A0A087WPD1_MOUSE Loading...

Regulator of G-protein signaling 6

AlphaFold DB , UniProt , Accession A0A087WPD1, Species MOUSE (Mus musculus, Mouse), Gene Rgs6, Length 505 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	29.8	Very low	250 Å²	250	146 Å²	146	100%	1.232	86%	0.857	S	S	*	*				0	146	0	-77.2	-161.1	-129.5	0	0	107.6
2	A	29.6	Very low	29.8	Very low	94 Å²	94	139.2 Å²	139.2	78%	0.777	84%	0.84	S	S	*	*			trans	-70.6	155.3	-169	0	0	0	0	0	113.6
3	Q	35.2	Very low	30.2	Very low	203 Å²	203	140.8 Å²	140.8	95%	0.949	84%	0.839	S	S	*	*			trans	13.4	103.9	152.6	-69.8	177.2	-15.5	0	0	116.2
4	G	26.2	Very low	30.6	Very low	72 Å²	72	136.1 Å²	136.1	74%	0.742	82%	0.823	S	S	*	*			trans	-103.7	125	156.1	0	0	0	0	0	108.7
5	S	25.6	Very low	31.3	Very low	110 Å²	110	132.5 Å²	132.5	77%	0.769	80%	0.798	S	S	*	*			trans	-25.3	134.9	169.3	44.7	0	0	0	0	115.7	D7	S5-D7 PolarHBondContact O-N 2.99Å
6	G	34.2	Very low	32.2	Very low	82 Å²	82	130.5 Å²	130.5	85%	0.845	79%	0.789	S	S	*	*			trans	-62	106.9	168.5	0	0	0	0	0	110.9
7	D	25.2	Very low	33	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	77%	0.768	S	S	*	*			trans	-112.7	115.2	151.2	-92	-28.2	0	0	0	106.8	S5 R9	S5-D7 PolarHBondContact O-N 2.99Å; D7-R9 PolarHBondContact O-N 3.39Å
8	Q	33.5	Very low	34	Very low	200 Å²	200	130.1 Å²	130.1	94%	0.935	77%	0.767	S	S	*	*			trans	-58.5	90.8	159.5	-75	175.6	5.2	0	0	107	A10	Q8-A10 PolarHBondContact O-N 3.42Å
9	R	28.3	Very low	35.4	Very low	230 Å²	230	125.7 Å²	125.7	87%	0.868	74%	0.743	S	S	*	*			trans	-67.8	103.7	164.3	-83.9	-174.2	176.2	-179	-1.3	106.5	D7 V11	D7-R9 PolarHBondContact O-N 3.39Å; R9-V11 PolarHBondContact O-N 2.99Å
10	A	27.9	Very low	37	Very low	89 Å²	89	120.4 Å²	120.4	74%	0.736	71%	0.713	S	S	*	*			trans	-40.6	127.7	156	0	0	0	0	0	107.9	Q8 G12	Q8-A10 PolarHBondContact O-N 3.42Å; A10-G12 VanDerWaalsContact C-N 3.28Å; A10-G12 PolarHBondContact O-N 3.48Å
11	V	34	Very low	38.7	Very low	135 Å²	135	116.5 Å²	116.5	82%	0.818	69%	0.691	S	S	*	*			trans	-53.8	99.6	171.1	175.9	0	0	0	0	106.1	R9 I13	R9-V11 PolarHBondContact O-N 2.99Å; V11-I13 PolarHBondContact O-N 3.28Å
12	G	30.1	Very low	41.3	Very low	64 Å²	64	105.8 Å²	105.8	66%	0.66	64%	0.639	S	S	*	*			trans	-59.5	113.1	169.6	0	0	0	0	0	105.5	A10 A14	A10-G12 VanDerWaalsContact C-N 3.28Å; A10-G12 PolarHBondContact O-N 3.48Å; G12-A14 PolarHBondContact O-N 3Å
13	I	34.1	Very low	44.1	Very low	160 Å²	160	103.2 Å²	103.2	82%	0.821	61%	0.611	S	S	*	*			trans	-60.9	95.7	167.5	-61.8	168.9	0	0	0	104.3	V11 D15	V11-I13 PolarHBondContact O-N 3.28Å; I13-D15 PolarHBondContact O-N 3.41Å
14	A	36	Very low	46.7	Very low	75 Å²	75	99 Å²	99	62%	0.62	59%	0.594	S	S	*	*			trans	-54.2	134.4	170.6	0	0	0	0	0	107.1	G12 P16	G12-A14 PolarHBondContact O-N 3Å; A14-P16 WeakPolarHBondContact O-CD 3.18Å; A14-P16 VanDerWaalsContact O-N 3.14Å
15	D	41.7	Very low	49.9	Very low	83 Å²	83	99.1 Å²	99.1	44%	0.444	58%	0.58	S	S	.	*			trans	-53.5	121.8	178.3	-162.5	-20.8	0	0	0	108	I13 E17 E18	I13-D15 PolarHBondContact O-N 3.41Å; D15-E17 PolarHBondContact O-N 3.4Å; D15-E18 PolarHBondContact O-N 3.47Å
16	P	46	Very low	53.1	Low	100 Å²	100	94.8 Å²	94.8	65%	0.649	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-18.2	-177.1	14.9	-28.1	0	0	0	113.3	A14 S19	A14-P16 WeakPolarHBondContact O-CD 3.18Å; A14-P16 VanDerWaalsContact O-N 3.14Å; P16-S19 PolarHBondContact O-OG 3.22Å
17	E	45.9	Very low	56	Low	93 Å²	93	93.5 Å²	93.5	44%	0.435	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-16.2	176.9	-59.6	-159.7	178.3	0	0	115.2	D15 K230	D15-E17 PolarHBondContact O-N 3.4Å; E17-K230 WeakPolarHBondContact OE1-CE 3.26Å; E17-K230 IonicContact OE1-NZ 3.62Å; E17-K230 PolarHBondContact OE1-NZ 3.33Å; E17-K230 IonicContact OE2-NZ 3.79Å; E17-K230 PolarHBondContact OE2-NZ 3.05Å
18	E	50.8	Low	59.4	Low	161 Å²	161	93.2 Å²	93.2	75%	0.752	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-5.1	179	-72.5	-171.2	160.9	0	0	114	D15	D15-E18 PolarHBondContact O-N 3.47Å
19	S	59.9	Low	62.5	Low	46 Å²	46	84.6 Å²	84.6	32%	0.322	48%	0.477	S	S	.	.	S	Bend	trans	-74.1	139.4	-176.8	69.2	0	0	0	0	112.6	P16	P16-S19 PolarHBondContact O-OG 3.22Å
20	S	67.9	Low	65.8	Low	19 Å²	19	75 Å²	75	13%	0.133	44%	0.442	C	S	.	.			trans	-47.3	138	169.4	170.1	0	0	0	0	110.1	N22 M23	S20-N22 PolarHBondContact O-N 3.43Å; S20-N22 PolarHBondContact OG-N 3.27Å; S20-M23 WeakPolarHBondContact O-CB 3.36Å; S20-M23 PolarHBondContact O-N 3.23Å
21	P	72.5	Confident	69.1	Low	39 Å²	39	75.4 Å²	75.4	25%	0.253	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.4	176.1	-27.3	36.3	0	0	0	114.5	M215 K219	P21-M215 HydrophobicContact CB-SD 4.48Å; P21-M215 HydrophobicContact CG-SD 4.05Å; P21-K219 HydrophobicContact CB-CB 4Å; P21-K219 HydrophobicContact CB-CD 3.88Å; P21-K219 HydrophobicContact CB-CG 3.79Å; P21-K219 HydrophobicContact CG-CB 3.94Å; P21-K219 HydrophobicContact CG-CG 4.27Å
22	N	82.6	Confident	72.1	Confident	26 Å²	26	70.3 Å²	70.3	14%	0.139	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-2.6	177	-61.9	-19.2	0	0	0	113.2	S20 I24 V25 Y26 K219	S20-N22 PolarHBondContact O-N 3.43Å; S20-N22 PolarHBondContact OG-N 3.27Å; N22-I24 VanDerWaalsContact C-N 3.31Å; N22-I24 PolarHBondContact O-N 3.42Å; N22-V25 WeakPolarHBondContact O-CA 3.34Å; N22-V25 WeakPolarHBondContact O-CB 3.46Å; N22-V25 PolarHBondContact O-N 2.73Å; N22-Y26 HydrophobicContact CB-CE1 4.28Å; N22-Y26 HydrophobicContact CB-CE2 3.9Å; N22-Y26 PolarHBondContact O-N 2.91Å; N22-Y26 VanDerWaalsContact O-N 3.17Å; N22-K219 PolarHBondContact OD1-NZ 3.08Å
23	M	87.8	Confident	75.3	Confident	40 Å²	40	67.2 Å²	67.2	20%	0.197	37%	0.368	C	S	.	.	H	α-helix	trans	-57.1	-41.3	-173.5	-173.1	60.9	69.3	0	0	112.8	S20 V25 Y26 C27 S121	S20-M23 WeakPolarHBondContact O-CB 3.36Å; S20-M23 PolarHBondContact O-N 3.23Å; M23-V25 PolarHBondContact O-N 2.92Å; M23-Y26 PolarHBondContact O-N 2.83Å; M23-Y26 VanDerWaalsContact O-N 3.11Å; M23-Y26 HydrophobicContact SD-CD2 4.4Å; M23-C27 PolarHBondContact O-N 3.37Å; M23-C27 PolarHBondContact O-SG 3.08Å; M23-S121 WeakPolarHBondContact CE-O 3.5Å
24	I	90.4	Very high	78.2	Confident	113 Å²	113	63.6 Å²	63.6	58%	0.579	35%	0.353	S	S	*	.	H	α-helix	trans	-59.8	-31.5	176.9	-168.4	168.5	0	0	0	112.8	N22 K28	N22-I24 VanDerWaalsContact C-N 3.31Å; N22-I24 PolarHBondContact O-N 3.42Å; I24-K28 VanDerWaalsContact O-CG 3.3Å; I24-K28 WeakPolarHBondContact O-CG 3.47Å; I24-K28 PolarHBondContact O-N 2.8Å
25	V	93.3	Very high	81.1	Confident	75 Å²	75	65.9 Å²	65.9	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-73.6	-44.6	176.7	179.7	0	0	0	0	109.6	N22 M23 C27 K28 I29	N22-V25 WeakPolarHBondContact O-CA 3.34Å; N22-V25 WeakPolarHBondContact O-CB 3.46Å; N22-V25 PolarHBondContact O-N 2.73Å; M23-V25 PolarHBondContact O-N 2.92Å; V25-C27 PolarHBondContact O-N 3.14Å; V25-K28 PolarHBondContact O-N 2.74Å; V25-I29 HydrophobicContact CG1-CD1 4.03Å; V25-I29 WeakPolarHBondContact O-CG1 3.31Å; V25-I29 PolarHBondContact O-N 3.25Å
26	Y	94.1	Very high	83.8	Confident	20 Å²	20	62 Å²	62	8%	0.078	33%	0.328	C	S	.	.	H	α-helix	trans	-58.6	-48.7	176.7	-58.5	-30.3	0	0	0	111.9	N22 M23 K28 I29 E30 Y93 P120	N22-Y26 HydrophobicContact CB-CE1 4.28Å; N22-Y26 HydrophobicContact CB-CE2 3.9Å; N22-Y26 PolarHBondContact O-N 2.91Å; N22-Y26 VanDerWaalsContact O-N 3.17Å; M23-Y26 PolarHBondContact O-N 2.83Å; M23-Y26 VanDerWaalsContact O-N 3.11Å; M23-Y26 HydrophobicContact SD-CD2 4.4Å; Y26-K28 VanDerWaalsContact C-N 3.29Å; Y26-K28 PolarHBondContact O-N 3.13Å; Y26-I29 PolarHBondContact O-N 3.06Å; Y26-I29 VanDerWaalsContact O-N 3.09Å; Y26-E30 WeakPolarHBondContact O-CB 3.43Å; Y26-E30 VanDerWaalsContact O-CG 3.26Å; Y26-E30 WeakPolarHBondContact O-CG 3.12Å; Y26-E30 PolarHBondContact O-N 3.41Å; Y26-Y93 WeakPolarHBondContact CB-OH 3.42Å; Y26-P120 HydrophobicContact CD1-CB 4.43Å; Y26-P120 HydrophobicContact CD1-CG 3.99Å; Y26-P120 HydrophobicContact CE1-CB 4.1Å; Y26-P120 HydrophobicContact CE1-CG 4.04Å; Y26-P120 HydrophobicContact CE2-CB 4.35Å; Y26-P120 HydrophobicContact CG-CG 4.41Å
