49	L	96.6	Very high	94.8	Very high	19 Å²	19	55.6 Å²	55.6	10%	0.099	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-62.7	-33.1	-175.6	-170.3	63.2	0	0	0	112.6	D51 F52 M80 F119 Y126 F360 I362	L49-D51 PolarHBondContact O-N 3.35Å; L49-F52 PolarHBondContact O-N 2.95Å; L49-M80 HydrophobicContact CD1-CE 4.17Å; L49-M80 HydrophobicContact CD1-SD 3.81Å; L49-F119 HydrophobicContact CB-CE2 3.97Å; L49-F119 HydrophobicContact CB-CZ 4.44Å; L49-F119 HydrophobicContact CD1-CE2 4.4Å; L49-F119 HydrophobicContact CD1-CZ 4.37Å; L49-F119 VanDerWaalsContact N-CE2 3.28Å; L49-Y126 HydrophobicContact CD1-CD1 4.2Å; L49-Y126 HydrophobicContact CD1-CE1 3.65Å; L49-F360 HydrophobicContact CD1-CZ 4.34Å; L49-F360 HydrophobicContact CD2-CE2 4.27Å; L49-F360 HydrophobicContact CD2-CZ 3.86Å; L49-I362 HydrophobicContact CD2-CD1 3.71Å
50	D	96.7	Very high	94.4	Very high	120 Å²	120	58.2 Å²	58.2	64%	0.642	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-72.5	-12.3	-177.8	-71.2	-21.4	0	0	0	113.4	C48 F52 K72	C48-D50 PolarHBondContact O-N 2.89Å; D50-F52 PolarHBondContact O-N 3Å; D50-K72 WeakPolarHBondContact O-CD 3.3Å; D50-K72 VanDerWaalsContact O-CE 3.32Å; D50-K72 WeakPolarHBondContact O-CE 3.4Å; D50-K72 PolarHBondContact O-NZ 3.23Å
51	D	98.1	Very high	93.6	Very high	60 Å²	60	56 Å²	56	32%	0.321	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-72.5	-8.3	174	-61.8	-37.6	0	0	0	112.7	C48 L49 H71 K72	C48-D51 PolarHBondContact N-OD2 2.87Å; C48-D51 WeakPolarHBondContact O-CB 3.28Å; C48-D51 PolarHBondContact O-N 3.4Å; C48-D51 PolarHBondContact SG-OD2 3.2Å; L49-D51 PolarHBondContact O-N 3.35Å; D51-H71 PolarHBondContact O-CD2 3.39Å; D51-K72 WeakPolarHBondContact O-CB 3.32Å; D51-K72 WeakPolarHBondContact O-CG 3.37Å; D51-K72 PolarHBondContact O-N 3.36Å
52	F	98.2	Very high	92.9	Very high	3 Å²	3	55.1 Å²	55.1	1%	0.013	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.3	-171.8	-56.4	-88.3	0	0	0	113.1	A47 C48 L49 D50 V69 K70 H71 Y78 M80 F117 F119 V128	A47-F52 HydrophobicContact CB-CE2 3.76Å; A47-F52 HydrophobicContact CB-CZ 4Å; C48-F52 VanDerWaalsContact O-CD2 3.27Å; C48-F52 WeakPolarHBondContact O-CD2 3.41Å; C48-F52 WeakPolarHBondContact O-CE2 3.42Å; L49-F52 PolarHBondContact O-N 2.95Å; D50-F52 PolarHBondContact O-N 3Å; F52-V69 HydrophobicContact CB-CB 4.14Å; F52-V69 HydrophobicContact CB-CG2 4.41Å; F52-V69 HydrophobicContact CD1-CB 4.4Å; F52-V69 HydrophobicContact CD1-CG2 3.79Å; F52-V69 HydrophobicContact CG-CG2 4.34Å; F52-K70 CarbonylContact C-O 3.51Å; F52-K70 WeakPolarHBondContact CA-O 3.49Å; F52-H71 HydrophobicContact CD1-CB 3.95Å; F52-H71 HydrophobicContact CE1-CB 3.83Å; F52-H71 AromaticContact CE1-CD2 3.63Å; F52-H71 AromaticContact CZ-CD2 3.9Å; F52-Y78 HydrophobicContact CE1-CD2 4.27Å; F52-M80 HydrophobicContact CB-CE 3.88Å; F52-M80 HydrophobicContact CD1-CE 4.17Å; F52-M80 HydrophobicContact CD2-CE 3.47Å; F52-M80 VanDerWaalsContact CD2-CE 3.47Å; F52-M80 HydrophobicContact CE2-CE 4.02Å; F52-M80 HydrophobicContact CG-CE 3.57Å; F52-F117 HydrophobicContact CE1-CD2 4.11Å; F52-F117 HydrophobicContact CE1-CE2 4.25Å; F52-F117 HydrophobicContact CZ-CB 4.47Å; F52-F117 AromaticContact CZ-CD2 3.75Å; F52-F117 HydrophobicContact CZ-CD2 3.75Å; F52-F117 HydrophobicContact CZ-CE2 4.17Å; F52-F117 HydrophobicContact CZ-CG 4.16Å; F52-F119 HydrophobicContact CD2-CE1 4.39Å; F52-F119 HydrophobicContact CD2-CZ 4.35Å; F52-F119 AromaticContact CE2-CE1 3.75Å; F52-F119 HydrophobicContact CE2-CE1 3.75Å; F52-F119 HydrophobicContact CE2-CZ 4.15Å; F52-V128 HydrophobicContact CE1-CG1 3.94Å; F52-V128 HydrophobicContact CE1-CG2 4.48Å; F52-V128 HydrophobicContact CE2-CG2 4.37Å; F52-V128 HydrophobicContact CZ-CG1 4.21Å; F52-V128 HydrophobicContact CZ-CG2 4.04Å
53	D	97.5	Very high	92.4	Very high	76 Å²	76	55.5 Å²	55.5	41%	0.406	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	121.3	162.7	-62.6	-42.1	0	0	0	108.9	V69 K70 K72	D53-V69 CarbonylContact O-C 3.56Å; D53-V69 WeakPolarHBondContact O-CA 3.31Å; D53-K70 HydrophobicContact CB-CB 4.41Å; D53-K70 PolarHBondContact N-O 2.97Å; D53-K70 PolarHBondContact O-N 3.34Å; D53-K72 WeakPolarHBondContact OD1-CE 3.35Å; D53-K72 IonicContact OD1-NZ 3.8Å
54	R	95.3	Very high	92.1	Very high	62 Å²	62	53.9 Å²	53.9	23%	0.234	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	118.7	-180	-62.3	179.5	-62.6	-79.6	-1.8	110	M67 V69 T358	R54-M67 HydrophobicContact CB-CE 3.85Å; R54-V69 HydrophobicContact CG-CG1 4.27Å; R54-T358 WeakPolarHBondContact CD-O 3.24Å; R54-T358 PolarHBondContact NE-O 3.25Å
55	I	93.9	Very high	92.1	Very high	73 Å²	73	50.9 Å²	50.9	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-59.6	-166.6	-59.1	174.2	0	0	0	111.9	L68 K70 Y77 T358	I55-L68 HydrophobicContact CB-CD2 4.43Å; I55-L68 HydrophobicContact CB-CG 4.35Å; I55-L68 WeakPolarHBondContact CB-O 3.48Å; I55-L68 HydrophobicContact CD1-CG 4.38Å; I55-L68 HydrophobicContact CG2-CD2 4.25Å; I55-L68 PolarHBondContact N-O 3.38Å; I55-K70 HydrophobicContact CD1-CB 3.89Å; I55-Y77 HydrophobicContact CD1-CD1 3.87Å; I55-Y77 HydrophobicContact CD1-CE1 3.48Å; I55-Y77 VanDerWaalsContact CD1-CE1 3.48Å; I55-T358 WeakPolarHBondContact O-CG2 3.25Å
56	K	91.7	Very high	92	Very high	58 Å²	58	48.8 Å²	48.8	25%	0.252	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	142.4	-171.8	179.4	176.2	173.4	-175.1	0	111	L58 M67 L68 T347	K56-L58 PolarHBondContact O-N 3.31Å; K56-M67 CarbonylContact O-C 3.43Å; K56-M67 VanDerWaalsContact O-CA 3.28Å; K56-M67 WeakPolarHBondContact O-CA 3.48Å; K56-L68 PolarHBondContact N-O 3.38Å; K56-L68 PolarHBondContact O-N 3.34Å; K56-T347 HydrophobicContact CD-CG2 4.48Å; K56-T347 PolarHBondContact NZ-OG1 2.81Å; K56-T347 VanDerWaalsContact NZ-OG1 3.1Å
57	T	91.8	Very high	91.8	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.4	169	-57.8	0	0	0	0	109.8	T60 R65 V354	T57-T60 HydrophobicContact CG2-CG2 4.26Å; T57-R65 HydrophobicContact CG2-CB 4.27Å; T57-V354 HydrophobicContact CG2-CB 3.84Å; T57-V354 HydrophobicContact CG2-CG1 3.72Å; T57-V354 HydrophobicContact CG2-CG2 4.35Å
58	L	89	Confident	91.7	Very high	13 Å²	13	45 Å²	45	7%	0.068	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-29.4	178.6	-64.8	175.2	0	0	0	112.1	K56 V66 L68 A79 F131 T347 F350	K56-L58 PolarHBondContact O-N 3.31Å; L58-V66 HydrophobicContact CB-CG1 4.45Å; L58-V66 HydrophobicContact CD1-CG1 4.27Å; L58-V66 PolarHBondContact N-O 2.94Å; L58-L68 HydrophobicContact CD1-CB 4.12Å; L58-L68 HydrophobicContact CD2-CB 4.02Å; L58-L68 HydrophobicContact CG-CB 4.03Å; L58-A79 HydrophobicContact CD1-CB 4.19Å; L58-F131 HydrophobicContact CD1-CD2 3.87Å; L58-F131 HydrophobicContact CD1-CE2 3.67Å; L58-F131 HydrophobicContact CD2-CE2 4.04Å; L58-T347 HydrophobicContact CD2-CG2 3.51Å; L58-F350 HydrophobicContact CB-CD1 3.95Å; L58-F350 HydrophobicContact CB-CE1 4.21Å; L58-F350 HydrophobicContact CD1-CE1 4.28Å; L58-F350 HydrophobicContact CD1-CZ 4.44Å; L58-F350 HydrophobicContact CD2-CD1 4.08Å; L58-F350 HydrophobicContact CD2-CD2 4.1Å; L58-F350 HydrophobicContact CD2-CE1 4.32Å; L58-F350 HydrophobicContact CD2-CE2 4.36Å; L58-F350 HydrophobicContact CD2-CG 3.96Å; L58-F350 HydrophobicContact CD2-CZ 4.46Å; L58-F350 HydrophobicContact CG-CD1 4.47Å
59	G	87.2	Confident	91.7	Very high	25 Å²	25	42.3 Å²	42.3	26%	0.258	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	162.5	180	0	0	0	0	0	112	R65 V66	G59-R65 WeakPolarHBondContact O-CA 3.44Å; G59-V66 PolarHBondContact N-O 3.31Å; G59-V66 PolarHBondContact O-N 3.45Å
60	T	86.8	Confident	91.8	Very high	85 Å²	85	44.8 Å²	44.8	52%	0.521	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.4	178.7	50.1	0	0	0	0	110	T57 R65 V354	T57-T60 HydrophobicContact CG2-CG2 4.26Å; T60-R65 HydrophobicContact CG2-CB 4.02Å; T60-V354 HydrophobicContact CG2-CG1 3.8Å
61	G	80.6	Confident	91.9	Very high	55 Å²	55	39.8 Å²	39.8	57%	0.567	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	-177.3	174.1	0	0	0	0	0	111.7	F63 G64	G61-F63 PolarHBondContact O-N 2.92Å; G61-F63 VanDerWaalsContact O-N 3.15Å; G61-G64 PolarHBondContact N-O 2.94Å; G61-G64 PolarHBondContact O-N 3.32Å; G61-G64 VanDerWaalsContact O-O 3.05Å
62	S	79.4	Confident	91.9	Very high	93 Å²	93	42.3 Å²	42.3	65%	0.65	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.7	-174.9	-49.3	0	0	0	0	114.6
63	F	83.3	Confident	91.8	Very high	53 Å²	53	50.6 Å²	50.6	23%	0.232	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-5.9	-172.9	-39.3	-70.8	0	0	0	113.5	G61 L83 D84 V88 L91 Q93	G61-F63 PolarHBondContact O-N 2.92Å; G61-F63 VanDerWaalsContact O-N 3.15Å; F63-L83 HydrophobicContact CB-CD2 3.97Å; F63-D84 PolarHBondContact O-N 3.29Å; F63-D84 VanDerWaalsContact O-N 3.14Å; F63-V88 HydrophobicContact CB-CG2 4.17Å; F63-L91 HydrophobicContact CD1-CB 3.98Å; F63-L91 HydrophobicContact CD1-CD1 3.44Å; F63-L91 VanDerWaalsContact CD1-CD1 3.44Å; F63-L91 HydrophobicContact CD1-CG 4.29Å; F63-L91 HydrophobicContact CE1-CB 3.54Å; F63-L91 HydrophobicContact CE1-CD1 3.38Å; F63-L91 HydrophobicContact CE1-CG 4.06Å; F63-Q93 HydrophobicContact CD1-CG 4.13Å; F63-Q93 HydrophobicContact CE1-CB 4.25Å; F63-Q93 HydrophobicContact CE1-CG 3.37Å; F63-Q93 HydrophobicContact CE2-CG 4.2Å; F63-Q93 HydrophobicContact CZ-CB 4.42Å; F63-Q93 HydrophobicContact CZ-CG 3.43Å; F63-Q93 VanDerWaalsContact CZ-CG 3.43Å
64	G	86.3	Confident	91.8	Very high	20 Å²	20	49.7 Å²	49.7	21%	0.206	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.1	-149.7	-170	0	0	0	0	0	112.9	G61 I82	G61-G64 PolarHBondContact N-O 2.94Å; G61-G64 PolarHBondContact O-N 3.32Å; G61-G64 VanDerWaalsContact O-O 3.05Å; G64-I82 CarbonylContact C-O 3.54Å; G64-I82 VanDerWaalsContact CA-O 3.28Å; G64-I82 WeakPolarHBondContact CA-O 3.36Å
65	R	92.5	Very high	91.9	Very high	23 Å²	23	48.1 Å²	48.1	9%	0.087	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.1	-171.7	68.8	-169.9	-173.8	176.5	9.1	112.3	T57 G59 T60 M67 I82 E356 P357 T358	T57-R65 HydrophobicContact CG2-CB 4.27Å; G59-R65 WeakPolarHBondContact O-CA 3.44Å; T60-R65 HydrophobicContact CG2-CB 4.02Å; R65-M67 HydrophobicContact CG-CG 4.27Å; R65-M67 PolarHBondContact NH2-SD 2.79Å; R65-I82 HydrophobicContact CG-CB 4.4Å; R65-I82 HydrophobicContact CG-CD1 4.44Å; R65-I82 PolarHBondContact N-O 3.42Å; R65-I82 PolarHBondContact O-N 2.81Å; R65-E356 WeakPolarHBondContact CD-OE2 3.43Å; R65-E356 IonicContact CZ-OE2 2.95Å; R65-E356 IonicContact NE-OE2 2.82Å; R65-E356 IonicContact NH1-OE2 3.42Å; R65-E356 PolarHBondContact NH1-OE2 3.15Å; R65-P357 VanDerWaalsContact CZ-O 3.23Å; R65-P357 PolarHBondContact NH1-O 3.37Å; R65-P357 PolarHBondContact NH2-O 3.5Å; R65-T358 PolarHBondContact NH2-O 2.8Å
66	V	93.1	Very high	92	Very high	44 Å²	44	48.8 Å²	48.8	27%	0.267	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.7	173.8	-175.5	0	0	0	0	108.2	L58 G59 A79 M80 K81	L58-V66 HydrophobicContact CB-CG1 4.45Å; L58-V66 HydrophobicContact CD1-CG1 4.27Å; L58-V66 PolarHBondContact N-O 2.94Å; G59-V66 PolarHBondContact N-O 3.31Å; G59-V66 PolarHBondContact O-N 3.45Å; V66-A79 HydrophobicContact CG1-CB 3.92Å; V66-M80 CarbonylContact C-O 3.44Å; V66-M80 WeakPolarHBondContact CA-O 3.29Å; V66-K81 HydrophobicContact CG2-CB 4.18Å; V66-K81 HydrophobicContact CG2-CG 4.22Å
67	M	94.5	Very high	92.3	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.6	179.6	-63.7	-174	72.3	0	0	111.3	R54 K56 R65 V69 A79 M80 I82 T358	R54-M67 HydrophobicContact CB-CE 3.85Å; K56-M67 CarbonylContact O-C 3.43Å; K56-M67 VanDerWaalsContact O-CA 3.28Å; K56-M67 WeakPolarHBondContact O-CA 3.48Å; R65-M67 HydrophobicContact CG-CG 4.27Å; R65-M67 PolarHBondContact NH2-SD 2.79Å; M67-V69 HydrophobicContact CB-CG1 4.2Å; M67-V69 PolarHBondContact O-N 3.49Å; M67-A79 CarbonylContact O-C 3.58Å; M67-A79 WeakPolarHBondContact O-CA 3.44Å; M67-M80 PolarHBondContact N-O 2.79Å; M67-M80 PolarHBondContact O-N 3.39Å; M67-I82 HydrophobicContact CG-CD1 3.93Å; M67-I82 HydrophobicContact SD-CD1 3.48Å; M67-I82 WeakPolarHBondContact SD-CD1 3.47Å; M67-T358 HydrophobicContact CE-CG2 3.72Å
68	L	95.5	Very high	92.6	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	125.9	160.4	-179.4	64.8	0	0	0	108.1	I55 K56 L58 Y77 Y78 F131 A345 T347	I55-L68 HydrophobicContact CB-CD2 4.43Å; I55-L68 HydrophobicContact CB-CG 4.35Å; I55-L68 WeakPolarHBondContact CB-O 3.48Å; I55-L68 HydrophobicContact CD1-CG 4.38Å; I55-L68 HydrophobicContact CG2-CD2 4.25Å; I55-L68 PolarHBondContact N-O 3.38Å; K56-L68 PolarHBondContact N-O 3.38Å; K56-L68 PolarHBondContact O-N 3.34Å; L58-L68 HydrophobicContact CD1-CB 4.12Å; L58-L68 HydrophobicContact CD2-CB 4.02Å; L58-L68 HydrophobicContact CG-CB 4.03Å; L68-Y77 HydrophobicContact CD1-CD1 4.07Å; L68-Y77 HydrophobicContact CD2-CD1 4.5Å; L68-Y77 HydrophobicContact CG-CD1 4.34Å; L68-Y78 WeakPolarHBondContact CA-O 3.23Å; L68-F131 HydrophobicContact CD1-CB 4.41Å; L68-F131 HydrophobicContact CD1-CD1 3.75Å; L68-F131 HydrophobicContact CD1-CD2 3.87Å; L68-F131 HydrophobicContact CD1-CE1 3.89Å; L68-F131 HydrophobicContact CD1-CE2 4.02Å; L68-F131 HydrophobicContact CD1-CG 3.73Å; L68-F131 HydrophobicContact CD1-CZ 4.04Å; L68-A345 HydrophobicContact CD2-CB 4.22Å; L68-T347 HydrophobicContact CD2-CG2 3.72Å
69	V	97.5	Very high	93	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.7	177.2	-56.8	0	0	0	0	110.4	F52 D53 R54 M67 Y77 Y78 M80	F52-V69 HydrophobicContact CB-CB 4.14Å; F52-V69 HydrophobicContact CB-CG2 4.41Å; F52-V69 HydrophobicContact CD1-CB 4.4Å; F52-V69 HydrophobicContact CD1-CG2 3.79Å; F52-V69 HydrophobicContact CG-CG2 4.34Å; D53-V69 CarbonylContact O-C 3.56Å; D53-V69 WeakPolarHBondContact O-CA 3.31Å; R54-V69 HydrophobicContact CG-CG1 4.27Å; M67-V69 HydrophobicContact CB-CG1 4.2Å; M67-V69 PolarHBondContact O-N 3.49Å; V69-Y77 CarbonylContact O-C 3.56Å; V69-Y77 VanDerWaalsContact O-CA 3.3Å; V69-Y77 WeakPolarHBondContact O-CA 3.49Å; V69-Y78 PolarHBondContact N-O 3.4Å; V69-Y78 PolarHBondContact O-N 3.34Å; V69-M80 HydrophobicContact CB-CB 4.48Å; V69-M80 HydrophobicContact CG1-CB 3.66Å; V69-M80 HydrophobicContact CG1-CE 4.09Å; V69-M80 HydrophobicContact CG1-SD 4.14Å; V69-M80 HydrophobicContact CG2-CB 3.93Å; V69-M80 HydrophobicContact CG2-CE 4.2Å
70	K	98.3	Very high	93.5	Very high	70 Å²	70	48.6 Å²	48.6	30%	0.304	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.1	170.9	-176.9	-176.6	-179.1	-174.7	0	109.3	F52 D53 I55 K72 G75 N76 Y77	F52-K70 CarbonylContact C-O 3.51Å; F52-K70 WeakPolarHBondContact CA-O 3.49Å; D53-K70 HydrophobicContact CB-CB 4.41Å; D53-K70 PolarHBondContact N-O 2.97Å; D53-K70 PolarHBondContact O-N 3.34Å; I55-K70 HydrophobicContact CD1-CB 3.89Å; K70-K72 PolarHBondContact O-N 3.38Å; K70-G75 WeakPolarHBondContact CE-O 3.42Å; K70-N76 WeakPolarHBondContact CA-O 3.24Å; K70-Y77 HydrophobicContact CB-CD1 4.1Å; K70-Y77 HydrophobicContact CB-CE1 3.99Å; K70-Y77 HydrophobicContact CD-CE1 4.19Å; K70-Y77 HydrophobicContact CG-CE1 4.23Å
71	H	98.4	Very high	93.9	Very high	16 Å²	16	46.4 Å²	46.4	7%	0.074	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	120.1	174.5	-178.3	-123.6	0	0	0	109.4	D51 F52 Q73 S74 G75 N76 Y78	D51-H71 PolarHBondContact O-CD2 3.39Å; F52-H71 HydrophobicContact CD1-CB 3.95Å; F52-H71 HydrophobicContact CE1-CB 3.83Å; F52-H71 AromaticContact CE1-CD2 3.63Å; F52-H71 AromaticContact CZ-CD2 3.9Å; H71-Q73 VanDerWaalsContact C-N 3.34Å; H71-Q73 PolarHBondContact O-N 3.31Å; H71-S74 PolarHBondContact ND1-N 2.79Å; H71-S74 PolarHBondContact ND1-OG 3.4Å; H71-G75 VanDerWaalsContact O-CA 3.31Å; H71-G75 WeakPolarHBondContact O-CA 3.48Å; H71-G75 PolarHBondContact O-N 2.96Å; H71-N76 PolarHBondContact N-O 2.91Å; H71-Y78 HydrophobicContact CB-CD2 4.01Å; H71-Y78 HydrophobicContact CB-CE2 3.64Å
72	K	98.3	Very high	94.7	Very high	113 Å²	113	44 Å²	44	49%	0.491	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-42.5	-169.9	-71.3	174.9	179.1	170.2	0	112.5	D50 D51 D53 K70	D50-K72 WeakPolarHBondContact O-CD 3.3Å; D50-K72 VanDerWaalsContact O-CE 3.32Å; D50-K72 WeakPolarHBondContact O-CE 3.4Å; D50-K72 PolarHBondContact O-NZ 3.23Å; D51-K72 WeakPolarHBondContact O-CB 3.32Å; D51-K72 WeakPolarHBondContact O-CG 3.37Å; D51-K72 PolarHBondContact O-N 3.36Å; D53-K72 WeakPolarHBondContact OD1-CE 3.35Å; D53-K72 IonicContact OD1-NZ 3.8Å; K70-K72 PolarHBondContact O-N 3.38Å
73	Q	97.2	Very high	95.4	Very high	177 Å²	177	40 Å²	40	83%	0.827	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-45.1	-175	-170.5	-176.9	26.1	0	0	112.7	H71	H71-Q73 VanDerWaalsContact C-N 3.34Å; H71-Q73 PolarHBondContact O-N 3.31Å
74	S	97.3	Very high	96	Very high	57 Å²	57	39.4 Å²	39.4	40%	0.399	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-17.2	-175.7	69.7	0	0	0	0	114	H71 N76	H71-S74 PolarHBondContact ND1-N 2.79Å; H71-S74 PolarHBondContact ND1-OG 3.4Å; S74-N76 PolarHBondContact O-N 2.79Å; S74-N76 PolarHBondContact OG-N 3.36Å
75	G	97	Very high	96.5	Very high	28 Å²	28	38.5 Å²	38.5	29%	0.289	20%	0.196	S	C	.	.			trans	73.4	1.4	-174.1	0	0	0	0	0	114.9	K70 H71	K70-G75 WeakPolarHBondContact CE-O 3.42Å; H71-G75 VanDerWaalsContact O-CA 3.31Å; H71-G75 WeakPolarHBondContact O-CA 3.48Å; H71-G75 PolarHBondContact O-N 2.96Å
76	N	97.2	Very high	96.7	Very high	88 Å²	88	42.4 Å²	42.4	47%	0.471	22%	0.215	S	C	.	.			trans	-76	148.9	-179.4	-67.7	-17.4	0	0	0	111.8	K70 H71 S74 Y78	K70-N76 WeakPolarHBondContact CA-O 3.24Å; H71-N76 PolarHBondContact N-O 2.91Å; S74-N76 PolarHBondContact O-N 2.79Å; S74-N76 PolarHBondContact OG-N 3.36Å; N76-Y78 HydrophobicContact CB-CE2 3.73Å
77	Y	97.5	Very high	96.8	Very high	62 Å²	62	45.1 Å²	45.1	24%	0.243	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.9	176.4	-65.9	-94.5	0	0	0	111.3	I55 L68 V69 K70 P344 A345	I55-Y77 HydrophobicContact CD1-CD1 3.87Å; I55-Y77 HydrophobicContact CD1-CE1 3.48Å; I55-Y77 VanDerWaalsContact CD1-CE1 3.48Å; L68-Y77 HydrophobicContact CD1-CD1 4.07Å; L68-Y77 HydrophobicContact CD2-CD1 4.5Å; L68-Y77 HydrophobicContact CG-CD1 4.34Å; V69-Y77 CarbonylContact O-C 3.56Å; V69-Y77 VanDerWaalsContact O-CA 3.3Å; V69-Y77 WeakPolarHBondContact O-CA 3.49Å; K70-Y77 HydrophobicContact CB-CD1 4.1Å; K70-Y77 HydrophobicContact CB-CE1 3.99Å; K70-Y77 HydrophobicContact CD-CE1 4.19Å; K70-Y77 HydrophobicContact CG-CE1 4.23Å; Y77-P344 HydrophobicContact CD2-CB 3.73Å; Y77-P344 HydrophobicContact CD2-CG 3.97Å; Y77-P344 HydrophobicContact CE2-CB 3.97Å; Y77-P344 HydrophobicContact CE2-CG 3.66Å; Y77-A345 HydrophobicContact CD1-CB 3.8Å; Y77-A345 HydrophobicContact CE1-CB 3.4Å; Y77-A345 HydrophobicContact CE2-CB 4.27Å; Y77-A345 HydrophobicContact CG-CB 4.39Å
78	Y	98	Very high	96.8	Very high	22 Å²	22	45.1 Å²	45.1	9%	0.086	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	160.6	-179.2	-63	-79.9	0	0	0	111.1	F52 L68 V69 H71 N76 T116 F117 V128 L129	F52-Y78 HydrophobicContact CE1-CD2 4.27Å; L68-Y78 WeakPolarHBondContact CA-O 3.23Å; V69-Y78 PolarHBondContact N-O 3.4Å; V69-Y78 PolarHBondContact O-N 3.34Å; H71-Y78 HydrophobicContact CB-CD2 4.01Å; H71-Y78 HydrophobicContact CB-CE2 3.64Å; N76-Y78 HydrophobicContact CB-CE2 3.73Å; Y78-T116 HydrophobicContact CE1-CG2 4.09Å; Y78-F117 HydrophobicContact CE1-CE2 4.4Å; Y78-F117 AromaticContact CE2-CE2 3.95Å; Y78-F117 HydrophobicContact CE2-CE2 3.95Å; Y78-F117 AromaticContact CZ-CE2 3.86Å; Y78-V128 VanDerWaalsContact CB-CG1 3.41Å; Y78-V128 HydrophobicContact CD1-CG1 4.11Å; Y78-V128 HydrophobicContact CD2-CG1 4.21Å; Y78-V128 HydrophobicContact CG-CG1 3.66Å; Y78-L129 WeakPolarHBondContact CA-O 3.5Å; Y78-L129 WeakPolarHBondContact CB-O 3.1Å; Y78-L129 WeakPolarHBondContact CD1-O 3.48Å
79	A	96.6	Very high	96.9	Very high	13 Å²	13	47.2 Å²	47.2	11%	0.107	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	108.1	166.4	0	0	0	0	0	108.8	L58 V66 M67 L129 F131	L58-A79 HydrophobicContact CD1-CB 4.19Å; V66-A79 HydrophobicContact CG1-CB 3.92Å; M67-A79 CarbonylContact O-C 3.58Å; M67-A79 WeakPolarHBondContact O-CA 3.44Å; A79-L129 PolarHBondContact N-O 3.09Å; A79-L129 WeakPolarHBondContact O-CD1 3.48Å; A79-L129 PolarHBondContact O-N 3.43Å; A79-F131 HydrophobicContact CB-CD2 4.46Å
80	M	97.6	Very high	96.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.3	176.8	-177.6	-176.8	-73.3	0	0	109.9	L49 F52 V66 M67 V69 I82 F119 Y126 V128	L49-M80 HydrophobicContact CD1-CE 4.17Å; L49-M80 HydrophobicContact CD1-SD 3.81Å; F52-M80 HydrophobicContact CB-CE 3.88Å; F52-M80 HydrophobicContact CD1-CE 4.17Å; F52-M80 HydrophobicContact CD2-CE 3.47Å; F52-M80 VanDerWaalsContact CD2-CE 3.47Å; F52-M80 HydrophobicContact CE2-CE 4.02Å; F52-M80 HydrophobicContact CG-CE 3.57Å; V66-M80 CarbonylContact C-O 3.44Å; V66-M80 WeakPolarHBondContact CA-O 3.29Å; M67-M80 PolarHBondContact N-O 2.79Å; M67-M80 PolarHBondContact O-N 3.39Å; V69-M80 HydrophobicContact CB-CB 4.48Å; V69-M80 HydrophobicContact CG1-CB 3.66Å; V69-M80 HydrophobicContact CG1-CE 4.09Å; V69-M80 HydrophobicContact CG1-SD 4.14Å; V69-M80 HydrophobicContact CG2-CB 3.93Å; V69-M80 HydrophobicContact CG2-CE 4.2Å; M80-I82 HydrophobicContact CG-CD1 4.48Å; M80-I82 HydrophobicContact CG-CG1 3.87Å; M80-I82 HydrophobicContact SD-CD1 4.22Å; M80-I82 HydrophobicContact SD-CG1 4.1Å; M80-F119 HydrophobicContact CE-CE1 4.32Å; M80-F119 HydrophobicContact CE-CZ 3.88Å; M80-F119 HydrophobicContact SD-CZ 4.5Å; M80-Y126 HydrophobicContact CG-CD1 4.15Å; M80-Y126 HydrophobicContact SD-CD1 3.73Å; M80-Y126 HydrophobicContact SD-CE1 4.24Å; M80-V128 HydrophobicContact CE-CG2 3.95Å; M80-V128 HydrophobicContact CG-CG2 4.19Å
81	K	95.8	Very high	96.5	Very high	38 Å²	38	56.3 Å²	56.3	17%	0.165	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.7	169.5	-176.9	169	172.7	-178.2	0	108.5	V66 L83 E100 Y126 M127 L129	V66-K81 HydrophobicContact CG2-CB 4.18Å; V66-K81 HydrophobicContact CG2-CG 4.22Å; K81-L83 HydrophobicContact CG-CD2 4.24Å; K81-L83 HydrophobicContact CG-CG 4.33Å; K81-E100 IonicContact NZ-OE1 3.49Å; K81-E100 PolarHBondContact NZ-OE1 2.95Å; K81-E100 IonicContact NZ-OE2 3.21Å; K81-E100 PolarHBondContact NZ-OE2 3.19Å; K81-Y126 WeakPolarHBondContact O-CA 3.35Å; K81-M127 HydrophobicContact CB-CB 4.36Å; K81-M127 HydrophobicContact CD-CE 3.91Å; K81-M127 HydrophobicContact CG-CE 4.32Å; K81-M127 PolarHBondContact N-O 3.21Å; K81-M127 PolarHBondContact O-N 3.28Å; K81-L129 HydrophobicContact CB-CD1 3.87Å
82	I	96.7	Very high	96.3	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.5	-177.2	-51.1	173.7	0	0	0	107.7	G64 R65 M67 M80 N124 Y126 F360	G64-I82 CarbonylContact C-O 3.54Å; G64-I82 VanDerWaalsContact CA-O 3.28Å; G64-I82 WeakPolarHBondContact CA-O 3.36Å; R65-I82 HydrophobicContact CG-CB 4.4Å; R65-I82 HydrophobicContact CG-CD1 4.44Å; R65-I82 PolarHBondContact N-O 3.42Å; R65-I82 PolarHBondContact O-N 2.81Å; M67-I82 HydrophobicContact CG-CD1 3.93Å; M67-I82 HydrophobicContact SD-CD1 3.48Å; M67-I82 WeakPolarHBondContact SD-CD1 3.47Å; M80-I82 HydrophobicContact CG-CD1 4.48Å; M80-I82 HydrophobicContact CG-CG1 3.87Å; M80-I82 HydrophobicContact SD-CD1 4.22Å; M80-I82 HydrophobicContact SD-CG1 4.1Å; I82-N124 HydrophobicContact CG2-CB 4.08Å; I82-Y126 HydrophobicContact CB-CD1 4.39Å; I82-Y126 HydrophobicContact CB-CE1 4.32Å; I82-Y126 HydrophobicContact CD1-CE1 4.38Å; I82-Y126 HydrophobicContact CG1-CD1 3.93Å; I82-Y126 HydrophobicContact CG1-CE1 3.98Å; I82-Y126 HydrophobicContact CG2-CD1 4.13Å; I82-Y126 HydrophobicContact CG2-CE1 3.66Å; I82-F360 HydrophobicContact CD1-CE1 3.83Å; I82-F360 HydrophobicContact CD1-CZ 3.99Å; I82-F360 HydrophobicContact CG2-CE2 4.48Å; I82-F360 HydrophobicContact CG2-CZ 4.28Å
83	L	95.9	Very high	96	Very high	7 Å²	7	61 Å²	61	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.4	-177.4	-57.8	170.3	0	0	0	110.2	F63 K81 K85 V88 T97 N124 L125 M127	F63-L83 HydrophobicContact CB-CD2 3.97Å; K81-L83 HydrophobicContact CG-CD2 4.24Å; K81-L83 HydrophobicContact CG-CG 4.33Å; L83-K85 PolarHBondContact O-N 2.93Å; L83-V88 HydrophobicContact CB-CG2 4.09Å; L83-T97 HydrophobicContact CD1-CG2 3.62Å; L83-N124 CarbonylContact O-C 3.49Å; L83-N124 WeakPolarHBondContact O-CA 3.44Å; L83-L125 HydrophobicContact CB-CB 4.25Å; L83-L125 PolarHBondContact N-O 3.27Å; L83-L125 PolarHBondContact O-N 3.07Å; L83-M127 HydrophobicContact CD1-CE 3.52Å
84	D	95.6	Very high	95.8	Very high	42 Å²	42	54 Å²	54	23%	0.225	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	120.4	176.5	174.4	-43.3	0	0	0	109.6	F63 Q86 K87 V88	F63-D84 PolarHBondContact O-N 3.29Å; F63-D84 VanDerWaalsContact O-N 3.14Å; D84-Q86 VanDerWaalsContact C-N 3.28Å; D84-Q86 PolarHBondContact O-N 2.8Å; D84-Q86 WeakPolarHBondContact OD1-CA 3.5Å; D84-Q86 VanDerWaalsContact OD1-CB 3.28Å; D84-Q86 WeakPolarHBondContact OD1-CB 3.42Å; D84-Q86 PolarHBondContact OD1-N 3.29Å; D84-K87 HydrophobicContact CB-CB 4Å; D84-K87 HydrophobicContact CB-CD 3.95Å; D84-K87 HydrophobicContact CB-CG 3.93Å; D84-K87 PolarHBondContact O-N 2.83Å; D84-K87 VanDerWaalsContact O-N 3.15Å; D84-K87 PolarHBondContact OD1-N 3.39Å; D84-V88 WeakPolarHBondContact O-CG2 3.39Å; D84-V88 PolarHBondContact O-N 3.25Å
85	K	96.7	Very high	95.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.9	-40.8	-177.7	-72.6	178.8	175.4	178.1	0	111.7	L83 V88 V89 D121 S123 L125 Q367 L368 E369 F372	L83-K85 PolarHBondContact O-N 2.93Å; K85-V88 PolarHBondContact O-N 3.08Å; K85-V89 WeakPolarHBondContact O-CG2 3.07Å; K85-V89 PolarHBondContact O-N 3.3Å; K85-D121 VanDerWaalsContact CE-O 3.23Å; K85-D121 WeakPolarHBondContact CE-O 3.38Å; K85-D121 PolarHBondContact NZ-O 2.93Å; K85-S123 VanDerWaalsContact CB-O 3.31Å; K85-S123 WeakPolarHBondContact CB-O 3.38Å; K85-S123 VanDerWaalsContact CG-O 3.32Å; K85-S123 WeakPolarHBondContact CG-O 3.19Å; K85-S123 PolarHBondContact N-O 3.08Å; K85-L125 HydrophobicContact CD-CD2 4.34Å; K85-L125 HydrophobicContact CG-CD2 3.9Å; K85-L125 HydrophobicContact CG-CG 3.89Å; K85-Q367 WeakPolarHBondContact CD-O 3.22Å; K85-Q367 PolarHBondContact NZ-O 2.64Å; K85-Q367 VanDerWaalsContact NZ-O 3.17Å; K85-L368 HydrophobicContact CB-CD1 3.93Å; K85-L368 WeakPolarHBondContact O-CD1 3.29Å; K85-E369 IonicContact NZ-OE2 3.72Å; K85-E369 PolarHBondContact NZ-OE2 2.86Å; K85-F372 HydrophobicContact CB-CD2 4.26Å; K85-F372 HydrophobicContact CB-CE2 3.8Å; K85-F372 HydrophobicContact CD-CD2 3.99Å; K85-F372 HydrophobicContact CD-CE2 4.38Å; K85-F372 HydrophobicContact CG-CD2 3.87Å; K85-F372 HydrophobicContact CG-CE2 3.87Å
86	Q	95.5	Very high	95.3	Very high	106 Å²	106	58 Å²	58	50%	0.495	27%	0.274	S	S	.	.	H	α-helix	trans	-67.2	-41.6	179.5	-59.4	-171.7	-18.8	0	0	111.3	D84 V89 K90 L368	D84-Q86 VanDerWaalsContact C-N 3.28Å; D84-Q86 PolarHBondContact O-N 2.8Å; D84-Q86 WeakPolarHBondContact OD1-CA 3.5Å; D84-Q86 VanDerWaalsContact OD1-CB 3.28Å; D84-Q86 WeakPolarHBondContact OD1-CB 3.42Å; D84-Q86 PolarHBondContact OD1-N 3.29Å; Q86-V89 PolarHBondContact O-N 3.08Å; Q86-K90 VanDerWaalsContact O-CB 3.23Å; Q86-K90 WeakPolarHBondContact O-CB 3.16Å; Q86-K90 PolarHBondContact O-N 3.44Å; Q86-L368 HydrophobicContact CB-CD1 4.44Å; Q86-L368 HydrophobicContact CG-CD1 4.05Å
87	K	95.5	Very high	95.1	Very high	100 Å²	100	54 Å²	54	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-41.9	175.9	-68.3	-175.9	-172.3	174.5	0	111.8	D84 V89 K90 L91	D84-K87 HydrophobicContact CB-CB 4Å; D84-K87 HydrophobicContact CB-CD 3.95Å; D84-K87 HydrophobicContact CB-CG 3.93Å; D84-K87 PolarHBondContact O-N 2.83Å; D84-K87 VanDerWaalsContact O-N 3.15Å; D84-K87 PolarHBondContact OD1-N 3.39Å; K87-V89 VanDerWaalsContact C-N 3.34Å; K87-V89 PolarHBondContact O-N 2.91Å; K87-K90 PolarHBondContact O-N 3.24Å; K87-L91 WeakPolarHBondContact O-CB 3.45Å; K87-L91 PolarHBondContact O-N 3.07Å
88	V	95.7	Very high	95	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-46.2	176.2	171.7	0	0	0	0	110.8	F63 L83 D84 K85 K92 Q93 V94 T97 F372	F63-V88 HydrophobicContact CB-CG2 4.17Å; L83-V88 HydrophobicContact CB-CG2 4.09Å; D84-V88 WeakPolarHBondContact O-CG2 3.39Å; D84-V88 PolarHBondContact O-N 3.25Å; K85-V88 PolarHBondContact O-N 3.08Å; V88-K92 PolarHBondContact O-N 3.28Å; V88-Q93 HydrophobicContact CG1-CB 4.2Å; V88-Q93 PolarHBondContact O-N 2.52Å; V88-V94 HydrophobicContact CG1-CG2 4.24Å; V88-T97 WeakPolarHBondContact CG1-OG1 3.36Å; V88-F372 HydrophobicContact CB-CZ 4.13Å; V88-F372 HydrophobicContact CG1-CE1 3.92Å; V88-F372 HydrophobicContact CG1-CZ 3.72Å
89	V	96.1	Very high	94.8	Very high	47 Å²	47	53.1 Å²	53.1	29%	0.285	25%	0.254	S	S	.	.	H	α-helix	trans	-66.6	-48.3	177.1	173.3	0	0	0	0	111.5	K85 Q86 K87 L91 K92 V94 L368 L371 F372	K85-V89 WeakPolarHBondContact O-CG2 3.07Å; K85-V89 PolarHBondContact O-N 3.3Å; Q86-V89 PolarHBondContact O-N 3.08Å; K87-V89 VanDerWaalsContact C-N 3.34Å; K87-V89 PolarHBondContact O-N 2.91Å; V89-L91 PolarHBondContact O-N 3.35Å; V89-K92 PolarHBondContact O-N 2.88Å; V89-V94 HydrophobicContact CB-CG2 4.49Å; V89-V94 HydrophobicContact CG2-CG2 3.76Å; V89-L368 HydrophobicContact CB-CD1 4.28Å; V89-L368 HydrophobicContact CG2-CD1 3.76Å; V89-L368 HydrophobicContact CG2-CD2 4.35Å; V89-L368 HydrophobicContact CG2-CG 4.49Å; V89-L371 HydrophobicContact CG1-CD1 4.34Å; V89-L371 HydrophobicContact CG2-CD1 3.56Å; V89-F372 HydrophobicContact CG2-CE2 3.97Å; V89-F372 HydrophobicContact CG2-CZ 4Å
90	K	95.4	Very high	94.7	Very high	179 Å²	179	53 Å²	53	78%	0.778	25%	0.251	S	S	*	.	H	α-helix	trans	-56.5	-38.3	-179.3	-177.7	178.4	179.4	-179.8	0	112.2	Q86 K87 K92	Q86-K90 VanDerWaalsContact O-CB 3.23Å; Q86-K90 WeakPolarHBondContact O-CB 3.16Å; Q86-K90 PolarHBondContact O-N 3.44Å; K87-K90 PolarHBondContact O-N 3.24Å; K90-K92 VanDerWaalsContact C-N 3.32Å
91	L	92.7	Very high	94.7	Very high	81 Å²	81	53.1 Å²	53.1	42%	0.424	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	10.7	179.8	-63	172	0	0	0	113.3	F63 K87 V89 Q93	F63-L91 HydrophobicContact CD1-CB 3.98Å; F63-L91 HydrophobicContact CD1-CD1 3.44Å; F63-L91 VanDerWaalsContact CD1-CD1 3.44Å; F63-L91 HydrophobicContact CD1-CG 4.29Å; F63-L91 HydrophobicContact CE1-CB 3.54Å; F63-L91 HydrophobicContact CE1-CD1 3.38Å; F63-L91 HydrophobicContact CE1-CG 4.06Å; K87-L91 WeakPolarHBondContact O-CB 3.45Å; K87-L91 PolarHBondContact O-N 3.07Å; V89-L91 PolarHBondContact O-N 3.35Å; L91-Q93 VanDerWaalsContact C-N 3.32Å; L91-Q93 HydrophobicContact CB-CG 4.31Å; L91-Q93 WeakPolarHBondContact O-CG 3.34Å; L91-Q93 PolarHBondContact O-N 3.2Å; L91-Q93 PolarHBondContact O-NE2 2.9Å
92	K	93.3	Very high	94.7	Very high	185 Å²	185	55 Å²	55	80%	0.804	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	39.9	175.9	-56.4	-178.1	178.8	-178.8	0	113.5	V88 V89 K90	V88-K92 PolarHBondContact O-N 3.28Å; V89-K92 PolarHBondContact O-N 2.88Å; K90-K92 VanDerWaalsContact C-N 3.32Å
93	Q	92.2	Very high	94.8	Very high	42 Å²	42	54.7 Å²	54.7	20%	0.196	26%	0.256	C	S	.	.			trans	-107.5	16.5	-177	-62.6	-54.7	-53.8	0	0	114.4	F63 V88 L91 H96 T97	F63-Q93 HydrophobicContact CD1-CG 4.13Å; F63-Q93 HydrophobicContact CE1-CB 4.25Å; F63-Q93 HydrophobicContact CE1-CG 3.37Å; F63-Q93 HydrophobicContact CE2-CG 4.2Å; F63-Q93 HydrophobicContact CZ-CB 4.42Å; F63-Q93 HydrophobicContact CZ-CG 3.43Å; F63-Q93 VanDerWaalsContact CZ-CG 3.43Å; V88-Q93 HydrophobicContact CG1-CB 4.2Å; V88-Q93 PolarHBondContact O-N 2.52Å; L91-Q93 VanDerWaalsContact C-N 3.32Å; L91-Q93 HydrophobicContact CB-CG 4.31Å; L91-Q93 WeakPolarHBondContact O-CG 3.34Å; L91-Q93 PolarHBondContact O-N 3.2Å; L91-Q93 PolarHBondContact O-NE2 2.9Å; Q93-H96 PolarHBondContact O-N 3.05Å; Q93-H96 PolarHBondContact OE1-ND1 3.42Å; Q93-T97 WeakPolarHBondContact O-CB 3.27Å; Q93-T97 PolarHBondContact O-N 3.23Å; Q93-T97 PolarHBondContact O-OG1 3.44Å