27	C	94.9	Very high	86.1	Confident	55 Å²	55	60.8 Å²	60.8	37%	0.372	31%	0.314	S	S	.	.	H	α-helix	trans	-57.5	-41.9	177.1	-61.6	0	0	0	0	112.3	M23 V25 I29 E30 D31	M23-C27 PolarHBondContact O-N 3.37Å; M23-C27 PolarHBondContact O-SG 3.08Å; V25-C27 PolarHBondContact O-N 3.14Å; C27-I29 PolarHBondContact O-N 3.34Å; C27-E30 PolarHBondContact O-N 3.21Å; C27-D31 VanDerWaalsContact O-CG 3.31Å; C27-D31 PolarHBondContact O-N 3.41Å
28	K	96.5	Very high	88.3	Confident	134 Å²	134	59 Å²	59	58%	0.583	31%	0.307	S	S	*	.	H	α-helix	trans	-64.7	-38.7	177.1	-74.4	178.6	178.2	-168.8	0	112.7	I24 V25 Y26 I32	I24-K28 VanDerWaalsContact O-CG 3.3Å; I24-K28 WeakPolarHBondContact O-CG 3.47Å; I24-K28 PolarHBondContact O-N 2.8Å; V25-K28 PolarHBondContact O-N 2.74Å; Y26-K28 VanDerWaalsContact C-N 3.29Å; Y26-K28 PolarHBondContact O-N 3.13Å; K28-I32 WeakPolarHBondContact O-CG1 3.29Å; K28-I32 PolarHBondContact O-N 3.23Å
29	I	97.8	Very high	89.6	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.097	31%	0.305	C	S	.	.	H	α-helix	trans	-67.2	-42.9	175.4	-64.9	168	0	0	0	109.8	V25 Y26 C27 D31 I32 I33 I88 Q91 Y93	V25-I29 HydrophobicContact CG1-CD1 4.03Å; V25-I29 WeakPolarHBondContact O-CG1 3.31Å; V25-I29 PolarHBondContact O-N 3.25Å; Y26-I29 PolarHBondContact O-N 3.06Å; Y26-I29 VanDerWaalsContact O-N 3.09Å; C27-I29 PolarHBondContact O-N 3.34Å; I29-D31 VanDerWaalsContact C-N 3.33Å; I29-D31 PolarHBondContact O-N 2.99Å; I29-I32 WeakPolarHBondContact O-CA 3.38Å; I29-I32 WeakPolarHBondContact O-CB 3.26Å; I29-I32 PolarHBondContact O-N 3.12Å; I29-I33 HydrophobicContact CG2-CG1 4.07Å; I29-I33 VanDerWaalsContact O-CG1 3.28Å; I29-I33 WeakPolarHBondContact O-CG1 3.5Å; I29-I33 PolarHBondContact O-N 3.41Å; I29-I88 HydrophobicContact CG2-CB 4.44Å; I29-I88 HydrophobicContact CG2-CG1 4Å; I29-I88 HydrophobicContact CG2-CG2 4Å; I29-Q91 HydrophobicContact CD1-CG 4.23Å; I29-Y93 HydrophobicContact CB-CD2 4.28Å; I29-Y93 HydrophobicContact CB-CE2 3.97Å; I29-Y93 HydrophobicContact CD1-CE2 4.14Å; I29-Y93 HydrophobicContact CG2-CD1 4.3Å; I29-Y93 HydrophobicContact CG2-CD2 3.32Å; I29-Y93 HydrophobicContact CG2-CE1 4.47Å; I29-Y93 HydrophobicContact CG2-CE2 3.51Å; I29-Y93 HydrophobicContact CG2-CG 3.73Å
30	E	97.2	Very high	90.6	Very high	29 Å²	29	64.8 Å²	64.8	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-37.2	179.6	-71.9	170.4	-161	0	0	112.8	Y26 C27 I32 I33 T34 Y93 W119 S121	Y26-E30 WeakPolarHBondContact O-CB 3.43Å; Y26-E30 VanDerWaalsContact O-CG 3.26Å; Y26-E30 WeakPolarHBondContact O-CG 3.12Å; Y26-E30 PolarHBondContact O-N 3.41Å; C27-E30 PolarHBondContact O-N 3.21Å; E30-I32 VanDerWaalsContact C-N 3.31Å; E30-I32 PolarHBondContact O-N 3.42Å; E30-I33 PolarHBondContact O-N 3.31Å; E30-T34 WeakPolarHBondContact O-CB 3.47Å; E30-T34 PolarHBondContact O-N 3.06Å; E30-T34 PolarHBondContact O-OG1 3.38Å; E30-Y93 HydrophobicContact CG-CD1 4.25Å; E30-Y93 HydrophobicContact CG-CE1 3.31Å; E30-Y93 PolarHBondContact OE1-OH 2.81Å; E30-W119 HydrophobicContact CB-CE3 4.34Å; E30-W119 HydrophobicContact CB-CH2 4.32Å; E30-W119 HydrophobicContact CB-CZ3 3.83Å; E30-W119 HydrophobicContact CG-CD2 4.13Å; E30-W119 HydrophobicContact CG-CE3 3.45Å; E30-W119 VanDerWaalsContact CG-CE3 3.45Å; E30-W119 HydrophobicContact CG-CH2 4.13Å; E30-W119 HydrophobicContact CG-CZ3 3.44Å; E30-W119 VanDerWaalsContact CG-CZ3 3.44Å; E30-S121 WeakPolarHBondContact OE1-CB 3.29Å; E30-S121 PolarHBondContact OE1-OG 2.88Å
31	D	96.8	Very high	91	Very high	97 Å²	97	68.3 Å²	68.3	52%	0.519	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-41	171.8	-73.9	-19.8	0	0	0	111.5	C27 I29 K35	C27-D31 VanDerWaalsContact O-CG 3.31Å; C27-D31 PolarHBondContact O-N 3.41Å; I29-D31 VanDerWaalsContact C-N 3.33Å; I29-D31 PolarHBondContact O-N 2.99Å; D31-K35 WeakPolarHBondContact O-CG 3.38Å; D31-K35 PolarHBondContact O-N 2.92Å
32	I	97.6	Very high	91.7	Very high	28 Å²	28	68.8 Å²	68.8	14%	0.144	36%	0.363	C	S	.	.	H	α-helix	trans	-64.8	-48.7	175.1	-67	166.6	0	0	0	110.1	K28 I29 E30 T34 K35 M36 W68 L69 L73 I88	K28-I32 WeakPolarHBondContact O-CG1 3.29Å; K28-I32 PolarHBondContact O-N 3.23Å; I29-I32 WeakPolarHBondContact O-CA 3.38Å; I29-I32 WeakPolarHBondContact O-CB 3.26Å; I29-I32 PolarHBondContact O-N 3.12Å; E30-I32 VanDerWaalsContact C-N 3.31Å; E30-I32 PolarHBondContact O-N 3.42Å; I32-T34 VanDerWaalsContact C-N 3.28Å; I32-T34 PolarHBondContact O-N 2.85Å; I32-K35 PolarHBondContact O-N 2.95Å; I32-M36 HydrophobicContact CG2-CE 3.78Å; I32-M36 HydrophobicContact CG2-CG 4.36Å; I32-M36 HydrophobicContact CG2-SD 4.18Å; I32-M36 WeakPolarHBondContact O-CG 3.43Å; I32-M36 PolarHBondContact O-N 2.93Å; I32-W68 HydrophobicContact CG2-CH2 4.49Å; I32-W68 HydrophobicContact CG2-CZ3 4.01Å; I32-L69 HydrophobicContact CG2-CD2 4.26Å; I32-L73 HydrophobicContact CD1-CD1 4.26Å; I32-I88 HydrophobicContact CG2-CD1 4.24Å
33	I	97.9	Very high	92.2	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-36.8	-179.4	-68.1	-67.5	0	0	0	112.1	I29 E30 M36 Q37 I88 Y93 I94 F113 W119	I29-I33 HydrophobicContact CG2-CG1 4.07Å; I29-I33 VanDerWaalsContact O-CG1 3.28Å; I29-I33 WeakPolarHBondContact O-CG1 3.5Å; I29-I33 PolarHBondContact O-N 3.41Å; E30-I33 PolarHBondContact O-N 3.31Å; I33-M36 HydrophobicContact CD1-SD 4.22Å; I33-M36 PolarHBondContact O-N 3.33Å; I33-Q37 WeakPolarHBondContact O-CG 3.36Å; I33-Q37 PolarHBondContact O-N 3.1Å; I33-Q37 PolarHBondContact O-NE2 3.42Å; I33-I88 HydrophobicContact CD1-CG2 3.74Å; I33-I88 HydrophobicContact CG1-CG2 4.41Å; I33-Y93 HydrophobicContact CG1-CD1 4.18Å; I33-Y93 HydrophobicContact CG1-CG 4.16Å; I33-I94 HydrophobicContact CD1-CD1 3.63Å; I33-I94 HydrophobicContact CD1-CG1 3.58Å; I33-F113 HydrophobicContact CD1-CD1 4.27Å; I33-F113 HydrophobicContact CD1-CE1 4.28Å; I33-F113 HydrophobicContact CG2-CD1 4.32Å; I33-W119 HydrophobicContact CG2-CH2 4.39Å; I33-W119 HydrophobicContact CG2-CZ2 3.83Å
34	T	95.7	Very high	92.6	Very high	83 Å²	83	66.4 Å²	66.4	51%	0.509	36%	0.356	S	S	.	.	H	α-helix	trans	-65.9	-44.9	176.4	-59.4	0	0	0	0	110.6	E30 I32 Q37 D38	E30-T34 WeakPolarHBondContact O-CB 3.47Å; E30-T34 PolarHBondContact O-N 3.06Å; E30-T34 PolarHBondContact O-OG1 3.38Å; I32-T34 VanDerWaalsContact C-N 3.28Å; I32-T34 PolarHBondContact O-N 2.85Å; T34-Q37 PolarHBondContact O-N 3.18Å; T34-D38 PolarHBondContact O-N 3.38Å
35	K	96.3	Very high	92.7	Very high	123 Å²	123	63.4 Å²	63.4	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-66	-37	175.7	-69	171.8	-176.9	176.2	0	112.6	D31 I32 Q37 D38 W68	D31-K35 WeakPolarHBondContact O-CG 3.38Å; D31-K35 PolarHBondContact O-N 2.92Å; I32-K35 PolarHBondContact O-N 2.95Å; K35-Q37 PolarHBondContact O-N 3.06Å; K35-D38 PolarHBondContact O-N 3.18Å; K35-W68 HydrophobicContact CB-CH2 3.74Å; K35-W68 HydrophobicContact CB-CZ2 3.76Å
36	M	97.1	Very high	92.7	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-30.3	175.4	-76.9	-178.8	169.9	0	0	112.7	I32 I33 G43 V44 I65 W68 L69 I94 F113	I32-M36 HydrophobicContact CG2-CE 3.78Å; I32-M36 HydrophobicContact CG2-CG 4.36Å; I32-M36 HydrophobicContact CG2-SD 4.18Å; I32-M36 WeakPolarHBondContact O-CG 3.43Å; I32-M36 PolarHBondContact O-N 2.93Å; I33-M36 HydrophobicContact CD1-SD 4.22Å; I33-M36 PolarHBondContact O-N 3.33Å; M36-G43 CarbonylContact O-C 3.42Å; M36-G43 VanDerWaalsContact O-CA 3.3Å; M36-G43 WeakPolarHBondContact O-CA 3.5Å; M36-V44 HydrophobicContact CB-CG2 4.1Å; M36-V44 HydrophobicContact CG-CG2 4.11Å; M36-V44 PolarHBondContact O-N 3.18Å; M36-I65 HydrophobicContact CE-CG2 3.84Å; M36-I65 HydrophobicContact SD-CG2 4.39Å; M36-W68 HydrophobicContact CE-CD2 4.47Å; M36-W68 HydrophobicContact CE-CE3 3.48Å; M36-W68 VanDerWaalsContact CE-CE3 3.48Å; M36-W68 HydrophobicContact CE-CZ3 3.64Å; M36-W68 HydrophobicContact CG-CD2 3.83Å; M36-W68 HydrophobicContact CG-CE3 3.47Å; M36-W68 VanDerWaalsContact CG-CE3 3.47Å; M36-W68 HydrophobicContact CG-CH2 3.66Å; M36-W68 HydrophobicContact CG-CZ2 3.99Å; M36-W68 HydrophobicContact CG-CZ3 3.4Å; M36-W68 HydrophobicContact SD-CE3 4.36Å; M36-W68 HydrophobicContact SD-CZ3 4.39Å; M36-L69 HydrophobicContact CE-CD1 4.14Å; M36-L69 HydrophobicContact CE-CD2 3.27Å; M36-L69 HydrophobicContact CE-CG 3.5Å; M36-I94 HydrophobicContact SD-CD1 3.94Å; M36-F113 HydrophobicContact CB-CE1 3.96Å; M36-F113 HydrophobicContact CB-CZ 3.91Å; M36-F113 HydrophobicContact SD-CE1 4.16Å