94	V	94.5	Very high	94.8	Very high	32 Å²	32	54.5 Å²	54.5	19%	0.194	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-53.2	-178.5	179.8	0	0	0	0	111.2	V88 V89 H96 T97 L98 L371 F372	V88-V94 HydrophobicContact CG1-CG2 4.24Å; V89-V94 HydrophobicContact CB-CG2 4.49Å; V89-V94 HydrophobicContact CG2-CG2 3.76Å; V94-H96 PolarHBondContact O-N 2.95Å; V94-T97 PolarHBondContact O-N 3.46Å; V94-L98 HydrophobicContact CG1-CD1 4.01Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 3.48Å; V94-L371 HydrophobicContact CG1-CB 4.46Å; V94-F372 HydrophobicContact CB-CE1 4.43Å; V94-F372 HydrophobicContact CG1-CD1 4.47Å; V94-F372 HydrophobicContact CG1-CE1 3.93Å; V94-F372 HydrophobicContact CG1-CZ 4.39Å; V94-F372 HydrophobicContact CG2-CE1 4.29Å; V94-F372 HydrophobicContact CG2-CZ 4.02Å
95	E	92.4	Very high	94.9	Very high	126 Å²	126	53.7 Å²	53.7	59%	0.589	25%	0.25	S	C	*	.	H	α-helix	trans	-60.3	-45.6	-180	-172.5	-170.6	154.5	0	0	111.5	T97 L98 N99 K198	E95-T97 VanDerWaalsContact C-N 3.35Å; E95-T97 PolarHBondContact O-N 3.16Å; E95-L98 PolarHBondContact O-N 2.92Å; E95-N99 WeakPolarHBondContact O-CB 3.2Å; E95-N99 PolarHBondContact O-N 3.4Å; E95-K198 IonicContact OE1-NZ 3.74Å; E95-K198 PolarHBondContact OE1-NZ 2.91Å
96	H	90.1	Very high	94.9	Very high	41 Å²	41	53.7 Å²	53.7	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-39.8	179.4	-67.1	156.6	0	0	0	112.3	Q93 V94 N99 E100	Q93-H96 PolarHBondContact O-N 3.05Å; Q93-H96 PolarHBondContact OE1-ND1 3.42Å; V94-H96 PolarHBondContact O-N 2.95Å; H96-N99 PolarHBondContact O-N 3.06Å; H96-E100 VanDerWaalsContact O-CB 3.26Å; H96-E100 WeakPolarHBondContact O-CB 3.27Å; H96-E100 PolarHBondContact O-N 3.23Å
97	T	94.1	Very high	95	Very high	6 Å²	6	48.9 Å²	48.9	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-45.9	179	-56.9	0	0	0	0	111.5	L83 V88 Q93 V94 E95 N99 E100 K101 L125 F375	L83-T97 HydrophobicContact CD1-CG2 3.62Å; V88-T97 WeakPolarHBondContact CG1-OG1 3.36Å; Q93-T97 WeakPolarHBondContact O-CB 3.27Å; Q93-T97 PolarHBondContact O-N 3.23Å; Q93-T97 PolarHBondContact O-OG1 3.44Å; V94-T97 PolarHBondContact O-N 3.46Å; E95-T97 VanDerWaalsContact C-N 3.35Å; E95-T97 PolarHBondContact O-N 3.16Å; T97-N99 VanDerWaalsContact C-N 3.34Å; T97-N99 PolarHBondContact O-N 2.81Å; T97-E100 PolarHBondContact O-N 3.23Å; T97-K101 PolarHBondContact O-N 3.3Å; T97-L125 HydrophobicContact CG2-CD1 3.73Å; T97-F375 HydrophobicContact CG2-CD2 4.47Å; T97-F375 HydrophobicContact CG2-CE2 4.03Å
98	L	95.1	Very high	95	Very high	37 Å²	37	47.8 Å²	47.8	19%	0.194	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-42.7	176.4	-70.3	173	0	0	0	111.2	V94 E95 R102 F372 E374 F375	V94-L98 HydrophobicContact CG1-CD1 4.01Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 3.48Å; E95-L98 PolarHBondContact O-N 2.92Å; L98-R102 WeakPolarHBondContact O-CB 3.46Å; L98-R102 PolarHBondContact O-N 3.05Å; L98-F372 HydrophobicContact CD2-CD1 4.34Å; L98-E374 HydrophobicContact CD2-CB 4.5Å; L98-F375 HydrophobicContact CD2-CB 3.94Å; L98-F375 HydrophobicContact CD2-CD2 4.16Å
99	N	93.6	Very high	95.1	Very high	28 Å²	28	48.1 Å²	48.1	15%	0.15	23%	0.228	C	C	.	.	H	α-helix	trans	-69.7	-38.5	179.4	179.7	65.3	0	0	0	112.2	E95 H96 T97 R102 I103 A197	E95-N99 WeakPolarHBondContact O-CB 3.2Å; E95-N99 PolarHBondContact O-N 3.4Å; H96-N99 PolarHBondContact O-N 3.06Å; T97-N99 VanDerWaalsContact C-N 3.34Å; T97-N99 PolarHBondContact O-N 2.81Å; N99-R102 PolarHBondContact O-N 3.33Å; N99-I103 WeakPolarHBondContact O-CB 3.34Å; N99-I103 VanDerWaalsContact O-CG1 3.23Å; N99-I103 WeakPolarHBondContact O-CG1 3.47Å; N99-I103 PolarHBondContact O-N 3.13Å; N99-A197 PolarHBondContact ND2-O 3.36Å
100	E	95.3	Very high	95	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-56.7	-55	172.3	179.7	178.5	-168.1	0	0	110.4	K81 H96 T97 R102 I103 L104 M127 F194	K81-E100 IonicContact NZ-OE1 3.49Å; K81-E100 PolarHBondContact NZ-OE1 2.95Å; K81-E100 IonicContact NZ-OE2 3.21Å; K81-E100 PolarHBondContact NZ-OE2 3.19Å; H96-E100 VanDerWaalsContact O-CB 3.26Å; H96-E100 WeakPolarHBondContact O-CB 3.27Å; H96-E100 PolarHBondContact O-N 3.23Å; T97-E100 PolarHBondContact O-N 3.23Å; E100-R102 VanDerWaalsContact C-N 3.29Å; E100-R102 PolarHBondContact O-N 3.3Å; E100-I103 PolarHBondContact O-N 2.97Å; E100-L104 HydrophobicContact CG-CD1 3.82Å; E100-L104 HydrophobicContact CG-CG 4.45Å; E100-L104 WeakPolarHBondContact O-CB 3.48Å; E100-L104 WeakPolarHBondContact O-CG 3.21Å; E100-L104 PolarHBondContact O-N 3.33Å; E100-M127 HydrophobicContact CG-CE 4.46Å; E100-M127 HydrophobicContact CG-SD 4.35Å; E100-F194 HydrophobicContact CG-CB 4.06Å
101	K	96.7	Very high	95.1	Very high	3 Å²	3	39 Å²	39	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-57.7	-44.2	177.6	-176	-91.3	171.8	164.2	0	111.3	A43 T97 I103 L104 Q105 M115 S118 M127 F375	A43-K101 PolarHBondContact O-NZ 3.47Å; T97-K101 PolarHBondContact O-N 3.3Å; K101-I103 VanDerWaalsContact C-N 3.33Å; K101-I103 PolarHBondContact O-N 2.77Å; K101-L104 PolarHBondContact O-N 3.33Å; K101-Q105 WeakPolarHBondContact O-CG 3.16Å; K101-Q105 PolarHBondContact O-N 3.41Å; K101-Q105 VanDerWaalsContact O-N 3.08Å; K101-M115 HydrophobicContact CD-CE 4.48Å; K101-M115 HydrophobicContact CG-CE 4.05Å; K101-M115 HydrophobicContact CG-SD 4.39Å; K101-S118 WeakPolarHBondContact CE-OG 3.47Å; K101-M127 HydrophobicContact CB-SD 3.92Å; K101-M127 HydrophobicContact CG-CG 4.4Å; K101-M127 HydrophobicContact CG-SD 4.39Å; K101-F375 HydrophobicContact CB-CD2 4.34Å; K101-F375 HydrophobicContact CB-CE2 3.84Å; K101-F375 HydrophobicContact CB-CZ 4.29Å; K101-F375 VanDerWaalsContact CD-OXT 3.28Å; K101-F375 WeakPolarHBondContact CD-OXT 3.48Å; K101-F375 WeakPolarHBondContact CE-OXT 3.38Å; K101-F375 HydrophobicContact CG-CD2 4.36Å; K101-F375 HydrophobicContact CG-CE1 4.43Å; K101-F375 HydrophobicContact CG-CE2 3.93Å; K101-F375 HydrophobicContact CG-CZ 3.96Å; K101-F375 PolarHBondContact NZ-OXT 2.91Å
102	R	96.8	Very high	95.4	Very high	77 Å²	77	35.1 Å²	35.1	29%	0.291	17%	0.168	S	C	.	.	H	α-helix	trans	-65.2	-36.1	-177.8	-168.2	178.7	-176.4	158	4.8	112.9	W39 L98 N99 E100 Q105 A106	W39-R102 HydrophobicContact CD2-CG 4.35Å; W39-R102 HydrophobicContact CE3-CG 3.89Å; W39-R102 HydrophobicContact CH2-CB 4.44Å; W39-R102 HydrophobicContact CH2-CG 3.93Å; W39-R102 HydrophobicContact CZ2-CG 4.37Å; W39-R102 HydrophobicContact CZ3-CB 4.2Å; W39-R102 HydrophobicContact CZ3-CG 3.67Å; W39-R102 PolarHBondContact O-NE 2.97Å; W39-R102 PolarHBondContact O-NH2 2.89Å; L98-R102 WeakPolarHBondContact O-CB 3.46Å; L98-R102 PolarHBondContact O-N 3.05Å; N99-R102 PolarHBondContact O-N 3.33Å; E100-R102 VanDerWaalsContact C-N 3.29Å; E100-R102 PolarHBondContact O-N 3.3Å; R102-Q105 VanDerWaalsContact O-CG 3.31Å; R102-Q105 WeakPolarHBondContact O-CG 3.34Å; R102-A106 WeakPolarHBondContact O-CB 3.3Å
103	I	97.3	Very high	95.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-71.3	-51.5	174.4	-68.9	168	0	0	0	109.9	W39 N99 E100 K101 Q105 A106 I107 L171 F194 A197	W39-I103 HydrophobicContact CH2-CG1 4.14Å; W39-I103 HydrophobicContact CZ3-CB 4.49Å; W39-I103 HydrophobicContact CZ3-CG1 3.66Å; N99-I103 WeakPolarHBondContact O-CB 3.34Å; N99-I103 VanDerWaalsContact O-CG1 3.23Å; N99-I103 WeakPolarHBondContact O-CG1 3.47Å; N99-I103 PolarHBondContact O-N 3.13Å; E100-I103 PolarHBondContact O-N 2.97Å; K101-I103 VanDerWaalsContact C-N 3.33Å; K101-I103 PolarHBondContact O-N 2.77Å; I103-Q105 VanDerWaalsContact C-N 3.32Å; I103-Q105 PolarHBondContact O-N 2.93Å; I103-A106 PolarHBondContact O-N 3Å; I103-I107 HydrophobicContact CG2-CD1 4.3Å; I103-I107 HydrophobicContact CG2-CG2 4.04Å; I103-I107 WeakPolarHBondContact O-CG1 3.38Å; I103-I107 PolarHBondContact O-N 3.23Å; I103-L171 HydrophobicContact CD1-CD2 3.92Å; I103-L171 HydrophobicContact CG1-CD2 3.88Å; I103-L171 HydrophobicContact CG2-CD1 4.01Å; I103-L171 HydrophobicContact CG2-CD2 4.36Å; I103-F194 HydrophobicContact CG2-CD1 3.69Å; I103-F194 HydrophobicContact CG2-CE1 4.24Å; I103-A197 HydrophobicContact CD1-CB 3.66Å; I103-A197 WeakPolarHBondContact CD1-O 3.29Å; I103-A197 HydrophobicContact CG2-CB 4.49Å
104	L	97.4	Very high	95.8	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-37.3	-175.2	-78.6	173.7	0	0	0	113.6	E100 K101 A106 I107 V113 M115 M127 L129 F194	E100-L104 HydrophobicContact CG-CD1 3.82Å; E100-L104 HydrophobicContact CG-CG 4.45Å; E100-L104 WeakPolarHBondContact O-CB 3.48Å; E100-L104 WeakPolarHBondContact O-CG 3.21Å; E100-L104 PolarHBondContact O-N 3.33Å; K101-L104 PolarHBondContact O-N 3.33Å; L104-A106 VanDerWaalsContact C-N 3.27Å; L104-A106 PolarHBondContact O-N 3.17Å; L104-I107 HydrophobicContact CD2-CD1 4.24Å; L104-V113 HydrophobicContact CD2-CG1 4.09Å; L104-M115 HydrophobicContact CB-CB 3.98Å; L104-M115 HydrophobicContact CB-CE 4.28Å; L104-M115 HydrophobicContact CB-SD 4.07Å; L104-M127 HydrophobicContact CD1-SD 4.07Å; L104-L129 HydrophobicContact CD1-CD2 4.09Å; L104-F194 HydrophobicContact CD2-CB 4.17Å; L104-F194 HydrophobicContact CD2-CD2 3.56Å; L104-F194 HydrophobicContact CD2-CE2 4.07Å; L104-F194 HydrophobicContact CD2-CG 3.89Å; L104-F194 HydrophobicContact CG-CB 4.1Å; L104-F194 HydrophobicContact CG-CD2 4.41Å; L104-F194 HydrophobicContact CG-CG 4.32Å
105	Q	96.6	Very high	95.9	Very high	24 Å²	24	26.4 Å²	26.4	11%	0.112	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-21.7	175.8	68.1	-173.1	-8	0	0	113.5	R38 A43 K101 R102 I103 M115	R38-Q105 WeakPolarHBondContact CD-O 3.37Å; A43-Q105 PolarHBondContact O-OE1 3.16Å; K101-Q105 WeakPolarHBondContact O-CG 3.16Å; K101-Q105 PolarHBondContact O-N 3.41Å; K101-Q105 VanDerWaalsContact O-N 3.08Å; R102-Q105 VanDerWaalsContact O-CG 3.31Å; R102-Q105 WeakPolarHBondContact O-CG 3.34Å; I103-Q105 VanDerWaalsContact C-N 3.32Å; I103-Q105 PolarHBondContact O-N 2.93Å; Q105-M115 HydrophobicContact CB-CE 3.47Å; Q105-M115 VanDerWaalsContact CB-CE 3.47Å
106	A	97.3	Very high	96.2	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.008	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-24.3	-170.7	0	0	0	0	0	112.9	F35 R38 W39 R102 I103 L104	F35-A106 HydrophobicContact CD2-CB 3.61Å; F35-A106 WeakPolarHBondContact CD2-O 3.46Å; F35-A106 HydrophobicContact CE2-CB 3.55Å; F35-A106 HydrophobicContact CZ-CB 4.49Å; R38-A106 HydrophobicContact CB-CB 4.01Å; W39-A106 HydrophobicContact CB-CB 4.29Å; W39-A106 HydrophobicContact CE3-CB 4.17Å; R102-A106 WeakPolarHBondContact O-CB 3.3Å; I103-A106 PolarHBondContact O-N 3Å; L104-A106 VanDerWaalsContact C-N 3.27Å; L104-A106 PolarHBondContact O-N 3.17Å
107	I	97.6	Very high	96.5	Very high	4 Å²	4	23 Å²	23	2%	0.021	12%	0.118	C	C	.	.			trans	-84.8	154.3	177.6	63.8	178.3	0	0	0	112	F35 I103 L104 L112 Y165 L166 L169 L171 F194	F35-I107 HydrophobicContact CD2-CG2 4.18Å; F35-I107 HydrophobicContact CE2-CG2 4.11Å; I103-I107 HydrophobicContact CG2-CD1 4.3Å; I103-I107 HydrophobicContact CG2-CG2 4.04Å; I103-I107 WeakPolarHBondContact O-CG1 3.38Å; I103-I107 PolarHBondContact O-N 3.23Å; L104-I107 HydrophobicContact CD2-CD1 4.24Å; I107-L112 HydrophobicContact CB-CD1 4.5Å; I107-L112 HydrophobicContact CD1-CB 4.43Å; I107-L112 HydrophobicContact CD1-CD1 3.95Å; I107-Y165 WeakPolarHBondContact CA-OH 3.44Å; I107-Y165 HydrophobicContact CB-CE1 4.11Å; I107-Y165 HydrophobicContact CG2-CE1 4.27Å; I107-L166 HydrophobicContact CG2-CD2 4.09Å; I107-L169 HydrophobicContact CG2-CD1 4.33Å; I107-L171 HydrophobicContact CG2-CD1 3.67Å; I107-F194 HydrophobicContact CD1-CD1 4.13Å; I107-F194 HydrophobicContact CD1-CE1 3.52Å; I107-F194 HydrophobicContact CD1-CE2 4.16Å; I107-F194 HydrophobicContact CD1-CZ 3.53Å
108	D	95.7	Very high	96.7	Very high	78 Å²	78	22.9 Å²	22.9	42%	0.417	12%	0.117	S	C	.	.			trans	-158.3	102.2	177.8	-166.5	-9.3	0	0	0	108.9	R38 Y165	R38-D108 IonicContact CZ-OD2 2.87Å; R38-D108 IonicContact NH1-OD2 3.78Å; R38-D108 PolarHBondContact NH1-OD2 2.63Å; R38-D108 IonicContact NH2-OD2 2.83Å; R38-D108 PolarHBondContact NH2-OD2 3.04Å; R38-D108 VanDerWaalsContact NH2-OD2 3.14Å; D108-Y165 PolarHBondContact N-OH 2.92Å; D108-Y165 PolarHBondContact O-OH 3Å
109	F	96.5	Very high	96.9	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.026	11%	0.109	C	C	.	.			trans	-153.3	143.9	-177.8	-162.9	-106.2	0	0	0	111.8	F27 F111 L112 L161 A162 Y165 Y315	F27-F109 HydrophobicContact CE1-CD2 4.23Å; F27-F109 AromaticContact CE1-CE2 3.85Å; F27-F109 HydrophobicContact CE1-CE2 3.85Å; F27-F109 HydrophobicContact CZ-CD2 4.23Å; F27-F109 HydrophobicContact CZ-CE2 4.19Å; F109-F111 HydrophobicContact CD1-CB 4.5Å; F109-F111 HydrophobicContact CD1-CD2 4.32Å; F109-F111 AromaticContact CE1-CD2 3.73Å; F109-F111 HydrophobicContact CE1-CD2 3.73Å; F109-F111 HydrophobicContact CE1-CE2 4.26Å; F109-F111 PolarHBondContact O-N 3.29Å; F109-L112 HydrophobicContact CB-CB 4.36Å; F109-L112 HydrophobicContact CB-CD1 3.75Å; F109-L112 HydrophobicContact CB-CG 3.86Å; F109-L112 HydrophobicContact CD1-CG 4.31Å; F109-L112 PolarHBondContact O-N 3.21Å; F109-L161 HydrophobicContact CE1-CB 4.08Å; F109-L161 HydrophobicContact CZ-CB 4.02Å; F109-L161 WeakPolarHBondContact CZ-O 3.4Å; F109-A162 HydrophobicContact CD1-CB 4.34Å; F109-A162 HydrophobicContact CE1-CB 4.31Å; F109-Y165 HydrophobicContact CB-CD1 3.69Å; F109-Y165 HydrophobicContact CB-CD2 4.45Å; F109-Y165 HydrophobicContact CB-CE1 3.74Å; F109-Y165 HydrophobicContact CB-CE2 4.47Å; F109-Y165 HydrophobicContact CB-CG 4.06Å; F109-Y165 HydrophobicContact CD1-CD1 4.45Å; F109-Y165 HydrophobicContact CD1-CG 4.42Å; F109-Y165 HydrophobicContact CD2-CD1 4.01Å; F109-Y165 AromaticContact CD2-CD2 3.55Å; F109-Y165 HydrophobicContact CD2-CD2 3.55Å; F109-Y165 HydrophobicContact CD2-CE2 4.13Å; F109-Y165 AromaticContact CD2-CG 3.47Å; F109-Y165 HydrophobicContact CD2-CG 3.47Å; F109-Y165 VanDerWaalsContact CD2-CG 3.47Å; F109-Y165 HydrophobicContact CE2-CD2 4.09Å; F109-Y165 AromaticContact CE2-CG 3.97Å; F109-Y165 HydrophobicContact CE2-CG 3.97Å; F109-Y165 AromaticContact CG-CD1 3.81Å; F109-Y165 HydrophobicContact CG-CD1 3.81Å; F109-Y165 HydrophobicContact CG-CD2 4.2Å; F109-Y165 HydrophobicContact CG-CE1 4.32Å; F109-Y165 AromaticContact CG-CG 3.73Å; F109-Y165 HydrophobicContact CG-CG 3.73Å; F109-Y315 HydrophobicContact CD2-CE2 4.32Å; F109-Y315 HydrophobicContact CE2-CD2 4.05Å; F109-Y315 AromaticContact CE2-CE2 3.62Å; F109-Y315 HydrophobicContact CE2-CE2 3.62Å; F109-Y315 AromaticContact CZ-CD2 3.91Å; F109-Y315 HydrophobicContact CZ-CD2 3.91Å; F109-Y315 AromaticContact CZ-CE2 3.96Å; F109-Y315 HydrophobicContact CZ-CE2 3.96Å
110	P	95.4	Very high	97.1	Very high	35 Å²	35	21.6 Å²	21.6	23%	0.227	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.6	-169.6	-29.4	36.5	0	0	0	116.1	K190 Y315	P110-K190 VanDerWaalsContact O-CE 3.26Å; P110-K190 WeakPolarHBondContact O-CE 3.16Å; P110-K190 PolarHBondContact O-NZ 2.91Å; P110-Y315 HydrophobicContact CG-CD2 4.06Å; P110-Y315 HydrophobicContact CG-CE2 3.59Å
111	F	97.7	Very high	97.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	10.1	-177.4	-45.1	-47	0	0	0	113.6	F109 Q158 L161 Y188 L189 K190 I191 I314 K317	F109-F111 HydrophobicContact CD1-CB 4.5Å; F109-F111 HydrophobicContact CD1-CD2 4.32Å; F109-F111 AromaticContact CE1-CD2 3.73Å; F109-F111 HydrophobicContact CE1-CD2 3.73Å; F109-F111 HydrophobicContact CE1-CE2 4.26Å; F109-F111 PolarHBondContact O-N 3.29Å; F111-Q158 HydrophobicContact CB-CB 4.48Å; F111-Q158 HydrophobicContact CD1-CB 4.28Å; F111-Q158 HydrophobicContact CD1-CG 4.16Å; F111-Q158 HydrophobicContact CD2-CB 3.76Å; F111-Q158 HydrophobicContact CD2-CG 4.17Å; F111-Q158 WeakPolarHBondContact CD2-O 3.46Å; F111-Q158 HydrophobicContact CE1-CG 4.01Å; F111-Q158 HydrophobicContact CE2-CB 4.05Å; F111-Q158 HydrophobicContact CE2-CG 4.02Å; F111-Q158 HydrophobicContact CG-CB 3.91Å; F111-Q158 HydrophobicContact CG-CG 4.26Å; F111-Q158 HydrophobicContact CZ-CB 4.43Å; F111-Q158 HydrophobicContact CZ-CG 3.94Å; F111-L161 HydrophobicContact CD2-CB 4.27Å; F111-L161 HydrophobicContact CE2-CB 4.05Å; F111-L161 HydrophobicContact CE2-CD1 3.79Å; F111-Y188 HydrophobicContact CD1-CD1 4.22Å; F111-Y188 AromaticContact CE1-CD1 3.55Å; F111-Y188 HydrophobicContact CE1-CD1 3.55Å; F111-Y188 AromaticContact CE1-CE1 3.99Å; F111-Y188 HydrophobicContact CE1-CE1 3.99Å; F111-Y188 HydrophobicContact CZ-CD1 4.36Å; F111-Y188 HydrophobicContact CZ-CE1 4.41Å; F111-L189 WeakPolarHBondContact CA-O 3.22Å; F111-K190 CarbonylContact O-C 3.57Å; F111-K190 WeakPolarHBondContact O-CA 3.43Å; F111-I191 WeakPolarHBondContact O-CG1 3.36Å; F111-I191 PolarHBondContact O-N 2.87Å; F111-I314 HydrophobicContact CE2-CG2 4.18Å; F111-I314 HydrophobicContact CZ-CG2 3.91Å; F111-I314 WeakPolarHBondContact CZ-O 3.48Å; F111-K317 HydrophobicContact CE1-CG 4.17Å
112	L	98.2	Very high	97.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-107.3	147.3	172.2	-55.2	-177.2	0	0	0	108.6	I107 F109 A162 Y165 L166 K190 I191 F194	I107-L112 HydrophobicContact CB-CD1 4.5Å; I107-L112 HydrophobicContact CD1-CB 4.43Å; I107-L112 HydrophobicContact CD1-CD1 3.95Å; F109-L112 HydrophobicContact CB-CB 4.36Å; F109-L112 HydrophobicContact CB-CD1 3.75Å; F109-L112 HydrophobicContact CB-CG 3.86Å; F109-L112 HydrophobicContact CD1-CG 4.31Å; F109-L112 PolarHBondContact O-N 3.21Å; L112-A162 HydrophobicContact CD2-CB 3.87Å; L112-Y165 HydrophobicContact CD1-CD1 3.75Å; L112-Y165 HydrophobicContact CD1-CE1 3.73Å; L112-L166 HydrophobicContact CD1-CD1 4.42Å; L112-L166 HydrophobicContact CD1-CD2 3.78Å; L112-L166 HydrophobicContact CD1-CG 4.06Å; L112-L166 HydrophobicContact CD2-CD1 4.39Å; L112-K190 WeakPolarHBondContact O-CD 3.38Å; L112-K190 PolarHBondContact O-NZ 3.44Å; L112-I191 HydrophobicContact CD2-CB 3.74Å; L112-I191 HydrophobicContact CD2-CD1 3.74Å; L112-I191 HydrophobicContact CD2-CG1 3.96Å; L112-I191 HydrophobicContact CD2-CG2 4.46Å; L112-F194 HydrophobicContact CB-CZ 4.46Å; L112-F194 HydrophobicContact CD1-CZ 4.26Å; L112-F194 HydrophobicContact CD2-CZ 3.99Å; L112-F194 HydrophobicContact CG-CZ 4.46Å
113	V	97.3	Very high	97.1	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-68.3	130.1	172.1	75.4	0	0	0	0	109.5	L104 L129 E130 I191	L104-V113 HydrophobicContact CD2-CG1 4.09Å; V113-L129 HydrophobicContact CG1-CD2 3.69Å; V113-L129 HydrophobicContact CG2-CB 4.03Å; V113-L129 HydrophobicContact CG2-CD2 4.08Å; V113-E130 WeakPolarHBondContact CA-OE1 3.44Å; V113-E130 HydrophobicContact CG2-CG 3.61Å; V113-I191 WeakPolarHBondContact CB-O 3.38Å; V113-I191 WeakPolarHBondContact CG1-O 3.34Å; V113-I191 PolarHBondContact N-O 2.93Å
114	N	96.3	Very high	97.1	Very high	48 Å²	48	22.1 Å²	22.1	26%	0.257	12%	0.119	S	C	.	.	P	Polyproline II helix	trans	-91.1	130.2	178.8	-72	-20.5	0	0	0	110.3	L129 E130	N114-L129 CarbonylContact O-C 3.5Å; N114-L129 WeakPolarHBondContact O-CA 3.38Å; N114-E130 HydrophobicContact CB-CG 4.5Å; N114-E130 PolarHBondContact N-OE1 2.86Å; N114-E130 PolarHBondContact O-N 3.14Å
115	M	97.6	Very high	97.2	Very high	25 Å²	25	22 Å²	22	12%	0.123	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.1	167.8	-173.3	175.6	76.9	0	0	109.2	K101 L104 Q105 F117 M127	K101-M115 HydrophobicContact CD-CE 4.48Å; K101-M115 HydrophobicContact CG-CE 4.05Å; K101-M115 HydrophobicContact CG-SD 4.39Å; L104-M115 HydrophobicContact CB-CB 3.98Å; L104-M115 HydrophobicContact CB-CE 4.28Å; L104-M115 HydrophobicContact CB-SD 4.07Å; Q105-M115 HydrophobicContact CB-CE 3.47Å; Q105-M115 VanDerWaalsContact CB-CE 3.47Å; M115-F117 WeakPolarHBondContact CG-O 3.35Å; M115-M127 HydrophobicContact SD-CB 3.81Å; M115-M127 HydrophobicContact SD-CG 3.75Å; M115-M127 HydrophobicContact SD-SD 4.21Å
116	T	97.1	Very high	97.2	Very high	62 Å²	62	20.9 Å²	20.9	38%	0.38	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-41.2	-177.3	-51.6	0	0	0	0	111.4	Y78 V128	Y78-T116 HydrophobicContact CE1-CG2 4.09Å; T116-V128 PolarHBondContact N-O 3.48Å
117	F	98.1	Very high	97.2	Very high	35 Å²	35	20.8 Å²	20.8	15%	0.154	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	154.2	178.9	-45.5	-84.6	0	0	0	111.6	T46 A47 F52 Y78 M115 V128	T46-F117 VanDerWaalsContact OG1-CA 3.29Å; T46-F117 WeakPolarHBondContact OG1-CA 3.21Å; A47-F117 HydrophobicContact CB-CB 3.92Å; A47-F117 HydrophobicContact CB-CD1 3.92Å; A47-F117 HydrophobicContact CB-CG 4.03Å; F52-F117 HydrophobicContact CE1-CD2 4.11Å; F52-F117 HydrophobicContact CE1-CE2 4.25Å; F52-F117 HydrophobicContact CZ-CB 4.47Å; F52-F117 AromaticContact CZ-CD2 3.75Å; F52-F117 HydrophobicContact CZ-CD2 3.75Å; F52-F117 HydrophobicContact CZ-CE2 4.17Å; F52-F117 HydrophobicContact CZ-CG 4.16Å; Y78-F117 HydrophobicContact CE1-CE2 4.4Å; Y78-F117 AromaticContact CE2-CE2 3.95Å; Y78-F117 HydrophobicContact CE2-CE2 3.95Å; Y78-F117 AromaticContact CZ-CE2 3.86Å; M115-F117 WeakPolarHBondContact CG-O 3.35Å; F117-V128 HydrophobicContact CB-CB 3.86Å; F117-V128 HydrophobicContact CB-CG2 3.98Å; F117-V128 HydrophobicContact CD2-CB 4.03Å; F117-V128 HydrophobicContact CD2-CG1 3.89Å; F117-V128 HydrophobicContact CG-CB 4.46Å; F117-V128 PolarHBondContact N-O 3.21Å; F117-V128 PolarHBondContact O-N 2.79Å
118	S	98.2	Very high	97.3	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.014	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	138.3	169.3	59.2	0	0	0	0	110.2	N45 T46 K101 Y126	N45-S118 WeakPolarHBondContact CA-O 3.44Å; N45-S118 PolarHBondContact N-O 2.84Å; T46-S118 PolarHBondContact N-O 2.8Å; T46-S118 PolarHBondContact OG1-N 3.13Å; T46-S118 PolarHBondContact OG1-O 2.99Å; K101-S118 WeakPolarHBondContact CE-OG 3.47Å; S118-Y126 VanDerWaalsContact CA-O 3.23Å; S118-Y126 WeakPolarHBondContact CA-O 3.31Å
119	F	98.3	Very high	97.4	Very high	5 Å²	5	17.5 Å²	17.5	2%	0.022	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	173.8	-179.7	57.8	-87.3	0	0	0	110.3	A47 L49 F52 M80 Y126 V128 F375	A47-F119 HydrophobicContact CB-CD1 3.9Å; A47-F119 HydrophobicContact CB-CE1 4.12Å; A47-F119 WeakPolarHBondContact O-CB 3.38Å; A47-F119 VanDerWaalsContact O-CG 3.29Å; A47-F119 WeakPolarHBondContact O-CG 3.48Å; L49-F119 HydrophobicContact CB-CE2 3.97Å; L49-F119 HydrophobicContact CB-CZ 4.44Å; L49-F119 HydrophobicContact CD1-CE2 4.4Å; L49-F119 HydrophobicContact CD1-CZ 4.37Å; L49-F119 VanDerWaalsContact N-CE2 3.28Å; F52-F119 HydrophobicContact CD2-CE1 4.39Å; F52-F119 HydrophobicContact CD2-CZ 4.35Å; F52-F119 AromaticContact CE2-CE1 3.75Å; F52-F119 HydrophobicContact CE2-CE1 3.75Å; F52-F119 HydrophobicContact CE2-CZ 4.15Å; M80-F119 HydrophobicContact CE-CE1 4.32Å; M80-F119 HydrophobicContact CE-CZ 3.88Å; M80-F119 HydrophobicContact SD-CZ 4.5Å; F119-Y126 AromaticContact CD2-CD2 3.36Å; F119-Y126 HydrophobicContact CD2-CD2 3.36Å; F119-Y126 HydrophobicContact CD2-CE2 4.07Å; F119-Y126 AromaticContact CD2-CG 3.75Å; F119-Y126 HydrophobicContact CD2-CG 3.75Å; F119-Y126 HydrophobicContact CE1-CG 4.35Å; F119-Y126 AromaticContact CE2-CD1 3.89Å; F119-Y126 HydrophobicContact CE2-CD1 3.89Å; F119-Y126 AromaticContact CE2-CD2 3.21Å; F119-Y126 HydrophobicContact CE2-CD2 3.21Å; F119-Y126 HydrophobicContact CE2-CE1 4.37Å; F119-Y126 AromaticContact CE2-CE2 3.76Å; F119-Y126 HydrophobicContact CE2-CE2 3.76Å; F119-Y126 AromaticContact CE2-CG 3.28Å; F119-Y126 HydrophobicContact CE2-CG 3.28Å; F119-Y126 HydrophobicContact CG-CD2 4.28Å; F119-Y126 HydrophobicContact CG-CG 4.45Å; F119-Y126 HydrophobicContact CZ-CD1 4.02Å; F119-Y126 HydrophobicContact CZ-CD2 4.06Å; F119-Y126 AromaticContact CZ-CG 3.62Å; F119-Y126 HydrophobicContact CZ-CG 3.62Å; F119-Y126 PolarHBondContact N-O 3.01Å; F119-Y126 VanDerWaalsContact N-O 3.11Å; F119-Y126 WeakPolarHBondContact O-CA 3.32Å; F119-Y126 WeakPolarHBondContact O-CB 3.46Å; F119-Y126 WeakPolarHBondContact O-CD2 3.14Å; F119-Y126 PolarHBondContact O-N 3Å; F119-V128 HydrophobicContact CE1-CG2 3.79Å; F119-F375 WeakPolarHBondContact O-CE1 3.39Å
120	K	97.6	Very high	97.4	Very high	34 Å²	34	19.4 Å²	19.4	15%	0.148	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.3	176.5	54.1	176	166.9	171.8	0	110	N124 L125 E369 F372 F375	K120-N124 WeakPolarHBondContact CA-O 3.24Å; K120-N124 WeakPolarHBondContact CB-O 3.38Å; K120-L125 HydrophobicContact CB-CD2 3.84Å; K120-E369 VanDerWaalsContact CE-OE1 3.24Å; K120-E369 WeakPolarHBondContact CE-OE1 3.23Å; K120-E369 IonicContact NZ-OE1 2.7Å; K120-E369 PolarHBondContact NZ-OE1 3.21Å; K120-F372 PolarHBondContact NZ-O 3.08Å; K120-F375 HydrophobicContact CB-CD1 4.31Å; K120-F375 HydrophobicContact CD-CB 4.45Å
121	D	96.7	Very high	97.4	Very high	30 Å²	30	18.9 Å²	18.9	16%	0.16	10%	0.098	C	C	.	.			trans	-124.4	-164.9	167.4	68.3	27.2	0	0	0	110.2	K85 S123 N124 Y126 I362	K85-D121 VanDerWaalsContact CE-O 3.23Å; K85-D121 WeakPolarHBondContact CE-O 3.38Å; K85-D121 PolarHBondContact NZ-O 2.93Å; D121-S123 PolarHBondContact O-N 3Å; D121-S123 WeakPolarHBondContact OD1-CA 3.49Å; D121-S123 PolarHBondContact OD1-N 3.33Å; D121-N124 PolarHBondContact N-O 2.75Å; D121-N124 PolarHBondContact OD1-N 2.76Å; D121-Y126 HydrophobicContact CB-CE2 4.17Å; D121-Y126 VanDerWaalsContact OD2-CE2 3.24Å; D121-Y126 WeakPolarHBondContact OD2-CE2 3.27Å; D121-Y126 VanDerWaalsContact OD2-CZ 3.25Å; D121-Y126 PolarHBondContact OD2-OH 2.83Å; D121-I362 HydrophobicContact CB-CG2 4.23Å; D121-I362 VanDerWaalsContact OD2-CD1 3.23Å; D121-I362 WeakPolarHBondContact OD2-CD1 3.46Å; D121-I362 WeakPolarHBondContact OD2-CG1 3.41Å
122	N	97.1	Very high	97.2	Very high	45 Å²	45	19.3 Å²	19.3	24%	0.241	10%	0.1	C	C	.	.	S	Bend	trans	-60.8	-26.1	-179.1	-71.6	-16	0	0	0	114.1	I362 A363 A364 P366 Q367	N122-I362 HydrophobicContact CB-CG2 3.98Å; N122-A363 HydrophobicContact CB-CB 4.34Å; N122-A363 WeakPolarHBondContact CB-O 3.41Å; N122-A363 PolarHBondContact ND2-O 3.45Å; N122-A364 PolarHBondContact ND2-O 2.92Å; N122-P366 WeakPolarHBondContact OD1-CA 3.48Å; N122-P366 WeakPolarHBondContact OD1-CG 3.19Å; N122-Q367 WeakPolarHBondContact O-CA 3.38Å; N122-Q367 WeakPolarHBondContact O-CB 3.43Å; N122-Q367 WeakPolarHBondContact O-CG 3.47Å; N122-Q367 PolarHBondContact O-N 2.97Å
123	S	96.3	Very high	96.9	Very high	13 Å²	13	19.9 Å²	19.9	9%	0.091	10%	0.104	C	C	.	.	S	Bend	trans	-119.2	-29.5	-172.7	-70.9	0	0	0	0	114.3	K85 D121 A363	K85-S123 VanDerWaalsContact CB-O 3.31Å; K85-S123 WeakPolarHBondContact CB-O 3.38Å; K85-S123 VanDerWaalsContact CG-O 3.32Å; K85-S123 WeakPolarHBondContact CG-O 3.19Å; K85-S123 PolarHBondContact N-O 3.08Å; D121-S123 PolarHBondContact O-N 3Å; D121-S123 WeakPolarHBondContact OD1-CA 3.49Å; D121-S123 PolarHBondContact OD1-N 3.33Å; S123-A363 VanDerWaalsContact OG-CB 3.24Å; S123-A363 WeakPolarHBondContact OG-CB 3.33Å; S123-A363 PolarHBondContact OG-N 3.34Å
124	N	97.2	Very high	96.5	Very high	13 Å²	13	19.8 Å²	19.8	7%	0.07	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	157.3	-164.7	-58.1	-65.9	0	0	0	112.8	I82 L83 K120 D121 Y126 F360	I82-N124 HydrophobicContact CG2-CB 4.08Å; L83-N124 CarbonylContact O-C 3.49Å; L83-N124 WeakPolarHBondContact O-CA 3.44Å; K120-N124 WeakPolarHBondContact CA-O 3.24Å; K120-N124 WeakPolarHBondContact CB-O 3.38Å; D121-N124 PolarHBondContact N-O 2.75Å; D121-N124 PolarHBondContact OD1-N 2.76Å; N124-Y126 HydrophobicContact CB-CD2 4.43Å; N124-Y126 HydrophobicContact CB-CE1 4.2Å; N124-Y126 HydrophobicContact CB-CE2 3.65Å; N124-Y126 WeakPolarHBondContact CB-OH 3.49Å; N124-Y126 PolarHBondContact ND2-OH 2.85Å; N124-F360 WeakPolarHBondContact ND2-CE2 3.12Å
125	L	97.7	Very high	96.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.5	168.6	-48.5	171.6	0	0	0	108.3	L83 K85 T97 K120 F372 F375	L83-L125 HydrophobicContact CB-CB 4.25Å; L83-L125 PolarHBondContact N-O 3.27Å; L83-L125 PolarHBondContact O-N 3.07Å; K85-L125 HydrophobicContact CD-CD2 4.34Å; K85-L125 HydrophobicContact CG-CD2 3.9Å; K85-L125 HydrophobicContact CG-CG 3.89Å; T97-L125 HydrophobicContact CG2-CD1 3.73Å; K120-L125 HydrophobicContact CB-CD2 3.84Å; L125-F372 HydrophobicContact CD1-CD1 3.57Å; L125-F372 HydrophobicContact CD1-CE1 3.54Å; L125-F372 HydrophobicContact CD1-CG 4.15Å; L125-F372 HydrophobicContact CD1-CZ 4.11Å; L125-F372 HydrophobicContact CD2-CB 3.96Å; L125-F372 HydrophobicContact CD2-CD1 4.11Å; L125-F372 HydrophobicContact CD2-CD2 4.44Å; L125-F372 HydrophobicContact CD2-CG 3.92Å; L125-F372 HydrophobicContact CG-CD1 4.44Å; L125-F375 HydrophobicContact CB-CD1 4.28Å; L125-F375 HydrophobicContact CB-CD2 4.2Å; L125-F375 HydrophobicContact CB-CE1 3.86Å; L125-F375 HydrophobicContact CB-CE2 3.77Å; L125-F375 HydrophobicContact CB-CG 4.45Å; L125-F375 HydrophobicContact CB-CZ 3.59Å; L125-F375 HydrophobicContact CD1-CD2 3.88Å; L125-F375 HydrophobicContact CD1-CE2 3.96Å; L125-F375 HydrophobicContact CD1-CG 4.47Å; L125-F375 HydrophobicContact CD2-CB 4.23Å; L125-F375 HydrophobicContact CD2-CD1 4.01Å; L125-F375 HydrophobicContact CD2-CD2 4.06Å; L125-F375 HydrophobicContact CD2-CE1 4.44Å; L125-F375 HydrophobicContact CD2-CE2 4.49Å; L125-F375 HydrophobicContact CD2-CG 3.81Å; L125-F375 HydrophobicContact CG-CD2 4.27Å; L125-F375 HydrophobicContact CG-CE2 4.29Å; L125-F375 HydrophobicContact CG-CG 4.46Å
126	Y	98	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.6	-174.4	-57.6	-89.3	0	0	0	110.6	L49 M80 K81 I82 S118 F119 D121 N124 F360	L49-Y126 HydrophobicContact CD1-CD1 4.2Å; L49-Y126 HydrophobicContact CD1-CE1 3.65Å; M80-Y126 HydrophobicContact CG-CD1 4.15Å; M80-Y126 HydrophobicContact SD-CD1 3.73Å; M80-Y126 HydrophobicContact SD-CE1 4.24Å; K81-Y126 WeakPolarHBondContact O-CA 3.35Å; I82-Y126 HydrophobicContact CB-CD1 4.39Å; I82-Y126 HydrophobicContact CB-CE1 4.32Å; I82-Y126 HydrophobicContact CD1-CE1 4.38Å; I82-Y126 HydrophobicContact CG1-CD1 3.93Å; I82-Y126 HydrophobicContact CG1-CE1 3.98Å; I82-Y126 HydrophobicContact CG2-CD1 4.13Å; I82-Y126 HydrophobicContact CG2-CE1 3.66Å; S118-Y126 VanDerWaalsContact CA-O 3.23Å; S118-Y126 WeakPolarHBondContact CA-O 3.31Å; F119-Y126 AromaticContact CD2-CD2 3.36Å; F119-Y126 HydrophobicContact CD2-CD2 3.36Å; F119-Y126 HydrophobicContact CD2-CE2 4.07Å; F119-Y126 AromaticContact CD2-CG 3.75Å; F119-Y126 HydrophobicContact CD2-CG 3.75Å; F119-Y126 HydrophobicContact CE1-CG 4.35Å; F119-Y126 AromaticContact CE2-CD1 3.89Å; F119-Y126 HydrophobicContact CE2-CD1 3.89Å; F119-Y126 AromaticContact CE2-CD2 3.21Å; F119-Y126 HydrophobicContact CE2-CD2 3.21Å; F119-Y126 HydrophobicContact CE2-CE1 4.37Å; F119-Y126 AromaticContact CE2-CE2 3.76Å; F119-Y126 HydrophobicContact CE2-CE2 3.76Å; F119-Y126 AromaticContact CE2-CG 3.28Å; F119-Y126 HydrophobicContact CE2-CG 3.28Å; F119-Y126 HydrophobicContact CG-CD2 4.28Å; F119-Y126 HydrophobicContact CG-CG 4.45Å; F119-Y126 HydrophobicContact CZ-CD1 4.02Å; F119-Y126 HydrophobicContact CZ-CD2 4.06Å; F119-Y126 AromaticContact CZ-CG 3.62Å; F119-Y126 HydrophobicContact CZ-CG 3.62Å; F119-Y126 PolarHBondContact N-O 3.01Å; F119-Y126 VanDerWaalsContact N-O 3.11Å; F119-Y126 WeakPolarHBondContact O-CA 3.32Å; F119-Y126 WeakPolarHBondContact O-CB 3.46Å; F119-Y126 WeakPolarHBondContact O-CD2 3.14Å; F119-Y126 PolarHBondContact O-N 3Å; D121-Y126 HydrophobicContact CB-CE2 4.17Å; D121-Y126 VanDerWaalsContact OD2-CE2 3.24Å; D121-Y126 WeakPolarHBondContact OD2-CE2 3.27Å; D121-Y126 VanDerWaalsContact OD2-CZ 3.25Å; D121-Y126 PolarHBondContact OD2-OH 2.83Å; N124-Y126 HydrophobicContact CB-CD2 4.43Å; N124-Y126 HydrophobicContact CB-CE1 4.2Å; N124-Y126 HydrophobicContact CB-CE2 3.65Å; N124-Y126 WeakPolarHBondContact CB-OH 3.49Å; N124-Y126 PolarHBondContact ND2-OH 2.85Å; Y126-F360 HydrophobicContact CE1-CE2 4.43Å; Y126-F360 AromaticContact CE1-CZ 4Å; Y126-F360 HydrophobicContact CE1-CZ 4Å; Y126-F360 VanDerWaalsContact OH-CE2 3.25Å; Y126-F360 WeakPolarHBondContact OH-CE2 3.43Å
127	M	97.9	Very high	95.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.7	166.9	-65.8	-179.2	-84.8	0	0	107.9	K81 L83 E100 K101 L104 M115 L129 F375	K81-M127 HydrophobicContact CB-CB 4.36Å; K81-M127 HydrophobicContact CD-CE 3.91Å; K81-M127 HydrophobicContact CG-CE 4.32Å; K81-M127 PolarHBondContact N-O 3.21Å; K81-M127 PolarHBondContact O-N 3.28Å; L83-M127 HydrophobicContact CD1-CE 3.52Å; E100-M127 HydrophobicContact CG-CE 4.46Å; E100-M127 HydrophobicContact CG-SD 4.35Å; K101-M127 HydrophobicContact CB-SD 3.92Å; K101-M127 HydrophobicContact CG-CG 4.4Å; K101-M127 HydrophobicContact CG-SD 4.39Å; L104-M127 HydrophobicContact CD1-SD 4.07Å; M115-M127 HydrophobicContact SD-CB 3.81Å; M115-M127 HydrophobicContact SD-CG 3.75Å; M115-M127 HydrophobicContact SD-SD 4.21Å; M127-L129 HydrophobicContact CB-CD1 4.21Å; M127-L129 WeakPolarHBondContact O-CD1 3.23Å; M127-F375 HydrophobicContact CG-CZ 3.86Å
128	V	98.2	Very high	95.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	103.8	-178.8	-172.2	0	0	0	0	108.5	F52 Y78 M80 T116 F117 F119	F52-V128 HydrophobicContact CE1-CG1 3.94Å; F52-V128 HydrophobicContact CE1-CG2 4.48Å; F52-V128 HydrophobicContact CE2-CG2 4.37Å; F52-V128 HydrophobicContact CZ-CG1 4.21Å; F52-V128 HydrophobicContact CZ-CG2 4.04Å; Y78-V128 VanDerWaalsContact CB-CG1 3.41Å; Y78-V128 HydrophobicContact CD1-CG1 4.11Å; Y78-V128 HydrophobicContact CD2-CG1 4.21Å; Y78-V128 HydrophobicContact CG-CG1 3.66Å; M80-V128 HydrophobicContact CE-CG2 3.95Å; M80-V128 HydrophobicContact CG-CG2 4.19Å; T116-V128 PolarHBondContact N-O 3.48Å; F117-V128 HydrophobicContact CB-CB 3.86Å; F117-V128 HydrophobicContact CB-CG2 3.98Å; F117-V128 HydrophobicContact CD2-CB 4.03Å; F117-V128 HydrophobicContact CD2-CG1 3.89Å; F117-V128 HydrophobicContact CG-CB 4.46Å; F117-V128 PolarHBondContact N-O 3.21Å; F117-V128 PolarHBondContact O-N 2.79Å; F119-V128 HydrophobicContact CE1-CG2 3.79Å
129	L	97.7	Very high	94.8	Very high	13 Å²	13	20 Å²	20	7%	0.068	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	156.8	-176.4	-53.1	103.6	0	0	0	110.9	Y78 A79 K81 L104 V113 N114 M127 F131	Y78-L129 WeakPolarHBondContact CA-O 3.5Å; Y78-L129 WeakPolarHBondContact CB-O 3.1Å; Y78-L129 WeakPolarHBondContact CD1-O 3.48Å; A79-L129 PolarHBondContact N-O 3.09Å; A79-L129 WeakPolarHBondContact O-CD1 3.48Å; A79-L129 PolarHBondContact O-N 3.43Å; K81-L129 HydrophobicContact CB-CD1 3.87Å; L104-L129 HydrophobicContact CD1-CD2 4.09Å; V113-L129 HydrophobicContact CG1-CD2 3.69Å; V113-L129 HydrophobicContact CG2-CB 4.03Å; V113-L129 HydrophobicContact CG2-CD2 4.08Å; N114-L129 CarbonylContact O-C 3.5Å; N114-L129 WeakPolarHBondContact O-CA 3.38Å; M127-L129 HydrophobicContact CB-CD1 4.21Å; M127-L129 WeakPolarHBondContact O-CD1 3.23Å; L129-F131 PolarHBondContact O-N 3.38Å
130	E	96.2	Very high	94.3	Very high	45 Å²	45	19.9 Å²	19.9	21%	0.21	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	139	168.6	66.4	-179.9	132.1	0	0	111	V113 N114 I132 K190	V113-E130 WeakPolarHBondContact CA-OE1 3.44Å; V113-E130 HydrophobicContact CG2-CG 3.61Å; N114-E130 HydrophobicContact CB-CG 4.5Å; N114-E130 PolarHBondContact N-OE1 2.86Å; N114-E130 PolarHBondContact O-N 3.14Å; E130-I132 HydrophobicContact CG-CD1 3.71Å; E130-I132 HydrophobicContact CG-CG1 4.3Å; E130-K190 VanDerWaalsContact CD-NZ 3.35Å; E130-K190 WeakPolarHBondContact OE1-CE 3.35Å; E130-K190 IonicContact OE1-NZ 2.81Å; E130-K190 PolarHBondContact OE1-NZ 3.45Å; E130-K190 WeakPolarHBondContact OE2-CE 3.29Å; E130-K190 IonicContact OE2-NZ 3.86Å; E130-K190 PolarHBondContact OE2-NZ 3.33Å
131	F	96	Very high	94	Very high	25 Å²	25	18.3 Å²	18.3	11%	0.11	10%	0.096	C	C	.	.	P	Polyproline II helix	trans	-84.4	119	178.2	175.8	-123.1	0	0	0	110.7	L58 L68 A79 L129 P344 D346 T347 F350	L58-F131 HydrophobicContact CD1-CD2 3.87Å; L58-F131 HydrophobicContact CD1-CE2 3.67Å; L58-F131 HydrophobicContact CD2-CE2 4.04Å; L68-F131 HydrophobicContact CD1-CB 4.41Å; L68-F131 HydrophobicContact CD1-CD1 3.75Å; L68-F131 HydrophobicContact CD1-CD2 3.87Å; L68-F131 HydrophobicContact CD1-CE1 3.89Å; L68-F131 HydrophobicContact CD1-CE2 4.02Å; L68-F131 HydrophobicContact CD1-CG 3.73Å; L68-F131 HydrophobicContact CD1-CZ 4.04Å; A79-F131 HydrophobicContact CB-CD2 4.46Å; L129-F131 PolarHBondContact O-N 3.38Å; F131-P344 WeakPolarHBondContact CD1-O 3.3Å; F131-D346 VanDerWaalsContact CZ-O 3.31Å; F131-D346 WeakPolarHBondContact CZ-O 3.45Å; F131-T347 HydrophobicContact CZ-CG2 4.08Å; F131-F350 HydrophobicContact CD2-CZ 4.37Å; F131-F350 HydrophobicContact CE2-CD2 4.43Å; F131-F350 AromaticContact CE2-CE2 3.48Å; F131-F350 HydrophobicContact CE2-CE2 3.48Å; F131-F350 VanDerWaalsContact CE2-CE2 3.48Å; F131-F350 AromaticContact CE2-CZ 3.55Å; F131-F350 HydrophobicContact CE2-CZ 3.55Å; F131-F350 AromaticContact CZ-CE2 3.73Å; F131-F350 HydrophobicContact CZ-CE2 3.73Å; F131-F350 HydrophobicContact CZ-CZ 4.27Å
132	I	94.6	Very high	93.7	Very high	9 Å²	9	22.3 Å²	22.3	5%	0.046	11%	0.109	C	C	.	.			trans	-105.1	99.2	178.5	-51.4	-53.6	0	0	0	109.4	E130 G134 L182 I183 D184 K190 F350	E130-I132 HydrophobicContact CG-CD1 3.71Å; E130-I132 HydrophobicContact CG-CG1 4.3Å; I132-G134 VanDerWaalsContact C-N 3.33Å; I132-G134 PolarHBondContact O-N 2.81Å; I132-L182 HydrophobicContact CB-CB 3.95Å; I132-L182 HydrophobicContact CB-CD1 3.86Å; I132-L182 HydrophobicContact CG1-CB 4.47Å; I132-L182 HydrophobicContact CG1-CD1 4.13Å; I132-L182 HydrophobicContact CG2-CB 3.58Å; I132-L182 HydrophobicContact CG2-CD1 4.44Å; I132-I183 VanDerWaalsContact CG2-O 3.28Å; I132-I183 WeakPolarHBondContact CG2-O 3.35Å; I132-D184 HydrophobicContact CG2-CB 4.06Å; I132-K190 HydrophobicContact CD1-CB 4.25Å; I132-K190 HydrophobicContact CD1-CD 4.28Å; I132-K190 HydrophobicContact CD1-CG 3.68Å; I132-K190 HydrophobicContact CG1-CB 3.95Å; I132-K190 HydrophobicContact CG1-CG 3.96Å; I132-K190 HydrophobicContact CG2-CB 4.45Å; I132-F350 VanDerWaalsContact O-CZ 3.28Å; I132-F350 WeakPolarHBondContact O-CZ 3.45Å
133	S	90.7	Very high	93.2	Very high	11 Å²	11	26.8 Å²	26.8	8%	0.077	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-15.8	-167.3	55.7	0	0	0	0	115.4	G135 V341 H349	S133-G135 VanDerWaalsContact C-N 3.27Å; S133-G135 PolarHBondContact O-N 2.85Å; S133-V341 WeakPolarHBondContact OG-CG1 3.21Å; S133-V341 WeakPolarHBondContact OG-CG2 3.2Å; S133-H349 PolarHBondContact O-CD2 3.08Å
134	G	88.7	Confident	92.7	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.5	-174.5	0	0	0	0	0	115.3	I132 H140 I183 H349	I132-G134 VanDerWaalsContact C-N 3.33Å; I132-G134 PolarHBondContact O-N 2.81Å; G134-H140 PolarHBondContact O-NE2 3.33Å; G134-I183 CarbonylContact C-O 3.54Å; G134-I183 WeakPolarHBondContact CA-O 3.35Å; G134-I183 PolarHBondContact N-O 3.28Å; G134-I183 VanDerWaalsContact N-O 3.16Å; G134-H349 WeakPolarHBondContact O-CB 3.42Å
135	G	88.7	Confident	92.5	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.01	14%	0.144	C	C	.	.			trans	74.4	-172.9	174.8	0	0	0	0	0	114.4	S133 L182 I183	S133-G135 VanDerWaalsContact C-N 3.27Å; S133-G135 PolarHBondContact O-N 2.85Å; G135-L182 WeakPolarHBondContact O-CA 3.28Å; G135-I183 PolarHBondContact O-N 2.8Å
136	E	90.7	Very high	92.2	Very high	62 Å²	62	34.5 Å²	34.5	29%	0.29	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-79.4	138.6	-172.5	-62.1	168.6	-170.8	0	0	112.8	F138 S139 H140 L182	E136-F138 HydrophobicContact CB-CB 4.38Å; E136-F138 PolarHBondContact O-N 2.97Å; E136-S139 PolarHBondContact O-N 3.14Å; E136-H140 PolarHBondContact O-CD2 3.16Å; E136-H140 PolarHBondContact O-N 2.81Å; E136-L182 HydrophobicContact CG-CD2 3.88Å
137	M	93.1	Very high	91.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.1	-35.8	170.8	176.4	-176	-71.1	0	0	111.1	S139 H140 L141 F147 Y155 P178 L181 L189 L236 M240	M137-S139 PolarHBondContact O-N 3.39Å; M137-H140 PolarHBondContact O-N 3.04Å; M137-L141 WeakPolarHBondContact O-CB 3.22Å; M137-L141 PolarHBondContact O-N 3.02Å; M137-F147 HydrophobicContact CG-CE2 4.01Å; M137-F147 HydrophobicContact CG-CZ 4.22Å; M137-F147 HydrophobicContact SD-CE2 4.2Å; M137-Y155 HydrophobicContact CE-CD1 4.13Å; M137-Y155 HydrophobicContact CE-CD2 3.97Å; M137-Y155 HydrophobicContact CE-CG 3.74Å; M137-P178 HydrophobicContact CB-CB 4.37Å; M137-P178 HydrophobicContact CG-CB 4.27Å; M137-P178 PolarHBondContact N-O 3.39Å; M137-P178 HydrophobicContact SD-CB 4.48Å; M137-L181 HydrophobicContact CB-CB 3.98Å; M137-L181 HydrophobicContact CE-CB 4.43Å; M137-L181 HydrophobicContact CE-CD1 3.92Å; M137-L181 PolarHBondContact N-O 2.91Å; M137-L181 HydrophobicContact SD-CD1 3.85Å; M137-L189 HydrophobicContact CE-CD1 3.77Å; M137-L189 HydrophobicContact CE-CD2 3.41Å; M137-L189 VanDerWaalsContact CE-CD2 3.41Å; M137-L189 HydrophobicContact CE-CG 4.21Å; M137-L236 HydrophobicContact SD-CD1 4.41Å; M137-M240 HydrophobicContact CE-SD 4.01Å; M137-M240 HydrophobicContact SD-CG 4.1Å; M137-M240 HydrophobicContact SD-SD 3.77Å
138	F	91.9	Very high	91.7	Very high	61 Å²	61	36.6 Å²	36.6	27%	0.268	18%	0.178	S	C	.	.	H	α-helix	trans	-51.8	-53.3	177	-177.8	-96.4	0	0	0	112.2	E136 H140 L141 R142 P178 E179	E136-F138 HydrophobicContact CB-CB 4.38Å; E136-F138 PolarHBondContact O-N 2.97Å; F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 3.32Å; F138-L141 PolarHBondContact O-N 3.13Å; F138-R142 HydrophobicContact CD1-CG 4.14Å; F138-R142 HydrophobicContact CD2-CG 4.35Å; F138-R142 HydrophobicContact CE1-CG 3.8Å; F138-R142 HydrophobicContact CE2-CG 4.04Å; F138-R142 HydrophobicContact CG-CG 4.4Å; F138-R142 HydrophobicContact CZ-CG 3.75Å; F138-R142 WeakPolarHBondContact O-CB 3.3Å; F138-R142 VanDerWaalsContact O-CG 3.27Å; F138-R142 WeakPolarHBondContact O-CG 3.23Å; F138-R142 PolarHBondContact O-N 2.85Å; F138-P178 HydrophobicContact CB-CB 3.82Å; F138-P178 HydrophobicContact CD2-CB 4.23Å; F138-P178 PolarHBondContact N-O 3.45Å; F138-P178 VanDerWaalsContact N-O 3.14Å; F138-E179 HydrophobicContact CB-CG 3.97Å; F138-E179 HydrophobicContact CD2-CG 3.96Å; F138-E179 HydrophobicContact CG-CG 3.93Å
139	S	88.4	Confident	91.5	Very high	52 Å²	52	38.1 Å²	38.1	36%	0.364	19%	0.185	S	C	.	.	H	α-helix	trans	-60.5	-40.7	-179.4	-70.5	0	0	0	0	111.7	E136 M137 R143	E136-S139 PolarHBondContact O-N 3.14Å; M137-S139 PolarHBondContact O-N 3.39Å; S139-R143 VanDerWaalsContact O-CB 3.28Å; S139-R143 WeakPolarHBondContact O-CB 2.84Å; S139-R143 PolarHBondContact O-N 2.84Å; S139-R143 VanDerWaalsContact O-N 3.13Å
140	H	87.2	Confident	91.4	Very high	3 Å²	3	40.5 Å²	40.5	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-66.2	-47.6	176.3	-65	-60.5	0	0	0	112.5	G134 E136 M137 F138 R142 R143 I144 F147 I183 A336	G134-H140 PolarHBondContact O-NE2 3.33Å; E136-H140 PolarHBondContact O-CD2 3.16Å; E136-H140 PolarHBondContact O-N 2.81Å; M137-H140 PolarHBondContact O-N 3.04Å; F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 3.32Å; H140-R142 PolarHBondContact O-N 2.86Å; H140-R143 PolarHBondContact CE1-NH2 3.49Å; H140-R143 VanDerWaalsContact CE1-NH2 3.31Å; H140-R143 PolarHBondContact ND1-NH2 2.98Å; H140-R143 PolarHBondContact O-N 2.87Å; H140-I144 WeakPolarHBondContact O-CG1 3.49Å; H140-I144 PolarHBondContact O-N 3.3Å; H140-F147 HydrophobicContact CB-CZ 4.48Å; H140-I183 HydrophobicContact CB-CD1 4.48Å; H140-A336 WeakPolarHBondContact CB-O 3.33Å; H140-A336 PolarHBondContact ND1-O 3.33Å
141	L	90.7	Very high	91.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-61.7	-46	-179.8	-179.5	59.7	0	0	0	111.3	M137 F138 R143 I144 G145 F147 P178 E239	M137-L141 WeakPolarHBondContact O-CB 3.22Å; M137-L141 PolarHBondContact O-N 3.02Å; F138-L141 PolarHBondContact O-N 3.13Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.24Å; L141-I144 PolarHBondContact O-N 3.2Å; L141-G145 CarbonylContact O-C 3.6Å; L141-G145 WeakPolarHBondContact O-CA 3.42Å; L141-G145 PolarHBondContact O-N 3.37Å; L141-F147 HydrophobicContact CB-CE1 4.22Å; L141-F147 HydrophobicContact CB-CE2 4.43Å; L141-F147 HydrophobicContact CB-CZ 3.89Å; L141-F147 HydrophobicContact CD1-CD1 3.96Å; L141-F147 HydrophobicContact CD1-CD2 4.17Å; L141-F147 HydrophobicContact CD1-CE1 3.94Å; L141-F147 HydrophobicContact CD1-CE2 4.18Å; L141-F147 HydrophobicContact CD1-CG 4.07Å; L141-F147 HydrophobicContact CD1-CZ 4.06Å; L141-P178 HydrophobicContact CD2-CG 4.44Å; L141-E239 HydrophobicContact CD2-CG 3.97Å
142	R	91.1	Very high	91.1	Very high	114 Å²	114	37.4 Å²	37.4	43%	0.43	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-39.8	178.9	-67.9	-69.3	164.8	-158.5	-5.1	112.3	F138 H140 E239 G243	F138-R142 HydrophobicContact CD1-CG 4.14Å; F138-R142 HydrophobicContact CD2-CG 4.35Å; F138-R142 HydrophobicContact CE1-CG 3.8Å; F138-R142 HydrophobicContact CE2-CG 4.04Å; F138-R142 HydrophobicContact CG-CG 4.4Å; F138-R142 HydrophobicContact CZ-CG 3.75Å; F138-R142 WeakPolarHBondContact O-CB 3.3Å; F138-R142 VanDerWaalsContact O-CG 3.27Å; F138-R142 WeakPolarHBondContact O-CG 3.23Å; F138-R142 PolarHBondContact O-N 2.85Å; H140-R142 PolarHBondContact O-N 2.86Å; R142-E239 IonicContact CZ-OE1 3.83Å; R142-E239 IonicContact NH2-OE1 2.77Å; R142-E239 PolarHBondContact NH2-OE1 3.47Å; R142-G243 PolarHBondContact NH1-O 3.29Å; R142-G243 VanDerWaalsContact NH1-O 3.09Å
143	R	86.5	Confident	91.2	Very high	140 Å²	140	38.9 Å²	38.9	53%	0.528	19%	0.192	S	C	.	.	H	α-helix	trans	-68.1	-40.2	177.9	178.5	172.4	54.8	171.4	-4.4	113.1	S139 H140 L141	S139-R143 VanDerWaalsContact O-CB 3.28Å; S139-R143 WeakPolarHBondContact O-CB 2.84Å; S139-R143 PolarHBondContact O-N 2.84Å; S139-R143 VanDerWaalsContact O-N 3.13Å; H140-R143 PolarHBondContact CE1-NH2 3.49Å; H140-R143 VanDerWaalsContact CE1-NH2 3.31Å; H140-R143 PolarHBondContact ND1-NH2 2.98Å; H140-R143 PolarHBondContact O-N 2.87Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.24Å
144	I	86.5	Confident	91.5	Very high	38 Å²	38	38.8 Å²	38.8	20%	0.195	19%	0.19	C	C	.	.	H	α-helix	trans	-80	-24.8	178.9	-59.6	175.3	0	0	0	111.3	H140 L141 R146 F147 L333 A336 L337	H140-I144 WeakPolarHBondContact O-CG1 3.49Å; H140-I144 PolarHBondContact O-N 3.3Å; L141-I144 PolarHBondContact O-N 3.2Å; I144-R146 VanDerWaalsContact C-N 3.33Å; I144-R146 WeakPolarHBondContact CG2-O 3.5Å; I144-R146 PolarHBondContact O-N 3.49Å; I144-F147 HydrophobicContact CD1-CD1 4.17Å; I144-F147 HydrophobicContact CD1-CE1 3.78Å; I144-L333 HydrophobicContact CG2-CD2 3.8Å; I144-L333 HydrophobicContact CG2-CG 4.33Å; I144-A336 HydrophobicContact CD1-CB 3.31Å; I144-A336 HydrophobicContact CG1-CB 3.47Å; I144-A336 VanDerWaalsContact CG1-CB 3.47Å; I144-L337 HydrophobicContact CD1-CD2 3.98Å; I144-L337 HydrophobicContact CD1-CG 4.05Å
145	G	91.4	Very high	91.9	Very high	39 Å²	39	38.9 Å²	38.9	40%	0.402	19%	0.191	S	C	.	.	S	Bend	trans	92.1	-56.7	-173.8	0	0	0	0	0	111.3	L141 G243	L141-G145 CarbonylContact O-C 3.6Å; L141-G145 WeakPolarHBondContact O-CA 3.42Å; L141-G145 PolarHBondContact O-N 3.37Å; G145-G243 WeakPolarHBondContact O-CA 3.25Å
146	R	92.6	Very high	92.3	Very high	111 Å²	111	38.8 Å²	38.8	42%	0.419	19%	0.19	S	C	.	.			trans	-155.8	153	173.4	69.3	-170.4	-178.7	95.5	-3.2	112	I144 A241 H269	I144-R146 VanDerWaalsContact C-N 3.33Å; I144-R146 WeakPolarHBondContact CG2-O 3.5Å; I144-R146 PolarHBondContact O-N 3.49Å; R146-A241 WeakPolarHBondContact CD-O 3.24Å; R146-H269 PolarHBondContact NH1-CD2 3.39Å; R146-H269 PolarHBondContact NH1-NE2 3.01Å
147	F	91.9	Very high	92.7	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	18%	0.176	C	C	.	.			trans	-84.3	150.6	170.9	-59.8	-21.1	0	0	0	111.1	M137 H140 L141 I144 H151 Y155 M240 L337	M137-F147 HydrophobicContact CG-CE2 4.01Å; M137-F147 HydrophobicContact CG-CZ 4.22Å; M137-F147 HydrophobicContact SD-CE2 4.2Å; H140-F147 HydrophobicContact CB-CZ 4.48Å; L141-F147 HydrophobicContact CB-CE1 4.22Å; L141-F147 HydrophobicContact CB-CE2 4.43Å; L141-F147 HydrophobicContact CB-CZ 3.89Å; L141-F147 HydrophobicContact CD1-CD1 3.96Å; L141-F147 HydrophobicContact CD1-CD2 4.17Å; L141-F147 HydrophobicContact CD1-CE1 3.94Å; L141-F147 HydrophobicContact CD1-CE2 4.18Å; L141-F147 HydrophobicContact CD1-CG 4.07Å; L141-F147 HydrophobicContact CD1-CZ 4.06Å; I144-F147 HydrophobicContact CD1-CD1 4.17Å; I144-F147 HydrophobicContact CD1-CE1 3.78Å; F147-H151 HydrophobicContact CB-CB 4.01Å; F147-Y155 AromaticContact CD2-CD2 3.96Å; F147-Y155 HydrophobicContact CD2-CD2 3.96Å; F147-Y155 HydrophobicContact CD2-CE2 4.11Å; F147-Y155 AromaticContact CE2-CD2 3.9Å; F147-Y155 HydrophobicContact CE2-CD2 3.9Å; F147-Y155 AromaticContact CE2-CE2 3.86Å; F147-Y155 HydrophobicContact CE2-CE2 3.86Å; F147-Y155 HydrophobicContact CZ-CE2 4.45Å; F147-M240 HydrophobicContact CD2-CB 3.91Å; F147-M240 HydrophobicContact CD2-CG 3.89Å; F147-M240 HydrophobicContact CD2-SD 4.04Å; F147-M240 HydrophobicContact CE2-CG 4.17Å; F147-M240 HydrophobicContact CE2-SD 4.26Å; F147-M240 PolarHBondContact N-O 2.9Å; F147-L337 HydrophobicContact CD1-CD2 4.16Å; F147-L337 HydrophobicContact CE1-CD2 3.59Å; F147-L337 HydrophobicContact CE2-CD2 4.48Å; F147-L337 HydrophobicContact CZ-CD2 3.77Å
148	S	92.6	Very high	92.9	Very high	42 Å²	42	35.9 Å²	35.9	29%	0.294	18%	0.176	S	C	.	.			trans	-73.2	156.4	168.1	71.3	0	0	0	0	110.2	P150 H151 S152	S148-P150 VanDerWaalsContact C-N 3.34Å; S148-H151 WeakPolarHBondContact O-CB 3.45Å; S148-H151 PolarHBondContact O-N 2.68Å; S148-H151 PolarHBondContact OG-ND1 3.21Å; S148-S152 PolarHBondContact O-N 3.24Å; S148-S152 PolarHBondContact O-OG 3.25Å
149	E	95.1	Very high	93.3	Very high	32 Å²	32	33 Å²	33	15%	0.15	16%	0.164	C	C	.	.	H	α-helix	trans	-56	-39.1	-177.1	-63.7	-165.3	-158.3	0	0	114.5	H151 S152 R153 S271 L274 W305	E149-H151 VanDerWaalsContact C-N 3.31Å; E149-H151 PolarHBondContact O-N 3.44Å; E149-S152 PolarHBondContact O-N 3.15Å; E149-R153 WeakPolarHBondContact O-CB 3.43Å; E149-R153 PolarHBondContact O-N 3.27Å; E149-S271 WeakPolarHBondContact OE1-CB 3.48Å; E149-S271 PolarHBondContact OE1-N 3.32Å; E149-L274 HydrophobicContact CG-CD2 3.87Å; E149-L274 WeakPolarHBondContact OE1-CD2 3.43Å; E149-W305 HydrophobicContact CB-CZ2 4.33Å; E149-W305 PolarHBondContact OE2-NE1 3.42Å
150	P	93.9	Very high	93.8	Very high	63 Å²	63	30.5 Å²	30.5	41%	0.409	15%	0.147	S	C	.	.	H	α-helix	trans	-58.2	-39	172.4	-26.9	36.3	0	0	0	114.1	S148 F154 P322	S148-P150 VanDerWaalsContact C-N 3.34Å; P150-F154 PolarHBondContact O-N 3.04Å; P150-P322 HydrophobicContact CB-CG 4.46Å
151	H	91.8	Very high	94.3	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.023	15%	0.147	C	C	.	.	H	α-helix	trans	-70.4	-47.5	176.1	-69.4	101.8	0	0	0	111.4	F147 S148 E149 R153 F154 Y155 P322 F324 L337	F147-H151 HydrophobicContact CB-CB 4.01Å; S148-H151 WeakPolarHBondContact O-CB 3.45Å; S148-H151 PolarHBondContact O-N 2.68Å; S148-H151 PolarHBondContact OG-ND1 3.21Å; E149-H151 VanDerWaalsContact C-N 3.31Å; E149-H151 PolarHBondContact O-N 3.44Å; H151-R153 PolarHBondContact O-N 3.04Å; H151-F154 WeakPolarHBondContact O-CB 3.12Å; H151-F154 PolarHBondContact O-N 3.48Å; H151-F154 VanDerWaalsContact O-N 3.14Å; H151-Y155 WeakPolarHBondContact O-CD2 3.48Å; H151-Y155 PolarHBondContact O-N 2.91Å; H151-Y155 VanDerWaalsContact O-N 3.09Å; H151-P322 PolarHBondContact NE2-O 2.73Å; H151-F324 AromaticContact CE1-CD1 3.72Å; H151-F324 AromaticContact CE1-CD2 3.73Å; H151-F324 AromaticContact CE1-CE1 3.35Å; H151-F324 WeakPolarHBondContact CE1-CE1 3.4Å; H151-F324 AromaticContact CE1-CE2 3.39Å; H151-F324 WeakPolarHBondContact CE1-CE2 3.13Å; H151-F324 AromaticContact CE1-CG 3.88Å; H151-F324 AromaticContact CE1-CZ 3.16Å; H151-F324 WeakPolarHBondContact CE1-CZ 3.36Å; H151-F324 AromaticContact ND1-CE1 3.8Å; H151-F324 AromaticContact ND1-CZ 3.53Å; H151-F324 AromaticContact NE2-CD2 3.74Å; H151-F324 AromaticContact NE2-CE2 3.47Å; H151-F324 WeakPolarHBondContact NE2-CE2 3.24Å; H151-F324 AromaticContact NE2-CZ 3.72Å; H151-L337 HydrophobicContact CB-CD1 4.35Å; H151-L337 WeakPolarHBondContact CD2-CD1 3.49Å; H151-L337 WeakPolarHBondContact NE2-CD1 3.23Å
152	S	95.7	Very high	94.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.3	-39.1	175	-55.6	0	0	0	0	111.2	S148 E149 A156 M240	S148-S152 PolarHBondContact O-N 3.24Å; S148-S152 PolarHBondContact O-OG 3.25Å; E149-S152 PolarHBondContact O-N 3.15Å; S152-A156 WeakPolarHBondContact O-CB 3.16Å; S152-A156 PolarHBondContact O-N 3.16Å; S152-M240 WeakPolarHBondContact O-CE 3.39Å; S152-M240 WeakPolarHBondContact OG-CB 3.17Å
153	R	97.1	Very high	95	Very high	41 Å²	41	25.1 Å²	25.1	16%	0.155	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-43.6	176.9	-174	-172.3	-57.7	123.5	7.6	112.6	E149 H151 Y155 A156 A157 W305 F306	E149-R153 WeakPolarHBondContact O-CB 3.43Å; E149-R153 PolarHBondContact O-N 3.27Å; H151-R153 PolarHBondContact O-N 3.04Å; R153-Y155 VanDerWaalsContact C-N 3.31Å; R153-Y155 PolarHBondContact O-N 3.37Å; R153-A156 PolarHBondContact O-N 3.4Å; R153-A157 VanDerWaalsContact O-CB 3.31Å; R153-A157 WeakPolarHBondContact O-CB 3.43Å; R153-A157 PolarHBondContact O-N 2.9Å; R153-W305 HydrophobicContact CB-CE3 4.34Å; R153-W305 HydrophobicContact CB-CH2 3.55Å; R153-W305 HydrophobicContact CB-CZ2 3.89Å; R153-W305 HydrophobicContact CB-CZ3 3.77Å; R153-W305 WeakPolarHBondContact CD-O 3.29Å; R153-W305 HydrophobicContact CG-CE3 4.1Å; R153-W305 HydrophobicContact CG-CH2 4.19Å; R153-W305 HydrophobicContact CG-CZ3 3.88Å; R153-W305 PolarHBondContact NE-O 2.81Å; R153-F306 HydrophobicContact CG-CD1 3.7Å; R153-F306 HydrophobicContact CG-CE1 3.91Å
154	F	95.7	Very high	95.5	Very high	9 Å²	9	19.8 Å²	19.8	4%	0.039	11%	0.107	C	C	.	.	H	α-helix	trans	-57.4	-45.5	176.7	172.5	-102.3	0	0	0	111.5	P150 H151 Q158 Y188 I314 I319 P321 P322	P150-F154 PolarHBondContact O-N 3.04Å; H151-F154 WeakPolarHBondContact O-CB 3.12Å; H151-F154 PolarHBondContact O-N 3.48Å; H151-F154 VanDerWaalsContact O-N 3.14Å; F154-Q158 VanDerWaalsContact CD1-NE2 3.35Å; F154-Q158 PolarHBondContact O-NE2 3.22Å; F154-Y188 AromaticContact CE2-CE1 3.92Å; F154-Y188 HydrophobicContact CE2-CE1 3.92Å; F154-Y188 HydrophobicContact CE2-CE2 4.37Å; F154-Y188 AromaticContact CE2-CZ 3.8Å; F154-Y188 AromaticContact CZ-CD1 3.94Å; F154-Y188 HydrophobicContact CZ-CD1 3.94Å; F154-Y188 HydrophobicContact CZ-CD2 4.11Å; F154-Y188 AromaticContact CZ-CE1 3.7Å; F154-Y188 HydrophobicContact CZ-CE1 3.7Å; F154-Y188 AromaticContact CZ-CE2 3.88Å; F154-Y188 HydrophobicContact CZ-CE2 3.88Å; F154-Y188 HydrophobicContact CZ-CG 4.15Å; F154-Y188 AromaticContact CZ-CZ 3.66Å; F154-I314 HydrophobicContact CD2-CD1 3.49Å; F154-I314 VanDerWaalsContact CD2-CD1 3.49Å; F154-I314 HydrophobicContact CE2-CD1 3.62Å; F154-I319 HydrophobicContact CD2-CG2 3.99Å; F154-I319 HydrophobicContact CE2-CB 4.18Å; F154-I319 HydrophobicContact CE2-CG2 3.91Å; F154-P321 HydrophobicContact CD1-CB 4.2Å; F154-P321 HydrophobicContact CE1-CB 3.69Å; F154-P321 HydrophobicContact CE1-CG 3.89Å; F154-P321 HydrophobicContact CE2-CB 4.4Å; F154-P321 HydrophobicContact CE2-CG 4.45Å; F154-P321 HydrophobicContact CZ-CB 3.82Å; F154-P321 HydrophobicContact CZ-CG 3.67Å; F154-P322 HydrophobicContact CB-CG 4.17Å
155	Y	96.7	Very high	96	Very high	1 Å²	1	18.1 Å²	18.1	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-70.4	-45.7	176.5	-69.4	-43.9	0	0	0	112.7	M137 F147 H151 R153 A157 Q158 I159 G187 L189 M240 L337	M137-Y155 HydrophobicContact CE-CD1 4.13Å; M137-Y155 HydrophobicContact CE-CD2 3.97Å; M137-Y155 HydrophobicContact CE-CG 3.74Å; F147-Y155 AromaticContact CD2-CD2 3.96Å; F147-Y155 HydrophobicContact CD2-CD2 3.96Å; F147-Y155 HydrophobicContact CD2-CE2 4.11Å; F147-Y155 AromaticContact CE2-CD2 3.9Å; F147-Y155 HydrophobicContact CE2-CD2 3.9Å; F147-Y155 AromaticContact CE2-CE2 3.86Å; F147-Y155 HydrophobicContact CE2-CE2 3.86Å; F147-Y155 HydrophobicContact CZ-CE2 4.45Å; H151-Y155 WeakPolarHBondContact O-CD2 3.48Å; H151-Y155 PolarHBondContact O-N 2.91Å; H151-Y155 VanDerWaalsContact O-N 3.09Å; R153-Y155 VanDerWaalsContact C-N 3.31Å; R153-Y155 PolarHBondContact O-N 3.37Å; Y155-A157 VanDerWaalsContact C-N 3.27Å; Y155-A157 PolarHBondContact O-N 2.64Å; Y155-Q158 WeakPolarHBondContact O-CB 3.27Å; Y155-Q158 PolarHBondContact O-N 3.01Å; Y155-Q158 VanDerWaalsContact O-N 3.09Å; Y155-I159 PolarHBondContact O-N 2.74Å; Y155-G187 WeakPolarHBondContact CE1-O 3.49Å; Y155-L189 HydrophobicContact CD1-CD1 3.6Å; Y155-L189 HydrophobicContact CD1-CD2 3.74Å; Y155-L189 HydrophobicContact CD1-CG 3.51Å; Y155-L189 HydrophobicContact CE1-CD2 3.95Å; Y155-L189 HydrophobicContact CE1-CG 4.05Å; Y155-L189 HydrophobicContact CG-CD1 4.03Å; Y155-L189 HydrophobicContact CG-CG 4.38Å; Y155-M240 HydrophobicContact CD2-SD 4.22Å; Y155-M240 HydrophobicContact CG-SD 4.44Å; Y155-L337 HydrophobicContact CE2-CD2 4Å; Y155-L337 WeakPolarHBondContact OH-CD2 3.32Å
156	A	98.6	Very high	96.3	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.1	-37.3	177.2	0	0	0	0	0	112.6	S152 R153 Q158 I159 V160 L233 I237 M240 W305 F306	S152-A156 WeakPolarHBondContact O-CB 3.16Å; S152-A156 PolarHBondContact O-N 3.16Å; R153-A156 PolarHBondContact O-N 3.4Å; A156-Q158 VanDerWaalsContact C-N 3.27Å; A156-Q158 PolarHBondContact O-N 2.7Å; A156-I159 PolarHBondContact O-N 3.1Å; A156-V160 VanDerWaalsContact O-CG2 3.3Å; A156-V160 WeakPolarHBondContact O-CG2 3.39Å; A156-V160 PolarHBondContact O-N 3.36Å; A156-L233 HydrophobicContact CB-CD1 4.39Å; A156-I237 HydrophobicContact CB-CD1 3.79Å; A156-I237 HydrophobicContact CB-CG1 3.65Å; A156-M240 HydrophobicContact CB-CE 4.33Å; A156-W305 HydrophobicContact CB-CH2 4.43Å; A156-W305 HydrophobicContact CB-CZ3 4.14Å; A156-F306 HydrophobicContact CB-CE1 4.1Å; A156-F306 HydrophobicContact CB-CZ 3.89Å
157	A	98.3	Very high	96.5	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.9	-37.5	177.3	0	0	0	0	0	112.1	R153 Y155 V160 L161 F306 T309 W311 I314	R153-A157 VanDerWaalsContact O-CB 3.31Å; R153-A157 WeakPolarHBondContact O-CB 3.43Å; R153-A157 PolarHBondContact O-N 2.9Å; Y155-A157 VanDerWaalsContact C-N 3.27Å; Y155-A157 PolarHBondContact O-N 2.64Å; A157-V160 PolarHBondContact O-N 3.16Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 3.17Å; A157-L161 VanDerWaalsContact O-N 3.11Å; A157-F306 HydrophobicContact CB-CE1 4.16Å; A157-T309 HydrophobicContact CB-CG2 3.77Å; A157-W311 HydrophobicContact CB-CE3 4.41Å; A157-W311 HydrophobicContact CB-CH2 4.17Å; A157-W311 HydrophobicContact CB-CZ3 3.8Å; A157-W311 WeakPolarHBondContact O-CZ3 3.21Å; A157-I314 HydrophobicContact CB-CG1 4.4Å; A157-I314 HydrophobicContact CB-CG2 4.38Å
158	Q	98.1	Very high	96.7	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.4	-42	176.7	-64.7	165.5	67.4	0	0	111.3	F111 F154 Y155 A156 L161 A162 Y188 L189 I314	F111-Q158 HydrophobicContact CB-CB 4.48Å; F111-Q158 HydrophobicContact CD1-CB 4.28Å; F111-Q158 HydrophobicContact CD1-CG 4.16Å; F111-Q158 HydrophobicContact CD2-CB 3.76Å; F111-Q158 HydrophobicContact CD2-CG 4.17Å; F111-Q158 WeakPolarHBondContact CD2-O 3.46Å; F111-Q158 HydrophobicContact CE1-CG 4.01Å; F111-Q158 HydrophobicContact CE2-CB 4.05Å; F111-Q158 HydrophobicContact CE2-CG 4.02Å; F111-Q158 HydrophobicContact CG-CB 3.91Å; F111-Q158 HydrophobicContact CG-CG 4.26Å; F111-Q158 HydrophobicContact CZ-CB 4.43Å; F111-Q158 HydrophobicContact CZ-CG 3.94Å; F154-Q158 VanDerWaalsContact CD1-NE2 3.35Å; F154-Q158 PolarHBondContact O-NE2 3.22Å; Y155-Q158 WeakPolarHBondContact O-CB 3.27Å; Y155-Q158 PolarHBondContact O-N 3.01Å; Y155-Q158 VanDerWaalsContact O-N 3.09Å; A156-Q158 VanDerWaalsContact C-N 3.27Å; A156-Q158 PolarHBondContact O-N 2.7Å; Q158-L161 PolarHBondContact O-N 3.21Å; Q158-A162 WeakPolarHBondContact O-CB 3.49Å; Q158-A162 PolarHBondContact O-N 2.95Å; Q158-Y188 HydrophobicContact CG-CD1 4.25Å; Q158-Y188 HydrophobicContact CG-CE1 4.5Å; Q158-Y188 VanDerWaalsContact OE1-CD1 3.24Å; Q158-L189 HydrophobicContact CB-CD1 4.4Å; Q158-I314 HydrophobicContact CG-CG2 3.74Å
159	I	98.8	Very high	96.9	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-64.2	-41	175.6	-55.1	-55	0	0	0	111.3	Y155 A156 L161 A162 F163 L176 L181 L189 I191 L233 L236	Y155-I159 PolarHBondContact O-N 2.74Å; A156-I159 PolarHBondContact O-N 3.1Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L161 PolarHBondContact O-N 3.34Å; I159-A162 PolarHBondContact O-N 2.94Å; I159-F163 HydrophobicContact CG2-CD1 4.48Å; I159-F163 HydrophobicContact CG2-CD2 3.91Å; I159-F163 HydrophobicContact CG2-CE1 4.28Å; I159-F163 HydrophobicContact CG2-CE2 3.66Å; I159-F163 HydrophobicContact CG2-CG 4.32Å; I159-F163 HydrophobicContact CG2-CZ 3.89Å; I159-F163 WeakPolarHBondContact O-CB 3.44Å; I159-F163 PolarHBondContact O-N 3.34Å; I159-L176 HydrophobicContact CD1-CD1 4.18Å; I159-L176 HydrophobicContact CG2-CD1 4.01Å; I159-L176 HydrophobicContact CG2-CD2 3.91Å; I159-L181 HydrophobicContact CD1-CD1 4.13Å; I159-L181 HydrophobicContact CD1-CD2 3.6Å; I159-L189 HydrophobicContact CD1-CD1 3.96Å; I159-L189 HydrophobicContact CG1-CD1 4.29Å; I159-I191 HydrophobicContact CD1-CD1 3.75Å; I159-I191 HydrophobicContact CD1-CG1 3.9Å; I159-L233 HydrophobicContact CB-CD1 4.01Å; I159-L233 HydrophobicContact CG2-CD1 3.85Å; I159-L236 HydrophobicContact CG1-CD2 4.06Å
160	V	98.7	Very high	97	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-58.8	-44.9	175.6	168.3	0	0	0	0	111.2	A156 A157 E164 W230 L233 V297 I300 K301 F306 W311	A156-V160 VanDerWaalsContact O-CG2 3.3Å; A156-V160 WeakPolarHBondContact O-CG2 3.39Å; A156-V160 PolarHBondContact O-N 3.36Å; A157-V160 PolarHBondContact O-N 3.16Å; V160-E164 WeakPolarHBondContact O-CB 3.31Å; V160-E164 PolarHBondContact O-N 3.01Å; V160-W230 HydrophobicContact CB-CZ3 4.5Å; V160-W230 HydrophobicContact CG1-CZ3 4.47Å; V160-W230 HydrophobicContact CG2-CZ3 4.25Å; V160-L233 HydrophobicContact CG2-CD2 3.54Å; V160-V297 HydrophobicContact CG1-CG2 3.65Å; V160-I300 HydrophobicContact CG1-CG2 4.48Å; V160-I300 HydrophobicContact CG2-CG2 3.82Å; V160-K301 HydrophobicContact CG1-CG 3.91Å; V160-F306 HydrophobicContact CG2-CZ 4.19Å; V160-W311 HydrophobicContact CB-CH2 4.09Å; V160-W311 HydrophobicContact CB-CZ3 3.83Å; V160-W311 HydrophobicContact CG1-CH2 3.82Å; V160-W311 HydrophobicContact CG1-CZ3 3.65Å; V160-W311 HydrophobicContact CG2-CH2 4.4Å
161	L	97.5	Very high	97.2	Very high	5 Å²	5	9 Å²	9	3%	0.026	4%	0.044	C	C	.	.	H	α-helix	trans	-66.3	-41	177.1	-71.2	170.5	0	0	0	112	F109 F111 A157 Q158 I159 E164 Y165 W311 I314	F109-L161 HydrophobicContact CE1-CB 4.08Å; F109-L161 HydrophobicContact CZ-CB 4.02Å; F109-L161 WeakPolarHBondContact CZ-O 3.4Å; F111-L161 HydrophobicContact CD2-CB 4.27Å; F111-L161 HydrophobicContact CE2-CB 4.05Å; F111-L161 HydrophobicContact CE2-CD1 3.79Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 3.17Å; A157-L161 VanDerWaalsContact O-N 3.11Å; Q158-L161 PolarHBondContact O-N 3.21Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L161 PolarHBondContact O-N 3.34Å; L161-E164 PolarHBondContact O-N 2.87Å; L161-Y165 WeakPolarHBondContact O-CB 2.99Å; L161-Y165 PolarHBondContact O-N 2.78Å; L161-W311 HydrophobicContact CD1-CE3 4.19Å; L161-W311 HydrophobicContact CD2-CE3 3.98Å; L161-W311 HydrophobicContact CG-CE3 3.88Å; L161-W311 HydrophobicContact CG-CZ3 4.27Å; L161-I314 HydrophobicContact CD1-CB 4.22Å; L161-I314 HydrophobicContact CD1-CG2 3.72Å
162	A	98.2	Very high	97.4	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.4	-42.9	177.1	0	0	0	0	0	112.4	F109 L112 Q158 I159 Y165 L166 I191	F109-A162 HydrophobicContact CD1-CB 4.34Å; F109-A162 HydrophobicContact CE1-CB 4.31Å; L112-A162 HydrophobicContact CD2-CB 3.87Å; Q158-A162 WeakPolarHBondContact O-CB 3.49Å; Q158-A162 PolarHBondContact O-N 2.95Å; I159-A162 PolarHBondContact O-N 2.94Å; A162-Y165 WeakPolarHBondContact O-CB 3.28Å; A162-Y165 PolarHBondContact O-N 3.14Å; A162-L166 WeakPolarHBondContact O-CB 3.46Å; A162-L166 WeakPolarHBondContact O-CG 3.45Å; A162-L166 PolarHBondContact O-N 2.79Å; A162-I191 HydrophobicContact CB-CD1 3.6Å