37	Q	94.6	Very high	92.6	Very high	75 Å²	75	69.2 Å²	69.2	35%	0.35	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	0.2	-179.6	-71.6	176.7	90.5	0	0	113.6	I33 T34 K35 D39 F113	I33-Q37 WeakPolarHBondContact O-CG 3.36Å; I33-Q37 PolarHBondContact O-N 3.1Å; I33-Q37 PolarHBondContact O-NE2 3.42Å; T34-Q37 PolarHBondContact O-N 3.18Å; K35-Q37 PolarHBondContact O-N 3.06Å; Q37-D39 PolarHBondContact O-N 2.85Å; Q37-F113 HydrophobicContact CG-CD1 4.01Å; Q37-F113 HydrophobicContact CG-CD2 3.62Å; Q37-F113 HydrophobicContact CG-CE1 4.07Å; Q37-F113 HydrophobicContact CG-CE2 3.68Å; Q37-F113 HydrophobicContact CG-CG 3.8Å; Q37-F113 HydrophobicContact CG-CZ 3.91Å
38	D	91.7	Very high	92.5	Very high	56 Å²	56	70 Å²	70	30%	0.299	36%	0.364	S	S	.	.			trans	-86.6	100.9	-178.8	-178.6	13.2	0	0	0	111.7	T34 K35 K40 T41 G43	T34-D38 PolarHBondContact O-N 3.38Å; K35-D38 PolarHBondContact O-N 3.18Å; D38-K40 PolarHBondContact O-N 3.12Å; D38-K40 VanDerWaalsContact O-N 3.14Å; D38-K40 WeakPolarHBondContact OD1-CB 3.43Å; D38-K40 PolarHBondContact OD1-N 3.25Å; D38-T41 WeakPolarHBondContact CB-OG1 3.32Å; D38-T41 PolarHBondContact O-N 3.02Å; D38-T41 WeakPolarHBondContact OD2-CB 3.45Å; D38-T41 WeakPolarHBondContact OD2-CG2 3.5Å; D38-T41 PolarHBondContact OD2-OG1 3.27Å; D38-G43 WeakPolarHBondContact O-CA 3.45Å; D38-G43 PolarHBondContact O-N 3.18Å
39	D	79.8	Confident	92.2	Very high	132 Å²	132	65.9 Å²	65.9	71%	0.706	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23	177.5	-68.7	-23.6	0	0	0	113.3	Q37	Q37-D39 PolarHBondContact O-N 2.85Å
40	K	80.6	Confident	91.8	Very high	196 Å²	196	72.6 Å²	72.6	85%	0.852	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-31	-177.2	-62.2	-178.4	-178.6	176.4	0	113.1	D38	D38-K40 PolarHBondContact O-N 3.12Å; D38-K40 VanDerWaalsContact O-N 3.14Å; D38-K40 WeakPolarHBondContact OD1-CB 3.43Å; D38-K40 PolarHBondContact OD1-N 3.25Å
41	T	76.5	Confident	91.1	Very high	93 Å²	93	74.4 Å²	74.4	57%	0.571	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	10.2	-176.9	53.7	0	0	0	0	112.9	D38	D38-T41 WeakPolarHBondContact CB-OG1 3.32Å; D38-T41 PolarHBondContact O-N 3.02Å; D38-T41 WeakPolarHBondContact OD2-CB 3.45Å; D38-T41 WeakPolarHBondContact OD2-CG2 3.5Å; D38-T41 PolarHBondContact OD2-OG1 3.27Å
42	G	86.2	Confident	90.3	Very high	49 Å²	49	79.6 Å²	79.6	51%	0.505	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	44.3	-179.2	0	0	0	0	0	112.5	W68	G42-W68 PolarHBondContact O-NE1 3.46Å; G42-W68 VanDerWaalsContact O-NE1 3.09Å
43	G	93.1	Very high	89.3	Confident	16 Å²	16	85.9 Å²	85.9	17%	0.165	45%	0.446	C	S	.	.			trans	-55.3	177.3	168.1	0	0	0	0	0	114	M36 D38	M36-G43 CarbonylContact O-C 3.42Å; M36-G43 VanDerWaalsContact O-CA 3.3Å; M36-G43 WeakPolarHBondContact O-CA 3.5Å; D38-G43 WeakPolarHBondContact O-CA 3.45Å; D38-G43 PolarHBondContact O-N 3.18Å
44	V	95.9	Very high	88.4	Confident	1 Å²	1	88.1 Å²	88.1	1%	0.006	46%	0.462	C	S	.	.			trans	-70.4	130.9	179	-175.2	0	0	0	0	109.1	M36 I46 V60 D64 I65 W68	M36-V44 HydrophobicContact CB-CG2 4.1Å; M36-V44 HydrophobicContact CG-CG2 4.11Å; M36-V44 PolarHBondContact O-N 3.18Å; V44-I46 PolarHBondContact O-N 3.26Å; V44-V60 HydrophobicContact CB-CG1 4.34Å; V44-V60 HydrophobicContact CG1-CB 3.76Å; V44-V60 HydrophobicContact CG1-CG1 3.67Å; V44-V60 HydrophobicContact CG1-CG2 4.47Å; V44-D64 HydrophobicContact CG1-CB 3.78Å; V44-I65 HydrophobicContact CG1-CG1 4.04Å; V44-W68 HydrophobicContact CG2-CB 3.7Å; V44-W68 HydrophobicContact CG2-CD2 4.17Å; V44-W68 HydrophobicContact CG2-CG 3.62Å
45	P	92.8	Very high	88	Confident	49 Å²	49	90.3 Å²	90.3	32%	0.318	46%	0.464	S	S	.	.			trans	-68	105.8	-175.2	27.4	-36	0	0	0	112.2	D64	P45-D64 HydrophobicContact CG-CB 4.22Å
46	I	94.2	Very high	87.6	Confident	73 Å²	73	86.4 Å²	86.4	37%	0.374	45%	0.449	S	S	.	.			trans	-79.4	121.4	175.6	-55.5	176.9	0	0	0	109.8	V44 V60 F113	V44-I46 PolarHBondContact O-N 3.26Å; I46-V60 HydrophobicContact CB-CG1 4.31Å; I46-V60 HydrophobicContact CG1-CG1 3.75Å; I46-F113 HydrophobicContact CD1-CD2 4.08Å; I46-F113 HydrophobicContact CD1-CE2 3.98Å; I46-F113 HydrophobicContact CG1-CE2 4.13Å
47	R	91.9	Very high	87.3	Confident	145 Å²	145	87.2 Å²	87.2	55%	0.547	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	158.8	-173.7	-60.2	-179.3	-169.5	174.4	7.9	112.8	S58 V59	R47-S58 PolarHBondContact O-N 3.12Å; R47-S58 VanDerWaalsContact O-N 3.13Å; R47-V59 PolarHBondContact N-O 3.4Å; R47-V59 WeakPolarHBondContact O-CG2 3.25Å; R47-V59 PolarHBondContact O-N 3.06Å
48	T	92.4	Very high	87.2	Confident	70 Å²	70	86.5 Å²	86.5	43%	0.429	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.9	164.2	-66.2	0	0	0	0	109.1	K55 I56 P57	T48-K55 HydrophobicContact CG2-CD 4.3Å; T48-K55 HydrophobicContact CG2-CG 3.8Å; T48-I56 CarbonylContact C-O 3.56Å; T48-I56 WeakPolarHBondContact CA-O 3.3Å; T48-P57 HydrophobicContact CG2-CB 4.16Å; T48-P57 WeakPolarHBondContact OG1-CA 3.36Å
49	V	90.1	Very high	87.3	Confident	49 Å²	49	84 Å²	84	30%	0.297	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.9	-179.1	-177.9	0	0	0	0	109.3	K55 I56 V59 F110	V49-K55 WeakPolarHBondContact O-CA 3.26Å; V49-I56 PolarHBondContact N-O 3.46Å; V49-I56 PolarHBondContact O-N 2.91Å; V49-V59 HydrophobicContact CG2-CG2 3.75Å; V49-F110 HydrophobicContact CB-CZ 4.3Å; V49-F110 HydrophobicContact CG1-CE2 4.42Å; V49-F110 HydrophobicContact CG1-CZ 3.99Å; V49-F110 HydrophobicContact CG2-CD1 4.48Å; V49-F110 HydrophobicContact CG2-CE1 3.72Å; V49-F110 HydrophobicContact CG2-CZ 3.78Å
50	K	88.9	Confident	88.2	Confident	160 Å²	160	77.8 Å²	77.8	70%	0.696	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.5	175.9	-67.7	178.8	-176.1	174.8	0	109	K55	K50-K55 HydrophobicContact CG-CD 4.41Å; K50-K55 HydrophobicContact CG-CG 4.05Å
51	S	84.1	Confident	89	Confident	66 Å²	66	69.8 Å²	69.8	46%	0.462	38%	0.379	S	S	.	.			trans	-122.3	172.7	168.6	74.3	0	0	0	0	109.5	L53 S54	S51-L53 PolarHBondContact O-N 3.17Å; S51-S54 PolarHBondContact N-O 2.86Å; S51-S54 PolarHBondContact OG-N 2.88Å; S51-S54 PolarHBondContact OG-O 3.43Å; S51-S54 VanDerWaalsContact OG-O 3.1Å; S51-S54 PolarHBondContact OG-OG 3.43Å
52	F	80	Confident	90	Very high	207 Å²	207	65.4 Å²	65.4	91%	0.908	35%	0.352	S	S	*	.	S	Bend	trans	-56.8	-34.6	178.3	-176.6	-108.1	0	0	0	113.1
53	L	76	Confident	90.5	Very high	159 Å²	159	65.5 Å²	65.5	83%	0.832	34%	0.343	S	S	*	.	S	Bend	trans	-106.3	-14.6	-175.2	-64.3	174.6	0	0	0	114	S51	S51-L53 PolarHBondContact O-N 3.17Å
54	S	79.5	Confident	90.8	Very high	48 Å²	48	66.7 Å²	66.7	34%	0.336	35%	0.345	S	S	.	.			trans	-150.4	144.1	-172	72.7	0	0	0	0	113.8	S51	S51-S54 PolarHBondContact N-O 2.86Å; S51-S54 PolarHBondContact OG-N 2.88Å; S51-S54 PolarHBondContact OG-O 3.43Å; S51-S54 VanDerWaalsContact OG-O 3.1Å; S51-S54 PolarHBondContact OG-OG 3.43Å
55	K	86.4	Confident	90.9	Very high	128 Å²	128	66.7 Å²	66.7	56%	0.557	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	118.2	166	-179	178.3	178.4	-170.2	0	107.7	T48 V49 K50	T48-K55 HydrophobicContact CG2-CD 4.3Å; T48-K55 HydrophobicContact CG2-CG 3.8Å; V49-K55 WeakPolarHBondContact O-CA 3.26Å; K50-K55 HydrophobicContact CG-CD 4.41Å; K50-K55 HydrophobicContact CG-CG 4.05Å
56	I	87.7	Confident	91.1	Very high	42 Å²	42	64.3 Å²	64.3	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	101.4	-178.1	-51.8	179.4	0	0	0	107.8	T48 V49 V59 I97	T48-I56 CarbonylContact C-O 3.56Å; T48-I56 WeakPolarHBondContact CA-O 3.3Å; V49-I56 PolarHBondContact N-O 3.46Å; V49-I56 PolarHBondContact O-N 2.91Å; I56-V59 HydrophobicContact CG2-CG1 3.6Å; I56-V59 HydrophobicContact CG2-CG2 4.48Å; I56-I97 HydrophobicContact CD1-CD1 4.12Å; I56-I97 HydrophobicContact CG2-CD1 3.75Å
57	P	91.8	Very high	91.3	Very high	17 Å²	17	65.8 Å²	65.8	11%	0.11	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	161.3	-178.1	27.1	-23.6	0	0	0	112.1	T48 V59 R112 T187 I191	T48-P57 HydrophobicContact CG2-CB 4.16Å; T48-P57 WeakPolarHBondContact OG1-CA 3.36Å; P57-V59 PolarHBondContact O-N 2.93Å; P57-R112 PolarHBondContact O-NH1 3.31Å; P57-R112 PolarHBondContact O-NH2 3.29Å; P57-T187 HydrophobicContact CB-CG2 4.33Å; P57-T187 HydrophobicContact CG-CG2 3.4Å; P57-I191 HydrophobicContact CG-CD1 4.3Å
58	S	91.3	Very high	91.6	Very high	60 Å²	60	59.8 Å²	59.8	42%	0.42	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.7	56.4	169.8	-46.9	0	0	0	0	114.2	R47 R112	R47-S58 PolarHBondContact O-N 3.12Å; R47-S58 VanDerWaalsContact O-N 3.13Å; S58-R112 PolarHBondContact O-NH1 3.03Å
59	V	95.1	Very high	91.9	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153	175.9	-67.7	0	0	0	0	111.3	R47 V49 I56 P57 I97 F110 Y111 R112	R47-V59 PolarHBondContact N-O 3.4Å; R47-V59 WeakPolarHBondContact O-CG2 3.25Å; R47-V59 PolarHBondContact O-N 3.06Å; V49-V59 HydrophobicContact CG2-CG2 3.75Å; I56-V59 HydrophobicContact CG2-CG1 3.6Å; I56-V59 HydrophobicContact CG2-CG2 4.48Å; P57-V59 PolarHBondContact O-N 2.93Å; V59-I97 HydrophobicContact CG1-CD1 4.21Å; V59-I97 HydrophobicContact CG1-CG2 4.17Å; V59-F110 HydrophobicContact CB-CB 4.15Å; V59-F110 HydrophobicContact CB-CD1 4.21Å; V59-F110 HydrophobicContact CB-CG 4.38Å; V59-F110 HydrophobicContact CG1-CB 4.24Å; V59-F110 HydrophobicContact CG2-CD1 3.88Å; V59-F110 HydrophobicContact CG2-CE1 4.38Å; V59-F110 HydrophobicContact CG2-CG 4.26Å; V59-Y111 WeakPolarHBondContact CA-O 3.3Å; V59-R112 HydrophobicContact CG1-CG 4.19Å
60	V	96.9	Very high	92.3	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	154.2	171.2	-64.8	0	0	0	0	108.8	V44 I46 I65 F110 Y111 F113	V44-V60 HydrophobicContact CB-CG1 4.34Å; V44-V60 HydrophobicContact CG1-CB 3.76Å; V44-V60 HydrophobicContact CG1-CG1 3.67Å; V44-V60 HydrophobicContact CG1-CG2 4.47Å; I46-V60 HydrophobicContact CB-CG1 4.31Å; I46-V60 HydrophobicContact CG1-CG1 3.75Å; V60-I65 HydrophobicContact CB-CG1 4.43Å; V60-I65 HydrophobicContact CG2-CD1 3.57Å; V60-I65 HydrophobicContact CG2-CG1 3.87Å; V60-F110 WeakPolarHBondContact O-CA 3.37Å; V60-Y111 PolarHBondContact N-O 3.5Å; V60-Y111 PolarHBondContact O-N 2.8Å; V60-F113 HydrophobicContact CG1-CE2 3.98Å; V60-F113 HydrophobicContact CG2-CE2 4.43Å
61	T	97.4	Very high	92.7	Very high	28 Å²	28	56.2 Å²	56.2	17%	0.172	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	153.5	175.5	70.2	0	0	0	0	110.8	T63 D64 I65 T109 F110	T61-T63 VanDerWaalsContact C-N 3.32Å; T61-T63 PolarHBondContact O-N 3.18Å; T61-D64 PolarHBondContact O-N 3.17Å; T61-D64 WeakPolarHBondContact OG1-CB 3.46Å; T61-D64 PolarHBondContact OG1-N 3.41Å; T61-D64 VanDerWaalsContact OG1-N 3.08Å; T61-D64 PolarHBondContact OG1-OD2 3.16Å; T61-I65 WeakPolarHBondContact O-CG1 3.35Å; T61-I65 PolarHBondContact O-N 3.22Å; T61-T109 CarbonylContact C-O 3.53Å; T61-T109 WeakPolarHBondContact CA-O 3.31Å; T61-F110 HydrophobicContact CG2-CD1 4.2Å; T61-F110 HydrophobicContact CG2-CE1 3.97Å
62	G	97.9	Very high	93.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-45.7	174.5	0	0	0	0	0	111.9	D64 I65 V66 K105 D107 T109	G62-D64 PolarHBondContact O-N 3.07Å; G62-I65 PolarHBondContact O-N 2.75Å; G62-I65 VanDerWaalsContact O-N 3.15Å; G62-V66 WeakPolarHBondContact O-CG2 3.44Å; G62-V66 PolarHBondContact O-N 3.15Å; G62-K105 CarbonylContact C-O 3.29Å; G62-K105 VanDerWaalsContact CA-O 3.23Å; G62-K105 WeakPolarHBondContact CA-O 3.44Å; G62-D107 PolarHBondContact N-O 3.47Å; G62-T109 PolarHBondContact N-O 3.04Å
63	T	98	Very high	94	Very high	51 Å²	51	49.8 Å²	49.8	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-57.7	-43.6	174.6	-60.8	0	0	0	0	113.1	T61 I65 V66 Q67 D106 D107	T61-T63 VanDerWaalsContact C-N 3.32Å; T61-T63 PolarHBondContact O-N 3.18Å; T63-I65 VanDerWaalsContact C-N 3.3Å; T63-I65 PolarHBondContact O-N 3.18Å; T63-V66 PolarHBondContact O-N 2.87Å; T63-Q67 HydrophobicContact CG2-CG 4.13Å; T63-Q67 WeakPolarHBondContact O-CB 3.39Å; T63-Q67 VanDerWaalsContact O-CG 3.25Å; T63-Q67 WeakPolarHBondContact O-CG 3.49Å; T63-Q67 PolarHBondContact O-N 3.37Å; T63-D106 WeakPolarHBondContact CA-OD1 3.23Å; T63-D106 WeakPolarHBondContact CB-OD1 3.27Å; T63-D106 PolarHBondContact OG1-OD1 2.8Å; T63-D107 PolarHBondContact N-O 3.47Å; T63-D107 VanDerWaalsContact N-O 3.08Å; T63-D107 WeakPolarHBondContact OG1-CA 3.37Å; T63-D107 PolarHBondContact OG1-N 3.47Å; T63-D107 PolarHBondContact OG1-O 3Å
64	D	97.8	Very high	95.1	Very high	42 Å²	42	47.2 Å²	47.2	23%	0.225	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-38.6	177.9	-68.5	-44.2	0	0	0	111.7	V44 P45 T61 G62 W68	V44-D64 HydrophobicContact CG1-CB 3.78Å; P45-D64 HydrophobicContact CG-CB 4.22Å; T61-D64 PolarHBondContact O-N 3.17Å; T61-D64 WeakPolarHBondContact OG1-CB 3.46Å; T61-D64 PolarHBondContact OG1-N 3.41Å; T61-D64 VanDerWaalsContact OG1-N 3.08Å; T61-D64 PolarHBondContact OG1-OD2 3.16Å; G62-D64 PolarHBondContact O-N 3.07Å; D64-W68 VanDerWaalsContact O-CB 3.29Å; D64-W68 WeakPolarHBondContact O-CB 3.43Å; D64-W68 PolarHBondContact O-N 3.18Å; D64-W68 VanDerWaalsContact O-N 3.07Å
65	I	98.2	Very high	96	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68.3	-46.5	177.3	-61.5	162.4	0	0	0	111	M36 V44 V60 T61 G62 T63 W68 L69 I94 M104 Y111	M36-I65 HydrophobicContact CE-CG2 3.84Å; M36-I65 HydrophobicContact SD-CG2 4.39Å; V44-I65 HydrophobicContact CG1-CG1 4.04Å; V60-I65 HydrophobicContact CB-CG1 4.43Å; V60-I65 HydrophobicContact CG2-CD1 3.57Å; V60-I65 HydrophobicContact CG2-CG1 3.87Å; T61-I65 WeakPolarHBondContact O-CG1 3.35Å; T61-I65 PolarHBondContact O-N 3.22Å; G62-I65 PolarHBondContact O-N 2.75Å; G62-I65 VanDerWaalsContact O-N 3.15Å; T63-I65 VanDerWaalsContact C-N 3.3Å; T63-I65 PolarHBondContact O-N 3.18Å; I65-W68 PolarHBondContact O-N 3.43Å; I65-L69 HydrophobicContact CG2-CD1 4.1Å; I65-L69 HydrophobicContact CG2-CG 4.42Å; I65-L69 WeakPolarHBondContact O-CG 3.44Å; I65-L69 PolarHBondContact O-N 3.24Å; I65-I94 HydrophobicContact CD1-CD1 4.4Å; I65-I94 HydrophobicContact CD1-CG2 4.04Å; I65-I94 HydrophobicContact CG2-CD1 4.46Å; I65-M104 HydrophobicContact CB-CE 4.2Å; I65-M104 HydrophobicContact CB-SD 4.1Å; I65-M104 HydrophobicContact CD1-CE 4.21Å; I65-M104 HydrophobicContact CD1-SD 3.85Å; I65-M104 HydrophobicContact CG2-CE 3.47Å; I65-M104 VanDerWaalsContact CG2-CE 3.47Å; I65-M104 HydrophobicContact CG2-SD 4.04Å; I65-Y111 HydrophobicContact CD1-CD2 4.24Å; I65-Y111 HydrophobicContact CD1-CG 4.11Å
66	V	98.4	Very high	96.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-46.6	-178.8	171.8	0	0	0	0	110.6	G62 T63 W68 L69 M70 A81 I82 M104 D106	G62-V66 WeakPolarHBondContact O-CG2 3.44Å; G62-V66 PolarHBondContact O-N 3.15Å; T63-V66 PolarHBondContact O-N 2.87Å; V66-W68 VanDerWaalsContact C-N 3.3Å; V66-W68 PolarHBondContact O-N 2.91Å; V66-L69 WeakPolarHBondContact O-CB 3.37Å; V66-L69 PolarHBondContact O-N 3.44Å; V66-M70 HydrophobicContact CG1-SD 4.36Å; V66-M70 WeakPolarHBondContact O-CG 3.5Å; V66-M70 PolarHBondContact O-N 3.47Å; V66-A81 HydrophobicContact CG1-CB 4.16Å; V66-I82 HydrophobicContact CG1-CG1 4.02Å; V66-I82 HydrophobicContact CG2-CG1 3.88Å; V66-M104 HydrophobicContact CG2-CG 4.02Å; V66-D106 HydrophobicContact CG1-CB 4.47Å; V66-D106 HydrophobicContact CG2-CB 4.17Å
67	Q	97.9	Very high	97	Very high	103 Å²	103	50.2 Å²	50.2	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-37.4	176.7	-68	-58.5	-42.9	0	0	112.1	T63 K71	T63-Q67 HydrophobicContact CG2-CG 4.13Å; T63-Q67 WeakPolarHBondContact O-CB 3.39Å; T63-Q67 VanDerWaalsContact O-CG 3.25Å; T63-Q67 WeakPolarHBondContact O-CG 3.49Å; T63-Q67 PolarHBondContact O-N 3.37Å; Q67-K71 WeakPolarHBondContact O-CB 3.18Å; Q67-K71 PolarHBondContact O-N 2.97Å; Q67-K71 VanDerWaalsContact O-N 3.08Å