163	F	98.5	Very high	97.6	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-68.5	-40.9	175.5	-75.6	-10.5	0	0	0	112.7	I159 Y165 L166 H167 Y173 L176 D229 W230 L233	I159-F163 HydrophobicContact CG2-CD1 4.48Å; I159-F163 HydrophobicContact CG2-CD2 3.91Å; I159-F163 HydrophobicContact CG2-CE1 4.28Å; I159-F163 HydrophobicContact CG2-CE2 3.66Å; I159-F163 HydrophobicContact CG2-CG 4.32Å; I159-F163 HydrophobicContact CG2-CZ 3.89Å; I159-F163 WeakPolarHBondContact O-CB 3.44Å; I159-F163 PolarHBondContact O-N 3.34Å; F163-Y165 VanDerWaalsContact C-N 3.26Å; F163-Y165 PolarHBondContact O-N 3.46Å; F163-L166 HydrophobicContact CD1-CD1 4.46Å; F163-L166 PolarHBondContact O-N 2.81Å; F163-H167 WeakPolarHBondContact O-CB 3.43Å; F163-H167 PolarHBondContact O-CD2 2.96Å; F163-H167 PolarHBondContact O-N 2.83Å; F163-Y173 HydrophobicContact CE1-CD1 4.02Å; F163-Y173 HydrophobicContact CE1-CG 4.27Å; F163-Y173 HydrophobicContact CZ-CD1 4.4Å; F163-L176 HydrophobicContact CE2-CD2 3.92Å; F163-L176 HydrophobicContact CZ-CB 4.05Å; F163-L176 HydrophobicContact CZ-CD1 4.17Å; F163-L176 HydrophobicContact CZ-CD2 3.78Å; F163-L176 HydrophobicContact CZ-CG 4.22Å; F163-D229 HydrophobicContact CD1-CB 4.49Å; F163-D229 HydrophobicContact CD2-CB 3.94Å; F163-D229 HydrophobicContact CE1-CB 4.23Å; F163-D229 HydrophobicContact CE2-CB 3.66Å; F163-D229 VanDerWaalsContact CE2-O 3.23Å; F163-D229 WeakPolarHBondContact CE2-O 3.28Å; F163-D229 HydrophobicContact CG-CB 4.34Å; F163-D229 HydrophobicContact CZ-CB 3.78Å; F163-W230 HydrophobicContact CB-CH2 3.53Å; F163-W230 HydrophobicContact CB-CZ2 4Å; F163-W230 HydrophobicContact CB-CZ3 3.89Å; F163-W230 HydrophobicContact CD2-CE3 4Å; F163-W230 HydrophobicContact CD2-CH2 4.37Å; F163-W230 AromaticContact CD2-CZ3 3.89Å; F163-W230 HydrophobicContact CD2-CZ3 3.89Å; F163-W230 HydrophobicContact CG-CH2 4.5Å; F163-W230 HydrophobicContact CG-CZ3 4.43Å; F163-L233 HydrophobicContact CE2-CB 4.26Å
164	E	97.1	Very high	97.6	Very high	28 Å²	28	7.7 Å²	7.7	13%	0.131	4%	0.039	C	C	.	.	H	α-helix	trans	-55.8	-46	172.8	179.9	-178.9	-130.4	0	0	111.3	L28 V160 L161 S168 V297 K301	L28-E164 HydrophobicContact CD1-CG 4.2Å; V160-E164 WeakPolarHBondContact O-CB 3.31Å; V160-E164 PolarHBondContact O-N 3.01Å; L161-E164 PolarHBondContact O-N 2.87Å; E164-S168 WeakPolarHBondContact O-CB 3.35Å; E164-S168 PolarHBondContact O-N 2.83Å; E164-V297 HydrophobicContact CB-CG1 4.45Å; E164-V297 HydrophobicContact CB-CG2 4.3Å; E164-V297 HydrophobicContact CG-CG1 4Å; E164-V297 VanDerWaalsContact OE1-CG1 3.31Å; E164-V297 WeakPolarHBondContact OE1-CG1 3.26Å; E164-K301 IonicContact OE1-NZ 2.7Å; E164-K301 PolarHBondContact OE1-NZ 3.43Å; E164-K301 WeakPolarHBondContact OE2-CE 3Å; E164-K301 IonicContact OE2-NZ 3.75Å; E164-K301 PolarHBondContact OE2-NZ 3Å
165	Y	97.3	Very high	97.6	Very high	3 Å²	3	7.6 Å²	7.6	1%	0.012	4%	0.039	C	C	.	.	H	α-helix	trans	-59.3	-58.4	174.6	169.1	-99.9	0	0	0	111.6	L28 A31 I107 D108 F109 L112 L161 A162 F163 H167 S168 L169	L28-Y165 HydrophobicContact CD2-CD2 4.4Å; A31-Y165 HydrophobicContact CB-CD2 4.38Å; A31-Y165 HydrophobicContact CB-CE2 3.81Å; I107-Y165 WeakPolarHBondContact CA-OH 3.44Å; I107-Y165 HydrophobicContact CB-CE1 4.11Å; I107-Y165 HydrophobicContact CG2-CE1 4.27Å; D108-Y165 PolarHBondContact N-OH 2.92Å; D108-Y165 PolarHBondContact O-OH 3Å; F109-Y165 HydrophobicContact CB-CD1 3.69Å; F109-Y165 HydrophobicContact CB-CD2 4.45Å; F109-Y165 HydrophobicContact CB-CE1 3.74Å; F109-Y165 HydrophobicContact CB-CE2 4.47Å; F109-Y165 HydrophobicContact CB-CG 4.06Å; F109-Y165 HydrophobicContact CD1-CD1 4.45Å; F109-Y165 HydrophobicContact CD1-CG 4.42Å; F109-Y165 HydrophobicContact CD2-CD1 4.01Å; F109-Y165 AromaticContact CD2-CD2 3.55Å; F109-Y165 HydrophobicContact CD2-CD2 3.55Å; F109-Y165 HydrophobicContact CD2-CE2 4.13Å; F109-Y165 AromaticContact CD2-CG 3.47Å; F109-Y165 HydrophobicContact CD2-CG 3.47Å; F109-Y165 VanDerWaalsContact CD2-CG 3.47Å; F109-Y165 HydrophobicContact CE2-CD2 4.09Å; F109-Y165 AromaticContact CE2-CG 3.97Å; F109-Y165 HydrophobicContact CE2-CG 3.97Å; F109-Y165 AromaticContact CG-CD1 3.81Å; F109-Y165 HydrophobicContact CG-CD1 3.81Å; F109-Y165 HydrophobicContact CG-CD2 4.2Å; F109-Y165 HydrophobicContact CG-CE1 4.32Å; F109-Y165 AromaticContact CG-CG 3.73Å; F109-Y165 HydrophobicContact CG-CG 3.73Å; L112-Y165 HydrophobicContact CD1-CD1 3.75Å; L112-Y165 HydrophobicContact CD1-CE1 3.73Å; L161-Y165 WeakPolarHBondContact O-CB 2.99Å; L161-Y165 PolarHBondContact O-N 2.78Å; A162-Y165 WeakPolarHBondContact O-CB 3.28Å; A162-Y165 PolarHBondContact O-N 3.14Å; F163-Y165 VanDerWaalsContact C-N 3.26Å; F163-Y165 PolarHBondContact O-N 3.46Å; Y165-H167 VanDerWaalsContact C-N 3.34Å; Y165-H167 PolarHBondContact O-N 3.39Å; Y165-S168 WeakPolarHBondContact O-CB 3.31Å; Y165-S168 PolarHBondContact O-N 3.22Å; Y165-S168 PolarHBondContact O-OG 3.47Å; Y165-L169 HydrophobicContact CD1-CD1 4.38Å; Y165-L169 HydrophobicContact CE1-CD1 3.72Å; Y165-L169 HydrophobicContact CE2-CD1 3.94Å; Y165-L169 VanDerWaalsContact CZ-CD1 3.48Å; Y165-L169 PolarHBondContact O-N 2.88Å
166	L	98	Very high	97.7	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.01	4%	0.039	C	C	.	.	H	α-helix	trans	-58	-44.5	-178.2	-71.7	175.4	0	0	0	112.4	I107 L112 A162 F163 S168 L169 L171 F194	I107-L166 HydrophobicContact CG2-CD2 4.09Å; L112-L166 HydrophobicContact CD1-CD1 4.42Å; L112-L166 HydrophobicContact CD1-CD2 3.78Å; L112-L166 HydrophobicContact CD1-CG 4.06Å; L112-L166 HydrophobicContact CD2-CD1 4.39Å; A162-L166 WeakPolarHBondContact O-CB 3.46Å; A162-L166 WeakPolarHBondContact O-CG 3.45Å; A162-L166 PolarHBondContact O-N 2.79Å; F163-L166 HydrophobicContact CD1-CD1 4.46Å; F163-L166 PolarHBondContact O-N 2.81Å; L166-S168 PolarHBondContact O-N 2.93Å; L166-L169 WeakPolarHBondContact O-CA 3.3Å; L166-L169 WeakPolarHBondContact O-CB 3.11Å; L166-L169 PolarHBondContact O-N 3.35Å; L166-L171 CarbonylContact C-O 3.47Å; L166-L171 HydrophobicContact CB-CB 4.18Å; L166-L171 HydrophobicContact CD2-CB 4.27Å; L166-L171 HydrophobicContact CD2-CD1 3.81Å; L166-L171 WeakPolarHBondContact O-CB 3.44Å; L166-L171 PolarHBondContact O-N 2.82Å; L166-F194 HydrophobicContact CD1-CE1 4.17Å; L166-F194 HydrophobicContact CD2-CE1 4.06Å
167	H	97.1	Very high	97.7	Very high	13 Å²	13	9 Å²	9	6%	0.06	5%	0.046	C	C	.	.	H	α-helix	trans	-67.7	-25.7	-179.8	-66.6	-177	0	0	0	112	F163 Y165 L169 D170 L171 K226 D229 W230	F163-H167 WeakPolarHBondContact O-CB 3.43Å; F163-H167 PolarHBondContact O-CD2 2.96Å; F163-H167 PolarHBondContact O-N 2.83Å; Y165-H167 VanDerWaalsContact C-N 3.34Å; Y165-H167 PolarHBondContact O-N 3.39Å; H167-L169 PolarHBondContact O-N 3.22Å; H167-D170 PolarHBondContact O-N 2.88Å; H167-L171 PolarHBondContact CD2-O 3.36Å; H167-K226 HydrophobicContact CB-CD 3.88Å; H167-K226 PolarHBondContact CE1-O 3.48Å; H167-D229 IonicContact CD2-OD2 2.68Å; H167-D229 IonicContact CE1-OD2 3.96Å; H167-D229 IonicContact NE2-OD2 3.24Å; H167-D229 PolarHBondContact NE2-OD2 3.24Å; H167-W230 AromaticContact CE1-CE2 3.63Å; H167-W230 AromaticContact CE1-CZ2 3.85Å; H167-W230 AromaticContact CE1-NE1 3.47Å; H167-W230 PolarHBondContact CE1-NE1 2.99Å; H167-W230 AromaticContact ND1-CE2 3.65Å; H167-W230 AromaticContact ND1-CZ2 3.6Å; H167-W230 AromaticContact ND1-NE1 3.42Å; H167-W230 PolarHBondContact ND1-NE1 2.8Å
168	S	95.5	Very high	97.5	Very high	18 Å²	18	9 Å²	9	13%	0.126	5%	0.046	C	C	.	.	H	α-helix	trans	-70.1	-17	173.3	83.2	0	0	0	0	113.6	R32 E164 Y165 L166	R32-S168 PolarHBondContact NE-O 3.09Å; R32-S168 PolarHBondContact NH2-O 3.29Å; E164-S168 WeakPolarHBondContact O-CB 3.35Å; E164-S168 PolarHBondContact O-N 2.83Å; Y165-S168 WeakPolarHBondContact O-CB 3.31Å; Y165-S168 PolarHBondContact O-N 3.22Å; Y165-S168 PolarHBondContact O-OG 3.47Å; L166-S168 PolarHBondContact O-N 2.93Å
169	L	96.9	Very high	97.3	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.01	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	8.4	177.4	-53.4	178.5	0	0	0	113.2	R32 F35 I107 Y165 L166 H167 L171	R32-L169 HydrophobicContact CB-CD2 4.02Å; R32-L169 HydrophobicContact CG-CD2 4.16Å; F35-L169 HydrophobicContact CB-CD1 4.03Å; F35-L169 HydrophobicContact CB-CD2 3.7Å; F35-L169 HydrophobicContact CB-CG 4.43Å; F35-L169 HydrophobicContact CD1-CB 4.11Å; F35-L169 HydrophobicContact CD1-CD1 4.38Å; F35-L169 HydrophobicContact CD1-CD2 3.98Å; F35-L169 HydrophobicContact CD1-CG 4.38Å; F35-L169 HydrophobicContact CD2-CD1 3.67Å; F35-L169 HydrophobicContact CD2-CG 4.49Å; F35-L169 HydrophobicContact CE1-CB 4.15Å; F35-L169 HydrophobicContact CE2-CD1 4.23Å; F35-L169 HydrophobicContact CG-CB 4.32Å; F35-L169 HydrophobicContact CG-CD1 3.76Å; F35-L169 HydrophobicContact CG-CD2 3.84Å; F35-L169 HydrophobicContact CG-CG 4.18Å; F35-L169 HydrophobicContact CZ-CB 4.42Å; I107-L169 HydrophobicContact CG2-CD1 4.33Å; Y165-L169 HydrophobicContact CD1-CD1 4.38Å; Y165-L169 HydrophobicContact CE1-CD1 3.72Å; Y165-L169 HydrophobicContact CE2-CD1 3.94Å; Y165-L169 VanDerWaalsContact CZ-CD1 3.48Å; Y165-L169 PolarHBondContact O-N 2.88Å; L166-L169 WeakPolarHBondContact O-CA 3.3Å; L166-L169 WeakPolarHBondContact O-CB 3.11Å; L166-L169 PolarHBondContact O-N 3.35Å; H167-L169 PolarHBondContact O-N 3.22Å; L169-L171 HydrophobicContact CB-CD1 4.1Å; L169-L171 HydrophobicContact CB-CG 4.14Å; L169-L171 HydrophobicContact CD1-CD1 4.19Å; L169-L171 PolarHBondContact O-N 3.31Å
170	D	96.8	Very high	97.2	Very high	59 Å²	59	12.7 Å²	12.7	32%	0.316	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	22.4	-170.1	-50.7	-51	0	0	0	113.7	H167 R199 V200 K201	H167-D170 PolarHBondContact O-N 2.88Å; D170-R199 HydrophobicContact CB-CG 4.09Å; D170-R199 CarbonylContact O-C 3.49Å; D170-R199 VanDerWaalsContact O-CA 3.26Å; D170-R199 WeakPolarHBondContact O-CA 3.28Å; D170-V200 PolarHBondContact O-N 2.91Å; D170-K201 HydrophobicContact CB-CG 4.32Å
171	L	98	Very high	97.1	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.01	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.3	176.9	-64.3	170.5	0	0	0	110.7	F35 I103 I107 L166 H167 L169 K198 R199	F35-L171 HydrophobicContact CE2-CD1 3.81Å; F35-L171 HydrophobicContact CZ-CD1 4.03Å; F35-L171 HydrophobicContact CZ-CD2 4.37Å; F35-L171 HydrophobicContact CZ-CG 4.31Å; I103-L171 HydrophobicContact CD1-CD2 3.92Å; I103-L171 HydrophobicContact CG1-CD2 3.88Å; I103-L171 HydrophobicContact CG2-CD1 4.01Å; I103-L171 HydrophobicContact CG2-CD2 4.36Å; I107-L171 HydrophobicContact CG2-CD1 3.67Å; L166-L171 CarbonylContact C-O 3.47Å; L166-L171 HydrophobicContact CB-CB 4.18Å; L166-L171 HydrophobicContact CD2-CB 4.27Å; L166-L171 HydrophobicContact CD2-CD1 3.81Å; L166-L171 WeakPolarHBondContact O-CB 3.44Å; L166-L171 PolarHBondContact O-N 2.82Å; H167-L171 PolarHBondContact CD2-O 3.36Å; L169-L171 HydrophobicContact CB-CD1 4.1Å; L169-L171 HydrophobicContact CB-CG 4.14Å; L169-L171 HydrophobicContact CD1-CD1 4.19Å; L169-L171 PolarHBondContact O-N 3.31Å; L171-K198 WeakPolarHBondContact CA-O 3.48Å; L171-R199 HydrophobicContact CD2-CB 3.77Å; L171-R199 HydrophobicContact CD2-CG 4.17Å
172	I	97.7	Very high	97	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.015	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.9	168.8	-48.2	173.6	0	0	0	107.2	R174 A197 K198 V200 K226 V228 D229	I172-R174 HydrophobicContact CB-CG 4.07Å; I172-R174 HydrophobicContact CG2-CG 3.46Å; I172-R174 VanDerWaalsContact CG2-CG 3.46Å; I172-A197 CarbonylContact O-C 3.48Å; I172-A197 WeakPolarHBondContact O-CA 3.28Å; I172-K198 PolarHBondContact N-O 2.96Å; I172-K198 PolarHBondContact O-N 2.6Å; I172-V200 HydrophobicContact CD1-CB 3.74Å; I172-V200 HydrophobicContact CD1-CG1 4.14Å; I172-V200 HydrophobicContact CD1-CG2 3.98Å; I172-V200 HydrophobicContact CG1-CB 4.31Å; I172-K226 HydrophobicContact CG1-CB 4.21Å; I172-V228 HydrophobicContact CG2-CG2 3.94Å; I172-D229 VanDerWaalsContact CG2-OD2 3.28Å; I172-D229 WeakPolarHBondContact CG2-OD2 3.47Å
173	Y	98.2	Very high	96.7	Very high	1 Å²	1	13.6 Å²	13.6	0%	0.004	7%	0.068	C	C	.	.			trans	-84.1	-45.8	-173.7	178.7	-115.2	0	0	0	113.4	F163 D175 L176 N180 I191 T192 D193 F194 F196 A197 D229	F163-Y173 HydrophobicContact CE1-CD1 4.02Å; F163-Y173 HydrophobicContact CE1-CG 4.27Å; F163-Y173 HydrophobicContact CZ-CD1 4.4Å; Y173-D175 VanDerWaalsContact C-N 3.3Å; Y173-D175 WeakPolarHBondContact CE1-O 3.5Å; Y173-D175 PolarHBondContact O-N 3.15Å; Y173-L176 HydrophobicContact CD1-CB 4.18Å; Y173-L176 HydrophobicContact CE1-CB 4.19Å; Y173-N180 WeakPolarHBondContact OH-CB 3.26Å; Y173-N180 PolarHBondContact OH-ND2 2.95Å; Y173-I191 HydrophobicContact CD2-CG2 4.38Å; Y173-I191 HydrophobicContact CE1-CG2 3.9Å; Y173-I191 HydrophobicContact CE2-CG2 3.7Å; Y173-I191 VanDerWaalsContact CZ-CG2 3.45Å; Y173-T192 PolarHBondContact OH-O 3.06Å; Y173-D193 VanDerWaalsContact CE2-O 3.26Å; Y173-D193 WeakPolarHBondContact CE2-O 3.48Å; Y173-D193 PolarHBondContact OH-O 3.34Å; Y173-F194 HydrophobicContact CD2-CD1 4.15Å; Y173-F194 HydrophobicContact CD2-CE1 4.07Å; Y173-F194 HydrophobicContact CD2-CG 4.5Å; Y173-F194 HydrophobicContact CD2-CZ 4.35Å; Y173-F194 HydrophobicContact CE2-CD1 4.34Å; Y173-F194 HydrophobicContact CE2-CD2 4.17Å; Y173-F194 HydrophobicContact CE2-CE1 4.38Å; Y173-F194 HydrophobicContact CE2-CE2 4.21Å; Y173-F194 HydrophobicContact CE2-CG 4.24Å; Y173-F194 HydrophobicContact CE2-CZ 4.32Å; Y173-F196 CarbonylContact O-C 3.57Å; Y173-A197 HydrophobicContact CD2-CB 4.44Å; Y173-A197 PolarHBondContact O-N 3.11Å; Y173-D229 PolarHBondContact N-OD1 3Å; Y173-D229 PolarHBondContact N-OD2 3.42Å
174	R	97.6	Very high	96.3	Very high	14 Å²	14	14.3 Å²	14.3	5%	0.053	7%	0.071	C	C	.	.			trans	67.8	-0.9	170	-51.7	-170.9	-67.7	166.9	3.2	118.6	I172 F196 Y224 V228 D229	I172-R174 HydrophobicContact CB-CG 4.07Å; I172-R174 HydrophobicContact CG2-CG 3.46Å; I172-R174 VanDerWaalsContact CG2-CG 3.46Å; R174-F196 HydrophobicContact CB-CB 4.24Å; R174-F196 PolarHBondContact NE-O 3.42Å; R174-F196 PolarHBondContact NH2-O 3Å; R174-Y224 WeakPolarHBondContact CD-OH 3.46Å; R174-Y224 HydrophobicContact CG-CE2 4.47Å; R174-Y224 PolarHBondContact NH1-OH 3.32Å; R174-V228 HydrophobicContact CG-CG2 4.41Å; R174-D229 PolarHBondContact N-OD1 2.85Å
175	D	96.8	Very high	95.7	Very high	7 Å²	7	16.6 Å²	16.6	4%	0.037	9%	0.091	C	C	.	.			trans	-138.3	44.2	175.8	-152.4	31.4	0	0	0	113.7	Y173 K177 N180 F196 G209 T210	Y173-D175 VanDerWaalsContact C-N 3.3Å; Y173-D175 WeakPolarHBondContact CE1-O 3.5Å; Y173-D175 PolarHBondContact O-N 3.15Å; D175-K177 PolarHBondContact O-N 2.61Å; D175-K177 IonicContact OD1-NZ 2.89Å; D175-K177 PolarHBondContact OD1-NZ 2.99Å; D175-K177 WeakPolarHBondContact OD2-CE 3.49Å; D175-K177 IonicContact OD2-NZ 2.84Å; D175-K177 PolarHBondContact OD2-NZ 2.87Å; D175-N180 PolarHBondContact O-ND2 3.35Å; D175-N180 PolarHBondContact OD2-ND2 3.41Å; D175-F196 HydrophobicContact CB-CB 4.46Å; D175-F196 HydrophobicContact CB-CD2 3.76Å; D175-G209 WeakPolarHBondContact OD1-CA 3.43Å; D175-T210 PolarHBondContact OD1-N 3.3Å; D175-T210 PolarHBondContact OD1-OG1 2.85Å
176	L	98.6	Very high	95.2	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.111	C	C	.	.			trans	-68.9	123	173.9	-174.8	73.5	0	0	0	110	I159 F163 Y173 L181 Y213 A232 L233 L236	I159-L176 HydrophobicContact CD1-CD1 4.18Å; I159-L176 HydrophobicContact CG2-CD1 4.01Å; I159-L176 HydrophobicContact CG2-CD2 3.91Å; F163-L176 HydrophobicContact CE2-CD2 3.92Å; F163-L176 HydrophobicContact CZ-CB 4.05Å; F163-L176 HydrophobicContact CZ-CD1 4.17Å; F163-L176 HydrophobicContact CZ-CD2 3.78Å; F163-L176 HydrophobicContact CZ-CG 4.22Å; Y173-L176 HydrophobicContact CD1-CB 4.18Å; Y173-L176 HydrophobicContact CE1-CB 4.19Å; L176-L181 HydrophobicContact CD1-CD1 4.24Å; L176-L181 HydrophobicContact CD1-CD2 3.97Å; L176-L181 HydrophobicContact CD1-CG 4.4Å; L176-Y213 WeakPolarHBondContact O-CD1 3.4Å; L176-Y213 WeakPolarHBondContact O-CE1 3.32Å; L176-A232 HydrophobicContact CB-CB 3.98Å; L176-A232 HydrophobicContact CD2-CB 4.26Å; L176-L233 HydrophobicContact CD2-CB 4.37Å; L176-L236 HydrophobicContact CD1-CD2 4.09Å; L176-L236 HydrophobicContact CD2-CB 4.08Å; L176-L236 HydrophobicContact CD2-CD2 3.81Å; L176-L236 HydrophobicContact CG-CD2 4.03Å
177	K	97.1	Very high	94.8	Very high	31 Å²	31	19.8 Å²	19.8	14%	0.135	11%	0.11	C	C	.	.	S	Bend	trans	-164.2	159.2	174	61.1	-176.5	160.8	-159.7	0	109.6	D175 E179 N180 L181 T210 Y213	D175-K177 PolarHBondContact O-N 2.61Å; D175-K177 IonicContact OD1-NZ 2.89Å; D175-K177 PolarHBondContact OD1-NZ 2.99Å; D175-K177 WeakPolarHBondContact OD2-CE 3.49Å; D175-K177 IonicContact OD2-NZ 2.84Å; D175-K177 PolarHBondContact OD2-NZ 2.87Å; K177-E179 VanDerWaalsContact CB-OE2 3.29Å; K177-E179 WeakPolarHBondContact CB-OE2 3.38Å; K177-E179 HydrophobicContact CD-CB 4.14Å; K177-E179 WeakPolarHBondContact CD-OE2 3.45Å; K177-E179 HydrophobicContact CG-CB 4.13Å; K177-E179 VanDerWaalsContact CG-OE2 3.3Å; K177-E179 WeakPolarHBondContact CG-OE2 3.23Å; K177-E179 PolarHBondContact O-N 2.84Å; K177-E179 VanDerWaalsContact O-N 3.13Å; K177-N180 VanDerWaalsContact CE-CG 3.4Å; K177-N180 WeakPolarHBondContact CE-ND2 3.3Å; K177-N180 VanDerWaalsContact CE-OD1 3.3Å; K177-N180 WeakPolarHBondContact CE-OD1 3.32Å; K177-N180 HydrophobicContact CG-CB 4.15Å; K177-N180 PolarHBondContact O-N 2.93Å; K177-L181 WeakPolarHBondContact O-CG 3.28Å; K177-T210 HydrophobicContact CD-CG2 4.16Å; K177-T210 VanDerWaalsContact CD-OG1 3.3Å; K177-T210 WeakPolarHBondContact CD-OG1 3.36Å; K177-T210 PolarHBondContact NZ-OG1 3.07Å; K177-Y213 HydrophobicContact CB-CD2 4.04Å; K177-Y213 HydrophobicContact CB-CE2 3.93Å; K177-Y213 HydrophobicContact CB-CG 4.45Å
178	P	96	Very high	94.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-57.3	-27.1	-178.3	-26.1	35	0	0	0	114.4	M137 F138 L141 N180 L181 Y213 L236	M137-P178 HydrophobicContact CB-CB 4.37Å; M137-P178 HydrophobicContact CG-CB 4.27Å; M137-P178 PolarHBondContact N-O 3.39Å; M137-P178 HydrophobicContact SD-CB 4.48Å; F138-P178 HydrophobicContact CB-CB 3.82Å; F138-P178 HydrophobicContact CD2-CB 4.23Å; F138-P178 PolarHBondContact N-O 3.45Å; F138-P178 VanDerWaalsContact N-O 3.14Å; L141-P178 HydrophobicContact CD2-CG 4.44Å; P178-N180 VanDerWaalsContact C-N 3.33Å; P178-L181 PolarHBondContact O-N 3.18Å; P178-Y213 WeakPolarHBondContact CD-OH 3.26Å; P178-L236 HydrophobicContact CG-CD1 3.82Å
179	E	93.8	Very high	94.6	Very high	66 Å²	66	18.5 Å²	18.5	31%	0.308	10%	0.103	S	C	.	.	G	3₁₀ helix	trans	-68.6	-31.6	177.8	-60.4	88.8	152.7	0	0	112	F138 K177 L181	F138-E179 HydrophobicContact CB-CG 3.97Å; F138-E179 HydrophobicContact CD2-CG 3.96Å; F138-E179 HydrophobicContact CG-CG 3.93Å; K177-E179 VanDerWaalsContact CB-OE2 3.29Å; K177-E179 WeakPolarHBondContact CB-OE2 3.38Å; K177-E179 HydrophobicContact CD-CB 4.14Å; K177-E179 WeakPolarHBondContact CD-OE2 3.45Å; K177-E179 HydrophobicContact CG-CB 4.13Å; K177-E179 VanDerWaalsContact CG-OE2 3.3Å; K177-E179 WeakPolarHBondContact CG-OE2 3.23Å; K177-E179 PolarHBondContact O-N 2.84Å; K177-E179 VanDerWaalsContact O-N 3.13Å; E179-L181 VanDerWaalsContact C-N 3.31Å
180	N	96.1	Very high	94.6	Very high	12 Å²	12	18.9 Å²	18.9	6%	0.064	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-92.4	11	179	-70	-2.9	0	0	0	113	Y173 D175 K177 P178 T192	Y173-N180 WeakPolarHBondContact OH-CB 3.26Å; Y173-N180 PolarHBondContact OH-ND2 2.95Å; D175-N180 PolarHBondContact O-ND2 3.35Å; D175-N180 PolarHBondContact OD2-ND2 3.41Å; K177-N180 VanDerWaalsContact CE-CG 3.4Å; K177-N180 WeakPolarHBondContact CE-ND2 3.3Å; K177-N180 VanDerWaalsContact CE-OD1 3.3Å; K177-N180 WeakPolarHBondContact CE-OD1 3.32Å; K177-N180 HydrophobicContact CG-CB 4.15Å; K177-N180 PolarHBondContact O-N 2.93Å; P178-N180 VanDerWaalsContact C-N 3.33Å; N180-T192 WeakPolarHBondContact O-CG2 3.45Å; N180-T192 PolarHBondContact O-N 3.32Å
181	L	96.8	Very high	94.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	113.3	178.3	-61.8	-179.3	0	0	0	109.5	M137 I159 L176 K177 P178 E179 L189 I191 L236	M137-L181 HydrophobicContact CB-CB 3.98Å; M137-L181 HydrophobicContact CE-CB 4.43Å; M137-L181 HydrophobicContact CE-CD1 3.92Å; M137-L181 PolarHBondContact N-O 2.91Å; M137-L181 HydrophobicContact SD-CD1 3.85Å; I159-L181 HydrophobicContact CD1-CD1 4.13Å; I159-L181 HydrophobicContact CD1-CD2 3.6Å; L176-L181 HydrophobicContact CD1-CD1 4.24Å; L176-L181 HydrophobicContact CD1-CD2 3.97Å; L176-L181 HydrophobicContact CD1-CG 4.4Å; K177-L181 WeakPolarHBondContact O-CG 3.28Å; P178-L181 PolarHBondContact O-N 3.18Å; E179-L181 VanDerWaalsContact C-N 3.31Å; L181-L189 HydrophobicContact CB-CD2 4.45Å; L181-I191 HydrophobicContact CD2-CB 4.27Å; L181-I191 HydrophobicContact CD2-CD1 4.5Å; L181-I191 HydrophobicContact CD2-CG1 3.68Å; L181-I191 HydrophobicContact CD2-CG2 4.42Å; L181-L236 HydrophobicContact CD1-CD1 4.08Å; L181-L236 HydrophobicContact CD1-CD2 3.6Å; L181-L236 HydrophobicContact CD1-CG 4.49Å
182	L	94.3	Very high	94.6	Very high	23 Å²	23	17.5 Å²	17.5	12%	0.12	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	147	175.2	-55.9	176.8	0	0	0	110	I132 G135 E136 L189 K190 T192	I132-L182 HydrophobicContact CB-CB 3.95Å; I132-L182 HydrophobicContact CB-CD1 3.86Å; I132-L182 HydrophobicContact CG1-CB 4.47Å; I132-L182 HydrophobicContact CG1-CD1 4.13Å; I132-L182 HydrophobicContact CG2-CB 3.58Å; I132-L182 HydrophobicContact CG2-CD1 4.44Å; G135-L182 WeakPolarHBondContact O-CA 3.28Å; E136-L182 HydrophobicContact CG-CD2 3.88Å; L182-L189 CarbonylContact O-C 3.42Å; L182-L189 VanDerWaalsContact O-CA 3.3Å; L182-L189 WeakPolarHBondContact O-CA 3.26Å; L182-K190 HydrophobicContact CB-CB 4.36Å; L182-K190 PolarHBondContact N-O 3.28Å; L182-K190 PolarHBondContact O-N 3.47Å; L182-T192 HydrophobicContact CD1-CG2 4.01Å; L182-T192 HydrophobicContact CG-CG2 3.93Å
183	I	92.1	Very high	94.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.7	173	-56.4	-175.9	0	0	0	108.3	I132 G134 G135 H140 Y188 L189 P339	I132-I183 VanDerWaalsContact CG2-O 3.28Å; I132-I183 WeakPolarHBondContact CG2-O 3.35Å; G134-I183 CarbonylContact C-O 3.54Å; G134-I183 WeakPolarHBondContact CA-O 3.35Å; G134-I183 PolarHBondContact N-O 3.28Å; G134-I183 VanDerWaalsContact N-O 3.16Å; G135-I183 PolarHBondContact O-N 2.8Å; H140-I183 HydrophobicContact CB-CD1 4.48Å; I183-Y188 CarbonylContact C-O 3.52Å; I183-Y188 WeakPolarHBondContact CA-O 3.44Å; I183-L189 HydrophobicContact CG1-CD2 3.92Å; I183-P339 HydrophobicContact CG2-CG 4.15Å
184	D	90	Very high	94.2	Very high	15 Å²	15	20 Å²	20	8%	0.08	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-80.7	172	175.8	74.5	23.8	0	0	0	112.3	I132 T186 G187 Y188 K317	I132-D184 HydrophobicContact CG2-CB 4.06Å; D184-T186 PolarHBondContact O-N 3.41Å; D184-T186 VanDerWaalsContact OD1-CA 3.29Å; D184-T186 WeakPolarHBondContact OD1-CA 3.39Å; D184-T186 WeakPolarHBondContact OD1-CB 3.47Å; D184-T186 PolarHBondContact OD1-N 2.91Å; D184-T186 PolarHBondContact OD1-OG1 3.16Å; D184-T186 PolarHBondContact OD2-OG1 3.19Å; D184-G187 PolarHBondContact O-N 2.81Å; D184-G187 PolarHBondContact OD1-N 3.42Å; D184-G187 VanDerWaalsContact OD1-N 3.14Å; D184-Y188 PolarHBondContact N-O 3.08Å; D184-Y188 PolarHBondContact OD1-N 3.23Å; D184-K317 IonicContact OD2-NZ 3.14Å; D184-K317 PolarHBondContact OD2-NZ 2.85Å
185	S	85.6	Confident	94	Very high	77 Å²	77	19.8 Å²	19.8	54%	0.538	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.7	-179.5	57.3	0	0	0	0	114.1
186	T	86.6	Confident	93.8	Very high	71 Å²	71	22.3 Å²	22.3	44%	0.436	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.5	174.9	72.7	0	0	0	0	112.8	D184 Y188 P321	D184-T186 PolarHBondContact O-N 3.41Å; D184-T186 VanDerWaalsContact OD1-CA 3.29Å; D184-T186 WeakPolarHBondContact OD1-CA 3.39Å; D184-T186 WeakPolarHBondContact OD1-CB 3.47Å; D184-T186 PolarHBondContact OD1-N 2.91Å; D184-T186 PolarHBondContact OD1-OG1 3.16Å; D184-T186 PolarHBondContact OD2-OG1 3.19Å; T186-Y188 WeakPolarHBondContact OG1-CD2 3.31Å; T186-P321 WeakPolarHBondContact O-CG 3.42Å
187	G	89.1	Confident	93.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	85.5	6.1	-177.4	0	0	0	0	0	114.1	Y155 D184	Y155-G187 WeakPolarHBondContact CE1-O 3.49Å; D184-G187 PolarHBondContact O-N 2.81Å; D184-G187 PolarHBondContact OD1-N 3.42Å; D184-G187 VanDerWaalsContact OD1-N 3.14Å
188	Y	93.5	Very high	93.6	Very high	5 Å²	5	23.4 Å²	23.4	2%	0.02	13%	0.129	C	C	.	.			trans	-88.8	158.8	177	-85.2	-95.9	0	0	0	111.5	F111 F154 Q158 I183 D184 T186 K317 I319	F111-Y188 HydrophobicContact CD1-CD1 4.22Å; F111-Y188 AromaticContact CE1-CD1 3.55Å; F111-Y188 HydrophobicContact CE1-CD1 3.55Å; F111-Y188 AromaticContact CE1-CE1 3.99Å; F111-Y188 HydrophobicContact CE1-CE1 3.99Å; F111-Y188 HydrophobicContact CZ-CD1 4.36Å; F111-Y188 HydrophobicContact CZ-CE1 4.41Å; F154-Y188 AromaticContact CE2-CE1 3.92Å; F154-Y188 HydrophobicContact CE2-CE1 3.92Å; F154-Y188 HydrophobicContact CE2-CE2 4.37Å; F154-Y188 AromaticContact CE2-CZ 3.8Å; F154-Y188 AromaticContact CZ-CD1 3.94Å; F154-Y188 HydrophobicContact CZ-CD1 3.94Å; F154-Y188 HydrophobicContact CZ-CD2 4.11Å; F154-Y188 AromaticContact CZ-CE1 3.7Å; F154-Y188 HydrophobicContact CZ-CE1 3.7Å; F154-Y188 AromaticContact CZ-CE2 3.88Å; F154-Y188 HydrophobicContact CZ-CE2 3.88Å; F154-Y188 HydrophobicContact CZ-CG 4.15Å; F154-Y188 AromaticContact CZ-CZ 3.66Å; Q158-Y188 HydrophobicContact CG-CD1 4.25Å; Q158-Y188 HydrophobicContact CG-CE1 4.5Å; Q158-Y188 VanDerWaalsContact OE1-CD1 3.24Å; I183-Y188 CarbonylContact C-O 3.52Å; I183-Y188 WeakPolarHBondContact CA-O 3.44Å; D184-Y188 PolarHBondContact N-O 3.08Å; D184-Y188 PolarHBondContact OD1-N 3.23Å; T186-Y188 WeakPolarHBondContact OG1-CD2 3.31Å; Y188-K317 HydrophobicContact CD1-CD 4.31Å; Y188-K317 HydrophobicContact CD1-CG 3.9Å; Y188-K317 HydrophobicContact CD2-CB 4.32Å; Y188-K317 HydrophobicContact CD2-CD 4.27Å; Y188-K317 HydrophobicContact CD2-CG 4.26Å; Y188-K317 HydrophobicContact CE1-CB 4.23Å; Y188-K317 HydrophobicContact CE1-CG 3.92Å; Y188-K317 HydrophobicContact CE2-CB 3.95Å; Y188-K317 HydrophobicContact CE2-CG 4.28Å; Y188-K317 HydrophobicContact CG-CD 4.05Å; Y188-K317 HydrophobicContact CG-CG 4.07Å; Y188-K317 VanDerWaalsContact CZ-CA 3.47Å; Y188-K317 VanDerWaalsContact OH-C 3.31Å; Y188-K317 VanDerWaalsContact OH-CA 3.28Å; Y188-K317 WeakPolarHBondContact OH-CA 3.37Å; Y188-I319 WeakPolarHBondContact CE2-O 3.19Å; Y188-I319 PolarHBondContact OH-N 2.88Å; Y188-I319 VanDerWaalsContact OH-N 3.12Å; Y188-I319 PolarHBondContact OH-O 3Å
189	L	95.3	Very high	93.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	151.2	-179	-64.3	176.4	0	0	0	113.1	F111 M137 Y155 Q158 I159 L181 L182 I183	F111-L189 WeakPolarHBondContact CA-O 3.22Å; M137-L189 HydrophobicContact CE-CD1 3.77Å; M137-L189 HydrophobicContact CE-CD2 3.41Å; M137-L189 VanDerWaalsContact CE-CD2 3.41Å; M137-L189 HydrophobicContact CE-CG 4.21Å; Y155-L189 HydrophobicContact CD1-CD1 3.6Å; Y155-L189 HydrophobicContact CD1-CD2 3.74Å; Y155-L189 HydrophobicContact CD1-CG 3.51Å; Y155-L189 HydrophobicContact CE1-CD2 3.95Å; Y155-L189 HydrophobicContact CE1-CG 4.05Å; Y155-L189 HydrophobicContact CG-CD1 4.03Å; Y155-L189 HydrophobicContact CG-CG 4.38Å; Q158-L189 HydrophobicContact CB-CD1 4.4Å; I159-L189 HydrophobicContact CD1-CD1 3.96Å; I159-L189 HydrophobicContact CG1-CD1 4.29Å; L181-L189 HydrophobicContact CB-CD2 4.45Å; L182-L189 CarbonylContact O-C 3.42Å; L182-L189 VanDerWaalsContact O-CA 3.3Å; L182-L189 WeakPolarHBondContact O-CA 3.26Å; I183-L189 HydrophobicContact CG1-CD2 3.92Å
190	K	97.3	Very high	93.5	Very high	10 Å²	10	24.7 Å²	24.7	4%	0.043	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	111	165.7	-73.3	-77.1	-173	167.8	0	108.4	P110 F111 L112 E130 I132 L182 T192	P110-K190 VanDerWaalsContact O-CE 3.26Å; P110-K190 WeakPolarHBondContact O-CE 3.16Å; P110-K190 PolarHBondContact O-NZ 2.91Å; F111-K190 CarbonylContact O-C 3.57Å; F111-K190 WeakPolarHBondContact O-CA 3.43Å; L112-K190 WeakPolarHBondContact O-CD 3.38Å; L112-K190 PolarHBondContact O-NZ 3.44Å; E130-K190 VanDerWaalsContact CD-NZ 3.35Å; E130-K190 WeakPolarHBondContact OE1-CE 3.35Å; E130-K190 IonicContact OE1-NZ 2.81Å; E130-K190 PolarHBondContact OE1-NZ 3.45Å; E130-K190 WeakPolarHBondContact OE2-CE 3.29Å; E130-K190 IonicContact OE2-NZ 3.86Å; E130-K190 PolarHBondContact OE2-NZ 3.33Å; I132-K190 HydrophobicContact CD1-CB 4.25Å; I132-K190 HydrophobicContact CD1-CD 4.28Å; I132-K190 HydrophobicContact CD1-CG 3.68Å; I132-K190 HydrophobicContact CG1-CB 3.95Å; I132-K190 HydrophobicContact CG1-CG 3.96Å; I132-K190 HydrophobicContact CG2-CB 4.45Å; L182-K190 HydrophobicContact CB-CB 4.36Å; L182-K190 PolarHBondContact N-O 3.28Å; L182-K190 PolarHBondContact O-N 3.47Å; K190-T192 PolarHBondContact O-N 3.42Å
191	I	98.4	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	126.9	170.5	-53.4	-176.2	0	0	0	107.6	F111 L112 V113 I159 A162 Y173 L181 F194	F111-I191 WeakPolarHBondContact O-CG1 3.36Å; F111-I191 PolarHBondContact O-N 2.87Å; L112-I191 HydrophobicContact CD2-CB 3.74Å; L112-I191 HydrophobicContact CD2-CD1 3.74Å; L112-I191 HydrophobicContact CD2-CG1 3.96Å; L112-I191 HydrophobicContact CD2-CG2 4.46Å; V113-I191 WeakPolarHBondContact CB-O 3.38Å; V113-I191 WeakPolarHBondContact CG1-O 3.34Å; V113-I191 PolarHBondContact N-O 2.93Å; I159-I191 HydrophobicContact CD1-CD1 3.75Å; I159-I191 HydrophobicContact CD1-CG1 3.9Å; A162-I191 HydrophobicContact CB-CD1 3.6Å; Y173-I191 HydrophobicContact CD2-CG2 4.38Å; Y173-I191 HydrophobicContact CE1-CG2 3.9Å; Y173-I191 HydrophobicContact CE2-CG2 3.7Å; Y173-I191 VanDerWaalsContact CZ-CG2 3.45Å; L181-I191 HydrophobicContact CD2-CB 4.27Å; L181-I191 HydrophobicContact CD2-CD1 4.5Å; L181-I191 HydrophobicContact CD2-CG1 3.68Å; L181-I191 HydrophobicContact CD2-CG2 4.42Å; I191-F194 HydrophobicContact CG2-CE2 4.31Å
192	T	95.8	Very high	93.1	Very high	31 Å²	31	34.8 Å²	34.8	19%	0.19	19%	0.19	C	C	.	.			trans	-117.5	-175.9	176.7	-168.8	0	0	0	0	110.7	Y173 N180 L182 K190	Y173-T192 PolarHBondContact OH-O 3.06Å; N180-T192 WeakPolarHBondContact O-CG2 3.45Å; N180-T192 PolarHBondContact O-N 3.32Å; L182-T192 HydrophobicContact CD1-CG2 4.01Å; L182-T192 HydrophobicContact CG-CG2 3.93Å; K190-T192 PolarHBondContact O-N 3.42Å
193	D	92.6	Very high	93.2	Very high	56 Å²	56	41.4 Å²	41.4	30%	0.299	21%	0.214	S	C	.	.			trans	51.7	88.6	177.7	-161.3	-8.1	0	0	0	114.9	Y173 G195	Y173-D193 VanDerWaalsContact CE2-O 3.26Å; Y173-D193 WeakPolarHBondContact CE2-O 3.48Å; Y173-D193 PolarHBondContact OH-O 3.34Å; D193-G195 VanDerWaalsContact C-N 3.33Å; D193-G195 PolarHBondContact OD1-N 2.71Å; D193-G195 VanDerWaalsContact OD1-N 3.16Å
194	F	95.4	Very high	93.3	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.217	C	C	.	.			trans	-97.1	18.3	178.9	-80.1	-109.5	0	0	0	112.1	E100 I103 L104 I107 L112 L166 Y173 I191 F196 A197	E100-F194 HydrophobicContact CG-CB 4.06Å; I103-F194 HydrophobicContact CG2-CD1 3.69Å; I103-F194 HydrophobicContact CG2-CE1 4.24Å; L104-F194 HydrophobicContact CD2-CB 4.17Å; L104-F194 HydrophobicContact CD2-CD2 3.56Å; L104-F194 HydrophobicContact CD2-CE2 4.07Å; L104-F194 HydrophobicContact CD2-CG 3.89Å; L104-F194 HydrophobicContact CG-CB 4.1Å; L104-F194 HydrophobicContact CG-CD2 4.41Å; L104-F194 HydrophobicContact CG-CG 4.32Å; I107-F194 HydrophobicContact CD1-CD1 4.13Å; I107-F194 HydrophobicContact CD1-CE1 3.52Å; I107-F194 HydrophobicContact CD1-CE2 4.16Å; I107-F194 HydrophobicContact CD1-CZ 3.53Å; L112-F194 HydrophobicContact CB-CZ 4.46Å; L112-F194 HydrophobicContact CD1-CZ 4.26Å; L112-F194 HydrophobicContact CD2-CZ 3.99Å; L112-F194 HydrophobicContact CG-CZ 4.46Å; L166-F194 HydrophobicContact CD1-CE1 4.17Å; L166-F194 HydrophobicContact CD2-CE1 4.06Å; Y173-F194 HydrophobicContact CD2-CD1 4.15Å; Y173-F194 HydrophobicContact CD2-CE1 4.07Å; Y173-F194 HydrophobicContact CD2-CG 4.5Å; Y173-F194 HydrophobicContact CD2-CZ 4.35Å; Y173-F194 HydrophobicContact CE2-CD1 4.34Å; Y173-F194 HydrophobicContact CE2-CD2 4.17Å; Y173-F194 HydrophobicContact CE2-CE1 4.38Å; Y173-F194 HydrophobicContact CE2-CE2 4.21Å; Y173-F194 HydrophobicContact CE2-CG 4.24Å; Y173-F194 HydrophobicContact CE2-CZ 4.32Å; I191-F194 HydrophobicContact CG2-CE2 4.31Å; F194-F196 PolarHBondContact O-N 2.94Å; F194-F196 VanDerWaalsContact O-N 3.16Å; F194-A197 HydrophobicContact CB-CB 3.97Å; F194-A197 HydrophobicContact CD1-CB 3.55Å; F194-A197 HydrophobicContact CE1-CB 4.49Å; F194-A197 HydrophobicContact CG-CB 4.17Å; F194-A197 WeakPolarHBondContact O-CB 3.5Å; F194-A197 PolarHBondContact O-N 3.26Å