68	W	97.9	Very high	97.2	Very high	20 Å²	20	52 Å²	52	8%	0.076	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-43.1	174.6	-172.4	99.1	0	0	0	111.8	I32 K35 M36 G42 V44 D64 I65 V66 K71 N72	I32-W68 HydrophobicContact CG2-CH2 4.49Å; I32-W68 HydrophobicContact CG2-CZ3 4.01Å; K35-W68 HydrophobicContact CB-CH2 3.74Å; K35-W68 HydrophobicContact CB-CZ2 3.76Å; M36-W68 HydrophobicContact CE-CD2 4.47Å; M36-W68 HydrophobicContact CE-CE3 3.48Å; M36-W68 VanDerWaalsContact CE-CE3 3.48Å; M36-W68 HydrophobicContact CE-CZ3 3.64Å; M36-W68 HydrophobicContact CG-CD2 3.83Å; M36-W68 HydrophobicContact CG-CE3 3.47Å; M36-W68 VanDerWaalsContact CG-CE3 3.47Å; M36-W68 HydrophobicContact CG-CH2 3.66Å; M36-W68 HydrophobicContact CG-CZ2 3.99Å; M36-W68 HydrophobicContact CG-CZ3 3.4Å; M36-W68 HydrophobicContact SD-CE3 4.36Å; M36-W68 HydrophobicContact SD-CZ3 4.39Å; G42-W68 PolarHBondContact O-NE1 3.46Å; G42-W68 VanDerWaalsContact O-NE1 3.09Å; V44-W68 HydrophobicContact CG2-CB 3.7Å; V44-W68 HydrophobicContact CG2-CD2 4.17Å; V44-W68 HydrophobicContact CG2-CG 3.62Å; D64-W68 VanDerWaalsContact O-CB 3.29Å; D64-W68 WeakPolarHBondContact O-CB 3.43Å; D64-W68 PolarHBondContact O-N 3.18Å; D64-W68 VanDerWaalsContact O-N 3.07Å; I65-W68 PolarHBondContact O-N 3.43Å; V66-W68 VanDerWaalsContact C-N 3.3Å; V66-W68 PolarHBondContact O-N 2.91Å; W68-K71 PolarHBondContact O-N 3.07Å; W68-N72 HydrophobicContact CD2-CB 4.24Å; W68-N72 VanDerWaalsContact CE2-ND2 3.27Å; W68-N72 HydrophobicContact CE3-CB 4.21Å; W68-N72 HydrophobicContact CH2-CB 4Å; W68-N72 HydrophobicContact CZ2-CB 4.03Å; W68-N72 HydrophobicContact CZ3-CB 4.08Å; W68-N72 PolarHBondContact NE1-ND2 3.03Å; W68-N72 WeakPolarHBondContact O-CB 3.46Å; W68-N72 PolarHBondContact O-N 2.85Å; W68-N72 PolarHBondContact O-ND2 3.18Å
69	L	98.3	Very high	97.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-49.7	176.9	-76.3	169.5	0	0	0	111.4	I32 M36 I65 V66 K71 N72 L73 A81 L84 I88	I32-L69 HydrophobicContact CG2-CD2 4.26Å; M36-L69 HydrophobicContact CE-CD1 4.14Å; M36-L69 HydrophobicContact CE-CD2 3.27Å; M36-L69 HydrophobicContact CE-CG 3.5Å; I65-L69 HydrophobicContact CG2-CD1 4.1Å; I65-L69 HydrophobicContact CG2-CG 4.42Å; I65-L69 WeakPolarHBondContact O-CG 3.44Å; I65-L69 PolarHBondContact O-N 3.24Å; V66-L69 WeakPolarHBondContact O-CB 3.37Å; V66-L69 PolarHBondContact O-N 3.44Å; L69-K71 VanDerWaalsContact C-N 3.34Å; L69-K71 PolarHBondContact O-N 3.41Å; L69-N72 PolarHBondContact O-N 2.84Å; L69-L73 HydrophobicContact CD2-CD1 3.63Å; L69-L73 HydrophobicContact CD2-CG 4.47Å; L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.45Å; L69-L73 PolarHBondContact O-N 3.09Å; L69-A81 HydrophobicContact CB-CB 4.27Å; L69-L84 HydrophobicContact CD2-CD2 4.23Å; L69-I88 HydrophobicContact CD2-CD1 4.48Å
70	M	98.1	Very high	97.7	Very high	34 Å²	34	59.1 Å²	59.1	17%	0.167	31%	0.31	C	S	.	.	H	α-helix	trans	-55.4	-49.3	178	-70.1	-177	75.8	0	0	111.9	V66 S74 I75 E76 P78 A81	V66-M70 HydrophobicContact CG1-SD 4.36Å; V66-M70 WeakPolarHBondContact O-CG 3.5Å; V66-M70 PolarHBondContact O-N 3.47Å; M70-S74 CarbonylContact O-C 3.5Å; M70-S74 WeakPolarHBondContact O-CA 3.45Å; M70-S74 PolarHBondContact O-N 3.16Å; M70-S74 VanDerWaalsContact O-N 3.13Å; M70-I75 PolarHBondContact O-N 3.38Å; M70-E76 WeakPolarHBondContact CE-O 3.31Å; M70-P78 HydrophobicContact CE-CB 4.34Å; M70-P78 HydrophobicContact CE-CG 3.76Å; M70-P78 HydrophobicContact SD-CB 4.11Å; M70-P78 HydrophobicContact SD-CG 4.1Å; M70-A81 HydrophobicContact CG-CB 3.51Å
71	K	97	Very high	97.8	Very high	169 Å²	169	59 Å²	59	74%	0.735	31%	0.309	S	S	*	.	H	α-helix	trans	-68	-47	-178.1	-177.1	-177.8	175.5	-174.1	0	113.2	Q67 W68 L69	Q67-K71 WeakPolarHBondContact O-CB 3.18Å; Q67-K71 PolarHBondContact O-N 2.97Å; Q67-K71 VanDerWaalsContact O-N 3.08Å; W68-K71 PolarHBondContact O-N 3.07Å; L69-K71 VanDerWaalsContact C-N 3.34Å; L69-K71 PolarHBondContact O-N 3.41Å
72	N	96.6	Very high	97.8	Very high	72 Å²	72	59.9 Å²	59.9	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-88.1	-19.2	-169	-70	-84.6	0	0	0	113.7	W68 L69	W68-N72 HydrophobicContact CD2-CB 4.24Å; W68-N72 VanDerWaalsContact CE2-ND2 3.27Å; W68-N72 HydrophobicContact CE3-CB 4.21Å; W68-N72 HydrophobicContact CH2-CB 4Å; W68-N72 HydrophobicContact CZ2-CB 4.03Å; W68-N72 HydrophobicContact CZ3-CB 4.08Å; W68-N72 PolarHBondContact NE1-ND2 3.03Å; W68-N72 WeakPolarHBondContact O-CB 3.46Å; W68-N72 PolarHBondContact O-N 2.85Å; W68-N72 PolarHBondContact O-ND2 3.18Å; L69-N72 PolarHBondContact O-N 2.84Å
73	L	96.7	Very high	97.9	Very high	67 Å²	67	65.4 Å²	65.4	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-107.4	4.5	175.1	-54.5	-178.3	0	0	0	112.7	I32 L69 I75 L84	I32-L73 HydrophobicContact CD1-CD1 4.26Å; L69-L73 HydrophobicContact CD2-CD1 3.63Å; L69-L73 HydrophobicContact CD2-CG 4.47Å; L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.45Å; L69-L73 PolarHBondContact O-N 3.09Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 HydrophobicContact CB-CD1 3.97Å; L73-I75 HydrophobicContact CB-CG1 3.99Å; L73-I75 HydrophobicContact CD1-CD1 4.22Å; L73-I75 PolarHBondContact O-N 3.16Å; L73-L84 HydrophobicContact CD1-CD2 3.54Å
74	S	97.4	Very high	97.9	Very high	104 Å²	104	65.4 Å²	65.4	73%	0.727	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	43.1	-177.9	-55.2	0	0	0	0	113	M70	M70-S74 CarbonylContact O-C 3.5Å; M70-S74 WeakPolarHBondContact O-CA 3.45Å; M70-S74 PolarHBondContact O-N 3.16Å; M70-S74 VanDerWaalsContact O-N 3.13Å
75	I	98.2	Very high	97.9	Very high	16 Å²	16	63.4 Å²	63.4	8%	0.082	33%	0.325	C	S	.	.			trans	-87.4	120.8	177	-59.7	166.7	0	0	0	108.4	M70 L73 D77 E80 A81 L84	M70-I75 PolarHBondContact O-N 3.38Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 HydrophobicContact CB-CD1 3.97Å; L73-I75 HydrophobicContact CB-CG1 3.99Å; L73-I75 HydrophobicContact CD1-CD1 4.22Å; L73-I75 PolarHBondContact O-N 3.16Å; I75-D77 VanDerWaalsContact CG2-O 3.28Å; I75-D77 WeakPolarHBondContact CG2-O 3.46Å; I75-E80 HydrophobicContact CG2-CB 3.73Å; I75-E80 HydrophobicContact CG2-CG 3.86Å; I75-A81 HydrophobicContact CD1-CB 4.25Å; I75-A81 HydrophobicContact CG2-CB 4.08Å; I75-L84 HydrophobicContact CD1-CD2 3.99Å
76	E	97.4	Very high	97.9	Very high	184 Å²	184	64.6 Å²	64.6	86%	0.86	33%	0.333	S	S	*	.			trans	-82.4	-39.6	-178.1	-63.9	-175.5	176.8	0	0	112.4	M70 P78	M70-E76 WeakPolarHBondContact CE-O 3.31Å; E76-P78 WeakPolarHBondContact O-CD 3.28Å
77	D	97.8	Very high	97.9	Very high	81 Å²	81	68.7 Å²	68.7	43%	0.433	36%	0.355	S	S	.	.			trans	-88.5	118	-179.6	-176.8	1	0	0	0	111.3	I75 V79 E80 A81	I75-D77 VanDerWaalsContact CG2-O 3.28Å; I75-D77 WeakPolarHBondContact CG2-O 3.46Å; D77-V79 PolarHBondContact O-N 3.46Å; D77-V79 VanDerWaalsContact O-N 3.16Å; D77-V79 WeakPolarHBondContact OD1-CB 3.46Å; D77-V79 PolarHBondContact OD1-N 3.43Å; D77-E80 HydrophobicContact CB-CB 4.31Å; D77-E80 WeakPolarHBondContact O-CB 3.44Å; D77-E80 PolarHBondContact O-N 3.31Å; D77-E80 VanDerWaalsContact O-N 3.11Å; D77-A81 PolarHBondContact O-N 3.24Å
78	P	97.4	Very high	97.9	Very high	56 Å²	56	63.8 Å²	63.8	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-54.4	-32.4	174.3	-23.6	32.3	0	0	0	113.6	M70 E76 E80 A81 I82	M70-P78 HydrophobicContact CE-CB 4.34Å; M70-P78 HydrophobicContact CE-CG 3.76Å; M70-P78 HydrophobicContact SD-CB 4.11Å; M70-P78 HydrophobicContact SD-CG 4.1Å; E76-P78 WeakPolarHBondContact O-CD 3.28Å; P78-E80 VanDerWaalsContact C-N 3.33Å; P78-E80 PolarHBondContact O-N 2.94Å; P78-A81 PolarHBondContact O-N 3.33Å; P78-I82 WeakPolarHBondContact O-CD1 3.25Å; P78-I82 VanDerWaalsContact O-CG1 3.24Å; P78-I82 WeakPolarHBondContact O-CG1 3.43Å; P78-I82 PolarHBondContact O-N 2.7Å
79	V	98.2	Very high	98	Very high	99 Å²	99	62.9 Å²	62.9	60%	0.6	33%	0.329	S	S	*	.	H	α-helix	trans	-64.8	-39.1	180	-179.1	0	0	0	0	111	D77 I82 H83	D77-V79 PolarHBondContact O-N 3.46Å; D77-V79 VanDerWaalsContact O-N 3.16Å; D77-V79 WeakPolarHBondContact OD1-CB 3.46Å; D77-V79 PolarHBondContact OD1-N 3.43Å; V79-I82 PolarHBondContact O-N 3.04Å; V79-H83 VanDerWaalsContact O-CB 3.3Å; V79-H83 WeakPolarHBondContact O-CB 3.42Å; V79-H83 PolarHBondContact O-N 3.03Å