195	G	92	Very high	93.6	Very high	10 Å²	10	49.5 Å²	49.5	10%	0.103	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.8	-177.4	0	0	0	0	0	114.2	D193	D193-G195 VanDerWaalsContact C-N 3.33Å; D193-G195 PolarHBondContact OD1-N 2.71Å; D193-G195 VanDerWaalsContact OD1-N 3.16Å
196	F	93	Very high	93.9	Very high	59 Å²	59	48.4 Å²	48.4	26%	0.259	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-0.3	173.7	-59	-27.5	0	0	0	113.8	Y173 R174 D175 F194 C208	Y173-F196 CarbonylContact O-C 3.57Å; R174-F196 HydrophobicContact CB-CB 4.24Å; R174-F196 PolarHBondContact NE-O 3.42Å; R174-F196 PolarHBondContact NH2-O 3Å; D175-F196 HydrophobicContact CB-CB 4.46Å; D175-F196 HydrophobicContact CB-CD2 3.76Å; F194-F196 PolarHBondContact O-N 2.94Å; F194-F196 VanDerWaalsContact O-N 3.16Å; F196-C208 HydrophobicContact CD1-CB 4.16Å; F196-C208 HydrophobicContact CD2-CB 4.14Å; F196-C208 HydrophobicContact CE1-CB 4.35Å; F196-C208 HydrophobicContact CE2-CB 4.36Å; F196-C208 HydrophobicContact CG-CB 4.09Å; F196-C208 HydrophobicContact CZ-CB 4.46Å
197	A	96.1	Very high	94.2	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.008	24%	0.241	C	C	.	.			trans	-63.8	144	176.8	0	0	0	0	0	110.1	N99 I103 I172 Y173 F194	N99-A197 PolarHBondContact ND2-O 3.36Å; I103-A197 HydrophobicContact CD1-CB 3.66Å; I103-A197 WeakPolarHBondContact CD1-O 3.29Å; I103-A197 HydrophobicContact CG2-CB 4.49Å; I172-A197 CarbonylContact O-C 3.48Å; I172-A197 WeakPolarHBondContact O-CA 3.28Å; Y173-A197 HydrophobicContact CD2-CB 4.44Å; Y173-A197 PolarHBondContact O-N 3.11Å; F194-A197 HydrophobicContact CB-CB 3.97Å; F194-A197 HydrophobicContact CD1-CB 3.55Å; F194-A197 HydrophobicContact CE1-CB 4.49Å; F194-A197 HydrophobicContact CG-CB 4.17Å; F194-A197 WeakPolarHBondContact O-CB 3.5Å; F194-A197 PolarHBondContact O-N 3.26Å
198	K	95.1	Very high	94.4	Very high	54 Å²	54	51 Å²	51	24%	0.235	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	140.8	179.1	-171.2	165.6	-177.1	144.2	0	111.5	E95 L171 I172 V200	E95-K198 IonicContact OE1-NZ 3.74Å; E95-K198 PolarHBondContact OE1-NZ 2.91Å; L171-K198 WeakPolarHBondContact CA-O 3.48Å; I172-K198 PolarHBondContact N-O 2.96Å; I172-K198 PolarHBondContact O-N 2.6Å; K198-V200 HydrophobicContact CB-CG2 4.07Å; K198-V200 HydrophobicContact CD-CG2 4.23Å; K198-V200 HydrophobicContact CG-CG2 3.78Å; K198-V200 PolarHBondContact O-N 2.92Å
199	R	95.7	Very high	94.3	Very high	74 Å²	74	51.8 Å²	51.8	28%	0.279	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	115.4	170.9	-161.2	175.2	179.5	-169.5	-2.3	110.3	W39 D170 L171	W39-R199 HydrophobicContact CH2-CB 4.31Å; W39-R199 HydrophobicContact CZ2-CB 4.37Å; W39-R199 VanDerWaalsContact NE1-NH1 3.17Å; D170-R199 HydrophobicContact CB-CG 4.09Å; D170-R199 CarbonylContact O-C 3.49Å; D170-R199 VanDerWaalsContact O-CA 3.26Å; D170-R199 WeakPolarHBondContact O-CA 3.28Å; L171-R199 HydrophobicContact CD2-CB 3.77Å; L171-R199 HydrophobicContact CD2-CG 4.17Å
200	V	93.9	Very high	94.3	Very high	20 Å²	20	52.9 Å²	52.9	12%	0.121	26%	0.263	C	S	.	.			trans	-139	111.4	-173	-176.2	0	0	0	0	110.2	D170 I172 K198 T204	D170-V200 PolarHBondContact O-N 2.91Å; I172-V200 HydrophobicContact CD1-CB 3.74Å; I172-V200 HydrophobicContact CD1-CG1 4.14Å; I172-V200 HydrophobicContact CD1-CG2 3.98Å; I172-V200 HydrophobicContact CG1-CB 4.31Å; K198-V200 HydrophobicContact CB-CG2 4.07Å; K198-V200 HydrophobicContact CD-CG2 4.23Å; K198-V200 HydrophobicContact CG-CG2 3.78Å; K198-V200 PolarHBondContact O-N 2.92Å; V200-T204 HydrophobicContact CG2-CG2 4.31Å
201	K	90.9	Very high	94.3	Very high	176 Å²	176	54 Å²	54	77%	0.765	27%	0.271	S	S	*	.	S	Bend	trans	-80.7	-23.1	171.8	-68.5	-176.1	177	-178.6	0	113.7	D170	D170-K201 HydrophobicContact CB-CG 4.32Å
202	G	93.2	Very high	94.2	Very high	48 Å²	48	56.8 Å²	56.8	50%	0.495	28%	0.284	S	S	.	.	S	Bend	trans	-120.8	-116	-175.7	0	0	0	0	0	112
203	R	95	Very high	94.3	Very high	162 Å²	162	56 Å²	56	61%	0.611	28%	0.278	S	S	*	.			trans	-117.1	158	176.1	-69	179.8	176.5	-170.9	1.7	111	W205 G223 Y224	R203-W205 HydrophobicContact CB-CH2 3.94Å; R203-W205 HydrophobicContact CB-CZ2 4.16Å; R203-W205 HydrophobicContact CB-CZ3 4.35Å; R203-W205 WeakPolarHBondContact O-CZ3 3.48Å; R203-G223 WeakPolarHBondContact CD-O 3.44Å; R203-Y224 CarbonylContact C-O 3.51Å; R203-Y224 WeakPolarHBondContact CA-O 3.37Å
204	T	95.4	Very high	94.6	Very high	11 Å²	11	53.6 Å²	53.6	7%	0.067	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-131.5	166.7	168	-167.1	0	0	0	0	109.9	V200 G223 Y224	V200-T204 HydrophobicContact CG2-CG2 4.31Å; T204-G223 WeakPolarHBondContact O-CA 3.44Å; T204-Y224 HydrophobicContact CG2-CD1 4.48Å; T204-Y224 HydrophobicContact CG2-CD2 3.85Å; T204-Y224 HydrophobicContact CG2-CE1 4.01Å; T204-Y224 HydrophobicContact CG2-CE2 3.28Å; T204-Y224 HydrophobicContact CG2-CG 4.42Å; T204-Y224 PolarHBondContact N-O 2.87Å; T204-Y224 VanDerWaalsContact O-CD1 3.26Å; T204-Y224 WeakPolarHBondContact O-CD1 3.43Å; T204-Y224 PolarHBondContact O-N 3.44Å
205	W	96.2	Very high	94.7	Very high	173 Å²	173	53.6 Å²	53.6	66%	0.655	27%	0.265	S	S	*	.			trans	-131.8	-4.1	-170	-68.3	-99.1	0	0	0	113.8	R203 L207	R203-W205 HydrophobicContact CB-CH2 3.94Å; R203-W205 HydrophobicContact CB-CZ2 4.16Å; R203-W205 HydrophobicContact CB-CZ3 4.35Å; R203-W205 WeakPolarHBondContact O-CZ3 3.48Å; W205-L207 PolarHBondContact O-N 3.19Å
206	T	92	Very high	95	Very high	54 Å²	54	53.2 Å²	53.2	33%	0.331	26%	0.261	S	S	.	.			trans	-64.1	124.8	-176.6	-49.8	0	0	0	0	110.4	C208 Y224	T206-C208 HydrophobicContact CG2-CB 4.26Å; T206-C208 PolarHBondContact O-N 3.37Å; T206-Y224 VanDerWaalsContact O-CE1 3.31Å; T206-Y224 WeakPolarHBondContact O-CE1 3.28Å; T206-Y224 PolarHBondContact O-OH 3.06Å
207	L	93.1	Very high	95.2	Very high	110 Å²	110	50.8 Å²	50.8	58%	0.576	25%	0.25	S	S	*	.			trans	-76.1	103.1	168	177.9	63.5	0	0	0	108.6	W205 L214 I218	W205-L207 PolarHBondContact O-N 3.19Å; L207-L214 HydrophobicContact CD1-CD1 4.13Å; L207-I218 HydrophobicContact CD1-CG2 3.56Å
208	C	92.5	Very high	95.3	Very high	15 Å²	15	51.1 Å²	51.1	10%	0.101	25%	0.252	C	S	.	.			trans	-149.9	161.3	178	61.4	0	0	0	0	110.2	F196 T206 L214	F196-C208 HydrophobicContact CD1-CB 4.16Å; F196-C208 HydrophobicContact CD2-CB 4.14Å; F196-C208 HydrophobicContact CE1-CB 4.35Å; F196-C208 HydrophobicContact CE2-CB 4.36Å; F196-C208 HydrophobicContact CG-CB 4.09Å; F196-C208 HydrophobicContact CZ-CB 4.46Å; T206-C208 HydrophobicContact CG2-CB 4.26Å; T206-C208 PolarHBondContact O-N 3.37Å; C208-L214 WeakPolarHBondContact O-CD2 3.21Å
209	G	92.6	Very high	95.4	Very high	22 Å²	22	50.1 Å²	50.1	23%	0.227	25%	0.249	C	C	.	.	S	Bend	trans	113.7	-175.1	-175.9	0	0	0	0	0	111.9	D175	D175-G209 WeakPolarHBondContact OD1-CA 3.43Å
210	T	94.1	Very high	95.4	Very high	24 Å²	24	50.3 Å²	50.3	15%	0.147	26%	0.255	C	S	.	.			trans	-98.7	133.6	-175.9	-57.2	0	0	0	0	110.4	D175 K177 E212 Y213 L214	D175-T210 PolarHBondContact OD1-N 3.3Å; D175-T210 PolarHBondContact OD1-OG1 2.85Å; K177-T210 HydrophobicContact CD-CG2 4.16Å; K177-T210 VanDerWaalsContact CD-OG1 3.3Å; K177-T210 WeakPolarHBondContact CD-OG1 3.36Å; K177-T210 PolarHBondContact NZ-OG1 3.07Å; T210-E212 VanDerWaalsContact C-N 3.33Å; T210-E212 PolarHBondContact O-N 2.8Å; T210-E212 VanDerWaalsContact O-N 3.13Å; T210-Y213 PolarHBondContact O-N 3.4Å; T210-L214 PolarHBondContact O-N 3.17Å
211	P	96.5	Very high	95.5	Very high	34 Å²	34	53.8 Å²	53.8	22%	0.221	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-48.8	-44.8	-167	-32.2	37	0	0	0	115.8	Y213 L214 P252 I255 Y256 I259	P211-Y213 PolarHBondContact O-N 2.58Å; P211-L214 PolarHBondContact O-N 2.81Å; P211-P252 HydrophobicContact CB-CB 4.46Å; P211-P252 HydrophobicContact CG-CB 4.49Å; P211-I255 HydrophobicContact CB-CD1 4.35Å; P211-Y256 HydrophobicContact CB-CE1 3.84Å; P211-I259 VanDerWaalsContact O-CD1 3.3Å; P211-I259 WeakPolarHBondContact O-CD1 3.41Å
212	E	97.5	Very high	95.7	Very high	57 Å²	57	51.3 Å²	51.3	27%	0.266	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-66.4	-24.9	-178.4	-65.1	83.4	171.2	0	0	113.1	T210 V235 P245 I255	T210-E212 VanDerWaalsContact C-N 3.33Å; T210-E212 PolarHBondContact O-N 2.8Å; T210-E212 VanDerWaalsContact O-N 3.13Å; E212-V235 WeakPolarHBondContact O-CG1 3.39Å; E212-P245 HydrophobicContact CB-CB 4.27Å; E212-P245 HydrophobicContact CB-CG 4.48Å; E212-P245 HydrophobicContact CG-CB 4.45Å; E212-P245 HydrophobicContact CG-CG 4.13Å; E212-I255 HydrophobicContact CG-CD1 4.22Å
213	Y	98.4	Very high	95.8	Very high	14 Å²	14	49.5 Å²	49.5	6%	0.055	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-101.4	-8	-174.1	-77.2	-94.4	0	0	0	113.5	L176 K177 P178 T210 P211 A215 A232 V235 L236 E239	L176-Y213 WeakPolarHBondContact O-CD1 3.4Å; L176-Y213 WeakPolarHBondContact O-CE1 3.32Å; K177-Y213 HydrophobicContact CB-CD2 4.04Å; K177-Y213 HydrophobicContact CB-CE2 3.93Å; K177-Y213 HydrophobicContact CB-CG 4.45Å; P178-Y213 WeakPolarHBondContact CD-OH 3.26Å; T210-Y213 PolarHBondContact O-N 3.4Å; P211-Y213 PolarHBondContact O-N 2.58Å; Y213-A215 PolarHBondContact O-N 3.12Å; Y213-A232 HydrophobicContact CD1-CB 4.2Å; Y213-V235 HydrophobicContact CD1-CB 3.69Å; Y213-V235 HydrophobicContact CD1-CG1 3.55Å; Y213-V235 HydrophobicContact CD2-CG1 4.1Å; Y213-V235 HydrophobicContact CE1-CB 3.77Å; Y213-V235 HydrophobicContact CE1-CG1 3.48Å; Y213-V235 VanDerWaalsContact CE1-CG1 3.48Å; Y213-V235 HydrophobicContact CE2-CG1 3.99Å; Y213-V235 HydrophobicContact CG-CB 4.37Å; Y213-V235 HydrophobicContact CG-CG1 3.87Å; Y213-L236 HydrophobicContact CE1-CB 4Å; Y213-L236 HydrophobicContact CE1-CD1 4.39Å; Y213-E239 WeakPolarHBondContact CE2-OE2 3.19Å; Y213-E239 PolarHBondContact OH-OE2 3.37Å
214	L	98.2	Very high	96	Very high	7 Å²	7	42 Å²	42	4%	0.037	22%	0.222	C	C	.	.			trans	-63.5	135.9	-179.8	-67.5	-175.6	0	0	0	111.7	L207 C208 T210 P211 I218 I219 W231 Y256	L207-L214 HydrophobicContact CD1-CD1 4.13Å; C208-L214 WeakPolarHBondContact O-CD2 3.21Å; T210-L214 PolarHBondContact O-N 3.17Å; P211-L214 PolarHBondContact O-N 2.81Å; L214-I218 HydrophobicContact CD2-CD1 4.28Å; L214-I218 HydrophobicContact CD2-CG2 4.17Å; L214-I219 HydrophobicContact CB-CD1 4.02Å; L214-I219 HydrophobicContact CB-CG1 3.99Å; L214-I219 HydrophobicContact CD1-CG1 4.17Å; L214-W231 PolarHBondContact O-NE1 2.9Å; L214-Y256 HydrophobicContact CD1-CE1 3.8Å
215	A	98.2	Very high	96	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	23%	0.23	C	C	.	.			trans	-76.6	150.7	171.7	0	0	0	0	0	111.2	Y213 E217 I218 I219 V228 W231	Y213-A215 PolarHBondContact O-N 3.12Å; A215-E217 HydrophobicContact CB-CG 4.36Å; A215-E217 PolarHBondContact O-N 2.92Å; A215-E217 VanDerWaalsContact O-N 3.17Å; A215-I218 HydrophobicContact CB-CD1 4.38Å; A215-I218 HydrophobicContact CB-CG1 4.42Å; A215-I218 WeakPolarHBondContact O-CB 3.32Å; A215-I218 PolarHBondContact O-N 3.28Å; A215-I219 PolarHBondContact O-N 3.26Å; A215-V228 HydrophobicContact CB-CB 3.95Å; A215-V228 HydrophobicContact CB-CG1 3.8Å; A215-W231 HydrophobicContact CB-CB 3.95Å; A215-W231 HydrophobicContact CB-CD2 4.33Å; A215-W231 HydrophobicContact CB-CG 3.79Å
216	P	98.2	Very high	96	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-54.8	-38.2	-178.7	-24.8	31.6	0	0	0	113.5	I218 I219 L220 W231 I259 V284	P216-I218 VanDerWaalsContact C-N 3.31Å; P216-I218 PolarHBondContact O-N 3.28Å; P216-I219 PolarHBondContact O-N 3.27Å; P216-L220 WeakPolarHBondContact O-CB 3.36Å; P216-L220 WeakPolarHBondContact O-CG 3.39Å; P216-L220 PolarHBondContact O-N 3.25Å; P216-W231 HydrophobicContact CG-CE3 4.21Å; P216-W231 HydrophobicContact CG-CH2 3.52Å; P216-W231 HydrophobicContact CG-CZ2 3.94Å; P216-W231 HydrophobicContact CG-CZ3 3.67Å; P216-I259 HydrophobicContact CB-CG2 4.33Å; P216-I259 HydrophobicContact CG-CG2 3.81Å; P216-V284 HydrophobicContact CB-CG1 4.2Å; P216-V284 HydrophobicContact CG-CG1 4.29Å; P216-V284 HydrophobicContact CG-CG2 4.11Å
217	E	97.8	Very high	96.3	Very high	9 Å²	9	36.9 Å²	36.9	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-27.8	179.3	61.4	-89.3	-153.7	0	0	113.9	A215 S221 K222 V228 R289	A215-E217 HydrophobicContact CB-CG 4.36Å; A215-E217 PolarHBondContact O-N 2.92Å; A215-E217 VanDerWaalsContact O-N 3.17Å; E217-S221 PolarHBondContact O-N 3.3Å; E217-K222 HydrophobicContact CB-CB 4.23Å; E217-K222 WeakPolarHBondContact O-CB 3.34Å; E217-K222 PolarHBondContact O-N 2.93Å; E217-V228 HydrophobicContact CG-CG1 4.07Å; E217-V228 WeakPolarHBondContact OE1-CG1 3.49Å; E217-R289 IonicContact OE1-CZ 3.83Å; E217-R289 IonicContact OE1-NH1 2.84Å; E217-R289 PolarHBondContact OE1-NH1 3.28Å; E217-R289 IonicContact OE1-NH2 2.79Å; E217-R289 IonicContact OE2-CZ 3.47Å; E217-R289 IonicContact OE2-NH1 3.55Å; E217-R289 PolarHBondContact OE2-NH1 3.45Å; E217-R289 IonicContact OE2-NH2 2.79Å; E217-R289 PolarHBondContact OE2-NH2 2.9Å
218	I	97.6	Very high	96.6	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-70.6	-48.2	173.6	-61.6	175.4	0	0	0	109.2	L207 L214 A215 P216 L220 S221 Y224 V228	L207-I218 HydrophobicContact CD1-CG2 3.56Å; L214-I218 HydrophobicContact CD2-CD1 4.28Å; L214-I218 HydrophobicContact CD2-CG2 4.17Å; A215-I218 HydrophobicContact CB-CD1 4.38Å; A215-I218 HydrophobicContact CB-CG1 4.42Å; A215-I218 WeakPolarHBondContact O-CB 3.32Å; A215-I218 PolarHBondContact O-N 3.28Å; P216-I218 VanDerWaalsContact C-N 3.31Å; P216-I218 PolarHBondContact O-N 3.28Å; I218-L220 VanDerWaalsContact C-N 3.29Å; I218-L220 PolarHBondContact O-N 2.75Å; I218-S221 PolarHBondContact O-N 3.41Å; I218-Y224 HydrophobicContact CD1-CD2 4.48Å; I218-Y224 HydrophobicContact CD1-CE2 4.34Å; I218-Y224 HydrophobicContact CG1-CD1 3.75Å; I218-Y224 HydrophobicContact CG1-CD2 4.2Å; I218-Y224 HydrophobicContact CG1-CE1 3.9Å; I218-Y224 HydrophobicContact CG1-CE2 4.34Å; I218-Y224 HydrophobicContact CG1-CG 3.9Å; I218-Y224 HydrophobicContact CG2-CE1 4.46Å; I218-V228 HydrophobicContact CD1-CB 3.89Å; I218-V228 HydrophobicContact CD1-CG1 3.75Å; I218-V228 HydrophobicContact CD1-CG2 4.25Å; I218-V228 HydrophobicContact CG1-CG1 3.81Å
219	I	97.2	Very high	96.9	Very high	34 Å²	34	31.2 Å²	31.2	17%	0.174	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-40.1	179.8	-66.5	162.5	0	0	0	111.1	L214 A215 P216 S221 Y256 I259 V260	L214-I219 HydrophobicContact CB-CD1 4.02Å; L214-I219 HydrophobicContact CB-CG1 3.99Å; L214-I219 HydrophobicContact CD1-CG1 4.17Å; A215-I219 PolarHBondContact O-N 3.26Å; P216-I219 PolarHBondContact O-N 3.27Å; I219-S221 PolarHBondContact O-N 3.26Å; I219-Y256 HydrophobicContact CD1-CD1 3.83Å; I219-Y256 HydrophobicContact CD1-CG 4.26Å; I219-Y256 HydrophobicContact CG1-CD1 4.02Å; I219-Y256 HydrophobicContact CG1-CG 4.3Å; I219-Y256 HydrophobicContact CG2-CG 4.18Å; I219-I259 HydrophobicContact CD1-CB 3.77Å; I219-I259 HydrophobicContact CD1-CD1 3.8Å; I219-I259 HydrophobicContact CD1-CG1 4.39Å; I219-I259 HydrophobicContact CD1-CG2 3.46Å; I219-I259 VanDerWaalsContact CD1-CG2 3.46Å; I219-V260 HydrophobicContact CB-CG2 4.35Å; I219-V260 HydrophobicContact CG2-CG2 3.8Å
220	L	96.3	Very high	97.2	Very high	77 Å²	77	30.3 Å²	30.3	40%	0.403	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	9.5	178	-65	173.2	0	0	0	113.3	P216 I218 K222 V260	P216-L220 WeakPolarHBondContact O-CB 3.36Å; P216-L220 WeakPolarHBondContact O-CG 3.39Å; P216-L220 PolarHBondContact O-N 3.25Å; I218-L220 VanDerWaalsContact C-N 3.29Å; I218-L220 PolarHBondContact O-N 2.75Å; L220-K222 HydrophobicContact CB-CD 4.3Å; L220-K222 HydrophobicContact CB-CG 4.16Å; L220-K222 PolarHBondContact O-N 3.01Å; L220-K222 VanDerWaalsContact O-N 3.13Å; L220-V260 HydrophobicContact CD1-CG1 4.46Å; L220-V260 HydrophobicContact CD2-CG1 4.16Å; L220-V260 HydrophobicContact CD2-CG2 4.09Å; L220-V260 HydrophobicContact CG-CG2 4.15Å
221	S	95.1	Very high	97.4	Very high	93 Å²	93	29.2 Å²	29.2	65%	0.65	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	33.3	-179.9	-61.7	0	0	0	0	113.6	E217 I218 I219	E217-S221 PolarHBondContact O-N 3.3Å; I218-S221 PolarHBondContact O-N 3.41Å; I219-S221 PolarHBondContact O-N 3.26Å
222	K	96	Very high	97.5	Very high	124 Å²	124	27.9 Å²	27.9	54%	0.539	15%	0.146	S	C	.	.			trans	-89	147.7	175.5	-64.3	179.3	-178.7	175.7	0	109.2	E217 L220 Y224	E217-K222 HydrophobicContact CB-CB 4.23Å; E217-K222 WeakPolarHBondContact O-CB 3.34Å; E217-K222 PolarHBondContact O-N 2.93Å; L220-K222 HydrophobicContact CB-CD 4.3Å; L220-K222 HydrophobicContact CB-CG 4.16Å; L220-K222 PolarHBondContact O-N 3.01Å; L220-K222 VanDerWaalsContact O-N 3.13Å; K222-Y224 PolarHBondContact O-N 2.92Å
223	G	95.2	Very high	97.6	Very high	10 Å²	10	25.2 Å²	25.2	10%	0.103	13%	0.133	C	C	.	.			trans	-60.4	122.9	171.7	0	0	0	0	0	110.3	R203 T204	R203-G223 WeakPolarHBondContact CD-O 3.44Å; T204-G223 WeakPolarHBondContact O-CA 3.44Å
224	Y	97.3	Very high	97.6	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.016	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-119.9	165.3	-173.4	66.1	-94.8	0	0	0	112	R174 R203 T204 T206 I218 K222 V228	R174-Y224 WeakPolarHBondContact CD-OH 3.46Å; R174-Y224 HydrophobicContact CG-CE2 4.47Å; R174-Y224 PolarHBondContact NH1-OH 3.32Å; R203-Y224 CarbonylContact C-O 3.51Å; R203-Y224 WeakPolarHBondContact CA-O 3.37Å; T204-Y224 HydrophobicContact CG2-CD1 4.48Å; T204-Y224 HydrophobicContact CG2-CD2 3.85Å; T204-Y224 HydrophobicContact CG2-CE1 4.01Å; T204-Y224 HydrophobicContact CG2-CE2 3.28Å; T204-Y224 HydrophobicContact CG2-CG 4.42Å; T204-Y224 PolarHBondContact N-O 2.87Å; T204-Y224 VanDerWaalsContact O-CD1 3.26Å; T204-Y224 WeakPolarHBondContact O-CD1 3.43Å; T204-Y224 PolarHBondContact O-N 3.44Å; T206-Y224 VanDerWaalsContact O-CE1 3.31Å; T206-Y224 WeakPolarHBondContact O-CE1 3.28Å; T206-Y224 PolarHBondContact O-OH 3.06Å; I218-Y224 HydrophobicContact CD1-CD2 4.48Å; I218-Y224 HydrophobicContact CD1-CE2 4.34Å; I218-Y224 HydrophobicContact CG1-CD1 3.75Å; I218-Y224 HydrophobicContact CG1-CD2 4.2Å; I218-Y224 HydrophobicContact CG1-CE1 3.9Å; I218-Y224 HydrophobicContact CG1-CE2 4.34Å; I218-Y224 HydrophobicContact CG1-CG 3.9Å; I218-Y224 HydrophobicContact CG2-CE1 4.46Å; K222-Y224 PolarHBondContact O-N 2.92Å; Y224-V228 HydrophobicContact CD2-CB 4.44Å; Y224-V228 HydrophobicContact CD2-CG1 3.59Å; Y224-V228 HydrophobicContact CD2-CG2 3.97Å; Y224-V228 HydrophobicContact CE2-CG1 4.45Å; Y224-V228 HydrophobicContact CE2-CG2 4.21Å; Y224-V228 HydrophobicContact CG-CG1 3.92Å
225	N	95.9	Very high	97.6	Very high	44 Å²	44	24.2 Å²	24.2	24%	0.235	13%	0.129	C	C	.	.			trans	-136.6	-163.3	-178.2	69.5	2.4	0	0	0	109.9	A227 V228	N225-A227 PolarHBondContact O-N 2.81Å; N225-A227 WeakPolarHBondContact OD1-CB 3.26Å; N225-A227 PolarHBondContact OD1-N 2.82Å; N225-V228 WeakPolarHBondContact O-CG2 3.48Å; N225-V228 PolarHBondContact O-N 3.48Å
226	K	97.3	Very high	97.6	Very high	88 Å²	88	24.1 Å²	24.1	38%	0.383	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-13.6	178.5	67.4	179.5	177.2	-177.6	0	116.5	H167 I172 V228 D229	H167-K226 HydrophobicContact CB-CD 3.88Å; H167-K226 PolarHBondContact CE1-O 3.48Å; I172-K226 HydrophobicContact CG1-CB 4.21Å; K226-V228 PolarHBondContact O-N 2.85Å; K226-D229 PolarHBondContact O-N 2.81Å
227	A	97.9	Very high	97.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-19.5	175.5	0	0	0	0	0	114.1	N225 W230 W231 L286 R289 N292	N225-A227 PolarHBondContact O-N 2.81Å; N225-A227 WeakPolarHBondContact OD1-CB 3.26Å; N225-A227 PolarHBondContact OD1-N 2.82Å; A227-W230 PolarHBondContact O-N 2.57Å; A227-W231 PolarHBondContact O-N 2.69Å; A227-L286 HydrophobicContact CB-CD2 3.92Å; A227-R289 PolarHBondContact O-NH1 3.43Å; A227-N292 HydrophobicContact CB-CB 3.89Å
228	V	98.3	Very high	97.7	Very high	5 Å²	5	24 Å²	24	3%	0.03	13%	0.127	C	C	.	.	H	α-helix	trans	-70.7	-33.3	176.6	-55.4	0	0	0	0	112.1	I172 R174 A215 E217 I218 Y224 N225 K226 W230 W231 A232	I172-V228 HydrophobicContact CG2-CG2 3.94Å; R174-V228 HydrophobicContact CG-CG2 4.41Å; A215-V228 HydrophobicContact CB-CB 3.95Å; A215-V228 HydrophobicContact CB-CG1 3.8Å; E217-V228 HydrophobicContact CG-CG1 4.07Å; E217-V228 WeakPolarHBondContact OE1-CG1 3.49Å; I218-V228 HydrophobicContact CD1-CB 3.89Å; I218-V228 HydrophobicContact CD1-CG1 3.75Å; I218-V228 HydrophobicContact CD1-CG2 4.25Å; I218-V228 HydrophobicContact CG1-CG1 3.81Å; Y224-V228 HydrophobicContact CD2-CB 4.44Å; Y224-V228 HydrophobicContact CD2-CG1 3.59Å; Y224-V228 HydrophobicContact CD2-CG2 3.97Å; Y224-V228 HydrophobicContact CE2-CG1 4.45Å; Y224-V228 HydrophobicContact CE2-CG2 4.21Å; Y224-V228 HydrophobicContact CG-CG1 3.92Å; N225-V228 WeakPolarHBondContact O-CG2 3.48Å; N225-V228 PolarHBondContact O-N 3.48Å; K226-V228 PolarHBondContact O-N 2.85Å; V228-W230 VanDerWaalsContact C-N 3.34Å; V228-W231 WeakPolarHBondContact O-CB 3.34Å; V228-W231 PolarHBondContact O-N 2.89Å; V228-A232 PolarHBondContact O-N 3.4Å
229	D	98.7	Very high	97.8	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-39.3	176.1	-72.7	-17.3	0	0	0	110.4	F163 H167 I172 Y173 R174 K226 W231 A232 L233	F163-D229 HydrophobicContact CD1-CB 4.49Å; F163-D229 HydrophobicContact CD2-CB 3.94Å; F163-D229 HydrophobicContact CE1-CB 4.23Å; F163-D229 HydrophobicContact CE2-CB 3.66Å; F163-D229 VanDerWaalsContact CE2-O 3.23Å; F163-D229 WeakPolarHBondContact CE2-O 3.28Å; F163-D229 HydrophobicContact CG-CB 4.34Å; F163-D229 HydrophobicContact CZ-CB 3.78Å; H167-D229 IonicContact CD2-OD2 2.68Å; H167-D229 IonicContact CE1-OD2 3.96Å; H167-D229 IonicContact NE2-OD2 3.24Å; H167-D229 PolarHBondContact NE2-OD2 3.24Å; I172-D229 VanDerWaalsContact CG2-OD2 3.28Å; I172-D229 WeakPolarHBondContact CG2-OD2 3.47Å; Y173-D229 PolarHBondContact N-OD1 3Å; Y173-D229 PolarHBondContact N-OD2 3.42Å; R174-D229 PolarHBondContact N-OD1 2.85Å; K226-D229 PolarHBondContact O-N 2.81Å; D229-W231 PolarHBondContact O-N 3.01Å; D229-A232 PolarHBondContact O-N 3.03Å; D229-L233 PolarHBondContact O-N 3.37Å
230	W	98.8	Very high	97.8	Very high	3 Å²	3	22.4 Å²	22.4	1%	0.011	12%	0.119	C	C	.	.	H	α-helix	trans	-68.3	-32.4	175.8	-60	122.2	0	0	0	113.2	V160 F163 H167 A227 V228 L233 G234 L281 G291 V297 I300	V160-W230 HydrophobicContact CB-CZ3 4.5Å; V160-W230 HydrophobicContact CG1-CZ3 4.47Å; V160-W230 HydrophobicContact CG2-CZ3 4.25Å; F163-W230 HydrophobicContact CB-CH2 3.53Å; F163-W230 HydrophobicContact CB-CZ2 4Å; F163-W230 HydrophobicContact CB-CZ3 3.89Å; F163-W230 HydrophobicContact CD2-CE3 4Å; F163-W230 HydrophobicContact CD2-CH2 4.37Å; F163-W230 AromaticContact CD2-CZ3 3.89Å; F163-W230 HydrophobicContact CD2-CZ3 3.89Å; F163-W230 HydrophobicContact CG-CH2 4.5Å; F163-W230 HydrophobicContact CG-CZ3 4.43Å; H167-W230 AromaticContact CE1-CE2 3.63Å; H167-W230 AromaticContact CE1-CZ2 3.85Å; H167-W230 AromaticContact CE1-NE1 3.47Å; H167-W230 PolarHBondContact CE1-NE1 2.99Å; H167-W230 AromaticContact ND1-CE2 3.65Å; H167-W230 AromaticContact ND1-CZ2 3.6Å; H167-W230 AromaticContact ND1-NE1 3.42Å; H167-W230 PolarHBondContact ND1-NE1 2.8Å; A227-W230 PolarHBondContact O-N 2.57Å; V228-W230 VanDerWaalsContact C-N 3.34Å; W230-L233 HydrophobicContact CE3-CD2 3.73Å; W230-L233 HydrophobicContact CZ3-CD2 3.89Å; W230-G234 PolarHBondContact O-N 3.47Å; W230-L281 HydrophobicContact CB-CD2 4.37Å; W230-G291 PolarHBondContact NE1-O 2.8Å; W230-V297 HydrophobicContact CH2-CB 4.2Å; W230-V297 HydrophobicContact CH2-CG2 3.56Å; W230-V297 HydrophobicContact CZ2-CB 4.12Å; W230-V297 HydrophobicContact CZ2-CG2 4Å; W230-V297 HydrophobicContact CZ3-CG2 4.35Å; W230-I300 HydrophobicContact CD2-CD1 3.63Å; W230-I300 HydrophobicContact CE3-CD1 3.26Å; W230-I300 HydrophobicContact CG-CD1 4.26Å; W230-I300 HydrophobicContact CH2-CD1 4.26Å; W230-I300 HydrophobicContact CZ3-CD1 3.61Å
231	W	98.8	Very high	97.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63	-49.8	168.8	173.4	-83.2	0	0	0	110.8	L214 A215 P216 A227 V228 D229 L233 G234 V235 F247 I259 L282 V284	L214-W231 PolarHBondContact O-NE1 2.9Å; A215-W231 HydrophobicContact CB-CB 3.95Å; A215-W231 HydrophobicContact CB-CD2 4.33Å; A215-W231 HydrophobicContact CB-CG 3.79Å; P216-W231 HydrophobicContact CG-CE3 4.21Å; P216-W231 HydrophobicContact CG-CH2 3.52Å; P216-W231 HydrophobicContact CG-CZ2 3.94Å; P216-W231 HydrophobicContact CG-CZ3 3.67Å; A227-W231 PolarHBondContact O-N 2.69Å; V228-W231 WeakPolarHBondContact O-CB 3.34Å; V228-W231 PolarHBondContact O-N 2.89Å; D229-W231 PolarHBondContact O-N 3.01Å; W231-L233 PolarHBondContact O-N 2.95Å; W231-G234 WeakPolarHBondContact O-CA 3.31Å; W231-G234 PolarHBondContact O-N 2.94Å; W231-V235 PolarHBondContact O-N 2.94Å; W231-F247 HydrophobicContact CH2-CE2 4.14Å; W231-F247 HydrophobicContact CH2-CZ 4.19Å; W231-F247 HydrophobicContact CZ2-CD2 4.42Å; W231-F247 AromaticContact CZ2-CE2 3.53Å; W231-F247 HydrophobicContact CZ2-CE2 3.53Å; W231-F247 HydrophobicContact CZ2-CZ 4.02Å; W231-I259 HydrophobicContact CH2-CG2 4.43Å; W231-I259 HydrophobicContact CZ2-CG2 3.78Å; W231-L282 HydrophobicContact CD2-CD2 4.08Å; W231-L282 HydrophobicContact CE3-CD2 4.39Å; W231-L282 HydrophobicContact CH2-CB 4.43Å; W231-L282 HydrophobicContact CZ2-CD2 4.24Å; W231-L282 HydrophobicContact CZ3-CB 4.29Å; W231-L282 WeakPolarHBondContact CZ3-O 3.4Å; W231-V284 HydrophobicContact CH2-CG2 4.44Å; W231-V284 HydrophobicContact CZ3-CG2 4.37Å
232	A	98.8	Very high	98	Very high	7 Å²	7	14.8 Å²	14.8	6%	0.058	7%	0.072	C	C	.	.	H	α-helix	trans	-60.2	-35.2	179.1	0	0	0	0	0	111.9	L176 Y213 V228 D229 G234 V235 L236	L176-A232 HydrophobicContact CB-CB 3.98Å; L176-A232 HydrophobicContact CD2-CB 4.26Å; Y213-A232 HydrophobicContact CD1-CB 4.2Å; V228-A232 PolarHBondContact O-N 3.4Å; D229-A232 PolarHBondContact O-N 3.03Å; A232-G234 VanDerWaalsContact C-N 3.31Å; A232-G234 PolarHBondContact O-N 3.14Å; A232-V235 WeakPolarHBondContact O-CB 3.38Å; A232-V235 PolarHBondContact O-N 3.16Å; A232-L236 WeakPolarHBondContact O-CB 3.39Å; A232-L236 PolarHBondContact O-N 3.2Å
233	L	98.9	Very high	98	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-59.3	-41.7	170.3	175.9	65.7	0	0	0	111.8	A156 I159 V160 F163 L176 D229 W230 W231 V235 L236 I237 L281	A156-L233 HydrophobicContact CB-CD1 4.39Å; I159-L233 HydrophobicContact CB-CD1 4.01Å; I159-L233 HydrophobicContact CG2-CD1 3.85Å; V160-L233 HydrophobicContact CG2-CD2 3.54Å; F163-L233 HydrophobicContact CE2-CB 4.26Å; L176-L233 HydrophobicContact CD2-CB 4.37Å; D229-L233 PolarHBondContact O-N 3.37Å; W230-L233 HydrophobicContact CE3-CD2 3.73Å; W230-L233 HydrophobicContact CZ3-CD2 3.89Å; W231-L233 PolarHBondContact O-N 2.95Å; L233-V235 VanDerWaalsContact C-N 3.34Å; L233-L236 PolarHBondContact O-N 3.33Å; L233-I237 HydrophobicContact CD1-CD1 3.89Å; L233-I237 HydrophobicContact CD1-CG1 4.05Å; L233-I237 HydrophobicContact CD2-CD1 4.41Å; L233-I237 HydrophobicContact CG-CD1 3.82Å; L233-I237 HydrophobicContact CG-CG1 4.36Å; L233-I237 WeakPolarHBondContact O-CB 3.2Å; L233-I237 VanDerWaalsContact O-CG1 3.27Å; L233-I237 WeakPolarHBondContact O-CG1 3.13Å; L233-I237 PolarHBondContact O-N 3.06Å; L233-L281 HydrophobicContact CD2-CD1 4.34Å; L233-L281 HydrophobicContact CG-CD1 4.32Å
234	G	98.9	Very high	98.1	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.5	-42.5	174.2	0	0	0	0	0	112.5	W230 W231 A232 Y238 L278	W230-G234 PolarHBondContact O-N 3.47Å; W231-G234 WeakPolarHBondContact O-CA 3.31Å; W231-G234 PolarHBondContact O-N 2.94Å; A232-G234 VanDerWaalsContact C-N 3.31Å; A232-G234 PolarHBondContact O-N 3.14Å; G234-Y238 WeakPolarHBondContact O-CB 3.35Å; G234-Y238 PolarHBondContact O-N 3.47Å; G234-Y238 VanDerWaalsContact O-N 3.08Å; G234-L278 WeakPolarHBondContact O-CD2 3.31Å
235	V	98.9	Very high	98.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-62.8	-46.9	175.9	179.9	0	0	0	0	110.1	E212 Y213 W231 A232 L233 Y238 E239 P246 L282	E212-V235 WeakPolarHBondContact O-CG1 3.39Å; Y213-V235 HydrophobicContact CD1-CB 3.69Å; Y213-V235 HydrophobicContact CD1-CG1 3.55Å; Y213-V235 HydrophobicContact CD2-CG1 4.1Å; Y213-V235 HydrophobicContact CE1-CB 3.77Å; Y213-V235 HydrophobicContact CE1-CG1 3.48Å; Y213-V235 VanDerWaalsContact CE1-CG1 3.48Å; Y213-V235 HydrophobicContact CE2-CG1 3.99Å; Y213-V235 HydrophobicContact CG-CB 4.37Å; Y213-V235 HydrophobicContact CG-CG1 3.87Å; W231-V235 PolarHBondContact O-N 2.94Å; A232-V235 WeakPolarHBondContact O-CB 3.38Å; A232-V235 PolarHBondContact O-N 3.16Å; L233-V235 VanDerWaalsContact C-N 3.34Å; V235-Y238 WeakPolarHBondContact O-CB 3.23Å; V235-Y238 PolarHBondContact O-N 3.42Å; V235-E239 WeakPolarHBondContact O-CB 3.48Å; V235-E239 PolarHBondContact O-N 2.98Å; V235-P246 HydrophobicContact CB-CG 4.37Å; V235-P246 HydrophobicContact CG1-CG 4.1Å; V235-P246 HydrophobicContact CG2-CG 4.22Å; V235-L282 HydrophobicContact CG2-CD2 3.72Å
236	L	98.8	Very high	98.2	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.6	-47.2	179.7	-173.9	67	0	0	0	112.2	M137 I159 L176 P178 L181 Y213 A232 L233 Y238 E239 M240	M137-L236 HydrophobicContact SD-CD1 4.41Å; I159-L236 HydrophobicContact CG1-CD2 4.06Å; L176-L236 HydrophobicContact CD1-CD2 4.09Å; L176-L236 HydrophobicContact CD2-CB 4.08Å; L176-L236 HydrophobicContact CD2-CD2 3.81Å; L176-L236 HydrophobicContact CG-CD2 4.03Å; P178-L236 HydrophobicContact CG-CD1 3.82Å; L181-L236 HydrophobicContact CD1-CD1 4.08Å; L181-L236 HydrophobicContact CD1-CD2 3.6Å; L181-L236 HydrophobicContact CD1-CG 4.49Å; Y213-L236 HydrophobicContact CE1-CB 4Å; Y213-L236 HydrophobicContact CE1-CD1 4.39Å; A232-L236 WeakPolarHBondContact O-CB 3.39Å; A232-L236 PolarHBondContact O-N 3.2Å; L233-L236 PolarHBondContact O-N 3.33Å; L236-Y238 VanDerWaalsContact C-N 3.31Å; L236-Y238 PolarHBondContact O-N 2.79Å; L236-E239 PolarHBondContact O-N 3.33Å; L236-M240 HydrophobicContact CD1-CG 4.46Å; L236-M240 HydrophobicContact CD2-CE 4.4Å; L236-M240 HydrophobicContact CG-CE 4.05Å; L236-M240 HydrophobicContact CG-CG 4.45Å; L236-M240 HydrophobicContact CG-SD 4.41Å; L236-M240 WeakPolarHBondContact O-CB 3.41Å; L236-M240 WeakPolarHBondContact O-CG 3.21Å; L236-M240 PolarHBondContact O-N 2.86Å
237	I	98.9	Very high	98.3	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.1	-43.4	178.9	-69.9	170.6	0	0	0	110.4	A156 L233 M240 A241 L274 L277 L278 L281 W305	A156-I237 HydrophobicContact CB-CD1 3.79Å; A156-I237 HydrophobicContact CB-CG1 3.65Å; L233-I237 HydrophobicContact CD1-CD1 3.89Å; L233-I237 HydrophobicContact CD1-CG1 4.05Å; L233-I237 HydrophobicContact CD2-CD1 4.41Å; L233-I237 HydrophobicContact CG-CD1 3.82Å; L233-I237 HydrophobicContact CG-CG1 4.36Å; L233-I237 WeakPolarHBondContact O-CB 3.2Å; L233-I237 VanDerWaalsContact O-CG1 3.27Å; L233-I237 WeakPolarHBondContact O-CG1 3.13Å; L233-I237 PolarHBondContact O-N 3.06Å; I237-M240 HydrophobicContact CG1-CE 4.29Å; I237-A241 WeakPolarHBondContact O-CB 3.3Å; I237-A241 PolarHBondContact O-N 3.24Å; I237-A241 VanDerWaalsContact O-N 3.13Å; I237-L274 HydrophobicContact CG2-CD1 3.55Å; I237-L277 HydrophobicContact CD1-CD2 4.12Å; I237-L278 HydrophobicContact CB-CD2 4.01Å; I237-L278 HydrophobicContact CG2-CD2 3.89Å; I237-L281 HydrophobicContact CD1-CD1 4Å; I237-W305 HydrophobicContact CD1-CZ3 4.31Å; I237-W305 HydrophobicContact CG2-CH2 3.91Å; I237-W305 HydrophobicContact CG2-CZ2 4.36Å; I237-W305 HydrophobicContact CG2-CZ3 4.34Å
238	Y	98.8	Very high	98.2	Very high	7 Å²	7	13.6 Å²	13.6	3%	0.027	7%	0.066	C	C	.	.	H	α-helix	trans	-59.5	-51.5	175.2	-175.9	-69.2	0	0	0	110.1	G234 V235 L236 M240 A241 A242 Y244 P246 V264 K265 F266 F270 L278	G234-Y238 WeakPolarHBondContact O-CB 3.35Å; G234-Y238 PolarHBondContact O-N 3.47Å; G234-Y238 VanDerWaalsContact O-N 3.08Å; V235-Y238 WeakPolarHBondContact O-CB 3.23Å; V235-Y238 PolarHBondContact O-N 3.42Å; L236-Y238 VanDerWaalsContact C-N 3.31Å; L236-Y238 PolarHBondContact O-N 2.79Å; Y238-M240 PolarHBondContact O-N 3.05Å; Y238-A241 PolarHBondContact O-N 2.73Å; Y238-A242 HydrophobicContact CD1-CB 3.86Å; Y238-A242 HydrophobicContact CE1-CB 3.6Å; Y238-A242 WeakPolarHBondContact O-CB 3.31Å; Y238-A242 PolarHBondContact O-N 3.4Å; Y238-Y244 VanDerWaalsContact CD1-O 3.25Å; Y238-Y244 WeakPolarHBondContact CD1-O 3.48Å; Y238-Y244 HydrophobicContact CE1-CD2 4.03Å; Y238-Y244 AromaticContact CE1-CE2 3.78Å; Y238-Y244 HydrophobicContact CE1-CE2 3.78Å; Y238-Y244 VanDerWaalsContact CE1-O 3.29Å; Y238-Y244 WeakPolarHBondContact CE1-O 3.45Å; Y238-P246 HydrophobicContact CD1-CB 3.86Å; Y238-P246 HydrophobicContact CD1-CG 4.21Å; Y238-P246 HydrophobicContact CD2-CB 3.73Å; Y238-P246 HydrophobicContact CD2-CG 4.45Å; Y238-P246 HydrophobicContact CE1-CB 4.05Å; Y238-P246 HydrophobicContact CE2-CB 3.91Å; Y238-P246 HydrophobicContact CG-CB 3.73Å; Y238-P246 HydrophobicContact CG-CG 4.05Å; Y238-V264 HydrophobicContact CD2-CG1 4.1Å; Y238-V264 HydrophobicContact CE2-CG1 3.75Å; Y238-K265 WeakPolarHBondContact CE2-O 3.48Å; Y238-K265 PolarHBondContact OH-O 3.44Å; Y238-F266 HydrophobicContact CD2-CD1 4.37Å; Y238-F266 HydrophobicContact CD2-CE1 4.43Å; Y238-F266 HydrophobicContact CE2-CD1 4.1Å; Y238-F266 HydrophobicContact CE2-CE1 4.46Å; Y238-F270 AromaticContact CD2-CE2 4Å; Y238-F270 HydrophobicContact CD2-CE2 4Å; Y238-F270 HydrophobicContact CE2-CE2 4.22Å; Y238-F270 HydrophobicContact CG-CE2 4.42Å; Y238-L278 HydrophobicContact CD2-CD1 4.03Å
239	E	98.5	Very high	98.1	Very high	8 Å²	8	14.7 Å²	14.7	4%	0.037	8%	0.076	C	C	.	.	H	α-helix	trans	-62.8	-43	-176.1	-173.6	168.7	-178.9	0	0	112	L141 R142 Y213 V235 L236 A241 A242 G243 Y244	L141-E239 HydrophobicContact CD2-CG 3.97Å; R142-E239 IonicContact CZ-OE1 3.83Å; R142-E239 IonicContact NH2-OE1 2.77Å; R142-E239 PolarHBondContact NH2-OE1 3.47Å; Y213-E239 WeakPolarHBondContact CE2-OE2 3.19Å; Y213-E239 PolarHBondContact OH-OE2 3.37Å; V235-E239 WeakPolarHBondContact O-CB 3.48Å; V235-E239 PolarHBondContact O-N 2.98Å; L236-E239 PolarHBondContact O-N 3.33Å; E239-A241 PolarHBondContact O-N 2.89Å; E239-A242 PolarHBondContact O-N 2.78Å; E239-G243 VanDerWaalsContact O-CA 3.28Å; E239-G243 WeakPolarHBondContact O-CA 3.37Å; E239-G243 PolarHBondContact O-N 3.49Å; E239-Y244 WeakPolarHBondContact CA-O 3.34Å
240	M	97.5	Very high	98	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.9	-45.5	174.7	-72.8	-171.2	-63.5	0	0	111.8	M137 F147 S152 Y155 A156 L236 I237 Y238	M137-M240 HydrophobicContact CE-SD 4.01Å; M137-M240 HydrophobicContact SD-CG 4.1Å; M137-M240 HydrophobicContact SD-SD 3.77Å; F147-M240 HydrophobicContact CD2-CB 3.91Å; F147-M240 HydrophobicContact CD2-CG 3.89Å; F147-M240 HydrophobicContact CD2-SD 4.04Å; F147-M240 HydrophobicContact CE2-CG 4.17Å; F147-M240 HydrophobicContact CE2-SD 4.26Å; F147-M240 PolarHBondContact N-O 2.9Å; S152-M240 WeakPolarHBondContact O-CE 3.39Å; S152-M240 WeakPolarHBondContact OG-CB 3.17Å; Y155-M240 HydrophobicContact CD2-SD 4.22Å; Y155-M240 HydrophobicContact CG-SD 4.44Å; A156-M240 HydrophobicContact CB-CE 4.33Å; L236-M240 HydrophobicContact CD1-CG 4.46Å; L236-M240 HydrophobicContact CD2-CE 4.4Å; L236-M240 HydrophobicContact CG-CE 4.05Å; L236-M240 HydrophobicContact CG-CG 4.45Å; L236-M240 HydrophobicContact CG-SD 4.41Å; L236-M240 WeakPolarHBondContact O-CB 3.41Å; L236-M240 WeakPolarHBondContact O-CG 3.21Å; L236-M240 PolarHBondContact O-N 2.86Å; I237-M240 HydrophobicContact CG1-CE 4.29Å; Y238-M240 PolarHBondContact O-N 3.05Å
241	A	97.4	Very high	97.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-79.9	-25.9	-175.7	0	0	0	0	0	114.3	R146 I237 Y238 E239 H269 F270 L274	R146-A241 WeakPolarHBondContact CD-O 3.24Å; I237-A241 WeakPolarHBondContact O-CB 3.3Å; I237-A241 PolarHBondContact O-N 3.24Å; I237-A241 VanDerWaalsContact O-N 3.13Å; Y238-A241 PolarHBondContact O-N 2.73Å; E239-A241 PolarHBondContact O-N 2.89Å; A241-H269 PolarHBondContact O-NE2 3.09Å; A241-F270 HydrophobicContact CB-CD1 4.49Å; A241-F270 HydrophobicContact CB-CE1 3.6Å; A241-F270 HydrophobicContact CB-CZ 3.62Å; A241-L274 HydrophobicContact CB-CD2 3.83Å
242	A	97.7	Very high	97.7	Very high	8 Å²	8	30 Å²	30	7%	0.066	16%	0.157	C	C	.	.	H	α-helix	trans	-97.1	-32.4	-179.1	0	0	0	0	0	113.4	Y238 E239 Y244 P267 F270	Y238-A242 HydrophobicContact CD1-CB 3.86Å; Y238-A242 HydrophobicContact CE1-CB 3.6Å; Y238-A242 WeakPolarHBondContact O-CB 3.31Å; Y238-A242 PolarHBondContact O-N 3.4Å; E239-A242 PolarHBondContact O-N 2.78Å; A242-Y244 HydrophobicContact CB-CD1 4.1Å; A242-Y244 HydrophobicContact CB-CD2 4.48Å; A242-Y244 HydrophobicContact CB-CE1 3.9Å; A242-Y244 HydrophobicContact CB-CE2 4.28Å; A242-Y244 HydrophobicContact CB-CG 4.39Å; A242-Y244 WeakPolarHBondContact O-CD1 3.44Å; A242-P267 HydrophobicContact CB-CG 4.04Å; A242-F270 HydrophobicContact CB-CE1 4.16Å; A242-F270 HydrophobicContact CB-CZ 3.86Å
243	G	96.4	Very high	97.5	Very high	9 Å²	9	34.7 Å²	34.7	9%	0.093	18%	0.18	C	C	.	.	S	Bend	trans	90.1	-0.3	-170	0	0	0	0	0	115	R142 G145 E239	R142-G243 PolarHBondContact NH1-O 3.29Å; R142-G243 VanDerWaalsContact NH1-O 3.09Å; G145-G243 WeakPolarHBondContact O-CA 3.25Å; E239-G243 VanDerWaalsContact O-CA 3.28Å; E239-G243 WeakPolarHBondContact O-CA 3.37Å; E239-G243 PolarHBondContact O-N 3.49Å
244	Y	97.1	Very high	97.5	Very high	91 Å²	91	38.6 Å²	38.6	36%	0.357	20%	0.198	S	C	.	.	S	Bend	trans	-152.6	150.8	-179	57.8	-93	0	0	0	109.6	Y238 E239 A242 F248	Y238-Y244 VanDerWaalsContact CD1-O 3.25Å; Y238-Y244 WeakPolarHBondContact CD1-O 3.48Å; Y238-Y244 HydrophobicContact CE1-CD2 4.03Å; Y238-Y244 AromaticContact CE1-CE2 3.78Å; Y238-Y244 HydrophobicContact CE1-CE2 3.78Å; Y238-Y244 VanDerWaalsContact CE1-O 3.29Å; Y238-Y244 WeakPolarHBondContact CE1-O 3.45Å; E239-Y244 WeakPolarHBondContact CA-O 3.34Å; A242-Y244 HydrophobicContact CB-CD1 4.1Å; A242-Y244 HydrophobicContact CB-CD2 4.48Å; A242-Y244 HydrophobicContact CB-CE1 3.9Å; A242-Y244 HydrophobicContact CB-CE2 4.28Å; A242-Y244 HydrophobicContact CB-CG 4.39Å; A242-Y244 WeakPolarHBondContact O-CD1 3.44Å; Y244-F248 HydrophobicContact CD2-CD1 4.33Å; Y244-F248 AromaticContact CD2-CE1 3.78Å; Y244-F248 HydrophobicContact CD2-CE1 3.78Å; Y244-F248 HydrophobicContact CE2-CE1 4.21Å
245	P	97.9	Very high	97.4	Very high	12 Å²	12	38.9 Å²	38.9	8%	0.078	20%	0.2	C	C	.	.			trans	-69.4	156.7	-177.5	28.3	-35.3	0	0	0	112.2	E212 F247 F248	E212-P245 HydrophobicContact CB-CB 4.27Å; E212-P245 HydrophobicContact CB-CG 4.48Å; E212-P245 HydrophobicContact CG-CB 4.45Å; E212-P245 HydrophobicContact CG-CG 4.13Å; P245-F247 PolarHBondContact O-N 2.91Å; P245-F248 HydrophobicContact CG-CB 4.11Å; P245-F248 WeakPolarHBondContact O-CD1 3.48Å
246	P	98.4	Very high	97.4	Very high	14 Å²	14	41.7 Å²	41.7	9%	0.091	21%	0.211	C	C	.	.	S	Bend	trans	-65.4	-25.6	180	24.4	-32.2	0	0	0	113.6	V235 Y238 V264 L282	V235-P246 HydrophobicContact CB-CG 4.37Å; V235-P246 HydrophobicContact CG1-CG 4.1Å; V235-P246 HydrophobicContact CG2-CG 4.22Å; Y238-P246 HydrophobicContact CD1-CB 3.86Å; Y238-P246 HydrophobicContact CD1-CG 4.21Å; Y238-P246 HydrophobicContact CD2-CB 3.73Å; Y238-P246 HydrophobicContact CD2-CG 4.45Å; Y238-P246 HydrophobicContact CE1-CB 4.05Å; Y238-P246 HydrophobicContact CE2-CB 3.91Å; Y238-P246 HydrophobicContact CG-CB 3.73Å; Y238-P246 HydrophobicContact CG-CG 4.05Å; P246-V264 HydrophobicContact CB-CG1 4.22Å; P246-L282 HydrophobicContact CB-CD1 4.2Å; P246-L282 HydrophobicContact CG-CD1 4.13Å
247	F	98.1	Very high	97.3	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.013	24%	0.239	C	C	.	.	S	Bend	trans	-128.8	114.5	178.9	-45.7	-73.5	0	0	0	108.5	W231 P245 I255 K258 I259 V264	W231-F247 HydrophobicContact CH2-CE2 4.14Å; W231-F247 HydrophobicContact CH2-CZ 4.19Å; W231-F247 HydrophobicContact CZ2-CD2 4.42Å; W231-F247 AromaticContact CZ2-CE2 3.53Å; W231-F247 HydrophobicContact CZ2-CE2 3.53Å; W231-F247 HydrophobicContact CZ2-CZ 4.02Å; P245-F247 PolarHBondContact O-N 2.91Å; F247-I255 HydrophobicContact CB-CG2 4.3Å; F247-K258 HydrophobicContact CB-CB 4.26Å; F247-K258 HydrophobicContact CD1-CB 3.99Å; F247-I259 HydrophobicContact CB-CG1 3.8Å; F247-I259 HydrophobicContact CD1-CG1 4.41Å; F247-I259 HydrophobicContact CD2-CG1 3.57Å; F247-I259 HydrophobicContact CE2-CG1 4.22Å; F247-I259 HydrophobicContact CG-CG1 3.67Å; F247-V264 HydrophobicContact CE1-CG2 3.86Å; F247-V264 HydrophobicContact CE2-CG2 4.41Å; F247-V264 HydrophobicContact CZ-CG2 3.49Å; F247-V264 VanDerWaalsContact CZ-CG2 3.49Å
248	F	96.1	Very high	97.3	Very high	116 Å²	116	52.2 Å²	52.2	51%	0.509	26%	0.259	S	S	.	.			trans	-143.8	152.7	175.2	60.9	-82.1	0	0	0	110.6	Y244 P245 K258	Y244-F248 HydrophobicContact CD2-CD1 4.33Å; Y244-F248 AromaticContact CD2-CE1 3.78Å; Y244-F248 HydrophobicContact CD2-CE1 3.78Å; Y244-F248 HydrophobicContact CE2-CE1 4.21Å; P245-F248 HydrophobicContact CG-CB 4.11Å; P245-F248 WeakPolarHBondContact O-CD1 3.48Å; F248-K258 WeakPolarHBondContact O-CD 3.32Å; F248-K258 VanDerWaalsContact O-CE 3.27Å; F248-K258 WeakPolarHBondContact O-CE 3.42Å; F248-K258 PolarHBondContact O-NZ 3.46Å
249	A	96.9	Very high	97.3	Very high	28 Å²	28	51.9 Å²	51.9	23%	0.231	26%	0.257	C	S	.	.			trans	-167.1	171	175.9	0	0	0	0	0	108.6	Q251 Q254 I255	A249-Q251 VanDerWaalsContact C-N 3.34Å; A249-Q254 HydrophobicContact CB-CB 3.42Å; A249-Q254 VanDerWaalsContact CB-CB 3.42Å; A249-Q254 HydrophobicContact CB-CG 4.48Å; A249-I255 HydrophobicContact CB-CG1 3.84Å
250	D	95.6	Very high	97.2	Very high	152 Å²	152	54.2 Å²	54.2	81%	0.813	27%	0.272	S	S	*	.	S	Bend	trans	-73.8	-28.4	-178.6	-57.6	-35.3	0	0	0	112.6
251	Q	96	Very high	97.2	Very high	116 Å²	116	57.1 Å²	57.1	54%	0.542	29%	0.292	S	S	.	.	S	Bend	trans	-117.8	137.1	-178.3	-63.4	-61.1	-40.5	0	0	111.2	A249 I253 Q254 I255	A249-Q251 VanDerWaalsContact C-N 3.34Å; Q251-I253 HydrophobicContact CB-CG2 4.15Å; Q251-I253 PolarHBondContact O-N 2.9Å; Q251-I253 VanDerWaalsContact O-N 3.09Å; Q251-Q254 HydrophobicContact CB-CG 4.35Å; Q251-Q254 WeakPolarHBondContact O-CB 3.48Å; Q251-Q254 PolarHBondContact O-N 2.66Å; Q251-I255 PolarHBondContact O-N 2.7Å
252	P	95.2	Very high	97.1	Very high	57 Å²	57	58.1 Å²	58.1	37%	0.37	30%	0.303	S	S	.	.	H	α-helix	trans	-52.6	-36.8	180	-29.8	35.5	0	0	0	114	P211 Q254 I255 Y256	P211-P252 HydrophobicContact CB-CB 4.46Å; P211-P252 HydrophobicContact CG-CB 4.49Å; P252-Q254 VanDerWaalsContact C-N 3.29Å; P252-Q254 PolarHBondContact O-N 3.23Å; P252-I255 WeakPolarHBondContact O-CB 3.36Å; P252-I255 PolarHBondContact O-N 2.91Å; P252-I255 VanDerWaalsContact O-N 3.11Å; P252-Y256 HydrophobicContact CB-CE1 4.46Å; P252-Y256 HydrophobicContact CB-CE2 4.14Å; P252-Y256 WeakPolarHBondContact O-CD1 3.33Å; P252-Y256 WeakPolarHBondContact O-CD2 3.28Å; P252-Y256 PolarHBondContact O-N 2.95Å
253	I	96.3	Very high	97	Very high	106 Å²	106	66 Å²	66	54%	0.544	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-37.6	179.1	-167.2	62.2	0	0	0	112.8	Q251 Y256 E257	Q251-I253 HydrophobicContact CB-CG2 4.15Å; Q251-I253 PolarHBondContact O-N 2.9Å; Q251-I253 VanDerWaalsContact O-N 3.09Å; I253-Y256 HydrophobicContact CD1-CD2 4.33Å; I253-Y256 WeakPolarHBondContact O-CB 3.46Å; I253-Y256 PolarHBondContact O-N 2.82Å; I253-E257 WeakPolarHBondContact O-CG 3.48Å; I253-E257 PolarHBondContact O-N 3.42Å
254	Q	97.8	Very high	97	Very high	83 Å²	83	67 Å²	67	39%	0.388	34%	0.34	S	S	.	.	H	α-helix	trans	-72.8	-32.8	178	-64.1	171.1	-28.7	0	0	111.4	A249 Q251 P252 Y256 K258	A249-Q254 HydrophobicContact CB-CB 3.42Å; A249-Q254 VanDerWaalsContact CB-CB 3.42Å; A249-Q254 HydrophobicContact CB-CG 4.48Å; Q251-Q254 HydrophobicContact CB-CG 4.35Å; Q251-Q254 WeakPolarHBondContact O-CB 3.48Å; Q251-Q254 PolarHBondContact O-N 2.66Å; P252-Q254 VanDerWaalsContact C-N 3.29Å; P252-Q254 PolarHBondContact O-N 3.23Å; Q254-Y256 VanDerWaalsContact C-N 3.34Å; Q254-K258 WeakPolarHBondContact O-CG 3.49Å; Q254-K258 PolarHBondContact O-N 3.06Å
255	I	97.8	Very high	97	Very high	5 Å²	5	71.3 Å²	71.3	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-45.6	171.9	-55.5	178.4	0	0	0	109	P211 E212 F247 A249 Q251 P252 E257 K258 I259	P211-I255 HydrophobicContact CB-CD1 4.35Å; E212-I255 HydrophobicContact CG-CD1 4.22Å; F247-I255 HydrophobicContact CB-CG2 4.3Å; A249-I255 HydrophobicContact CB-CG1 3.84Å; Q251-I255 PolarHBondContact O-N 2.7Å; P252-I255 WeakPolarHBondContact O-CB 3.36Å; P252-I255 PolarHBondContact O-N 2.91Å; P252-I255 VanDerWaalsContact O-N 3.11Å; I255-E257 PolarHBondContact O-N 2.88Å; I255-K258 WeakPolarHBondContact O-CB 3.39Å; I255-K258 PolarHBondContact O-N 3.46Å; I255-I259 HydrophobicContact CG2-CD1 3.78Å; I255-I259 HydrophobicContact CG2-CG1 4.4Å; I255-I259 WeakPolarHBondContact O-CG1 3.4Å; I255-I259 PolarHBondContact O-N 2.88Å
256	Y	97.8	Very high	97	Very high	59 Å²	59	73.3 Å²	73.3	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-44	179.3	-59.3	-19.5	0	0	0	112.7	P211 L214 I219 P252 I253 Q254 K258 I259 V260	P211-Y256 HydrophobicContact CB-CE1 3.84Å; L214-Y256 HydrophobicContact CD1-CE1 3.8Å; I219-Y256 HydrophobicContact CD1-CD1 3.83Å; I219-Y256 HydrophobicContact CD1-CG 4.26Å; I219-Y256 HydrophobicContact CG1-CD1 4.02Å; I219-Y256 HydrophobicContact CG1-CG 4.3Å; I219-Y256 HydrophobicContact CG2-CG 4.18Å; P252-Y256 HydrophobicContact CB-CE1 4.46Å; P252-Y256 HydrophobicContact CB-CE2 4.14Å; P252-Y256 WeakPolarHBondContact O-CD1 3.33Å; P252-Y256 WeakPolarHBondContact O-CD2 3.28Å; P252-Y256 PolarHBondContact O-N 2.95Å; I253-Y256 HydrophobicContact CD1-CD2 4.33Å; I253-Y256 WeakPolarHBondContact O-CB 3.46Å; I253-Y256 PolarHBondContact O-N 2.82Å; Q254-Y256 VanDerWaalsContact C-N 3.34Å; Y256-K258 VanDerWaalsContact C-N 3.32Å; Y256-K258 PolarHBondContact O-N 2.91Å; Y256-I259 PolarHBondContact O-N 2.85Å; Y256-V260 WeakPolarHBondContact O-CG2 3.48Å; Y256-V260 PolarHBondContact O-N 3.42Å
257	E	97.7	Very high	97	Very high	128 Å²	128	73.2 Å²	73.2	60%	0.598	37%	0.367	S	S	*	.	H	α-helix	trans	-57.6	-43.8	174.4	-72.5	173	176.3	0	0	112.1	I253 I255 S261	I253-E257 WeakPolarHBondContact O-CG 3.48Å; I253-E257 PolarHBondContact O-N 3.42Å; I255-E257 PolarHBondContact O-N 2.88Å; E257-S261 WeakPolarHBondContact O-CB 3.3Å; E257-S261 PolarHBondContact O-N 3.24Å
258	K	98.1	Very high	97	Very high	94 Å²	94	78.7 Å²	78.7	41%	0.409	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-45	177.5	-71.1	166	-177.4	-101.3	0	111.7	F247 F248 Q254 I255 Y256 S261 G262	F247-K258 HydrophobicContact CB-CB 4.26Å; F247-K258 HydrophobicContact CD1-CB 3.99Å; F248-K258 WeakPolarHBondContact O-CD 3.32Å; F248-K258 VanDerWaalsContact O-CE 3.27Å; F248-K258 WeakPolarHBondContact O-CE 3.42Å; F248-K258 PolarHBondContact O-NZ 3.46Å; Q254-K258 WeakPolarHBondContact O-CG 3.49Å; Q254-K258 PolarHBondContact O-N 3.06Å; I255-K258 WeakPolarHBondContact O-CB 3.39Å; I255-K258 PolarHBondContact O-N 3.46Å; Y256-K258 VanDerWaalsContact C-N 3.32Å; Y256-K258 PolarHBondContact O-N 2.91Å; K258-S261 WeakPolarHBondContact O-CB 3.48Å; K258-S261 PolarHBondContact O-N 3.47Å; K258-S261 PolarHBondContact O-OG 2.68Å; K258-G262 PolarHBondContact O-N 2.77Å
259	I	98.2	Very high	97.1	Very high	0 Å²	0	77 Å²	77	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-50.1	177.7	-72.1	166.4	0	0	0	110.6	P211 P216 I219 W231 F247 I255 Y256 S261 G262	P211-I259 VanDerWaalsContact O-CD1 3.3Å; P211-I259 WeakPolarHBondContact O-CD1 3.41Å; P216-I259 HydrophobicContact CB-CG2 4.33Å; P216-I259 HydrophobicContact CG-CG2 3.81Å; I219-I259 HydrophobicContact CD1-CB 3.77Å; I219-I259 HydrophobicContact CD1-CD1 3.8Å; I219-I259 HydrophobicContact CD1-CG1 4.39Å; I219-I259 HydrophobicContact CD1-CG2 3.46Å; I219-I259 VanDerWaalsContact CD1-CG2 3.46Å; W231-I259 HydrophobicContact CH2-CG2 4.43Å; W231-I259 HydrophobicContact CZ2-CG2 3.78Å; F247-I259 HydrophobicContact CB-CG1 3.8Å; F247-I259 HydrophobicContact CD1-CG1 4.41Å; F247-I259 HydrophobicContact CD2-CG1 3.57Å; F247-I259 HydrophobicContact CE2-CG1 4.22Å; F247-I259 HydrophobicContact CG-CG1 3.67Å; I255-I259 HydrophobicContact CG2-CD1 3.78Å; I255-I259 HydrophobicContact CG2-CG1 4.4Å; I255-I259 WeakPolarHBondContact O-CG1 3.4Å; I255-I259 PolarHBondContact O-N 2.88Å; Y256-I259 PolarHBondContact O-N 2.85Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 2.92Å; I259-G262 PolarHBondContact O-N 2.77Å
260	V	97.5	Very high	97.2	Very high	56 Å²	56	75.9 Å²	75.9	34%	0.339	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-33.5	-179.7	172.9	0	0	0	0	111.5	I219 L220 Y256 G262	I219-V260 HydrophobicContact CB-CG2 4.35Å; I219-V260 HydrophobicContact CG2-CG2 3.8Å; L220-V260 HydrophobicContact CD1-CG1 4.46Å; L220-V260 HydrophobicContact CD2-CG1 4.16Å; L220-V260 HydrophobicContact CD2-CG2 4.09Å; L220-V260 HydrophobicContact CG-CG2 4.15Å; Y256-V260 WeakPolarHBondContact O-CG2 3.48Å; Y256-V260 PolarHBondContact O-N 3.42Å; V260-G262 PolarHBondContact O-N 2.89Å
261	S	96.8	Very high	97.3	Very high	62 Å²	62	70.1 Å²	70.1	43%	0.434	36%	0.361	S	S	.	.	H	α-helix	trans	-65.2	-25.4	174.4	85	0	0	0	0	113.6	E257 K258 I259 K263	E257-S261 WeakPolarHBondContact O-CB 3.3Å; E257-S261 PolarHBondContact O-N 3.24Å; K258-S261 WeakPolarHBondContact O-CB 3.48Å; K258-S261 PolarHBondContact O-N 3.47Å; K258-S261 PolarHBondContact O-OG 2.68Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 2.92Å; S261-K263 PolarHBondContact O-N 3.27Å; S261-K263 VanDerWaalsContact O-N 3.14Å; S261-K263 PolarHBondContact OG-N 2.93Å
262	G	94.9	Very high	97.4	Very high	22 Å²	22	70.4 Å²	70.4	23%	0.227	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	8.6	-177.9	0	0	0	0	0	115.3	K258 I259 V260 V264	K258-G262 PolarHBondContact O-N 2.77Å; I259-G262 PolarHBondContact O-N 2.77Å; V260-G262 PolarHBondContact O-N 2.89Å; G262-V264 PolarHBondContact O-N 3.46Å; G262-V264 VanDerWaalsContact O-N 3.12Å
263	K	95.8	Very high	97.6	Very high	173 Å²	173	71.7 Å²	71.7	75%	0.752	37%	0.367	S	S	*	.			trans	-82.9	90.6	-175.3	-67.2	-178.2	-177.1	176.1	0	111.4	S261	S261-K263 PolarHBondContact O-N 3.27Å; S261-K263 VanDerWaalsContact O-N 3.14Å; S261-K263 PolarHBondContact OG-N 2.93Å
264	V	97.5	Very high	97.7	Very high	30 Å²	30	66.6 Å²	66.6	18%	0.182	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-87.1	129.6	176.4	-174.9	0	0	0	0	111	Y238 P246 F247 G262 F266 L282	Y238-V264 HydrophobicContact CD2-CG1 4.1Å; Y238-V264 HydrophobicContact CE2-CG1 3.75Å; P246-V264 HydrophobicContact CB-CG1 4.22Å; F247-V264 HydrophobicContact CE1-CG2 3.86Å; F247-V264 HydrophobicContact CE2-CG2 4.41Å; F247-V264 HydrophobicContact CZ-CG2 3.49Å; F247-V264 VanDerWaalsContact CZ-CG2 3.49Å; G262-V264 PolarHBondContact O-N 3.46Å; G262-V264 VanDerWaalsContact O-N 3.12Å; V264-F266 HydrophobicContact CB-CE1 4.46Å; V264-F266 HydrophobicContact CB-CZ 4.1Å; V264-F266 HydrophobicContact CG1-CD1 4.12Å; V264-F266 HydrophobicContact CG1-CE1 3.6Å; V264-F266 HydrophobicContact CG1-CE2 4.33Å; V264-F266 HydrophobicContact CG1-CZ 3.72Å; V264-L282 HydrophobicContact CG1-CD1 4.29Å; V264-L282 HydrophobicContact CG2-CB 4.22Å; V264-L282 HydrophobicContact CG2-CD1 3.89Å
265	K	97.3	Very high	97.8	Very high	181 Å²	181	64.8 Å²	64.8	79%	0.787	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-100.3	133.4	168.2	-67.8	-176.5	179.6	179.6	0	109.5	Y238	Y238-K265 WeakPolarHBondContact CE2-O 3.48Å; Y238-K265 PolarHBondContact OH-O 3.44Å
266	F	98.3	Very high	97.8	Very high	55 Å²	55	68 Å²	68	24%	0.241	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-102.9	137.9	-179	-60.1	-72.9	0	0	0	111.4	Y238 V264 F270 K275 L278 K279	Y238-F266 HydrophobicContact CD2-CD1 4.37Å; Y238-F266 HydrophobicContact CD2-CE1 4.43Å; Y238-F266 HydrophobicContact CE2-CD1 4.1Å; Y238-F266 HydrophobicContact CE2-CE1 4.46Å; V264-F266 HydrophobicContact CB-CE1 4.46Å; V264-F266 HydrophobicContact CB-CZ 4.1Å; V264-F266 HydrophobicContact CG1-CD1 4.12Å; V264-F266 HydrophobicContact CG1-CE1 3.6Å; V264-F266 HydrophobicContact CG1-CE2 4.33Å; V264-F266 HydrophobicContact CG1-CZ 3.72Å; F266-F270 HydrophobicContact CB-CD2 4.33Å; F266-F270 AromaticContact CD1-CD2 3.94Å; F266-F270 HydrophobicContact CD1-CD2 3.94Å; F266-F270 HydrophobicContact CD1-CE2 4.24Å; F266-K275 HydrophobicContact CB-CD 4.23Å; F266-K275 HydrophobicContact CB-CG 3.95Å; F266-K275 HydrophobicContact CD1-CG 4.13Å; F266-K275 HydrophobicContact CD2-CG 4.18Å; F266-K275 HydrophobicContact CG-CB 4.5Å; F266-K275 HydrophobicContact CG-CD 4.46Å; F266-K275 HydrophobicContact CG-CG 3.81Å; F266-L278 HydrophobicContact CD1-CD1 4.2Å; F266-L278 HydrophobicContact CE1-CB 3.71Å; F266-L278 HydrophobicContact CE1-CD1 3.88Å; F266-L278 HydrophobicContact CE1-CG 4.48Å; F266-L278 HydrophobicContact CZ-CB 4.25Å; F266-K279 HydrophobicContact CE2-CG 4.04Å; F266-K279 HydrophobicContact CZ-CG 3.92Å
267	P	98.3	Very high	97.9	Very high	12 Å²	12	65.2 Å²	65.2	8%	0.078	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-56.1	149.9	168.4	-23.8	33.5	0	0	0	112.3	A242 H269 F270	A242-P267 HydrophobicContact CB-CG 4.04Å; P267-H269 WeakPolarHBondContact CB-CE1 3.25Å; P267-H269 WeakPolarHBondContact CB-ND1 3.38Å; P267-H269 PolarHBondContact O-N 2.83Å; P267-F270 HydrophobicContact CB-CD1 3.93Å; P267-F270 HydrophobicContact CB-CE1 4.12Å; P267-F270 HydrophobicContact CB-CG 4.44Å; P267-F270 HydrophobicContact CG-CD1 3.92Å; P267-F270 HydrophobicContact CG-CE1 3.65Å; P267-F270 HydrophobicContact CG-CE2 4.39Å; P267-F270 HydrophobicContact CG-CG 4.41Å; P267-F270 HydrophobicContact CG-CZ 3.92Å; P267-F270 PolarHBondContact O-N 3.18Å
268	S	97.6	Very high	97.9	Very high	118 Å²	118	59.1 Å²	59.1	83%	0.825	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.1	179.6	53.3	0	0	0	0	112.1	F270	S268-F270 VanDerWaalsContact C-N 3.28Å; S268-F270 PolarHBondContact O-N 2.8Å
269	H	97.6	Very high	97.9	Very high	79 Å²	79	60.3 Å²	60.3	37%	0.366	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.6	-178.8	64.4	-98.2	0	0	0	115.2	R146 A241 P267	R146-H269 PolarHBondContact NH1-CD2 3.39Å; R146-H269 PolarHBondContact NH1-NE2 3.01Å; A241-H269 PolarHBondContact O-NE2 3.09Å; P267-H269 WeakPolarHBondContact CB-CE1 3.25Å; P267-H269 WeakPolarHBondContact CB-ND1 3.38Å; P267-H269 PolarHBondContact O-N 2.83Å
270	F	98.6	Very high	98	Very high	6 Å²	6	62 Å²	62	3%	0.026	32%	0.324	C	S	.	.	S	Bend	trans	-72.3	135.1	175.7	-82.9	21.1	0	0	0	110.8	Y238 A241 A242 F266 P267 S268 L274 K275 L278	Y238-F270 AromaticContact CD2-CE2 4Å; Y238-F270 HydrophobicContact CD2-CE2 4Å; Y238-F270 HydrophobicContact CE2-CE2 4.22Å; Y238-F270 HydrophobicContact CG-CE2 4.42Å; A241-F270 HydrophobicContact CB-CD1 4.49Å; A241-F270 HydrophobicContact CB-CE1 3.6Å; A241-F270 HydrophobicContact CB-CZ 3.62Å; A242-F270 HydrophobicContact CB-CE1 4.16Å; A242-F270 HydrophobicContact CB-CZ 3.86Å; F266-F270 HydrophobicContact CB-CD2 4.33Å; F266-F270 AromaticContact CD1-CD2 3.94Å; F266-F270 HydrophobicContact CD1-CD2 3.94Å; F266-F270 HydrophobicContact CD1-CE2 4.24Å; P267-F270 HydrophobicContact CB-CD1 3.93Å; P267-F270 HydrophobicContact CB-CE1 4.12Å; P267-F270 HydrophobicContact CB-CG 4.44Å; P267-F270 HydrophobicContact CG-CD1 3.92Å; P267-F270 HydrophobicContact CG-CE1 3.65Å; P267-F270 HydrophobicContact CG-CE2 4.39Å; P267-F270 HydrophobicContact CG-CG 4.41Å; P267-F270 HydrophobicContact CG-CZ 3.92Å; P267-F270 PolarHBondContact O-N 3.18Å; S268-F270 VanDerWaalsContact C-N 3.28Å; S268-F270 PolarHBondContact O-N 2.8Å; F270-L274 HydrophobicContact CB-CD2 4.15Å; F270-L274 HydrophobicContact CD1-CD2 3.86Å; F270-L274 HydrophobicContact CD2-CD2 3.56Å; F270-L274 HydrophobicContact CD2-CG 3.84Å; F270-L274 HydrophobicContact CE1-CD2 4.08Å; F270-L274 HydrophobicContact CE2-CD2 3.82Å; F270-L274 HydrophobicContact CE2-CG 4.23Å; F270-L274 HydrophobicContact CG-CD2 3.58Å; F270-L274 HydrophobicContact CG-CG 4.22Å; F270-L274 HydrophobicContact CZ-CD2 4.06Å; F270-K275 HydrophobicContact CB-CD 4.36Å; F270-K275 HydrophobicContact CB-CG 3.95Å; F270-K275 WeakPolarHBondContact O-CE 3.28Å; F270-K275 PolarHBondContact O-NZ 3.29Å; F270-L278 HydrophobicContact CD2-CD1 3.98Å; F270-L278 HydrophobicContact CE2-CD1 3.57Å
271	S	98.7	Very high	98	Very high	30 Å²	30	59.3 Å²	59.3	21%	0.21	31%	0.308	C	S	.	.			trans	-62.6	160	172	106.3	0	0	0	0	111.5	E149 E273 L274 K275	E149-S271 WeakPolarHBondContact OE1-CB 3.48Å; E149-S271 PolarHBondContact OE1-N 3.32Å; S271-E273 VanDerWaalsContact C-N 3.29Å; S271-E273 WeakPolarHBondContact CB-OE2 3.44Å; S271-E273 PolarHBondContact O-N 3.46Å; S271-E273 PolarHBondContact OG-N 3.5Å; S271-E273 VanDerWaalsContact OG-N 3.16Å; S271-E273 PolarHBondContact OG-OE2 2.95Å; S271-L274 PolarHBondContact O-N 3.34Å; S271-L274 PolarHBondContact OG-N 2.79Å; S271-K275 VanDerWaalsContact O-CG 3.31Å; S271-K275 WeakPolarHBondContact O-CG 3.41Å; S271-K275 PolarHBondContact O-N 3.03Å
272	N	98.6	Very high	98.1	Very high	122 Å²	122	56.8 Å²	56.8	65%	0.652	29%	0.289	S	S	*	.	H	α-helix	trans	-65.6	-37.2	176	-71.7	-30	0	0	0	111.3	K275 D276	N272-K275 PolarHBondContact O-N 3.35Å; N272-D276 WeakPolarHBondContact O-CB 3.42Å; N272-D276 PolarHBondContact O-N 3.21Å
273	E	98.7	Very high	98.3	Very high	84 Å²	84	58.3 Å²	58.3	39%	0.393	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.9	-57.2	70.9	-155.4	0	0	111.1	S271 D276 L277 H303 K304 W305	S271-E273 VanDerWaalsContact C-N 3.29Å; S271-E273 WeakPolarHBondContact CB-OE2 3.44Å; S271-E273 PolarHBondContact O-N 3.46Å; S271-E273 PolarHBondContact OG-N 3.5Å; S271-E273 VanDerWaalsContact OG-N 3.16Å; S271-E273 PolarHBondContact OG-OE2 2.95Å; E273-D276 PolarHBondContact O-N 3.39Å; E273-L277 PolarHBondContact O-N 2.88Å; E273-H303 PolarHBondContact O-CE1 2.95Å; E273-K304 HydrophobicContact CB-CB 4.49Å; E273-K304 HydrophobicContact CG-CB 3.99Å; E273-W305 HydrophobicContact CB-CB 3.95Å; E273-W305 HydrophobicContact CB-CG 4.45Å
274	L	98.8	Very high	98.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-46.9	175.7	178.1	54.4	0	0	0	111.1	E149 I237 A241 F270 S271 D276 L277 L278 W305	E149-L274 HydrophobicContact CG-CD2 3.87Å; E149-L274 WeakPolarHBondContact OE1-CD2 3.43Å; I237-L274 HydrophobicContact CG2-CD1 3.55Å; A241-L274 HydrophobicContact CB-CD2 3.83Å; F270-L274 HydrophobicContact CB-CD2 4.15Å; F270-L274 HydrophobicContact CD1-CD2 3.86Å; F270-L274 HydrophobicContact CD2-CD2 3.56Å; F270-L274 HydrophobicContact CD2-CG 3.84Å; F270-L274 HydrophobicContact CE1-CD2 4.08Å; F270-L274 HydrophobicContact CE2-CD2 3.82Å; F270-L274 HydrophobicContact CE2-CG 4.23Å; F270-L274 HydrophobicContact CG-CD2 3.58Å; F270-L274 HydrophobicContact CG-CG 4.22Å; F270-L274 HydrophobicContact CZ-CD2 4.06Å; S271-L274 PolarHBondContact O-N 3.34Å; S271-L274 PolarHBondContact OG-N 2.79Å; L274-D276 VanDerWaalsContact C-N 3.28Å; L274-D276 PolarHBondContact O-N 2.91Å; L274-L277 PolarHBondContact O-N 2.84Å; L274-L278 HydrophobicContact CD1-CD1 3.75Å; L274-L278 HydrophobicContact CD1-CG 3.91Å; L274-L278 HydrophobicContact CG-CD1 3.88Å; L274-L278 HydrophobicContact CG-CG 4.44Å; L274-L278 WeakPolarHBondContact O-CB 3.33Å; L274-L278 VanDerWaalsContact O-CG 3.29Å; L274-L278 WeakPolarHBondContact O-CG 3.32Å; L274-L278 PolarHBondContact O-N 2.92Å; L274-W305 HydrophobicContact CD1-CD2 4.32Å; L274-W305 HydrophobicContact CD1-CZ2 3.88Å
275	K	98.8	Very high	98.3	Very high	44 Å²	44	53.8 Å²	53.8	19%	0.191	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-41.7	176.8	-70.3	169.2	-175.3	158	0	111.4	F266 F270 S271 N272 K279	F266-K275 HydrophobicContact CB-CD 4.23Å; F266-K275 HydrophobicContact CB-CG 3.95Å; F266-K275 HydrophobicContact CD1-CG 4.13Å; F266-K275 HydrophobicContact CD2-CG 4.18Å; F266-K275 HydrophobicContact CG-CB 4.5Å; F266-K275 HydrophobicContact CG-CD 4.46Å; F266-K275 HydrophobicContact CG-CG 3.81Å; F270-K275 HydrophobicContact CB-CD 4.36Å; F270-K275 HydrophobicContact CB-CG 3.95Å; F270-K275 WeakPolarHBondContact O-CE 3.28Å; F270-K275 PolarHBondContact O-NZ 3.29Å; S271-K275 VanDerWaalsContact O-CG 3.31Å; S271-K275 WeakPolarHBondContact O-CG 3.41Å; S271-K275 PolarHBondContact O-N 3.03Å; N272-K275 PolarHBondContact O-N 3.35Å; K275-K279 WeakPolarHBondContact O-CB 3.47Å; K275-K279 VanDerWaalsContact O-CG 3.23Å; K275-K279 WeakPolarHBondContact O-CG 3.38Å; K275-K279 PolarHBondContact O-N 3.43Å
276	D	98.7	Very high	98.3	Very high	74 Å²	74	47.6 Å²	47.6	40%	0.396	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-46.2	179.1	-165.1	52.6	0	0	0	111.9	N272 E273 L274 L278 K279 N280 H303	N272-D276 WeakPolarHBondContact O-CB 3.42Å; N272-D276 PolarHBondContact O-N 3.21Å; E273-D276 PolarHBondContact O-N 3.39Å; L274-D276 VanDerWaalsContact C-N 3.28Å; L274-D276 PolarHBondContact O-N 2.91Å; D276-L278 VanDerWaalsContact C-N 3.35Å; D276-L278 PolarHBondContact O-N 3.26Å; D276-K279 PolarHBondContact O-N 2.93Å; D276-N280 PolarHBondContact O-N 3.15Å; D276-N280 PolarHBondContact O-ND2 3.5Å; D276-H303 IonicContact OD2-NE2 3.11Å; D276-H303 PolarHBondContact OD2-NE2 2.49Å; D276-H303 VanDerWaalsContact OD2-NE2 3.16Å
277	L	98.8	Very high	98.2	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.1	-49.5	174.8	179.2	61	0	0	0	111.2	I237 E273 L274 K279 N280 L281 Y290 H303 W305 F306	I237-L277 HydrophobicContact CD1-CD2 4.12Å; E273-L277 PolarHBondContact O-N 2.88Å; L274-L277 PolarHBondContact O-N 2.84Å; L277-K279 VanDerWaalsContact C-N 3.34Å; L277-K279 PolarHBondContact O-N 3.45Å; L277-N280 PolarHBondContact O-N 2.91Å; L277-L281 HydrophobicContact CD1-CD1 3.94Å; L277-L281 HydrophobicContact CD1-CG 4.17Å; L277-L281 HydrophobicContact CD2-CD1 4.4Å; L277-L281 HydrophobicContact CG-CD1 3.87Å; L277-L281 HydrophobicContact CG-CG 4.44Å; L277-L281 PolarHBondContact O-N 3.39Å; L277-Y290 HydrophobicContact CD1-CD2 4.49Å; L277-H303 HydrophobicContact CD1-CB 4.14Å; L277-H303 PolarHBondContact N-CE1 3.07Å; L277-W305 HydrophobicContact CB-CB 4.31Å; L277-W305 HydrophobicContact CD2-CB 4.14Å; L277-W305 HydrophobicContact CD2-CD2 3.91Å; L277-W305 HydrophobicContact CD2-CE3 3.39Å; L277-W305 HydrophobicContact CD2-CG 4.25Å; L277-W305 HydrophobicContact CD2-CZ3 4.01Å; L277-F306 HydrophobicContact CD2-CD2 4.2Å; L277-F306 HydrophobicContact CD2-CE2 3.69Å; L277-F306 HydrophobicContact CD2-CZ 4.46Å
278	L	98.9	Very high	98.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.5	-36.5	-177.6	-70.8	173.8	0	0	0	112.3	G234 I237 Y238 F266 F270 L274 D276 N280 L281 L282	G234-L278 WeakPolarHBondContact O-CD2 3.31Å; I237-L278 HydrophobicContact CB-CD2 4.01Å; I237-L278 HydrophobicContact CG2-CD2 3.89Å; Y238-L278 HydrophobicContact CD2-CD1 4.03Å; F266-L278 HydrophobicContact CD1-CD1 4.2Å; F266-L278 HydrophobicContact CE1-CB 3.71Å; F266-L278 HydrophobicContact CE1-CD1 3.88Å; F266-L278 HydrophobicContact CE1-CG 4.48Å; F266-L278 HydrophobicContact CZ-CB 4.25Å; F270-L278 HydrophobicContact CD2-CD1 3.98Å; F270-L278 HydrophobicContact CE2-CD1 3.57Å; L274-L278 HydrophobicContact CD1-CD1 3.75Å; L274-L278 HydrophobicContact CD1-CG 3.91Å; L274-L278 HydrophobicContact CG-CD1 3.88Å; L274-L278 HydrophobicContact CG-CG 4.44Å; L274-L278 WeakPolarHBondContact O-CB 3.33Å; L274-L278 VanDerWaalsContact O-CG 3.29Å; L274-L278 WeakPolarHBondContact O-CG 3.32Å; L274-L278 PolarHBondContact O-N 2.92Å; D276-L278 VanDerWaalsContact C-N 3.35Å; D276-L278 PolarHBondContact O-N 3.26Å; L278-N280 PolarHBondContact O-N 3.35Å; L278-L281 PolarHBondContact O-N 2.8Å; L278-L282 WeakPolarHBondContact O-CA 3.21Å; L278-L282 VanDerWaalsContact O-CB 3.24Å; L278-L282 WeakPolarHBondContact O-CB 3.36Å; L278-L282 PolarHBondContact O-N 2.89Å
279	K	98.6	Very high	98.2	Very high	119 Å²	119	49.2 Å²	49.2	52%	0.517	25%	0.25	S	S	.	.	H	α-helix	trans	-61.9	-31.2	173	-76.8	170.4	-177.5	177.9	0	112.9	F266 K275 D276 L277	F266-K279 HydrophobicContact CE2-CG 4.04Å; F266-K279 HydrophobicContact CZ-CG 3.92Å; K275-K279 WeakPolarHBondContact O-CB 3.47Å; K275-K279 VanDerWaalsContact O-CG 3.23Å; K275-K279 WeakPolarHBondContact O-CG 3.38Å; K275-K279 PolarHBondContact O-N 3.43Å; D276-K279 PolarHBondContact O-N 2.93Å; L277-K279 VanDerWaalsContact C-N 3.34Å; L277-K279 PolarHBondContact O-N 3.45Å