80	E	98.5	Very high	97.9	Very high	113 Å²	113	64 Å²	64	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-64.4	-43.1	174.7	179.8	178.6	-170.9	0	0	111.2	I75 D77 P78 H83 L84	I75-E80 HydrophobicContact CG2-CB 3.73Å; I75-E80 HydrophobicContact CG2-CG 3.86Å; D77-E80 HydrophobicContact CB-CB 4.31Å; D77-E80 WeakPolarHBondContact O-CB 3.44Å; D77-E80 PolarHBondContact O-N 3.31Å; D77-E80 VanDerWaalsContact O-N 3.11Å; P78-E80 VanDerWaalsContact C-N 3.33Å; P78-E80 PolarHBondContact O-N 2.94Å; E80-H83 PolarHBondContact O-N 3.41Å; E80-L84 WeakPolarHBondContact O-CB 3.27Å; E80-L84 PolarHBondContact O-N 3.1Å
81	A	98.4	Very high	97.9	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-42.1	178.4	0	0	0	0	0	112.3	V66 L69 M70 I75 D77 P78 H83 G85	V66-A81 HydrophobicContact CG1-CB 4.16Å; L69-A81 HydrophobicContact CB-CB 4.27Å; M70-A81 HydrophobicContact CG-CB 3.51Å; I75-A81 HydrophobicContact CD1-CB 4.25Å; I75-A81 HydrophobicContact CG2-CB 4.08Å; D77-A81 PolarHBondContact O-N 3.24Å; P78-A81 PolarHBondContact O-N 3.33Å; A81-H83 VanDerWaalsContact C-N 3.33Å; A81-G85 PolarHBondContact O-N 3.45Å
82	I	98.5	Very high	97.9	Very high	47 Å²	47	56.3 Å²	56.3	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-41.1	174.4	-66.6	162.8	0	0	0	110.6	V66 P78 V79 G85 S86 D106	V66-I82 HydrophobicContact CG1-CG1 4.02Å; V66-I82 HydrophobicContact CG2-CG1 3.88Å; P78-I82 WeakPolarHBondContact O-CD1 3.25Å; P78-I82 VanDerWaalsContact O-CG1 3.24Å; P78-I82 WeakPolarHBondContact O-CG1 3.43Å; P78-I82 PolarHBondContact O-N 2.7Å; V79-I82 PolarHBondContact O-N 3.04Å; I82-G85 PolarHBondContact O-N 2.92Å; I82-S86 WeakPolarHBondContact O-CB 3.26Å; I82-S86 PolarHBondContact O-N 2.93Å; I82-S86 PolarHBondContact O-OG 3.27Å; I82-D106 HydrophobicContact CD1-CB 3.7Å; I82-D106 HydrophobicContact CG1-CB 3.99Å
83	H	98.6	Very high	98	Very high	116 Å²	116	52.9 Å²	52.9	54%	0.537	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-50.4	177.7	-177.1	68.2	0	0	0	111.5	V79 E80 A81 G85 S86 L87	V79-H83 VanDerWaalsContact O-CB 3.3Å; V79-H83 WeakPolarHBondContact O-CB 3.42Å; V79-H83 PolarHBondContact O-N 3.03Å; E80-H83 PolarHBondContact O-N 3.41Å; A81-H83 VanDerWaalsContact C-N 3.33Å; H83-G85 VanDerWaalsContact C-N 3.33Å; H83-G85 PolarHBondContact O-N 3.4Å; H83-S86 WeakPolarHBondContact O-CB 3.27Å; H83-S86 PolarHBondContact O-N 2.84Å; H83-S86 VanDerWaalsContact O-N 3.13Å; H83-L87 WeakPolarHBondContact O-CG 3.32Å; H83-L87 PolarHBondContact O-N 3.37Å
84	L	98.6	Very high	98.1	Very high	51 Å²	51	49.7 Å²	49.7	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-45.4	175.8	177.2	59.9	0	0	0	111.4	L69 L73 I75 E80 S86 L87 I88	L69-L84 HydrophobicContact CD2-CD2 4.23Å; L73-L84 HydrophobicContact CD1-CD2 3.54Å; I75-L84 HydrophobicContact CD1-CD2 3.99Å; E80-L84 WeakPolarHBondContact O-CB 3.27Å; E80-L84 PolarHBondContact O-N 3.1Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 2.86Å; L84-L87 PolarHBondContact O-N 3.47Å; L84-I88 HydrophobicContact CD1-CD1 4.35Å; L84-I88 HydrophobicContact CD1-CG1 4.47Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.4Å
85	G	98.4	Very high	98.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.2	-43.4	174.5	0	0	0	0	0	112.5	A81 I82 H83 L87 I88 A89 M104	A81-G85 PolarHBondContact O-N 3.45Å; I82-G85 PolarHBondContact O-N 2.92Å; H83-G85 VanDerWaalsContact C-N 3.33Å; H83-G85 PolarHBondContact O-N 3.4Å; G85-L87 VanDerWaalsContact C-N 3.35Å; G85-L87 PolarHBondContact O-N 3.35Å; G85-I88 PolarHBondContact O-N 3.36Å; G85-A89 WeakPolarHBondContact O-CB 3.44Å; G85-A89 PolarHBondContact O-N 3.5Å; G85-M104 VanDerWaalsContact C-CE 3.5Å; G85-M104 WeakPolarHBondContact O-CE 3.43Å
86	S	98.4	Very high	98.1	Very high	24 Å²	24	44.1 Å²	44.1	17%	0.168	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-37.5	177.4	-63.5	0	0	0	0	112.1	I82 H83 L84 A89 A90 M104	I82-S86 WeakPolarHBondContact O-CB 3.26Å; I82-S86 PolarHBondContact O-N 2.93Å; I82-S86 PolarHBondContact O-OG 3.27Å; H83-S86 WeakPolarHBondContact O-CB 3.27Å; H83-S86 PolarHBondContact O-N 2.84Å; H83-S86 VanDerWaalsContact O-N 3.13Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 2.86Å; S86-A89 PolarHBondContact O-N 3.03Å; S86-A90 WeakPolarHBondContact O-CB 3.46Å; S86-A90 PolarHBondContact O-N 3.04Å; S86-M104 WeakPolarHBondContact OG-CB 3.43Å; S86-M104 PolarHBondContact OG-N 2.74Å
87	L	98.4	Very high	97.9	Very high	86 Å²	86	37.1 Å²	37.1	45%	0.45	20%	0.201	S	C	.	.	H	α-helix	trans	-65.2	-42.7	173.6	-69.2	175.9	0	0	0	111.8	H83 L84 G85 A89 A90 Q91	H83-L87 WeakPolarHBondContact O-CG 3.32Å; H83-L87 PolarHBondContact O-N 3.37Å; L84-L87 PolarHBondContact O-N 3.47Å; G85-L87 VanDerWaalsContact C-N 3.35Å; G85-L87 PolarHBondContact O-N 3.35Å; L87-A89 VanDerWaalsContact C-N 3.27Å; L87-A89 PolarHBondContact O-N 2.93Å; L87-A90 PolarHBondContact O-N 3.11Å; L87-Q91 VanDerWaalsContact O-CG 3.25Å; L87-Q91 WeakPolarHBondContact O-CG 3.42Å; L87-Q91 PolarHBondContact O-N 3.33Å
88	I	98.3	Very high	97.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-41.2	174.6	-68.3	171	0	0	0	110.4	I29 I32 I33 L69 L84 G85 Q91 G92 Y93 I94	I29-I88 HydrophobicContact CG2-CB 4.44Å; I29-I88 HydrophobicContact CG2-CG1 4Å; I29-I88 HydrophobicContact CG2-CG2 4Å; I32-I88 HydrophobicContact CG2-CD1 4.24Å; I33-I88 HydrophobicContact CD1-CG2 3.74Å; I33-I88 HydrophobicContact CG1-CG2 4.41Å; L69-I88 HydrophobicContact CD2-CD1 4.48Å; L84-I88 HydrophobicContact CD1-CD1 4.35Å; L84-I88 HydrophobicContact CD1-CG1 4.47Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.4Å; G85-I88 PolarHBondContact O-N 3.36Å; I88-Q91 PolarHBondContact O-N 3.26Å; I88-G92 PolarHBondContact O-N 3.42Å; I88-Y93 PolarHBondContact O-N 2.65Å; I88-I94 HydrophobicContact CG2-CD1 4.03Å; I88-I94 HydrophobicContact CG2-CG1 4.14Å
89	A	98.2	Very high	97.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-45.3	177.3	0	0	0	0	0	112.5	G85 S86 L87 Q91 G92 I94	G85-A89 WeakPolarHBondContact O-CB 3.44Å; G85-A89 PolarHBondContact O-N 3.5Å; S86-A89 PolarHBondContact O-N 3.03Å; L87-A89 VanDerWaalsContact C-N 3.27Å; L87-A89 PolarHBondContact O-N 2.93Å; A89-Q91 PolarHBondContact O-N 2.98Å; A89-G92 WeakPolarHBondContact O-CA 3.28Å; A89-G92 PolarHBondContact O-N 3.45Å; A89-I94 WeakPolarHBondContact CA-O 3.12Å; A89-I94 WeakPolarHBondContact CB-O 3.44Å
90	A	97.7	Very high	97.3	Very high	25 Å²	25	35.2 Å²	35.2	21%	0.207	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-23.3	177.9	0	0	0	0	0	113.6	S86 L87 G92 L102 T212	S86-A90 WeakPolarHBondContact O-CB 3.46Å; S86-A90 PolarHBondContact O-N 3.04Å; L87-A90 PolarHBondContact O-N 3.11Å; A90-G92 VanDerWaalsContact C-N 3.28Å; A90-L102 PolarHBondContact N-O 2.84Å; A90-T212 HydrophobicContact CB-CG2 3.88Å; A90-T212 WeakPolarHBondContact O-CG2 3.29Å; A90-T212 PolarHBondContact O-OG1 3.34Å
91	Q	96.8	Very high	97.3	Very high	37 Å²	37	31.9 Å²	31.9	17%	0.173	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.2	171.1	-65.4	-66.8	-17.9	0	0	113.1	I29 L87 I88 A89 Y93	I29-Q91 HydrophobicContact CD1-CG 4.23Å; L87-Q91 VanDerWaalsContact O-CG 3.25Å; L87-Q91 WeakPolarHBondContact O-CG 3.42Å; L87-Q91 PolarHBondContact O-N 3.33Å; I88-Q91 PolarHBondContact O-N 3.26Å; A89-Q91 PolarHBondContact O-N 2.98Å; Q91-Y93 HydrophobicContact CB-CD2 3.81Å; Q91-Y93 HydrophobicContact CB-CE2 3.93Å
92	G	97.4	Very high	97.2	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.031	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	9.4	172.6	0	0	0	0	0	115.9	I88 A89 A90 Q114 V202	I88-G92 PolarHBondContact O-N 3.42Å; A89-G92 WeakPolarHBondContact O-CA 3.28Å; A89-G92 PolarHBondContact O-N 3.45Å; A90-G92 VanDerWaalsContact C-N 3.28Å; G92-Q114 WeakPolarHBondContact O-CB 3.31Å; G92-Q114 WeakPolarHBondContact O-CG 3.48Å; G92-V202 VanDerWaalsContact CA-CG2 3.44Å
93	Y	98.4	Very high	97.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-79.7	-29.5	-179.7	-70.2	-80.7	0	0	0	113.3	Y26 I29 E30 I33 I88 Q91 Q114 W119 P120	Y26-Y93 WeakPolarHBondContact CB-OH 3.42Å; I29-Y93 HydrophobicContact CB-CD2 4.28Å; I29-Y93 HydrophobicContact CB-CE2 3.97Å; I29-Y93 HydrophobicContact CD1-CE2 4.14Å; I29-Y93 HydrophobicContact CG2-CD1 4.3Å; I29-Y93 HydrophobicContact CG2-CD2 3.32Å; I29-Y93 HydrophobicContact CG2-CE1 4.47Å; I29-Y93 HydrophobicContact CG2-CE2 3.51Å; I29-Y93 HydrophobicContact CG2-CG 3.73Å; E30-Y93 HydrophobicContact CG-CD1 4.25Å; E30-Y93 HydrophobicContact CG-CE1 3.31Å; E30-Y93 PolarHBondContact OE1-OH 2.81Å; I33-Y93 HydrophobicContact CG1-CD1 4.18Å; I33-Y93 HydrophobicContact CG1-CG 4.16Å; I88-Y93 PolarHBondContact O-N 2.65Å; Q91-Y93 HydrophobicContact CB-CD2 3.81Å; Q91-Y93 HydrophobicContact CB-CE2 3.93Å; Y93-Q114 WeakPolarHBondContact O-CB 3.49Å; Y93-Q114 PolarHBondContact O-N 3.3Å; Y93-W119 AromaticContact CD1-CD1 3.72Å; Y93-W119 AromaticContact CD1-CD2 3.95Å; Y93-W119 HydrophobicContact CD1-CD2 3.95Å; Y93-W119 AromaticContact CD1-CE2 3.83Å; Y93-W119 AromaticContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CZ2 4.5Å; Y93-W119 AromaticContact CD1-NE1 3.71Å; Y93-W119 HydrophobicContact CE1-CB 3.91Å; Y93-W119 AromaticContact CE1-CD1 3.87Å; Y93-W119 AromaticContact CE1-CD2 3.62Å; Y93-W119 HydrophobicContact CE1-CD2 3.62Å; Y93-W119 AromaticContact CE1-CE2 4Å; Y93-W119 HydrophobicContact CE1-CE3 4.13Å; Y93-W119 AromaticContact CE1-CG 3.53Å; Y93-W119 HydrophobicContact CE1-CG 3.53Å; Y93-P120 HydrophobicContact CE2-CG 3.64Å; Y93-P120 WeakPolarHBondContact OH-CG 3.45Å
94	I	98.2	Very high	97.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.2	176.2	-56.7	176.8	0	0	0	107.2	I33 M36 I65 I88 A89 Y111 R112 F113	I33-I94 HydrophobicContact CD1-CD1 3.63Å; I33-I94 HydrophobicContact CD1-CG1 3.58Å; M36-I94 HydrophobicContact SD-CD1 3.94Å; I65-I94 HydrophobicContact CD1-CD1 4.4Å; I65-I94 HydrophobicContact CD1-CG2 4.04Å; I65-I94 HydrophobicContact CG2-CD1 4.46Å; I88-I94 HydrophobicContact CG2-CD1 4.03Å; I88-I94 HydrophobicContact CG2-CG1 4.14Å; A89-I94 WeakPolarHBondContact CA-O 3.12Å; A89-I94 WeakPolarHBondContact CB-O 3.44Å; I94-Y111 HydrophobicContact CG2-CD1 3.93Å; I94-Y111 HydrophobicContact CG2-CG 4.14Å; I94-R112 CarbonylContact C-O 3.57Å; I94-R112 VanDerWaalsContact CA-O 3.29Å; I94-R112 WeakPolarHBondContact CA-O 3.4Å; I94-F113 HydrophobicContact CD1-CD1 4.15Å; I94-F113 HydrophobicContact CD1-CE1 3.75Å; I94-F113 HydrophobicContact CG1-CD1 3.78Å; I94-F113 HydrophobicContact CG1-CE1 3.93Å
95	F	98.4	Very high	97	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	144.2	-179.4	58.2	-89.9	0	0	0	112.6	L102 Y111 R112 Q114 S194 Q195 A198	F95-L102 HydrophobicContact CB-CD2 3.74Å; F95-Y111 CarbonylContact O-C 3.38Å; F95-Y111 VanDerWaalsContact O-CA 3.28Å; F95-Y111 WeakPolarHBondContact O-CA 3.45Å; F95-R112 WeakPolarHBondContact CD1-O 3.43Å; F95-R112 HydrophobicContact CD2-CB 4.39Å; F95-R112 HydrophobicContact CE1-CB 3.96Å; F95-R112 HydrophobicContact CE2-CB 3.83Å; F95-R112 HydrophobicContact CE2-CG 4.42Å; F95-R112 HydrophobicContact CZ-CB 3.59Å; F95-R112 HydrophobicContact CZ-CG 4.43Å; F95-R112 PolarHBondContact N-O 3.03Å; F95-R112 PolarHBondContact O-N 3.44Å; F95-Q114 HydrophobicContact CD1-CB 4.27Å; F95-Q114 HydrophobicContact CE1-CB 4.16Å; F95-S194 WeakPolarHBondContact CE2-O 3.3Å; F95-Q195 HydrophobicContact CE1-CG 4.16Å; F95-Q195 HydrophobicContact CZ-CB 4.44Å; F95-Q195 HydrophobicContact CZ-CG 3.82Å; F95-A198 HydrophobicContact CB-CB 3.62Å; F95-A198 HydrophobicContact CD1-CB 3.37Å; F95-A198 HydrophobicContact CD2-CB 3.57Å; F95-A198 HydrophobicContact CE1-CB 3.82Å; F95-A198 HydrophobicContact CE2-CB 3.99Å; F95-A198 HydrophobicContact CG-CB 3.22Å; F95-A198 HydrophobicContact CZ-CB 4.1Å
96	P	97.6	Very high	97	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	138	173.9	27.7	-31.6	0	0	0	109.9	S98 D99 V101 T109 Y111 R197	P96-S98 VanDerWaalsContact C-N 3.31Å; P96-S98 PolarHBondContact O-N 3.03Å; P96-D99 HydrophobicContact CB-CB 4.24Å; P96-D99 HydrophobicContact CG-CB 4.03Å; P96-V101 WeakPolarHBondContact CG-O 3.39Å; P96-T109 HydrophobicContact CB-CG2 4.44Å; P96-Y111 HydrophobicContact CB-CD1 4.09Å; P96-Y111 HydrophobicContact CB-CE1 3.74Å; P96-Y111 HydrophobicContact CG-CE1 4.2Å; P96-R197 PolarHBondContact O-NH2 3.09Å
97	I	94.4	Very high	96.9	Very high	38 Å²	38	34.6 Å²	34.6	20%	0.195	19%	0.193	C	C	.	.	S	Bend	trans	-75.2	-23	-175	66	175.2	0	0	0	113.5	I56 V59 F110 R112 R197	I56-I97 HydrophobicContact CD1-CD1 4.12Å; I56-I97 HydrophobicContact CG2-CD1 3.75Å; V59-I97 HydrophobicContact CG1-CD1 4.21Å; V59-I97 HydrophobicContact CG1-CG2 4.17Å; I97-F110 HydrophobicContact CD1-CB 3.51Å; I97-F110 HydrophobicContact CD1-CD2 4.19Å; I97-F110 HydrophobicContact CD1-CG 4.26Å; I97-F110 HydrophobicContact CG1-CB 3.86Å; I97-F110 PolarHBondContact N-O 2.97Å; I97-R112 HydrophobicContact CG2-CB 4.41Å; I97-R112 HydrophobicContact CG2-CG 3.57Å; I97-R197 VanDerWaalsContact C-NH2 3.33Å; I97-R197 PolarHBondContact O-NH2 2.66Å
98	S	90.6	Very high	96.8	Very high	103 Å²	103	33.1 Å²	33.1	72%	0.72	20%	0.198	S	C	*	.	S	Bend	trans	-112.8	1.5	-169.6	52.9	0	0	0	0	114.4	P96	P96-S98 VanDerWaalsContact C-N 3.31Å; P96-S98 PolarHBondContact O-N 3.03Å
99	D	93.8	Very high	96.8	Very high	55 Å²	55	34.5 Å²	34.5	29%	0.294	21%	0.207	S	C	.	.			trans	-136.3	148.6	-175.4	-157.8	-23.1	0	0	0	110.1	P96 V101 R197	P96-D99 HydrophobicContact CB-CB 4.24Å; P96-D99 HydrophobicContact CG-CB 4.03Å; D99-V101 PolarHBondContact OD1-N 3.26Å; D99-R197 PolarHBondContact O-NH1 3.3Å; D99-R197 PolarHBondContact O-NH2 2.9Å
100	H	95.9	Very high	96.7	Very high	38 Å²	38	37.3 Å²	37.3	18%	0.176	22%	0.219	C	C	.	.	S	Bend	trans	-86.3	-19.4	172.7	-77.6	-87	0	0	0	112	L102 Y151 E152 D201 V206	H100-L102 PolarHBondContact O-N 3.49Å; H100-Y151 PolarHBondContact ND1-OH 2.99Å; H100-E152 IonicContact CE1-OE1 2.69Å; H100-E152 IonicContact CE1-OE2 2.68Å; H100-E152 IonicContact NE2-OE2 3.77Å; H100-D201 IonicContact CE1-OD1 2.67Å; H100-D201 IonicContact CG-OD1 2.92Å; H100-D201 IonicContact ND1-OD1 2.96Å; H100-D201 PolarHBondContact ND1-OD1 2.71Å; H100-D201 IonicContact ND1-OD2 3.24Å; H100-V206 HydrophobicContact CB-CG2 3.57Å
101	V	97.4	Very high	96.7	Very high	42 Å²	42	36.2 Å²	36.2	26%	0.255	21%	0.21	S	C	.	.	S	Bend	trans	-80.1	113.6	176.9	-179.5	0	0	0	0	110	P96 D99 T103 V206	P96-V101 WeakPolarHBondContact CG-O 3.39Å; D99-V101 PolarHBondContact OD1-N 3.26Å; V101-T103 VanDerWaalsContact C-N 3.33Å; V101-T103 HydrophobicContact CG1-CG2 3.79Å; V101-T103 PolarHBondContact O-N 3.03Å; V101-V206 HydrophobicContact CG2-CB 4.47Å; V101-V206 HydrophobicContact CG2-CG2 4.21Å
102	L	97.8	Very high	96.8	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.073	21%	0.205	C	C	.	.			trans	-79.5	75.4	-176.5	-59.9	-177.7	0	0	0	112.2	A90 F95 H100 D201 V202	A90-L102 PolarHBondContact N-O 2.84Å; F95-L102 HydrophobicContact CB-CD2 3.74Å; H100-L102 PolarHBondContact O-N 3.49Å; L102-D201 HydrophobicContact CD1-CB 3.9Å; L102-D201 HydrophobicContact CD2-CB 4.02Å; L102-D201 HydrophobicContact CG-CB 3.92Å; L102-V202 HydrophobicContact CD1-CB 4.45Å; L102-V202 HydrophobicContact CD1-CG2 3.46Å; L102-V202 VanDerWaalsContact CD1-CG2 3.46Å
103	T	97.3	Very high	96.8	Very high	53 Å²	53	36.2 Å²	36.2	33%	0.325	21%	0.208	S	C	.	.			trans	-131.6	151.7	178.9	55.2	0	0	0	0	112.3	V101 Y111	V101-T103 VanDerWaalsContact C-N 3.33Å; V101-T103 HydrophobicContact CG1-CG2 3.79Å; V101-T103 PolarHBondContact O-N 3.03Å; T103-Y111 VanDerWaalsContact O-CE1 3.28Å; T103-Y111 WeakPolarHBondContact O-CE1 3.43Å; T103-Y111 PolarHBondContact O-OH 3.25Å
104	M	97.3	Very high	96.8	Very high	9 Å²	9	36.4 Å²	36.4	4%	0.044	21%	0.209	C	C	.	.			trans	-89.5	138.3	175.3	-166.6	82.4	71.6	0	0	110.4	I65 V66 G85 S86 Y111	I65-M104 HydrophobicContact CB-CE 4.2Å; I65-M104 HydrophobicContact CB-SD 4.1Å; I65-M104 HydrophobicContact CD1-CE 4.21Å; I65-M104 HydrophobicContact CD1-SD 3.85Å; I65-M104 HydrophobicContact CG2-CE 3.47Å; I65-M104 VanDerWaalsContact CG2-CE 3.47Å; I65-M104 HydrophobicContact CG2-SD 4.04Å; V66-M104 HydrophobicContact CG2-CG 4.02Å; G85-M104 VanDerWaalsContact C-CE 3.5Å; G85-M104 WeakPolarHBondContact O-CE 3.43Å; S86-M104 WeakPolarHBondContact OG-CB 3.43Å; S86-M104 PolarHBondContact OG-N 2.74Å; M104-Y111 VanDerWaalsContact CA-OH 3.32Å; M104-Y111 WeakPolarHBondContact CA-OH 3.18Å; M104-Y111 HydrophobicContact SD-CE1 4.39Å; M104-Y111 HydrophobicContact SD-CE2 4.33Å