280	N	98.6	Very high	98.3	Very high	34 Å²	34	47.6 Å²	47.6	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-86.3	-26.7	180	-74.6	-67.8	0	0	0	113.2	D276 L277 L278 R289 Y290	D276-N280 PolarHBondContact O-N 3.15Å; D276-N280 PolarHBondContact O-ND2 3.5Å; L277-N280 PolarHBondContact O-N 2.91Å; L278-N280 PolarHBondContact O-N 3.35Å; N280-R289 WeakPolarHBondContact O-CA 3.33Å; N280-Y290 HydrophobicContact CB-CD1 3.56Å; N280-Y290 HydrophobicContact CB-CD2 3.82Å; N280-Y290 HydrophobicContact CB-CE1 3.65Å; N280-Y290 HydrophobicContact CB-CE2 3.92Å; N280-Y290 HydrophobicContact CB-CG 3.64Å; N280-Y290 PolarHBondContact O-N 3.31Å; N280-Y290 WeakPolarHBondContact OD1-CE1 3.26Å
281	L	98.8	Very high	98.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-84.4	-47.1	173.4	-69.5	173.5	0	0	0	112.5	W230 L233 I237 L277 L278 Q283 R289 I300	W230-L281 HydrophobicContact CB-CD2 4.37Å; L233-L281 HydrophobicContact CD2-CD1 4.34Å; L233-L281 HydrophobicContact CG-CD1 4.32Å; I237-L281 HydrophobicContact CD1-CD1 4Å; L277-L281 HydrophobicContact CD1-CD1 3.94Å; L277-L281 HydrophobicContact CD1-CG 4.17Å; L277-L281 HydrophobicContact CD2-CD1 4.4Å; L277-L281 HydrophobicContact CG-CD1 3.87Å; L277-L281 HydrophobicContact CG-CG 4.44Å; L277-L281 PolarHBondContact O-N 3.39Å; L278-L281 PolarHBondContact O-N 2.8Å; L281-Q283 PolarHBondContact O-N 2.97Å; L281-R289 WeakPolarHBondContact O-CD 3.44Å; L281-R289 WeakPolarHBondContact O-CG 3.23Å; L281-I300 HydrophobicContact CD2-CD1 3.78Å; L281-I300 HydrophobicContact CD2-CG1 4.07Å
282	L	98.7	Very high	98.1	Very high	9 Å²	9	48.3 Å²	48.3	5%	0.047	24%	0.244	C	C	.	.	S	Bend	trans	-81.7	40.3	176.6	-58.4	177.2	0	0	0	111.5	W231 V235 P246 V264 L278	W231-L282 HydrophobicContact CD2-CD2 4.08Å; W231-L282 HydrophobicContact CE3-CD2 4.39Å; W231-L282 HydrophobicContact CH2-CB 4.43Å; W231-L282 HydrophobicContact CZ2-CD2 4.24Å; W231-L282 HydrophobicContact CZ3-CB 4.29Å; W231-L282 WeakPolarHBondContact CZ3-O 3.4Å; V235-L282 HydrophobicContact CG2-CD2 3.72Å; P246-L282 HydrophobicContact CB-CD1 4.2Å; P246-L282 HydrophobicContact CG-CD1 4.13Å; V264-L282 HydrophobicContact CG1-CD1 4.29Å; V264-L282 HydrophobicContact CG2-CB 4.22Å; V264-L282 HydrophobicContact CG2-CD1 3.89Å; L278-L282 WeakPolarHBondContact O-CA 3.21Å; L278-L282 VanDerWaalsContact O-CB 3.24Å; L278-L282 WeakPolarHBondContact O-CB 3.36Å; L278-L282 PolarHBondContact O-N 2.89Å
283	Q	98.2	Very high	98	Very high	55 Å²	55	45.1 Å²	45.1	26%	0.257	23%	0.227	S	C	.	.			trans	-93.5	119.3	-178.3	178.8	52	-103.4	0	0	110.1	L281 D285 K288 R289	L281-Q283 PolarHBondContact O-N 2.97Å; Q283-D285 VanDerWaalsContact C-N 3.32Å; Q283-D285 HydrophobicContact CG-CB 4.27Å; Q283-D285 WeakPolarHBondContact CG-O 3.38Å; Q283-K288 HydrophobicContact CG-CB 3.7Å; Q283-R289 HydrophobicContact CB-CB 4.09Å; Q283-R289 HydrophobicContact CB-CG 4.28Å; Q283-R289 HydrophobicContact CG-CB 4.45Å; Q283-R289 VanDerWaalsContact O-CZ 3.28Å; Q283-R289 PolarHBondContact O-NE 3.02Å; Q283-R289 PolarHBondContact O-NH2 3.38Å
284	V	97.8	Very high	97.9	Very high	55 Å²	55	51.2 Å²	51.2	33%	0.333	25%	0.252	S	S	.	.	S	Bend	trans	-67.1	-36.5	178.9	-179	0	0	0	0	111	P216 W231 L286	P216-V284 HydrophobicContact CB-CG1 4.2Å; P216-V284 HydrophobicContact CG-CG1 4.29Å; P216-V284 HydrophobicContact CG-CG2 4.11Å; W231-V284 HydrophobicContact CH2-CG2 4.44Å; W231-V284 HydrophobicContact CZ3-CG2 4.37Å; V284-L286 PolarHBondContact O-N 3.31Å
285	D	96.8	Very high	97.7	Very high	53 Å²	53	56 Å²	56	28%	0.283	28%	0.278	S	S	.	.			trans	-75.2	104.9	177.3	-175.9	-8.1	0	0	0	111.3	Q283 T287 K288 R289	Q283-D285 VanDerWaalsContact C-N 3.32Å; Q283-D285 HydrophobicContact CG-CB 4.27Å; Q283-D285 WeakPolarHBondContact CG-O 3.38Å; D285-T287 VanDerWaalsContact CG-OG1 3.24Å; D285-T287 PolarHBondContact O-N 3.4Å; D285-T287 WeakPolarHBondContact OD1-CB 3.48Å; D285-T287 PolarHBondContact OD1-N 2.61Å; D285-T287 PolarHBondContact OD1-OG1 3.03Å; D285-T287 PolarHBondContact OD2-OG1 3.34Å; D285-K288 HydrophobicContact CB-CB 4.44Å; D285-K288 HydrophobicContact CB-CD 4.28Å; D285-K288 PolarHBondContact O-N 3.49Å; D285-K288 WeakPolarHBondContact OD2-CD 3.35Å; D285-K288 VanDerWaalsContact OD2-CE 3.23Å; D285-K288 WeakPolarHBondContact OD2-CE 3.5Å; D285-K288 IonicContact OD2-NZ 2.81Å; D285-K288 PolarHBondContact OD2-NZ 3.46Å; D285-R289 PolarHBondContact O-N 3.01Å; D285-R289 VanDerWaalsContact O-N 3.16Å
286	L	96.3	Very high	97.5	Very high	51 Å²	51	54.9 Å²	54.9	27%	0.267	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.1	179.8	-69.5	177.7	0	0	0	114.1	A227 V284 K288 N292	A227-L286 HydrophobicContact CB-CD2 3.92Å; V284-L286 PolarHBondContact O-N 3.31Å; L286-K288 PolarHBondContact O-N 3.4Å; L286-N292 PolarHBondContact O-ND2 3.06Å
287	T	96.2	Very high	97.4	Very high	104 Å²	104	52.6 Å²	52.6	64%	0.638	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.9	177.5	71.7	0	0	0	0	113.1	D285 L293	D285-T287 VanDerWaalsContact CG-OG1 3.24Å; D285-T287 PolarHBondContact O-N 3.4Å; D285-T287 WeakPolarHBondContact OD1-CB 3.48Å; D285-T287 PolarHBondContact OD1-N 2.61Å; D285-T287 PolarHBondContact OD1-OG1 3.03Å; D285-T287 PolarHBondContact OD2-OG1 3.34Å; T287-L293 WeakPolarHBondContact O-CD2 3.15Å
288	K	97.7	Very high	97.3	Very high	114 Å²	114	54.2 Å²	54.2	50%	0.496	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-10	-178.7	-65.4	174.4	-171.3	141.7	0	113.1	Q283 D285 L286 Y290	Q283-K288 HydrophobicContact CG-CB 3.7Å; D285-K288 HydrophobicContact CB-CB 4.44Å; D285-K288 HydrophobicContact CB-CD 4.28Å; D285-K288 PolarHBondContact O-N 3.49Å; D285-K288 WeakPolarHBondContact OD2-CD 3.35Å; D285-K288 VanDerWaalsContact OD2-CE 3.23Å; D285-K288 WeakPolarHBondContact OD2-CE 3.5Å; D285-K288 IonicContact OD2-NZ 2.81Å; D285-K288 PolarHBondContact OD2-NZ 3.46Å; L286-K288 PolarHBondContact O-N 3.4Å; K288-Y290 PolarHBondContact O-N 2.74Å
289	R	98.5	Very high	97.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.			trans	-71.1	124.5	-178.7	-166.7	-178.1	-60.6	161.4	4.7	111.3	E217 A227 N280 L281 Q283 D285 N292 L293	E217-R289 IonicContact OE1-CZ 3.83Å; E217-R289 IonicContact OE1-NH1 2.84Å; E217-R289 PolarHBondContact OE1-NH1 3.28Å; E217-R289 IonicContact OE1-NH2 2.79Å; E217-R289 IonicContact OE2-CZ 3.47Å; E217-R289 IonicContact OE2-NH1 3.55Å; E217-R289 PolarHBondContact OE2-NH1 3.45Å; E217-R289 IonicContact OE2-NH2 2.79Å; E217-R289 PolarHBondContact OE2-NH2 2.9Å; A227-R289 PolarHBondContact O-NH1 3.43Å; N280-R289 WeakPolarHBondContact O-CA 3.33Å; L281-R289 WeakPolarHBondContact O-CD 3.44Å; L281-R289 WeakPolarHBondContact O-CG 3.23Å; Q283-R289 HydrophobicContact CB-CB 4.09Å; Q283-R289 HydrophobicContact CB-CG 4.28Å; Q283-R289 HydrophobicContact CG-CB 4.45Å; Q283-R289 VanDerWaalsContact O-CZ 3.28Å; Q283-R289 PolarHBondContact O-NE 3.02Å; Q283-R289 PolarHBondContact O-NH2 3.38Å; D285-R289 PolarHBondContact O-N 3.01Å; D285-R289 VanDerWaalsContact O-N 3.16Å; R289-N292 PolarHBondContact O-N 3.45Å; R289-N292 VanDerWaalsContact O-N 3.15Å; R289-L293 WeakPolarHBondContact O-CG 3.38Å
290	Y	98.6	Very high	97.3	Very high	45 Å²	45	50 Å²	50	18%	0.176	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	147.1	174.3	-84.8	23	0	0	0	111.6	L277 N280 K288 N292 L293 D299 I300 H303	L277-Y290 HydrophobicContact CD1-CD2 4.49Å; N280-Y290 HydrophobicContact CB-CD1 3.56Å; N280-Y290 HydrophobicContact CB-CD2 3.82Å; N280-Y290 HydrophobicContact CB-CE1 3.65Å; N280-Y290 HydrophobicContact CB-CE2 3.92Å; N280-Y290 HydrophobicContact CB-CG 3.64Å; N280-Y290 PolarHBondContact O-N 3.31Å; N280-Y290 WeakPolarHBondContact OD1-CE1 3.26Å; K288-Y290 PolarHBondContact O-N 2.74Å; Y290-N292 PolarHBondContact O-N 2.84Å; Y290-L293 HydrophobicContact CD1-CD1 3.85Å; Y290-L293 HydrophobicContact CE1-CD1 4.12Å; Y290-D299 HydrophobicContact CD1-CB 4.21Å; Y290-D299 HydrophobicContact CD2-CB 3.97Å; Y290-D299 WeakPolarHBondContact CD2-O 2.94Å; Y290-D299 HydrophobicContact CE1-CB 4.4Å; Y290-D299 HydrophobicContact CE2-CB 4.15Å; Y290-D299 VanDerWaalsContact CE2-O 3.24Å; Y290-D299 WeakPolarHBondContact CE2-O 3.34Å; Y290-D299 HydrophobicContact CG-CB 4.01Å; Y290-I300 HydrophobicContact CD2-CG1 4.3Å; Y290-H303 AromaticContact CE2-CD2 3.81Å
291	G	97.6	Very high	97.3	Very high	4 Å²	4	49.4 Å²	49.4	4%	0.041	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-19.6	-171.4	0	0	0	0	0	114.3	W230 G296	W230-G291 PolarHBondContact NE1-O 2.8Å; G291-G296 WeakPolarHBondContact CA-O 3.44Å; G291-G296 PolarHBondContact N-O 2.87Å
292	N	96.8	Very high	97.2	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	29%	0.293	S	S	.	.	S	Bend	trans	-110.2	0.3	176.9	-165.8	57.8	0	0	0	113.7	A227 L286 R289 Y290	A227-N292 HydrophobicContact CB-CB 3.89Å; L286-N292 PolarHBondContact O-ND2 3.06Å; R289-N292 PolarHBondContact O-N 3.45Å; R289-N292 VanDerWaalsContact O-N 3.15Å; Y290-N292 PolarHBondContact O-N 2.84Å
293	L	96.4	Very high	97.2	Very high	54 Å²	54	55.9 Å²	55.9	28%	0.283	29%	0.293	S	S	.	.	S	Bend	trans	-82.7	179.2	177	-51.6	-173.4	0	0	0	111.6	T287 R289 Y290 N295 G296 D299	T287-L293 WeakPolarHBondContact O-CD2 3.15Å; R289-L293 WeakPolarHBondContact O-CG 3.38Å; Y290-L293 HydrophobicContact CD1-CD1 3.85Å; Y290-L293 HydrophobicContact CE1-CD1 4.12Å; L293-N295 VanDerWaalsContact C-N 3.27Å; L293-N295 PolarHBondContact O-N 3.37Å; L293-G296 WeakPolarHBondContact O-CA 3.43Å; L293-G296 PolarHBondContact O-N 3.42Å; L293-D299 WeakPolarHBondContact CB-OD2 3.27Å
294	K	95.3	Very high	97.2	Very high	212 Å²	212	61.3 Å²	61.3	92%	0.922	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-37.6	179.6	-173.7	-179.8	176.6	-176.2	0	113.3	G296	K294-G296 VanDerWaalsContact C-N 3.29Å
295	N	95	Very high	97.3	Very high	102 Å²	102	58.9 Å²	58.9	55%	0.545	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.8	178.6	-50.2	-34.8	0	0	0	112.6	L293 V297 A298 D299	L293-N295 VanDerWaalsContact C-N 3.27Å; L293-N295 PolarHBondContact O-N 3.37Å; N295-V297 PolarHBondContact O-N 3.28Å; N295-A298 HydrophobicContact CB-CB 4.21Å; N295-A298 VanDerWaalsContact O-CB 3.28Å; N295-A298 WeakPolarHBondContact O-CB 3.31Å; N295-A298 PolarHBondContact O-N 3.28Å; N295-A298 VanDerWaalsContact O-N 3.08Å; N295-D299 WeakPolarHBondContact CB-OD1 3.43Å; N295-D299 PolarHBondContact ND2-OD1 3.49Å
296	G	95.8	Very high	97.4	Very high	20 Å²	20	56.4 Å²	56.4	21%	0.206	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	-126.6	177.5	0	0	0	0	0	112.7	G291 L293 K294 A298 D299	G291-G296 WeakPolarHBondContact CA-O 3.44Å; G291-G296 PolarHBondContact N-O 2.87Å; L293-G296 WeakPolarHBondContact O-CA 3.43Å; L293-G296 PolarHBondContact O-N 3.42Å; K294-G296 VanDerWaalsContact C-N 3.29Å; G296-A298 PolarHBondContact O-N 2.83Å; G296-D299 PolarHBondContact O-N 3.14Å
297	V	96.7	Very high	97.4	Very high	26 Å²	26	57.1 Å²	57.1	16%	0.158	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.9	-179.6	68.5	0	0	0	0	113.3	V160 E164 W230 N295 D299 I300 K301	V160-V297 HydrophobicContact CG1-CG2 3.65Å; E164-V297 HydrophobicContact CB-CG1 4.45Å; E164-V297 HydrophobicContact CB-CG2 4.3Å; E164-V297 HydrophobicContact CG-CG1 4Å; E164-V297 VanDerWaalsContact OE1-CG1 3.31Å; E164-V297 WeakPolarHBondContact OE1-CG1 3.26Å; W230-V297 HydrophobicContact CH2-CB 4.2Å; W230-V297 HydrophobicContact CH2-CG2 3.56Å; W230-V297 HydrophobicContact CZ2-CB 4.12Å; W230-V297 HydrophobicContact CZ2-CG2 4Å; W230-V297 HydrophobicContact CZ3-CG2 4.35Å; N295-V297 PolarHBondContact O-N 3.28Å; V297-D299 VanDerWaalsContact C-N 3.26Å; V297-D299 PolarHBondContact O-N 3.3Å; V297-I300 WeakPolarHBondContact O-CB 3.14Å; V297-I300 PolarHBondContact O-N 3.38Å; V297-K301 HydrophobicContact CG2-CD 4.47Å; V297-K301 HydrophobicContact CG2-CG 4.23Å; V297-K301 PolarHBondContact O-N 3.14Å
298	A	96.9	Very high	97.3	Very high	34 Å²	34	56.7 Å²	56.7	28%	0.281	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-30.8	-179.9	0	0	0	0	0	112.2	N295 G296 I300 K301 N302	N295-A298 HydrophobicContact CB-CB 4.21Å; N295-A298 VanDerWaalsContact O-CB 3.28Å; N295-A298 WeakPolarHBondContact O-CB 3.31Å; N295-A298 PolarHBondContact O-N 3.28Å; N295-A298 VanDerWaalsContact O-N 3.08Å; G296-A298 PolarHBondContact O-N 2.83Å; A298-I300 PolarHBondContact O-N 3.39Å; A298-K301 PolarHBondContact O-N 3.01Å; A298-N302 VanDerWaalsContact O-CB 3.26Å; A298-N302 WeakPolarHBondContact O-CB 3.43Å; A298-N302 PolarHBondContact O-N 2.99Å; A298-N302 PolarHBondContact O-ND2 2.81Å
299	D	98.1	Very high	97.2	Very high	30 Å²	30	52.4 Å²	52.4	16%	0.16	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-30.7	173.8	-67.3	-38.6	0	0	0	111.7	Y290 L293 N295 G296 V297	Y290-D299 HydrophobicContact CD1-CB 4.21Å; Y290-D299 HydrophobicContact CD2-CB 3.97Å; Y290-D299 WeakPolarHBondContact CD2-O 2.94Å; Y290-D299 HydrophobicContact CE1-CB 4.4Å; Y290-D299 HydrophobicContact CE2-CB 4.15Å; Y290-D299 VanDerWaalsContact CE2-O 3.24Å; Y290-D299 WeakPolarHBondContact CE2-O 3.34Å; Y290-D299 HydrophobicContact CG-CB 4.01Å; L293-D299 WeakPolarHBondContact CB-OD2 3.27Å; N295-D299 WeakPolarHBondContact CB-OD1 3.43Å; N295-D299 PolarHBondContact ND2-OD1 3.49Å; G296-D299 PolarHBondContact O-N 3.14Å; V297-D299 VanDerWaalsContact C-N 3.26Å; V297-D299 PolarHBondContact O-N 3.3Å
300	I	98.6	Very high	97	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-78.4	-50.3	174.8	-56.9	171.6	0	0	0	109.8	V160 W230 L281 Y290 V297 A298 N302 H303 F306	V160-I300 HydrophobicContact CG1-CG2 4.48Å; V160-I300 HydrophobicContact CG2-CG2 3.82Å; W230-I300 HydrophobicContact CD2-CD1 3.63Å; W230-I300 HydrophobicContact CE3-CD1 3.26Å; W230-I300 HydrophobicContact CG-CD1 4.26Å; W230-I300 HydrophobicContact CH2-CD1 4.26Å; W230-I300 HydrophobicContact CZ3-CD1 3.61Å; L281-I300 HydrophobicContact CD2-CD1 3.78Å; L281-I300 HydrophobicContact CD2-CG1 4.07Å; Y290-I300 HydrophobicContact CD2-CG1 4.3Å; V297-I300 WeakPolarHBondContact O-CB 3.14Å; V297-I300 PolarHBondContact O-N 3.38Å; A298-I300 PolarHBondContact O-N 3.39Å; I300-N302 VanDerWaalsContact C-N 3.3Å; I300-N302 PolarHBondContact O-N 3.31Å; I300-H303 VanDerWaalsContact O-CB 3.25Å; I300-H303 WeakPolarHBondContact O-CB 3.36Å; I300-H303 PolarHBondContact O-N 3.32Å; I300-H303 VanDerWaalsContact O-N 3.16Å; I300-F306 HydrophobicContact CG2-CD2 4.25Å; I300-F306 HydrophobicContact CG2-CE2 3.7Å; I300-F306 VanDerWaalsContact O-CD2 3.23Å; I300-F306 WeakPolarHBondContact O-CD2 3.23Å
301	K	98	Very high	96.8	Very high	21 Å²	21	56.4 Å²	56.4	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-36.7	-175.1	-74.4	-175.2	170.2	176.8	0	113.8	V160 E164 V297 A298 H303 W311	V160-K301 HydrophobicContact CG1-CG 3.91Å; E164-K301 IonicContact OE1-NZ 2.7Å; E164-K301 PolarHBondContact OE1-NZ 3.43Å; E164-K301 WeakPolarHBondContact OE2-CE 3Å; E164-K301 IonicContact OE2-NZ 3.75Å; E164-K301 PolarHBondContact OE2-NZ 3Å; V297-K301 HydrophobicContact CG2-CD 4.47Å; V297-K301 HydrophobicContact CG2-CG 4.23Å; V297-K301 PolarHBondContact O-N 3.14Å; A298-K301 PolarHBondContact O-N 3.01Å; K301-H303 VanDerWaalsContact C-N 3.34Å; K301-W311 VanDerWaalsContact CA-CZ2 3.41Å; K301-W311 HydrophobicContact CB-CD2 4.43Å; K301-W311 HydrophobicContact CB-CH2 4.4Å; K301-W311 HydrophobicContact CB-CZ2 3.73Å; K301-W311 HydrophobicContact CD-CD2 4.09Å; K301-W311 HydrophobicContact CD-CE3 4.34Å; K301-W311 HydrophobicContact CD-CG 4.47Å; K301-W311 HydrophobicContact CG-CD2 3.97Å; K301-W311 HydrophobicContact CG-CE3 4.18Å; K301-W311 HydrophobicContact CG-CH2 3.83Å; K301-W311 HydrophobicContact CG-CZ2 3.63Å; K301-W311 HydrophobicContact CG-CZ3 4.09Å; K301-W311 PolarHBondContact O-NE1 2.91Å
302	N	97.8	Very high	96.6	Very high	133 Å²	133	58.6 Å²	58.6	71%	0.711	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	0.3	-178.4	-61.5	-27.7	0	0	0	112.8	A298 I300	A298-N302 VanDerWaalsContact O-CB 3.26Å; A298-N302 WeakPolarHBondContact O-CB 3.43Å; A298-N302 PolarHBondContact O-N 2.99Å; A298-N302 PolarHBondContact O-ND2 2.81Å; I300-N302 VanDerWaalsContact C-N 3.3Å; I300-N302 PolarHBondContact O-N 3.31Å
303	H	98.7	Very high	96.4	Very high	12 Å²	12	56.9 Å²	56.9	6%	0.056	32%	0.317	C	S	.	.	S	Bend	trans	-63	142.3	177.4	-172.7	-90.4	0	0	0	110.7	E273 D276 L277 Y290 I300 K301 W305 F306 G307	E273-H303 PolarHBondContact O-CE1 2.95Å; D276-H303 IonicContact OD2-NE2 3.11Å; D276-H303 PolarHBondContact OD2-NE2 2.49Å; D276-H303 VanDerWaalsContact OD2-NE2 3.16Å; L277-H303 HydrophobicContact CD1-CB 4.14Å; L277-H303 PolarHBondContact N-CE1 3.07Å; Y290-H303 AromaticContact CE2-CD2 3.81Å; I300-H303 VanDerWaalsContact O-CB 3.25Å; I300-H303 WeakPolarHBondContact O-CB 3.36Å; I300-H303 PolarHBondContact O-N 3.32Å; I300-H303 VanDerWaalsContact O-N 3.16Å; K301-H303 VanDerWaalsContact C-N 3.34Å; H303-W305 WeakPolarHBondContact ND1-CB 3.48Å; H303-W305 PolarHBondContact ND1-N 3.11Å; H303-W305 PolarHBondContact O-N 2.74Å; H303-W305 VanDerWaalsContact O-N 3.07Å; H303-F306 WeakPolarHBondContact O-CA 3.45Å; H303-F306 PolarHBondContact O-N 2.98Å; H303-G307 PolarHBondContact O-N 3.08Å
304	K	98.4	Very high	96.3	Very high	169 Å²	169	54.5 Å²	54.5	74%	0.735	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-54	-34.9	-176.5	-68.8	-178.5	179.7	176.9	0	113.6	E273 F306 G307	E273-K304 HydrophobicContact CB-CB 4.49Å; E273-K304 HydrophobicContact CG-CB 3.99Å; K304-F306 PolarHBondContact O-N 2.75Å; K304-G307 PolarHBondContact O-N 3.29Å
305	W	98.7	Very high	96.3	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.015	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.6	-30.6	176.1	-168.1	75.2	0	0	0	112.7	E149 R153 A156 I237 E273 L274 L277 H303	E149-W305 HydrophobicContact CB-CZ2 4.33Å; E149-W305 PolarHBondContact OE2-NE1 3.42Å; R153-W305 HydrophobicContact CB-CE3 4.34Å; R153-W305 HydrophobicContact CB-CH2 3.55Å; R153-W305 HydrophobicContact CB-CZ2 3.89Å; R153-W305 HydrophobicContact CB-CZ3 3.77Å; R153-W305 WeakPolarHBondContact CD-O 3.29Å; R153-W305 HydrophobicContact CG-CE3 4.1Å; R153-W305 HydrophobicContact CG-CH2 4.19Å; R153-W305 HydrophobicContact CG-CZ3 3.88Å; R153-W305 PolarHBondContact NE-O 2.81Å; A156-W305 HydrophobicContact CB-CH2 4.43Å; A156-W305 HydrophobicContact CB-CZ3 4.14Å; I237-W305 HydrophobicContact CD1-CZ3 4.31Å; I237-W305 HydrophobicContact CG2-CH2 3.91Å; I237-W305 HydrophobicContact CG2-CZ2 4.36Å; I237-W305 HydrophobicContact CG2-CZ3 4.34Å; E273-W305 HydrophobicContact CB-CB 3.95Å; E273-W305 HydrophobicContact CB-CG 4.45Å; L274-W305 HydrophobicContact CD1-CD2 4.32Å; L274-W305 HydrophobicContact CD1-CZ2 3.88Å; L277-W305 HydrophobicContact CB-CB 4.31Å; L277-W305 HydrophobicContact CD2-CB 4.14Å; L277-W305 HydrophobicContact CD2-CD2 3.91Å; L277-W305 HydrophobicContact CD2-CE3 3.39Å; L277-W305 HydrophobicContact CD2-CG 4.25Å; L277-W305 HydrophobicContact CD2-CZ3 4.01Å; H303-W305 WeakPolarHBondContact ND1-CB 3.48Å; H303-W305 PolarHBondContact ND1-N 3.11Å; H303-W305 PolarHBondContact O-N 2.74Å; H303-W305 VanDerWaalsContact O-N 3.07Å
306	F	98.5	Very high	96.2	Very high	1 Å²	1	47 Å²	47	0%	0.004	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-91.4	6.5	172.5	-74.3	-74.3	0	0	0	113.5	R153 A156 A157 V160 L277 I300 H303 K304 S308 T309 W311	R153-F306 HydrophobicContact CG-CD1 3.7Å; R153-F306 HydrophobicContact CG-CE1 3.91Å; A156-F306 HydrophobicContact CB-CE1 4.1Å; A156-F306 HydrophobicContact CB-CZ 3.89Å; A157-F306 HydrophobicContact CB-CE1 4.16Å; V160-F306 HydrophobicContact CG2-CZ 4.19Å; L277-F306 HydrophobicContact CD2-CD2 4.2Å; L277-F306 HydrophobicContact CD2-CE2 3.69Å; L277-F306 HydrophobicContact CD2-CZ 4.46Å; I300-F306 HydrophobicContact CG2-CD2 4.25Å; I300-F306 HydrophobicContact CG2-CE2 3.7Å; I300-F306 VanDerWaalsContact O-CD2 3.23Å; I300-F306 WeakPolarHBondContact O-CD2 3.23Å; H303-F306 WeakPolarHBondContact O-CA 3.45Å; H303-F306 PolarHBondContact O-N 2.98Å; K304-F306 PolarHBondContact O-N 2.75Å; F306-S308 PolarHBondContact O-N 3.45Å; F306-T309 WeakPolarHBondContact CA-OG1 3.45Å; F306-T309 HydrophobicContact CD1-CG2 4.42Å; F306-T309 WeakPolarHBondContact O-CA 3.37Å; F306-T309 WeakPolarHBondContact O-CB 3.38Å; F306-T309 PolarHBondContact O-N 3.06Å; F306-T309 PolarHBondContact O-OG1 2.89Å; F306-W311 HydrophobicContact CB-CZ2 3.79Å; F306-W311 AromaticContact CD1-CH2 3.68Å; F306-W311 HydrophobicContact CD1-CH2 3.68Å; F306-W311 AromaticContact CD1-CZ2 3.76Å; F306-W311 HydrophobicContact CD1-CZ2 3.76Å; F306-W311 HydrophobicContact CD2-CH2 4.44Å; F306-W311 HydrophobicContact CD2-CZ2 4.38Å; F306-W311 AromaticContact CE1-CH2 3.88Å; F306-W311 HydrophobicContact CE1-CH2 3.88Å; F306-W311 HydrophobicContact CE1-CZ2 4.43Å; F306-W311 AromaticContact CG-CH2 3.98Å; F306-W311 HydrophobicContact CG-CH2 3.98Å; F306-W311 AromaticContact CG-CZ2 3.74Å; F306-W311 HydrophobicContact CG-CZ2 3.74Å; F306-W311 HydrophobicContact CZ-CH2 4.34Å
307	G	96.3	Very high	96	Very high	67 Å²	67	49.5 Å²	49.5	69%	0.691	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.6	-171.1	0	0	0	0	0	115.7	H303 K304	H303-G307 PolarHBondContact O-N 3.08Å; K304-G307 PolarHBondContact O-N 3.29Å
308	S	93.7	Very high	95.8	Very high	95 Å²	95	55 Å²	55	66%	0.664	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	9.2	174.3	72.6	0	0	0	0	114.1	F306	F306-S308 PolarHBondContact O-N 3.45Å
309	T	96.1	Very high	95.4	Very high	23 Å²	23	56 Å²	56	14%	0.141	29%	0.294	C	S	.	.			trans	-95.3	116.1	-170.6	-48.8	0	0	0	0	110.5	A157 F306 W311 I314	A157-T309 HydrophobicContact CB-CG2 3.77Å; F306-T309 WeakPolarHBondContact CA-OG1 3.45Å; F306-T309 HydrophobicContact CD1-CG2 4.42Å; F306-T309 WeakPolarHBondContact O-CA 3.37Å; F306-T309 WeakPolarHBondContact O-CB 3.38Å; F306-T309 PolarHBondContact O-N 3.06Å; F306-T309 PolarHBondContact O-OG1 2.89Å; T309-W311 HydrophobicContact CG2-CD2 4.11Å; T309-W311 HydrophobicContact CG2-CE3 4.34Å; T309-W311 HydrophobicContact CG2-CH2 4.39Å; T309-W311 HydrophobicContact CG2-CZ2 4.12Å; T309-W311 HydrophobicContact CG2-CZ3 4.5Å; T309-W311 PolarHBondContact O-N 2.94Å; T309-I314 HydrophobicContact CG2-CG1 4.24Å
310	D	94.9	Very high	94.6	Very high	89 Å²	89	60 Å²	60	48%	0.476	32%	0.32	S	S	.	.			trans	-85.7	97.7	166.8	-175.7	-22.4	0	0	0	109.5	I312 A313 I314	D310-I312 VanDerWaalsContact C-N 3.27Å; D310-I312 PolarHBondContact O-N 3.29Å; D310-I312 PolarHBondContact OD1-N 3.36Å; D310-A313 HydrophobicContact CB-CB 3.83Å; D310-A313 VanDerWaalsContact CG-CB 3.41Å; D310-A313 PolarHBondContact O-N 3.42Å; D310-A313 PolarHBondContact OD1-N 2.85Å; D310-I314 VanDerWaalsContact O-CG1 3.31Å; D310-I314 WeakPolarHBondContact O-CG1 3.23Å; D310-I314 PolarHBondContact O-N 3.45Å
311	W	95	Very high	93.4	Very high	41 Å²	41	60.4 Å²	60.4	16%	0.155	32%	0.322	C	S	.	.	H	α-helix	trans	-58.8	-35.9	-178	-63.7	100	0	0	0	113.4	A157 V160 L161 K301 F306 T309 Y315	A157-W311 HydrophobicContact CB-CE3 4.41Å; A157-W311 HydrophobicContact CB-CH2 4.17Å; A157-W311 HydrophobicContact CB-CZ3 3.8Å; A157-W311 WeakPolarHBondContact O-CZ3 3.21Å; V160-W311 HydrophobicContact CB-CH2 4.09Å; V160-W311 HydrophobicContact CB-CZ3 3.83Å; V160-W311 HydrophobicContact CG1-CH2 3.82Å; V160-W311 HydrophobicContact CG1-CZ3 3.65Å; V160-W311 HydrophobicContact CG2-CH2 4.4Å; L161-W311 HydrophobicContact CD1-CE3 4.19Å; L161-W311 HydrophobicContact CD2-CE3 3.98Å; L161-W311 HydrophobicContact CG-CE3 3.88Å; L161-W311 HydrophobicContact CG-CZ3 4.27Å; K301-W311 VanDerWaalsContact CA-CZ2 3.41Å; K301-W311 HydrophobicContact CB-CD2 4.43Å; K301-W311 HydrophobicContact CB-CH2 4.4Å; K301-W311 HydrophobicContact CB-CZ2 3.73Å; K301-W311 HydrophobicContact CD-CD2 4.09Å; K301-W311 HydrophobicContact CD-CE3 4.34Å; K301-W311 HydrophobicContact CD-CG 4.47Å; K301-W311 HydrophobicContact CG-CD2 3.97Å; K301-W311 HydrophobicContact CG-CE3 4.18Å; K301-W311 HydrophobicContact CG-CH2 3.83Å; K301-W311 HydrophobicContact CG-CZ2 3.63Å; K301-W311 HydrophobicContact CG-CZ3 4.09Å; K301-W311 PolarHBondContact O-NE1 2.91Å; F306-W311 HydrophobicContact CB-CZ2 3.79Å; F306-W311 AromaticContact CD1-CH2 3.68Å; F306-W311 HydrophobicContact CD1-CH2 3.68Å; F306-W311 AromaticContact CD1-CZ2 3.76Å; F306-W311 HydrophobicContact CD1-CZ2 3.76Å; F306-W311 HydrophobicContact CD2-CH2 4.44Å; F306-W311 HydrophobicContact CD2-CZ2 4.38Å; F306-W311 AromaticContact CE1-CH2 3.88Å; F306-W311 HydrophobicContact CE1-CH2 3.88Å; F306-W311 HydrophobicContact CE1-CZ2 4.43Å; F306-W311 AromaticContact CG-CH2 3.98Å; F306-W311 HydrophobicContact CG-CH2 3.98Å; F306-W311 AromaticContact CG-CZ2 3.74Å; F306-W311 HydrophobicContact CG-CZ2 3.74Å; F306-W311 HydrophobicContact CZ-CH2 4.34Å; T309-W311 HydrophobicContact CG2-CD2 4.11Å; T309-W311 HydrophobicContact CG2-CE3 4.34Å; T309-W311 HydrophobicContact CG2-CH2 4.39Å; T309-W311 HydrophobicContact CG2-CZ2 4.12Å; T309-W311 HydrophobicContact CG2-CZ3 4.5Å; T309-W311 PolarHBondContact O-N 2.94Å; W311-Y315 WeakPolarHBondContact O-CB 3.24Å; W311-Y315 PolarHBondContact O-N 3.18Å
312	I	92.7	Very high	91.9	Very high	50 Å²	50	61.1 Å²	61.1	26%	0.256	33%	0.329	S	S	.	.	H	α-helix	trans	-74.8	-43.4	-179.7	-65.5	179.6	0	0	0	109.8	N20 D310 I314 Y315 Q316	N20-I312 HydrophobicContact CB-CD1 3.64Å; N20-I312 WeakPolarHBondContact OD1-CD1 3.49Å; D310-I312 VanDerWaalsContact C-N 3.27Å; D310-I312 PolarHBondContact O-N 3.29Å; D310-I312 PolarHBondContact OD1-N 3.36Å; I312-I314 VanDerWaalsContact C-N 3.3Å; I312-I314 PolarHBondContact O-N 2.88Å; I312-Y315 PolarHBondContact O-N 2.91Å; I312-Q316 HydrophobicContact CG2-CG 4.22Å; I312-Q316 WeakPolarHBondContact O-CB 3.32Å; I312-Q316 VanDerWaalsContact O-CG 3.31Å; I312-Q316 WeakPolarHBondContact O-CG 3.42Å; I312-Q316 PolarHBondContact O-N 2.92Å
313	A	93.4	Very high	89.7	Confident	12 Å²	12	58 Å²	58	10%	0.099	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-37.1	176.6	0	0	0	0	0	111.7	D310 K317 K318 I319	D310-A313 HydrophobicContact CB-CB 3.83Å; D310-A313 VanDerWaalsContact CG-CB 3.41Å; D310-A313 PolarHBondContact O-N 3.42Å; D310-A313 PolarHBondContact OD1-N 2.85Å; A313-K317 PolarHBondContact O-N 3.33Å; A313-K318 HydrophobicContact CB-CB 4.22Å; A313-K318 PolarHBondContact O-N 2.89Å; A313-I319 HydrophobicContact CB-CD1 3.53Å; A313-I319 HydrophobicContact CB-CG1 3.71Å
314	I	94.6	Very high	87.2	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-55.6	171.3	-67.7	-72.4	0	0	0	109.7	F111 F154 A157 Q158 L161 T309 D310 I312 Q316 K317 I319	F111-I314 HydrophobicContact CE2-CG2 4.18Å; F111-I314 HydrophobicContact CZ-CG2 3.91Å; F111-I314 WeakPolarHBondContact CZ-O 3.48Å; F154-I314 HydrophobicContact CD2-CD1 3.49Å; F154-I314 VanDerWaalsContact CD2-CD1 3.49Å; F154-I314 HydrophobicContact CE2-CD1 3.62Å; A157-I314 HydrophobicContact CB-CG1 4.4Å; A157-I314 HydrophobicContact CB-CG2 4.38Å; Q158-I314 HydrophobicContact CG-CG2 3.74Å; L161-I314 HydrophobicContact CD1-CB 4.22Å; L161-I314 HydrophobicContact CD1-CG2 3.72Å; T309-I314 HydrophobicContact CG2-CG1 4.24Å; D310-I314 VanDerWaalsContact O-CG1 3.31Å; D310-I314 WeakPolarHBondContact O-CG1 3.23Å; D310-I314 PolarHBondContact O-N 3.45Å; I312-I314 VanDerWaalsContact C-N 3.3Å; I312-I314 PolarHBondContact O-N 2.88Å; I314-Q316 VanDerWaalsContact C-N 3.27Å; I314-Q316 PolarHBondContact O-N 3.45Å; I314-K317 WeakPolarHBondContact O-CA 3.49Å; I314-K317 PolarHBondContact O-N 3.38Å; I314-I319 HydrophobicContact CD1-CB 3.85Å; I314-I319 HydrophobicContact CD1-CG1 3.72Å; I314-I319 HydrophobicContact CD1-CG2 4.11Å; I314-I319 HydrophobicContact CG1-CG1 4.02Å
315	Y	93.5	Very high	84.4	Confident	62 Å²	62	55.3 Å²	55.3	24%	0.243	32%	0.317	C	S	.	.	H	α-helix	trans	-53.1	-42.9	179.8	172.8	-105.1	0	0	0	112.8	F27 F109 P110 W311 I312 K317	F27-Y315 HydrophobicContact CE1-CE2 4.3Å; F27-Y315 WeakPolarHBondContact CE2-OH 3.41Å; F27-Y315 HydrophobicContact CZ-CE2 4.11Å; F27-Y315 AromaticContact CZ-CZ 3.9Å; F27-Y315 WeakPolarHBondContact CZ-OH 3.49Å; F109-Y315 HydrophobicContact CD2-CE2 4.32Å; F109-Y315 HydrophobicContact CE2-CD2 4.05Å; F109-Y315 AromaticContact CE2-CE2 3.62Å; F109-Y315 HydrophobicContact CE2-CE2 3.62Å; F109-Y315 AromaticContact CZ-CD2 3.91Å; F109-Y315 HydrophobicContact CZ-CD2 3.91Å; F109-Y315 AromaticContact CZ-CE2 3.96Å; F109-Y315 HydrophobicContact CZ-CE2 3.96Å; P110-Y315 HydrophobicContact CG-CD2 4.06Å; P110-Y315 HydrophobicContact CG-CE2 3.59Å; W311-Y315 WeakPolarHBondContact O-CB 3.24Å; W311-Y315 PolarHBondContact O-N 3.18Å; I312-Y315 PolarHBondContact O-N 2.91Å; Y315-K317 PolarHBondContact O-N 2.8Å
316	Q	93	Very high	81.5	Confident	95 Å²	95	65.6 Å²	65.6	44%	0.444	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	5.9	179.8	-66.8	179.9	-11.3	0	0	113.9	I312 I314 K318	I312-Q316 HydrophobicContact CG2-CG 4.22Å; I312-Q316 WeakPolarHBondContact O-CB 3.32Å; I312-Q316 VanDerWaalsContact O-CG 3.31Å; I312-Q316 WeakPolarHBondContact O-CG 3.42Å; I312-Q316 PolarHBondContact O-N 2.92Å; I314-Q316 VanDerWaalsContact C-N 3.27Å; I314-Q316 PolarHBondContact O-N 3.45Å; Q316-K318 HydrophobicContact CB-CD 3.94Å; Q316-K318 HydrophobicContact CB-CG 3.91Å; Q316-K318 PolarHBondContact O-N 3.2Å
317	K	92.9	Very high	78.8	Confident	72 Å²	72	69 Å²	69	31%	0.313	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	37.4	-174.2	-61.6	-166.9	173	-169.2	0	114.1	F111 D184 Y188 A313 I314 Y315	F111-K317 HydrophobicContact CE1-CG 4.17Å; D184-K317 IonicContact OD2-NZ 3.14Å; D184-K317 PolarHBondContact OD2-NZ 2.85Å; Y188-K317 HydrophobicContact CD1-CD 4.31Å; Y188-K317 HydrophobicContact CD1-CG 3.9Å; Y188-K317 HydrophobicContact CD2-CB 4.32Å; Y188-K317 HydrophobicContact CD2-CD 4.27Å; Y188-K317 HydrophobicContact CD2-CG 4.26Å; Y188-K317 HydrophobicContact CE1-CB 4.23Å; Y188-K317 HydrophobicContact CE1-CG 3.92Å; Y188-K317 HydrophobicContact CE2-CB 3.95Å; Y188-K317 HydrophobicContact CE2-CG 4.28Å; Y188-K317 HydrophobicContact CG-CD 4.05Å; Y188-K317 HydrophobicContact CG-CG 4.07Å; Y188-K317 VanDerWaalsContact CZ-CA 3.47Å; Y188-K317 VanDerWaalsContact OH-C 3.31Å; Y188-K317 VanDerWaalsContact OH-CA 3.28Å; Y188-K317 WeakPolarHBondContact OH-CA 3.37Å; A313-K317 PolarHBondContact O-N 3.33Å; I314-K317 WeakPolarHBondContact O-CA 3.49Å; I314-K317 PolarHBondContact O-N 3.38Å; Y315-K317 PolarHBondContact O-N 2.8Å
318	K	92	Very high	76.2	Confident	141 Å²	141	71.6 Å²	71.6	61%	0.613	39%	0.392	S	S	*	.			trans	-98.7	-8.4	-177.7	-70.9	-179	177.9	171.9	0	114.4	A313 Q316	A313-K318 HydrophobicContact CB-CB 4.22Å; A313-K318 PolarHBondContact O-N 2.89Å; Q316-K318 HydrophobicContact CB-CD 3.94Å; Q316-K318 HydrophobicContact CB-CG 3.91Å; Q316-K318 PolarHBondContact O-N 3.2Å
319	I	89.4	Confident	73.5	Confident	56 Å²	56	72.2 Å²	72.2	29%	0.287	40%	0.396	S	S	.	.	S	Bend	trans	-84.8	118.5	174.2	-62	-58.2	0	0	0	107	F154 Y188 A313 I314 P321	F154-I319 HydrophobicContact CD2-CG2 3.99Å; F154-I319 HydrophobicContact CE2-CB 4.18Å; F154-I319 HydrophobicContact CE2-CG2 3.91Å; Y188-I319 WeakPolarHBondContact CE2-O 3.19Å; Y188-I319 PolarHBondContact OH-N 2.88Å; Y188-I319 VanDerWaalsContact OH-N 3.12Å; Y188-I319 PolarHBondContact OH-O 3Å; A313-I319 HydrophobicContact CB-CD1 3.53Å; A313-I319 HydrophobicContact CB-CG1 3.71Å; I314-I319 HydrophobicContact CD1-CB 3.85Å; I314-I319 HydrophobicContact CD1-CG1 3.72Å; I314-I319 HydrophobicContact CD1-CG2 4.11Å; I314-I319 HydrophobicContact CG1-CG1 4.02Å; I319-P321 VanDerWaalsContact O-CD 3.27Å; I319-P321 WeakPolarHBondContact O-CD 3.32Å
320	T	81.1	Confident	70.8	Confident	114 Å²	114	76 Å²	76	70%	0.699	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-60.4	123.1	163	-51	0	0	0	0	106.5
321	P	72.2	Confident	68.6	Low	7 Å²	7	74.7 Å²	74.7	5%	0.045	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-49.9	147.5	174.4	-19.6	23.8	0	0	0	109.3	F154 T186 I319 S323 Y338	F154-P321 HydrophobicContact CD1-CB 4.2Å; F154-P321 HydrophobicContact CE1-CB 3.69Å; F154-P321 HydrophobicContact CE1-CG 3.89Å; F154-P321 HydrophobicContact CE2-CB 4.4Å; F154-P321 HydrophobicContact CE2-CG 4.45Å; F154-P321 HydrophobicContact CZ-CB 3.82Å; F154-P321 HydrophobicContact CZ-CG 3.67Å; T186-P321 WeakPolarHBondContact O-CG 3.42Å; I319-P321 VanDerWaalsContact O-CD 3.27Å; I319-P321 WeakPolarHBondContact O-CD 3.32Å; P321-S323 PolarHBondContact O-N 2.83Å; P321-Y338 WeakPolarHBondContact CA-OH 3.28Å; P321-Y338 HydrophobicContact CB-CE1 4.13Å; P321-Y338 HydrophobicContact CB-CE2 4.37Å; P321-Y338 WeakPolarHBondContact CB-OH 3.31Å; P321-Y338 WeakPolarHBondContact CD-OH 3.43Å; P321-Y338 HydrophobicContact CG-CE1 3.7Å; P321-Y338 WeakPolarHBondContact CG-OH 3.42Å; P321-Y338 PolarHBondContact O-OH 3.27Å
322	P	66.4	Low	66.4	Low	36 Å²	36	82 Å²	82	23%	0.234	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-54.3	121.3	-178	-20.6	30.2	0	0	0	108.8	P150 H151 F154	P150-P322 HydrophobicContact CB-CG 4.46Å; H151-P322 PolarHBondContact NE2-O 2.73Å; F154-P322 HydrophobicContact CB-CG 4.17Å
323	S	52.3	Low	64.2	Low	68 Å²	68	81.7 Å²	81.7	48%	0.476	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-80.2	128.8	171.4	178.3	0	0	0	0	106.3	P321 S325 F334	P321-S323 PolarHBondContact O-N 2.83Å; S323-S325 PolarHBondContact O-N 3.44Å; S323-F334 WeakPolarHBondContact OG-CE2 3.49Å
324	F	46.9	Very low	62.2	Low	31 Å²	31	85.7 Å²	85.7	14%	0.136	46%	0.464	C	S	.	.			trans	-57.4	109.1	162.5	-72.5	-80.7	0	0	0	106.8	H151 K326 L333 L337	H151-F324 AromaticContact CE1-CD1 3.72Å; H151-F324 AromaticContact CE1-CD2 3.73Å; H151-F324 AromaticContact CE1-CE1 3.35Å; H151-F324 WeakPolarHBondContact CE1-CE1 3.4Å; H151-F324 AromaticContact CE1-CE2 3.39Å; H151-F324 WeakPolarHBondContact CE1-CE2 3.13Å; H151-F324 AromaticContact CE1-CG 3.88Å; H151-F324 AromaticContact CE1-CZ 3.16Å; H151-F324 WeakPolarHBondContact CE1-CZ 3.36Å; H151-F324 AromaticContact ND1-CE1 3.8Å; H151-F324 AromaticContact ND1-CZ 3.53Å; H151-F324 AromaticContact NE2-CD2 3.74Å; H151-F324 AromaticContact NE2-CE2 3.47Å; H151-F324 WeakPolarHBondContact NE2-CE2 3.24Å; H151-F324 AromaticContact NE2-CZ 3.72Å; F324-K326 PolarHBondContact O-N 3.17Å; F324-L333 HydrophobicContact CD1-CD2 3.72Å; F324-L333 HydrophobicContact CD2-CB 3.88Å; F324-L333 HydrophobicContact CD2-CD2 3.91Å; F324-L333 HydrophobicContact CE1-CD2 3.38Å; F324-L333 HydrophobicContact CE2-CB 4.17Å; F324-L333 HydrophobicContact CE2-CD2 3.55Å; F324-L333 HydrophobicContact CE2-CG 4.45Å; F324-L333 HydrophobicContact CG-CB 4.12Å; F324-L333 HydrophobicContact CG-CD2 3.99Å; F324-L333 HydrophobicContact CZ-CD2 3.29Å; F324-L337 HydrophobicContact CD2-CD1 4.34Å; F324-L337 HydrophobicContact CE2-CD1 3.43Å; F324-L337 VanDerWaalsContact CE2-CD1 3.43Å; F324-L337 HydrophobicContact CE2-CG 4.13Å; F324-L337 HydrophobicContact CZ-CD1 4.09Å
325	S	38.1	Very low	60.2	Low	93 Å²	93	88.9 Å²	88.9	65%	0.65	48%	0.479	S	S	*	.			trans	-52.6	138.5	176.1	51.7	0	0	0	0	107.9	S323 G327 E328	S323-S325 PolarHBondContact O-N 3.44Å; S325-G327 PolarHBondContact O-N 2.88Å; S325-E328 PolarHBondContact O-N 2.87Å
326	K	39.3	Very low	58.2	Low	221 Å²	221	85.9 Å²	85.9	96%	0.961	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	5.1	-173.1	-70.9	-178.4	174.5	179.8	0	115.9	F324	F324-K326 PolarHBondContact O-N 3.17Å
327	G	41.8	Very low	56.6	Low	73 Å²	73	81.4 Å²	81.4	75%	0.753	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-14	178.5	0	0	0	0	0	115.1	S325	S325-G327 PolarHBondContact O-N 2.88Å
328	E	41.8	Very low	55.5	Low	120 Å²	120	79.8 Å²	79.8	56%	0.561	44%	0.439	S	S	*	.	S	Bend	trans	-89.6	111.2	169.8	-74.5	-174.4	161.4	0	0	109.4	S325 N330	S325-E328 PolarHBondContact O-N 2.87Å; E328-N330 VanDerWaalsContact C-N 3.28Å; E328-N330 PolarHBondContact O-N 3.3Å
329	S	37	Very low	54.4	Low	109 Å²	109	73.3 Å²	73.3	76%	0.762	41%	0.411	S	S	*	.	S	Bend	trans	-57.6	84.5	176.6	50.9	0	0	0	0	111.4
330	N	39.5	Very low	53.7	Low	103 Å²	103	78.1 Å²	78.1	55%	0.551	43%	0.425	S	S	*	.			trans	171.2	125	136.1	-88.8	-29.4	0	0	0	109.8	E328 R332 L333	E328-N330 VanDerWaalsContact C-N 3.28Å; E328-N330 PolarHBondContact O-N 3.3Å; N330-R332 HydrophobicContact CB-CB 4.2Å; N330-R332 HydrophobicContact CB-CG 4.43Å; N330-R332 PolarHBondContact O-N 3.37Å; N330-L333 PolarHBondContact O-N 3.06Å; N330-L333 VanDerWaalsContact O-N 3.1Å
331	G	46.9	Very low	53.6	Low	60 Å²	60	74.5 Å²	74.5	62%	0.619	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-11.1	171	0	0	0	0	0	115	L333 F334 E335	G331-L333 VanDerWaalsContact C-N 3.27Å; G331-L333 PolarHBondContact O-N 3.25Å; G331-F334 PolarHBondContact O-N 3.06Å; G331-E335 PolarHBondContact O-N 3.13Å
332	R	49.4	Very low	54.2	Low	195 Å²	195	79.5 Å²	79.5	74%	0.736	43%	0.429	S	S	*	.	H	α-helix	trans	-58	-30.2	171.2	-68.2	-175.9	175.9	-178.7	-1.3	114	N330 A336	N330-R332 HydrophobicContact CB-CB 4.2Å; N330-R332 HydrophobicContact CB-CG 4.43Å; N330-R332 PolarHBondContact O-N 3.37Å; R332-A336 WeakPolarHBondContact O-CB 3.16Å; R332-A336 PolarHBondContact O-N 3.34Å
333	L	46.4	Very low	55.3	Low	43 Å²	43	79.4 Å²	79.4	23%	0.225	44%	0.435	C	S	.	.	H	α-helix	trans	-78.6	-35.8	-178.4	-94.6	117.1	0	0	0	113.6	I144 F324 N330 G331 A336	I144-L333 HydrophobicContact CG2-CD2 3.8Å; I144-L333 HydrophobicContact CG2-CG 4.33Å; F324-L333 HydrophobicContact CD1-CD2 3.72Å; F324-L333 HydrophobicContact CD2-CB 3.88Å; F324-L333 HydrophobicContact CD2-CD2 3.91Å; F324-L333 HydrophobicContact CE1-CD2 3.38Å; F324-L333 HydrophobicContact CE2-CB 4.17Å; F324-L333 HydrophobicContact CE2-CD2 3.55Å; F324-L333 HydrophobicContact CE2-CG 4.45Å; F324-L333 HydrophobicContact CG-CB 4.12Å; F324-L333 HydrophobicContact CG-CD2 3.99Å; F324-L333 HydrophobicContact CZ-CD2 3.29Å; N330-L333 PolarHBondContact O-N 3.06Å; N330-L333 VanDerWaalsContact O-N 3.1Å; G331-L333 VanDerWaalsContact C-N 3.27Å; G331-L333 PolarHBondContact O-N 3.25Å; L333-A336 PolarHBondContact O-N 2.87Å
334	F	51.2	Low	57	Low	97 Å²	97	80.5 Å²	80.5	43%	0.425	44%	0.441	S	S	.	.	H	α-helix	trans	-69.4	-42.3	176	-168.9	-91.7	0	0	0	110.9	S323 G331 A336 L337 Y338	S323-F334 WeakPolarHBondContact OG-CE2 3.49Å; G331-F334 PolarHBondContact O-N 3.06Å; F334-A336 PolarHBondContact O-N 2.94Å; F334-L337 PolarHBondContact O-N 3.28Å; F334-Y338 HydrophobicContact CD1-CD2 4.22Å; F334-Y338 AromaticContact CD2-CD2 3.93Å; F334-Y338 HydrophobicContact CD2-CD2 3.93Å; F334-Y338 HydrophobicContact CD2-CE2 4.2Å; F334-Y338 AromaticContact CE1-CD2 3.9Å; F334-Y338 HydrophobicContact CE1-CD2 3.9Å; F334-Y338 HydrophobicContact CE1-CG 4.06Å; F334-Y338 AromaticContact CE2-CD2 3.57Å; F334-Y338 HydrophobicContact CE2-CD2 3.57Å; F334-Y338 AromaticContact CE2-CE2 3.62Å; F334-Y338 HydrophobicContact CE2-CE2 3.62Å; F334-Y338 HydrophobicContact CE2-CG 4.43Å; F334-Y338 HydrophobicContact CG-CD2 4.24Å; F334-Y338 AromaticContact CZ-CD2 3.55Å; F334-Y338 HydrophobicContact CZ-CD2 3.55Å; F334-Y338 AromaticContact CZ-CE2 3.88Å; F334-Y338 HydrophobicContact CZ-CE2 3.88Å; F334-Y338 AromaticContact CZ-CG 3.97Å; F334-Y338 HydrophobicContact CZ-CG 3.97Å; F334-Y338 WeakPolarHBondContact O-CB 3Å; F334-Y338 PolarHBondContact O-N 2.73Å
335	E	52	Low	59.1	Low	70 Å²	70	80.7 Å²	80.7	33%	0.327	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-23.6	175.3	-76.3	-178.5	169.2	0	0	113.8	G331 Y338 R340	G331-E335 PolarHBondContact O-N 3.13Å; E335-Y338 CarbonylContact O-C 3.43Å; E335-R340 HydrophobicContact CG-CG 4.31Å; E335-R340 IonicContact OE1-CZ 2.57Å; E335-R340 IonicContact OE1-NE 2.69Å; E335-R340 PolarHBondContact OE1-NE 2.83Å; E335-R340 IonicContact OE1-NH2 2.8Å; E335-R340 PolarHBondContact OE1-NH2 3.42Å
336	A	53.1	Low	61.6	Low	0 Å²	0	77.1 Å²	77.1	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-85.1	-14.4	-177.6	0	0	0	0	0	114.1	H140 I144 R332 L333 F334	H140-A336 WeakPolarHBondContact CB-O 3.33Å; H140-A336 PolarHBondContact ND1-O 3.33Å; I144-A336 HydrophobicContact CD1-CB 3.31Å; I144-A336 HydrophobicContact CG1-CB 3.47Å; I144-A336 VanDerWaalsContact CG1-CB 3.47Å; R332-A336 WeakPolarHBondContact O-CB 3.16Å; R332-A336 PolarHBondContact O-N 3.34Å; L333-A336 PolarHBondContact O-N 2.87Å; F334-A336 PolarHBondContact O-N 2.94Å
337	L	58.8	Low	63.9	Low	1 Å²	1	67.6 Å²	67.6	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-116.2	-19.8	172.4	-62	-174.9	0	0	0	113.1	I144 F147 H151 Y155 F324 F334 P339	I144-L337 HydrophobicContact CD1-CD2 3.98Å; I144-L337 HydrophobicContact CD1-CG 4.05Å; F147-L337 HydrophobicContact CD1-CD2 4.16Å; F147-L337 HydrophobicContact CE1-CD2 3.59Å; F147-L337 HydrophobicContact CE2-CD2 4.48Å; F147-L337 HydrophobicContact CZ-CD2 3.77Å; H151-L337 HydrophobicContact CB-CD1 4.35Å; H151-L337 WeakPolarHBondContact CD2-CD1 3.49Å; H151-L337 WeakPolarHBondContact NE2-CD1 3.23Å; Y155-L337 HydrophobicContact CE2-CD2 4Å; Y155-L337 WeakPolarHBondContact OH-CD2 3.32Å; F324-L337 HydrophobicContact CD2-CD1 4.34Å; F324-L337 HydrophobicContact CE2-CD1 3.43Å; F324-L337 VanDerWaalsContact CE2-CD1 3.43Å; F324-L337 HydrophobicContact CE2-CG 4.13Å; F324-L337 HydrophobicContact CZ-CD1 4.09Å; F334-L337 PolarHBondContact O-N 3.28Å; L337-P339 VanDerWaalsContact O-CD 3.24Å; L337-P339 WeakPolarHBondContact O-CD 3.4Å
338	Y	69	Low	66.1	Low	37 Å²	37	70 Å²	70	15%	0.145	37%	0.368	C	S	.	.	S	Bend	trans	-111.6	79.8	165.1	-64.8	-83.9	0	0	0	108.2	P321 F334 E335 R340	P321-Y338 WeakPolarHBondContact CA-OH 3.28Å; P321-Y338 HydrophobicContact CB-CE1 4.13Å; P321-Y338 HydrophobicContact CB-CE2 4.37Å; P321-Y338 WeakPolarHBondContact CB-OH 3.31Å; P321-Y338 WeakPolarHBondContact CD-OH 3.43Å; P321-Y338 HydrophobicContact CG-CE1 3.7Å; P321-Y338 WeakPolarHBondContact CG-OH 3.42Å; P321-Y338 PolarHBondContact O-OH 3.27Å; F334-Y338 HydrophobicContact CD1-CD2 4.22Å; F334-Y338 AromaticContact CD2-CD2 3.93Å; F334-Y338 HydrophobicContact CD2-CD2 3.93Å; F334-Y338 HydrophobicContact CD2-CE2 4.2Å; F334-Y338 AromaticContact CE1-CD2 3.9Å; F334-Y338 HydrophobicContact CE1-CD2 3.9Å; F334-Y338 HydrophobicContact CE1-CG 4.06Å; F334-Y338 AromaticContact CE2-CD2 3.57Å; F334-Y338 HydrophobicContact CE2-CD2 3.57Å; F334-Y338 AromaticContact CE2-CE2 3.62Å; F334-Y338 HydrophobicContact CE2-CE2 3.62Å; F334-Y338 HydrophobicContact CE2-CG 4.43Å; F334-Y338 HydrophobicContact CG-CD2 4.24Å; F334-Y338 AromaticContact CZ-CD2 3.55Å; F334-Y338 HydrophobicContact CZ-CD2 3.55Å; F334-Y338 AromaticContact CZ-CE2 3.88Å; F334-Y338 HydrophobicContact CZ-CE2 3.88Å; F334-Y338 AromaticContact CZ-CG 3.97Å; F334-Y338 HydrophobicContact CZ-CG 3.97Å; F334-Y338 WeakPolarHBondContact O-CB 3Å; F334-Y338 PolarHBondContact O-N 2.73Å; E335-Y338 CarbonylContact O-C 3.43Å; Y338-R340 PolarHBondContact O-N 3.2Å
339	P	68.8	Low	68.2	Low	5 Å²	5	65.8 Å²	65.8	3%	0.032	35%	0.349	C	S	.	.			trans	-52.1	118.1	176.5	16	-25.8	0	0	0	108.5	I183 L337 V341 H349	I183-P339 HydrophobicContact CG2-CG 4.15Å; L337-P339 VanDerWaalsContact O-CD 3.24Å; L337-P339 WeakPolarHBondContact O-CD 3.4Å; P339-V341 WeakPolarHBondContact O-CG2 3.32Å; P339-V341 PolarHBondContact O-N 3.46Å; P339-H349 VanDerWaalsContact CB-CE1 3.47Å; P339-H349 WeakPolarHBondContact CB-CE1 3.08Å; P339-H349 VanDerWaalsContact CB-NE2 3.27Å; P339-H349 WeakPolarHBondContact CB-NE2 3.4Å
340	R	75.4	Confident	70.2	Confident	157 Å²	157	62.4 Å²	62.4	59%	0.592	32%	0.32	S	S	*	.			trans	-64.8	122.1	173	-71.3	-166.3	-160.6	-153.1	12.1	107.9	E335 Y338 R348 H349	E335-R340 HydrophobicContact CG-CG 4.31Å; E335-R340 IonicContact OE1-CZ 2.57Å; E335-R340 IonicContact OE1-NE 2.69Å; E335-R340 PolarHBondContact OE1-NE 2.83Å; E335-R340 IonicContact OE1-NH2 2.8Å; E335-R340 PolarHBondContact OE1-NH2 3.42Å; Y338-R340 PolarHBondContact O-N 3.2Å; R340-R348 WeakPolarHBondContact O-CD 3.08Å; R340-H349 PolarHBondContact O-NE2 2.98Å
341	V	80	Confident	71.7	Confident	38 Å²	38	62.7 Å²	62.7	23%	0.23	33%	0.325	C	S	.	.			trans	-117	109.7	-179	171.9	0	0	0	0	106.6	S133 P339 G343 D346	S133-V341 WeakPolarHBondContact OG-CG1 3.21Å; S133-V341 WeakPolarHBondContact OG-CG2 3.2Å; P339-V341 WeakPolarHBondContact O-CG2 3.32Å; P339-V341 PolarHBondContact O-N 3.46Å; V341-G343 VanDerWaalsContact C-N 3.31Å; V341-G343 WeakPolarHBondContact CG1-O 3.37Å; V341-G343 PolarHBondContact O-N 3.27Å; V341-D346 WeakPolarHBondContact CA-OD2 3.48Å; V341-D346 HydrophobicContact CG1-CB 4.02Å
342	D	84.7	Confident	72.5	Confident	112 Å²	112	68.5 Å²	68.5	60%	0.599	34%	0.337	S	S	*	.			trans	-89.8	72.4	176.9	-62.8	-20	0	0	0	109.4	D346 R348	D342-D346 PolarHBondContact N-OD2 3.21Å; D342-R348 VanDerWaalsContact CB-NH2 3.26Å; D342-R348 IonicContact OD1-NH1 3.59Å; D342-R348 IonicContact OD2-CZ 3.63Å; D342-R348 IonicContact OD2-NH1 3.16Å; D342-R348 PolarHBondContact OD2-NH1 3.38Å; D342-R348 IonicContact OD2-NH2 3.14Å; D342-R348 PolarHBondContact OD2-NH2 3.45Å
343	G	88.6	Confident	73.1	Confident	34 Å²	34	65.7 Å²	65.7	35%	0.351	33%	0.332	S	S	.	.	S	Bend	trans	95.9	172.1	175.7	0	0	0	0	0	114.8	V341 A345 D346	V341-G343 VanDerWaalsContact C-N 3.31Å; V341-G343 WeakPolarHBondContact CG1-O 3.37Å; V341-G343 PolarHBondContact O-N 3.27Å; G343-A345 PolarHBondContact O-N 2.78Å; G343-D346 PolarHBondContact O-N 3.38Å
344	P	88.1	Confident	74.2	Confident	92 Å²	92	65.7 Å²	65.7	60%	0.597	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-12.4	-166.8	29.6	-37.3	0	0	0	114.7	Y77 F131	Y77-P344 HydrophobicContact CD2-CB 3.73Å; Y77-P344 HydrophobicContact CD2-CG 3.97Å; Y77-P344 HydrophobicContact CE2-CB 3.97Å; Y77-P344 HydrophobicContact CE2-CG 3.66Å; F131-P344 WeakPolarHBondContact CD1-O 3.3Å
345	A	90.5	Very high	75.2	Confident	34 Å²	34	69.4 Å²	69.4	28%	0.281	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	7.7	-178.7	0	0	0	0	0	113.1	L68 Y77 G343 T347	L68-A345 HydrophobicContact CD2-CB 4.22Å; Y77-A345 HydrophobicContact CD1-CB 3.8Å; Y77-A345 HydrophobicContact CE1-CB 3.4Å; Y77-A345 HydrophobicContact CE2-CB 4.27Å; Y77-A345 HydrophobicContact CG-CB 4.39Å; G343-A345 PolarHBondContact O-N 2.78Å; A345-T347 PolarHBondContact O-N 3.37Å
346	D	90.6	Very high	76.5	Confident	19 Å²	19	70.2 Å²	70.2	10%	0.102	36%	0.356	C	S	.	.			trans	-66.2	128	-174.5	-170.7	-3.5	0	0	0	111.3	F131 V341 D342 G343 R348	F131-D346 VanDerWaalsContact CZ-O 3.31Å; F131-D346 WeakPolarHBondContact CZ-O 3.45Å; V341-D346 WeakPolarHBondContact CA-OD2 3.48Å; V341-D346 HydrophobicContact CG1-CB 4.02Å; D342-D346 PolarHBondContact N-OD2 3.21Å; G343-D346 PolarHBondContact O-N 3.38Å; D346-R348 WeakPolarHBondContact OD1-CB 3.29Å; D346-R348 IonicContact OD1-CZ 3.44Å; D346-R348 PolarHBondContact OD1-N 3.02Å; D346-R348 IonicContact OD1-NE 3.01Å; D346-R348 PolarHBondContact OD1-NE 3.33Å; D346-R348 IonicContact OD1-NH2 3.95Å; D346-R348 IonicContact OD2-CZ 2.68Å; D346-R348 IonicContact OD2-NE 2.64Å; D346-R348 PolarHBondContact OD2-NE 3.28Å; D346-R348 IonicContact OD2-NH2 3.06Å; D346-R348 PolarHBondContact OD2-NH2 3.14Å
347	T	89.2	Confident	77.8	Confident	21 Å²	21	74.7 Å²	74.7	13%	0.129	39%	0.385	C	S	.	.			trans	-118.2	13.3	-178.3	58.6	0	0	0	0	113.4	K56 L58 L68 F131 A345 H349 F350	K56-T347 HydrophobicContact CD-CG2 4.48Å; K56-T347 PolarHBondContact NZ-OG1 2.81Å; K56-T347 VanDerWaalsContact NZ-OG1 3.1Å; L58-T347 HydrophobicContact CD2-CG2 3.51Å; L68-T347 HydrophobicContact CD2-CG2 3.72Å; F131-T347 HydrophobicContact CZ-CG2 4.08Å; A345-T347 PolarHBondContact O-N 3.37Å; T347-H349 PolarHBondContact O-N 2.93Å; T347-H349 VanDerWaalsContact O-N 3.08Å; T347-F350 WeakPolarHBondContact O-CB 3.43Å; T347-F350 PolarHBondContact O-N 3.2Å
348	R	87.9	Confident	78.9	Confident	122 Å²	122	77.1 Å²	77.1	46%	0.46	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.7	-175.5	77.3	-177.4	63.3	-171.1	-15.1	115.4	R340 D342 D346	R340-R348 WeakPolarHBondContact O-CD 3.08Å; D342-R348 VanDerWaalsContact CB-NH2 3.26Å; D342-R348 IonicContact OD1-NH1 3.59Å; D342-R348 IonicContact OD2-CZ 3.63Å; D342-R348 IonicContact OD2-NH1 3.16Å; D342-R348 PolarHBondContact OD2-NH1 3.38Å; D342-R348 IonicContact OD2-NH2 3.14Å; D342-R348 PolarHBondContact OD2-NH2 3.45Å; D346-R348 WeakPolarHBondContact OD1-CB 3.29Å; D346-R348 IonicContact OD1-CZ 3.44Å; D346-R348 PolarHBondContact OD1-N 3.02Å; D346-R348 IonicContact OD1-NE 3.01Å; D346-R348 PolarHBondContact OD1-NE 3.33Å; D346-R348 IonicContact OD1-NH2 3.95Å; D346-R348 IonicContact OD2-CZ 2.68Å; D346-R348 IonicContact OD2-NE 2.64Å; D346-R348 PolarHBondContact OD2-NE 3.28Å; D346-R348 IonicContact OD2-NH2 3.06Å; D346-R348 PolarHBondContact OD2-NH2 3.14Å
349	H	84.4	Confident	79.6	Confident	33 Å²	33	82.1 Å²	82.1	15%	0.153	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	1.2	-180	-55.5	-69	0	0	0	112.7	S133 G134 P339 R340 T347	S133-H349 PolarHBondContact O-CD2 3.08Å; G134-H349 WeakPolarHBondContact O-CB 3.42Å; P339-H349 VanDerWaalsContact CB-CE1 3.47Å; P339-H349 WeakPolarHBondContact CB-CE1 3.08Å; P339-H349 VanDerWaalsContact CB-NE2 3.27Å; P339-H349 WeakPolarHBondContact CB-NE2 3.4Å; R340-H349 PolarHBondContact O-NE2 2.98Å; T347-H349 PolarHBondContact O-N 2.93Å; T347-H349 VanDerWaalsContact O-N 3.08Å
350	F	79.8	Confident	80.5	Confident	38 Å²	38	84.5 Å²	84.5	17%	0.167	43%	0.434	C	S	.	.	S	Bend	trans	-94	150.2	169.2	-66.3	-96.4	0	0	0	109.1	L58 F131 I132 T347	L58-F350 HydrophobicContact CB-CD1 3.95Å; L58-F350 HydrophobicContact CB-CE1 4.21Å; L58-F350 HydrophobicContact CD1-CE1 4.28Å; L58-F350 HydrophobicContact CD1-CZ 4.44Å; L58-F350 HydrophobicContact CD2-CD1 4.08Å; L58-F350 HydrophobicContact CD2-CD2 4.1Å; L58-F350 HydrophobicContact CD2-CE1 4.32Å; L58-F350 HydrophobicContact CD2-CE2 4.36Å; L58-F350 HydrophobicContact CD2-CG 3.96Å; L58-F350 HydrophobicContact CD2-CZ 4.46Å; L58-F350 HydrophobicContact CG-CD1 4.47Å; F131-F350 HydrophobicContact CD2-CZ 4.37Å; F131-F350 HydrophobicContact CE2-CD2 4.43Å; F131-F350 AromaticContact CE2-CE2 3.48Å; F131-F350 HydrophobicContact CE2-CE2 3.48Å; F131-F350 VanDerWaalsContact CE2-CE2 3.48Å; F131-F350 AromaticContact CE2-CZ 3.55Å; F131-F350 HydrophobicContact CE2-CZ 3.55Å; F131-F350 AromaticContact CZ-CE2 3.73Å; F131-F350 HydrophobicContact CZ-CE2 3.73Å; F131-F350 HydrophobicContact CZ-CZ 4.27Å; I132-F350 VanDerWaalsContact O-CZ 3.28Å; I132-F350 WeakPolarHBondContact O-CZ 3.45Å; T347-F350 WeakPolarHBondContact O-CB 3.43Å; T347-F350 PolarHBondContact O-N 3.2Å
351	V	71.4	Confident	81.1	Confident	108 Å²	108	83.4 Å²	83.4	66%	0.655	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-54.7	144.3	-179.4	-155.8	0	0	0	0	110.3
352	E	64.2	Low	81.7	Confident	183 Å²	183	84.8 Å²	84.8	86%	0.855	45%	0.45	S	S	*	.	S	Bend	trans	-56.1	149.5	-176.4	-88.4	-179.5	158.8	0	0	113.4	V354	E352-V354 PolarHBondContact O-N 3.3Å
353	E	60.5	Low	82.2	Confident	135 Å²	135	80.3 Å²	80.3	63%	0.631	43%	0.429	S	S	*	.			trans	-22.1	103.8	-165.9	-67.2	-177.4	158.3	0	0	117	Q355	E353-Q355 HydrophobicContact CB-CG 4.44Å; E353-Q355 PolarHBondContact O-N 2.65Å
354	V	70.3	Confident	82.4	Confident	43 Å²	43	83.6 Å²	83.6	26%	0.261	45%	0.453	S	S	.	.			trans	-66.8	101.5	154.3	-177.7	0	0	0	0	107.4	T57 T60 E352 E356	T57-V354 HydrophobicContact CG2-CB 3.84Å; T57-V354 HydrophobicContact CG2-CG1 3.72Å; T57-V354 HydrophobicContact CG2-CG2 4.35Å; T60-V354 HydrophobicContact CG2-CG1 3.8Å; E352-V354 PolarHBondContact O-N 3.3Å; V354-E356 HydrophobicContact CG1-CB 4.12Å; V354-E356 HydrophobicContact CG1-CG 3.92Å; V354-E356 PolarHBondContact O-N 2.72Å
355	Q	72.2	Confident	82.7	Confident	175 Å²	175	83.9 Å²	83.9	82%	0.818	45%	0.453	S	S	*	.			trans	-73.9	60.2	174.8	-68.3	-168.2	-3.7	0	0	111.3	E353	E353-Q355 HydrophobicContact CB-CG 4.44Å; E353-Q355 PolarHBondContact O-N 2.65Å
356	E	78.6	Confident	82.8	Confident	88 Å²	88	86.2 Å²	86.2	41%	0.411	47%	0.465	S	S	.	.			trans	-103.7	137.4	166.1	-80.1	-157.3	174.4	0	0	110.6	R65 V354	R65-E356 WeakPolarHBondContact CD-OE2 3.43Å; R65-E356 IonicContact CZ-OE2 2.95Å; R65-E356 IonicContact NE-OE2 2.82Å; R65-E356 IonicContact NH1-OE2 3.42Å; R65-E356 PolarHBondContact NH1-OE2 3.15Å; V354-E356 HydrophobicContact CG1-CB 4.12Å; V354-E356 HydrophobicContact CG1-CG 3.92Å; V354-E356 PolarHBondContact O-N 2.72Å
357	P	81.1	Confident	82.9	Confident	94 Å²	94	87.4 Å²	87.4	61%	0.61	47%	0.47	S	S	*	.			trans	-57.5	140	176.2	-21.6	31.8	0	0	0	111.5	R65 E359	R65-P357 VanDerWaalsContact CZ-O 3.23Å; R65-P357 PolarHBondContact NH1-O 3.37Å; R65-P357 PolarHBondContact NH2-O 3.5Å; P357-E359 PolarHBondContact O-N 3.49Å
358	T	81.7	Confident	83.2	Confident	51 Å²	51	89 Å²	89	31%	0.313	48%	0.477	S	S	.	.	S	Bend	trans	-70.6	-23.7	176.2	53.7	0	0	0	0	112.6	R54 I55 R65 M67	R54-T358 WeakPolarHBondContact CD-O 3.24Å; R54-T358 PolarHBondContact NE-O 3.25Å; I55-T358 WeakPolarHBondContact O-CG2 3.25Å; R65-T358 PolarHBondContact NH2-O 2.8Å; M67-T358 HydrophobicContact CE-CG2 3.72Å
359	E	84.7	Confident	83.3	Confident	142 Å²	142	86.6 Å²	86.6	66%	0.664	47%	0.472	S	S	*	.			trans	-90.6	148.2	171.3	-59.5	-156.5	157.8	0	0	111.7	P357	P357-E359 PolarHBondContact O-N 3.49Å
360	F	87.4	Confident	83.8	Confident	56 Å²	56	93 Å²	93	25%	0.246	50%	0.502	C	S	.	.			trans	-151.4	154	178.5	51.9	-84.5	0	0	0	108.8	L49 I82 N124 Y126 I362	L49-F360 HydrophobicContact CD1-CZ 4.34Å; L49-F360 HydrophobicContact CD2-CE2 4.27Å; L49-F360 HydrophobicContact CD2-CZ 3.86Å; I82-F360 HydrophobicContact CD1-CE1 3.83Å; I82-F360 HydrophobicContact CD1-CZ 3.99Å; I82-F360 HydrophobicContact CG2-CE2 4.48Å; I82-F360 HydrophobicContact CG2-CZ 4.28Å; N124-F360 WeakPolarHBondContact ND2-CE2 3.12Å; Y126-F360 HydrophobicContact CE1-CE2 4.43Å; Y126-F360 AromaticContact CE1-CZ 4Å; Y126-F360 HydrophobicContact CE1-CZ 4Å; Y126-F360 VanDerWaalsContact OH-CE2 3.25Å; Y126-F360 WeakPolarHBondContact OH-CE2 3.43Å; F360-I362 HydrophobicContact CD2-CG1 4.46Å; F360-I362 HydrophobicContact CE2-CG1 4.27Å
361	V	87.8	Confident	84.6	Confident	133 Å²	133	94.6 Å²	94.6	81%	0.806	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-79.8	130.5	-175.4	-178.8	0	0	0	0	109.9
362	I	93.1	Very high	85.8	Confident	67 Å²	67	89.4 Å²	89.4	34%	0.344	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-101.8	131.3	169.3	-60.4	166.2	0	0	0	107.4	L49 D121 N122 F360	L49-I362 HydrophobicContact CD2-CD1 3.71Å; D121-I362 HydrophobicContact CB-CG2 4.23Å; D121-I362 VanDerWaalsContact OD2-CD1 3.23Å; D121-I362 WeakPolarHBondContact OD2-CD1 3.46Å; D121-I362 WeakPolarHBondContact OD2-CG1 3.41Å; N122-I362 HydrophobicContact CB-CG2 3.98Å; F360-I362 HydrophobicContact CD2-CG1 4.46Å; F360-I362 HydrophobicContact CE2-CG1 4.27Å
363	A	93.8	Very high	87.2	Confident	19 Å²	19	85 Å²	85	16%	0.157	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-61.3	146	179.2	0	0	0	0	0	111.5	N122 S123 T365 Q367	N122-A363 HydrophobicContact CB-CB 4.34Å; N122-A363 WeakPolarHBondContact CB-O 3.41Å; N122-A363 PolarHBondContact ND2-O 3.45Å; S123-A363 VanDerWaalsContact OG-CB 3.24Å; S123-A363 WeakPolarHBondContact OG-CB 3.33Å; S123-A363 PolarHBondContact OG-N 3.34Å; A363-T365 VanDerWaalsContact C-N 3.27Å; A363-T365 PolarHBondContact O-N 2.94Å; A363-Q367 HydrophobicContact CB-CG 4.06Å; A363-Q367 VanDerWaalsContact CB-NE2 3.34Å
364	A	93.8	Very high	88.7	Confident	103 Å²	103	84.7 Å²	84.7	85%	0.851	46%	0.464	S	S	*	.	S	Bend	trans	-68.4	-26.3	178.1	0	0	0	0	0	113.2	N122	N122-A364 PolarHBondContact ND2-O 2.92Å
365	T	93.6	Very high	89.9	Confident	97 Å²	97	82.6 Å²	82.6	60%	0.595	45%	0.451	S	S	*	.	S	Bend	trans	-116.5	143.7	-179.2	55.2	0	0	0	0	111	A363 Q367	A363-T365 VanDerWaalsContact C-N 3.27Å; A363-T365 PolarHBondContact O-N 2.94Å; T365-Q367 PolarHBondContact O-N 3.08Å
366	P	93.2	Very high	90.8	Very high	83 Å²	83	78 Å²	78	54%	0.539	43%	0.433	S	S	.	.			trans	-54.6	127.6	176	-24.6	32.4	0	0	0	112.2	N122 E369	N122-P366 WeakPolarHBondContact OD1-CA 3.48Å; N122-P366 WeakPolarHBondContact OD1-CG 3.19Å; P366-E369 HydrophobicContact CB-CB 4.38Å
367	Q	93.2	Very high	91.4	Very high	45 Å²	45	77.5 Å²	77.5	21%	0.21	43%	0.434	C	S	.	.			trans	-103.7	135.6	174.7	-55.2	179	-22	0	0	109.6	K85 N122 A363 T365 E369	K85-Q367 WeakPolarHBondContact CD-O 3.22Å; K85-Q367 PolarHBondContact NZ-O 2.64Å; K85-Q367 VanDerWaalsContact NZ-O 3.17Å; N122-Q367 WeakPolarHBondContact O-CA 3.38Å; N122-Q367 WeakPolarHBondContact O-CB 3.43Å; N122-Q367 WeakPolarHBondContact O-CG 3.47Å; N122-Q367 PolarHBondContact O-N 2.97Å; A363-Q367 HydrophobicContact CB-CG 4.06Å; A363-Q367 VanDerWaalsContact CB-NE2 3.34Å; T365-Q367 PolarHBondContact O-N 3.08Å; Q367-E369 PolarHBondContact O-N 3.25Å
368	L	93.7	Very high	92	Very high	54 Å²	54	76.6 Å²	76.6	28%	0.283	42%	0.424	S	S	.	.	S	Bend	trans	55.6	29	168.1	-56.6	162.3	0	0	0	113.8	K85 Q86 V89 E370 L371 F372	K85-L368 HydrophobicContact CB-CD1 3.93Å; K85-L368 WeakPolarHBondContact O-CD1 3.29Å; Q86-L368 HydrophobicContact CB-CD1 4.44Å; Q86-L368 HydrophobicContact CG-CD1 4.05Å; V89-L368 HydrophobicContact CB-CD1 4.28Å; V89-L368 HydrophobicContact CG2-CD1 3.76Å; V89-L368 HydrophobicContact CG2-CD2 4.35Å; V89-L368 HydrophobicContact CG2-CG 4.49Å; L368-E370 VanDerWaalsContact C-N 3.26Å; L368-E370 PolarHBondContact O-N 2.92Å; L368-L371 HydrophobicContact CB-CD1 4.42Å; L368-L371 HydrophobicContact CD2-CD1 4.07Å; L368-L371 PolarHBondContact O-N 2.7Å; L368-F372 HydrophobicContact CB-CD2 4.2Å; L368-F372 HydrophobicContact CB-CE2 4.11Å; L368-F372 WeakPolarHBondContact O-CD2 3.47Å
369	E	91.6	Very high	92.6	Very high	72 Å²	72	78.1 Å²	78.1	34%	0.336	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-61.4	-37.1	-169.1	-163.6	57.4	-149.4	0	0	112.3	K85 K120 P366 Q367 L371 F372 V373	K85-E369 IonicContact NZ-OE2 3.72Å; K85-E369 PolarHBondContact NZ-OE2 2.86Å; K120-E369 VanDerWaalsContact CE-OE1 3.24Å; K120-E369 WeakPolarHBondContact CE-OE1 3.23Å; K120-E369 IonicContact NZ-OE1 2.7Å; K120-E369 PolarHBondContact NZ-OE1 3.21Å; P366-E369 HydrophobicContact CB-CB 4.38Å; Q367-E369 PolarHBondContact O-N 3.25Å; E369-L371 PolarHBondContact O-N 3.1Å; E369-F372 CarbonylContact O-C 3.54Å; E369-F372 PolarHBondContact O-N 2.76Å; E369-F372 VanDerWaalsContact O-N 3.13Å; E369-V373 WeakPolarHBondContact O-CG2 2.96Å; E369-V373 PolarHBondContact O-N 3.42Å; E369-V373 VanDerWaalsContact O-N 3.1Å
370	E	94.8	Very high	93.1	Very high	168 Å²	168	74.1 Å²	74.1	79%	0.785	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-59.3	-29.6	176.7	66.5	-166.7	-179.1	0	0	113.9	L368	L368-E370 VanDerWaalsContact C-N 3.26Å; L368-E370 PolarHBondContact O-N 2.92Å
371	L	95.9	Very high	93.5	Very high	70 Å²	70	75.3 Å²	75.3	37%	0.366	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-83.4	-20.1	-180	-63.9	178	0	0	0	112.9	V89 V94 L368 E369	V89-L371 HydrophobicContact CG1-CD1 4.34Å; V89-L371 HydrophobicContact CG2-CD1 3.56Å; V94-L371 HydrophobicContact CG1-CB 4.46Å; L368-L371 HydrophobicContact CB-CD1 4.42Å; L368-L371 HydrophobicContact CD2-CD1 4.07Å; L368-L371 PolarHBondContact O-N 2.7Å; E369-L371 PolarHBondContact O-N 3.1Å
372	F	95.8	Very high	93.9	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	40%	0.401	C	S	.	.	S	Bend	trans	-122.7	22.7	-173.7	-59.8	-70	0	0	0	112.3	K85 V88 V89 V94 L98 K120 L125 L368 E369 E374 F375	K85-F372 HydrophobicContact CB-CD2 4.26Å; K85-F372 HydrophobicContact CB-CE2 3.8Å; K85-F372 HydrophobicContact CD-CD2 3.99Å; K85-F372 HydrophobicContact CD-CE2 4.38Å; K85-F372 HydrophobicContact CG-CD2 3.87Å; K85-F372 HydrophobicContact CG-CE2 3.87Å; V88-F372 HydrophobicContact CB-CZ 4.13Å; V88-F372 HydrophobicContact CG1-CE1 3.92Å; V88-F372 HydrophobicContact CG1-CZ 3.72Å; V89-F372 HydrophobicContact CG2-CE2 3.97Å; V89-F372 HydrophobicContact CG2-CZ 4Å; V94-F372 HydrophobicContact CB-CE1 4.43Å; V94-F372 HydrophobicContact CG1-CD1 4.47Å; V94-F372 HydrophobicContact CG1-CE1 3.93Å; V94-F372 HydrophobicContact CG1-CZ 4.39Å; V94-F372 HydrophobicContact CG2-CE1 4.29Å; V94-F372 HydrophobicContact CG2-CZ 4.02Å; L98-F372 HydrophobicContact CD2-CD1 4.34Å; K120-F372 PolarHBondContact NZ-O 3.08Å; L125-F372 HydrophobicContact CD1-CD1 3.57Å; L125-F372 HydrophobicContact CD1-CE1 3.54Å; L125-F372 HydrophobicContact CD1-CG 4.15Å; L125-F372 HydrophobicContact CD1-CZ 4.11Å; L125-F372 HydrophobicContact CD2-CB 3.96Å; L125-F372 HydrophobicContact CD2-CD1 4.11Å; L125-F372 HydrophobicContact CD2-CD2 4.44Å; L125-F372 HydrophobicContact CD2-CG 3.92Å; L125-F372 HydrophobicContact CG-CD1 4.44Å; L368-F372 HydrophobicContact CB-CD2 4.2Å; L368-F372 HydrophobicContact CB-CE2 4.11Å; L368-F372 WeakPolarHBondContact O-CD2 3.47Å; E369-F372 CarbonylContact O-C 3.54Å; E369-F372 PolarHBondContact O-N 2.76Å; E369-F372 VanDerWaalsContact O-N 3.13Å; F372-E374 PolarHBondContact O-N 3.3Å; F372-F375 HydrophobicContact CB-CB 4.19Å; F372-F375 VanDerWaalsContact O-CB 3.32Å; F372-F375 WeakPolarHBondContact O-CB 3.42Å; F372-F375 PolarHBondContact O-N 3.02Å; F372-F375 VanDerWaalsContact O-N 3.08Å
373	V	94.2	Very high	93.9	Very high	89 Å²	89	71.5 Å²	71.5	54%	0.539	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41.2	177.5	178.1	0	0	0	0	111.3	Q44 E369 F375	Q44-V373 PolarHBondContact NE2-O 2.93Å; E369-V373 WeakPolarHBondContact O-CG2 2.96Å; E369-V373 PolarHBondContact O-N 3.42Å; E369-V373 VanDerWaalsContact O-N 3.1Å; V373-F375 VanDerWaalsContact C-N 3.29Å; V373-F375 PolarHBondContact O-N 3.15Å
374	E	92.3	Very high	93.9	Very high	129 Å²	129	75.8 Å²	75.8	60%	0.603	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.4	-178.9	-63.4	-168.4	173	0	0	114.4	Q44 L98 F372	Q44-E374 VanDerWaalsContact NE2-CA 3.32Å; Q44-E374 PolarHBondContact NE2-O 3Å; L98-E374 HydrophobicContact CD2-CB 4.5Å; F372-E374 PolarHBondContact O-N 3.3Å
375	F	95	Very high	93.9	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.387	C	S	.	.			trans	-64.9	0	-177.5	-168.8	-83.9	0	0	0	112.2	T97 L98 K101 F119 K120 L125 M127 F372 V373	T97-F375 HydrophobicContact CG2-CD2 4.47Å; T97-F375 HydrophobicContact CG2-CE2 4.03Å; L98-F375 HydrophobicContact CD2-CB 3.94Å; L98-F375 HydrophobicContact CD2-CD2 4.16Å; K101-F375 HydrophobicContact CB-CD2 4.34Å; K101-F375 HydrophobicContact CB-CE2 3.84Å; K101-F375 HydrophobicContact CB-CZ 4.29Å; K101-F375 VanDerWaalsContact CD-OXT 3.28Å; K101-F375 WeakPolarHBondContact CD-OXT 3.48Å; K101-F375 WeakPolarHBondContact CE-OXT 3.38Å; K101-F375 HydrophobicContact CG-CD2 4.36Å; K101-F375 HydrophobicContact CG-CE1 4.43Å; K101-F375 HydrophobicContact CG-CE2 3.93Å; K101-F375 HydrophobicContact CG-CZ 3.96Å; K101-F375 PolarHBondContact NZ-OXT 2.91Å; F119-F375 WeakPolarHBondContact O-CE1 3.39Å; K120-F375 HydrophobicContact CB-CD1 4.31Å; K120-F375 HydrophobicContact CD-CB 4.45Å; L125-F375 HydrophobicContact CB-CD1 4.28Å; L125-F375 HydrophobicContact CB-CD2 4.2Å; L125-F375 HydrophobicContact CB-CE1 3.86Å; L125-F375 HydrophobicContact CB-CE2 3.77Å; L125-F375 HydrophobicContact CB-CG 4.45Å; L125-F375 HydrophobicContact CB-CZ 3.59Å; L125-F375 HydrophobicContact CD1-CD2 3.88Å; L125-F375 HydrophobicContact CD1-CE2 3.96Å; L125-F375 HydrophobicContact CD1-CG 4.47Å; L125-F375 HydrophobicContact CD2-CB 4.23Å; L125-F375 HydrophobicContact CD2-CD1 4.01Å; L125-F375 HydrophobicContact CD2-CD2 4.06Å; L125-F375 HydrophobicContact CD2-CE1 4.44Å; L125-F375 HydrophobicContact CD2-CE2 4.49Å; L125-F375 HydrophobicContact CD2-CG 3.81Å; L125-F375 HydrophobicContact CG-CD2 4.27Å; L125-F375 HydrophobicContact CG-CE2 4.29Å; L125-F375 HydrophobicContact CG-CG 4.46Å; M127-F375 HydrophobicContact CG-CZ 3.86Å; F372-F375 HydrophobicContact CB-CB 4.19Å; F372-F375 VanDerWaalsContact O-CB 3.32Å; F372-F375 WeakPolarHBondContact O-CB 3.42Å; F372-F375 PolarHBondContact O-N 3.02Å; F372-F375 VanDerWaalsContact O-N 3.08Å; V373-F375 VanDerWaalsContact C-N 3.29Å; V373-F375 PolarHBondContact O-N 3.15Å

Retrieved 375 of 375 residues in 2133.8 ms (Link to these results)

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