105	K	97.2	Very high	96.8	Very high	87 Å²	87	37.5 Å²	37.5	38%	0.378	22%	0.218	S	C	.	.			trans	-121.7	135.1	171	-63.1	178.6	-177.3	172.4	0	108.4	G62 D107 Y111	G62-K105 CarbonylContact C-O 3.29Å; G62-K105 VanDerWaalsContact CA-O 3.23Å; G62-K105 WeakPolarHBondContact CA-O 3.44Å; K105-D107 PolarHBondContact O-N 2.87Å; K105-Y111 PolarHBondContact N-OH 3.32Å
106	D	97.3	Very high	96.7	Very high	67 Å²	67	41.2 Å²	41.2	36%	0.358	24%	0.242	S	C	.	.	S	Bend	trans	-83.2	69	172.7	-173.9	14.3	0	0	0	110.2	T63 V66 I82	T63-D106 WeakPolarHBondContact CA-OD1 3.23Å; T63-D106 WeakPolarHBondContact CB-OD1 3.27Å; T63-D106 PolarHBondContact OG1-OD1 2.8Å; V66-D106 HydrophobicContact CG1-CB 4.47Å; V66-D106 HydrophobicContact CG2-CB 4.17Å; I82-D106 HydrophobicContact CD1-CB 3.7Å; I82-D106 HydrophobicContact CG1-CB 3.99Å
107	D	96.9	Very high	96.6	Very high	66 Å²	66	48 Å²	48	35%	0.353	27%	0.268	S	S	.	.	S	Bend	trans	-151.4	-168.3	177.5	64.8	19.4	0	0	0	111.2	G62 T63 K105 T109	G62-D107 PolarHBondContact N-O 3.47Å; T63-D107 PolarHBondContact N-O 3.47Å; T63-D107 VanDerWaalsContact N-O 3.08Å; T63-D107 WeakPolarHBondContact OG1-CA 3.37Å; T63-D107 PolarHBondContact OG1-N 3.47Å; T63-D107 PolarHBondContact OG1-O 3Å; K105-D107 PolarHBondContact O-N 2.87Å; D107-T109 PolarHBondContact O-N 2.64Å; D107-T109 VanDerWaalsContact O-N 3.14Å; D107-T109 WeakPolarHBondContact OD1-CA 3.47Å; D107-T109 WeakPolarHBondContact OD1-CB 3.32Å; D107-T109 PolarHBondContact OD1-N 3.38Å; D107-T109 PolarHBondContact OD1-OG1 2.84Å; D107-T109 PolarHBondContact OD2-OG1 3.49Å
108	G	96.1	Very high	96.7	Very high	54 Å²	54	48 Å²	48	56%	0.557	27%	0.267	S	S	*	.	S	Bend	trans	-72.1	7.8	177	0	0	0	0	0	115.4	F110	G108-F110 PolarHBondContact O-N 3.18Å
109	T	97.1	Very high	97	Very high	31 Å²	31	44.4 Å²	44.4	19%	0.19	24%	0.238	C	C	.	.			trans	-58.8	135.9	176.4	-63.1	0	0	0	0	110.2	T61 G62 P96 D107 Y111	T61-T109 CarbonylContact C-O 3.53Å; T61-T109 WeakPolarHBondContact CA-O 3.31Å; G62-T109 PolarHBondContact N-O 3.04Å; P96-T109 HydrophobicContact CB-CG2 4.44Å; D107-T109 PolarHBondContact O-N 2.64Å; D107-T109 VanDerWaalsContact O-N 3.14Å; D107-T109 WeakPolarHBondContact OD1-CA 3.47Å; D107-T109 WeakPolarHBondContact OD1-CB 3.32Å; D107-T109 PolarHBondContact OD1-N 3.38Å; D107-T109 PolarHBondContact OD1-OG1 2.84Å; D107-T109 PolarHBondContact OD2-OG1 3.49Å; T109-Y111 HydrophobicContact CG2-CD2 4.37Å; T109-Y111 HydrophobicContact CG2-CE2 3.68Å; T109-Y111 WeakPolarHBondContact O-CD2 3.36Å
110	F	97.5	Very high	96.9	Very high	59 Å²	59	42.6 Å²	42.6	26%	0.259	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.6	-178.1	-64.9	-54.8	0	0	0	112.3	V49 V59 V60 T61 I97 G108	V49-F110 HydrophobicContact CB-CZ 4.3Å; V49-F110 HydrophobicContact CG1-CE2 4.42Å; V49-F110 HydrophobicContact CG1-CZ 3.99Å; V49-F110 HydrophobicContact CG2-CD1 4.48Å; V49-F110 HydrophobicContact CG2-CE1 3.72Å; V49-F110 HydrophobicContact CG2-CZ 3.78Å; V59-F110 HydrophobicContact CB-CB 4.15Å; V59-F110 HydrophobicContact CB-CD1 4.21Å; V59-F110 HydrophobicContact CB-CG 4.38Å; V59-F110 HydrophobicContact CG1-CB 4.24Å; V59-F110 HydrophobicContact CG2-CD1 3.88Å; V59-F110 HydrophobicContact CG2-CE1 4.38Å; V59-F110 HydrophobicContact CG2-CG 4.26Å; V60-F110 WeakPolarHBondContact O-CA 3.37Å; T61-F110 HydrophobicContact CG2-CD1 4.2Å; T61-F110 HydrophobicContact CG2-CE1 3.97Å; I97-F110 HydrophobicContact CD1-CB 3.51Å; I97-F110 HydrophobicContact CD1-CD2 4.19Å; I97-F110 HydrophobicContact CD1-CG 4.26Å; I97-F110 HydrophobicContact CG1-CB 3.86Å; I97-F110 PolarHBondContact N-O 2.97Å; G108-F110 PolarHBondContact O-N 3.18Å
111	Y	98.3	Very high	96.6	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	162.2	177.4	-66.5	-94.1	0	0	0	111.6	V59 V60 I65 I94 F95 P96 T103 M104 K105 T109	V59-Y111 WeakPolarHBondContact CA-O 3.3Å; V60-Y111 PolarHBondContact N-O 3.5Å; V60-Y111 PolarHBondContact O-N 2.8Å; I65-Y111 HydrophobicContact CD1-CD2 4.24Å; I65-Y111 HydrophobicContact CD1-CG 4.11Å; I94-Y111 HydrophobicContact CG2-CD1 3.93Å; I94-Y111 HydrophobicContact CG2-CG 4.14Å; F95-Y111 CarbonylContact O-C 3.38Å; F95-Y111 VanDerWaalsContact O-CA 3.28Å; F95-Y111 WeakPolarHBondContact O-CA 3.45Å; P96-Y111 HydrophobicContact CB-CD1 4.09Å; P96-Y111 HydrophobicContact CB-CE1 3.74Å; P96-Y111 HydrophobicContact CG-CE1 4.2Å; T103-Y111 VanDerWaalsContact O-CE1 3.28Å; T103-Y111 WeakPolarHBondContact O-CE1 3.43Å; T103-Y111 PolarHBondContact O-OH 3.25Å; M104-Y111 VanDerWaalsContact CA-OH 3.32Å; M104-Y111 WeakPolarHBondContact CA-OH 3.18Å; M104-Y111 HydrophobicContact SD-CE1 4.39Å; M104-Y111 HydrophobicContact SD-CE2 4.33Å; K105-Y111 PolarHBondContact N-OH 3.32Å; T109-Y111 HydrophobicContact CG2-CD2 4.37Å; T109-Y111 HydrophobicContact CG2-CE2 3.68Å; T109-Y111 WeakPolarHBondContact O-CD2 3.36Å
112	R	97.8	Very high	96.2	Very high	18 Å²	18	43.8 Å²	43.8	7%	0.068	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.3	171.7	-74	177.4	-172.9	-74.8	-8.6	110.6	P57 S58 V59 I94 F95 I97	P57-R112 PolarHBondContact O-NH1 3.31Å; P57-R112 PolarHBondContact O-NH2 3.29Å; S58-R112 PolarHBondContact O-NH1 3.03Å; V59-R112 HydrophobicContact CG1-CG 4.19Å; I94-R112 CarbonylContact C-O 3.57Å; I94-R112 VanDerWaalsContact CA-O 3.29Å; I94-R112 WeakPolarHBondContact CA-O 3.4Å; F95-R112 WeakPolarHBondContact CD1-O 3.43Å; F95-R112 HydrophobicContact CD2-CB 4.39Å; F95-R112 HydrophobicContact CE1-CB 3.96Å; F95-R112 HydrophobicContact CE2-CB 3.83Å; F95-R112 HydrophobicContact CE2-CG 4.42Å; F95-R112 HydrophobicContact CZ-CB 3.59Å; F95-R112 HydrophobicContact CZ-CG 4.43Å; F95-R112 PolarHBondContact N-O 3.03Å; F95-R112 PolarHBondContact O-N 3.44Å; I97-R112 HydrophobicContact CG2-CB 4.41Å; I97-R112 HydrophobicContact CG2-CG 3.57Å
113	F	98.2	Very high	95.5	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.096	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138.6	165.1	-63.5	-72.3	0	0	0	110.6	I33 M36 Q37 I46 V60 I94	I33-F113 HydrophobicContact CD1-CD1 4.27Å; I33-F113 HydrophobicContact CD1-CE1 4.28Å; I33-F113 HydrophobicContact CG2-CD1 4.32Å; M36-F113 HydrophobicContact CB-CE1 3.96Å; M36-F113 HydrophobicContact CB-CZ 3.91Å; M36-F113 HydrophobicContact SD-CE1 4.16Å; Q37-F113 HydrophobicContact CG-CD1 4.01Å; Q37-F113 HydrophobicContact CG-CD2 3.62Å; Q37-F113 HydrophobicContact CG-CE1 4.07Å; Q37-F113 HydrophobicContact CG-CE2 3.68Å; Q37-F113 HydrophobicContact CG-CG 3.8Å; Q37-F113 HydrophobicContact CG-CZ 3.91Å; I46-F113 HydrophobicContact CD1-CD2 4.08Å; I46-F113 HydrophobicContact CD1-CE2 3.98Å; I46-F113 HydrophobicContact CG1-CE2 4.13Å; V60-F113 HydrophobicContact CG1-CE2 3.98Å; V60-F113 HydrophobicContact CG2-CE2 4.43Å; I94-F113 HydrophobicContact CD1-CD1 4.15Å; I94-F113 HydrophobicContact CD1-CE1 3.75Å; I94-F113 HydrophobicContact CG1-CD1 3.78Å; I94-F113 HydrophobicContact CG1-CE1 3.93Å
114	Q	98.2	Very high	95	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.019	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-78.5	144.8	175	-177.4	61	-79.1	0	0	111.4	G92 Y93 F95 F118 W119 Q195	G92-Q114 WeakPolarHBondContact O-CB 3.31Å; G92-Q114 WeakPolarHBondContact O-CG 3.48Å; Y93-Q114 WeakPolarHBondContact O-CB 3.49Å; Y93-Q114 PolarHBondContact O-N 3.3Å; F95-Q114 HydrophobicContact CD1-CB 4.27Å; F95-Q114 HydrophobicContact CE1-CB 4.16Å; Q114-F118 HydrophobicContact CG-CB 3.71Å; Q114-W119 PolarHBondContact O-NE1 3.28Å; Q114-Q195 PolarHBondContact NE2-O 3.46Å; Q114-Q195 VanDerWaalsContact OE1-CB 3.28Å
115	A	97	Very high	94.5	Very high	23 Å²	23	56 Å²	56	19%	0.19	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-65.4	138.4	174.9	0	0	0	0	0	110.6	Y117 F118	A115-Y117 PolarHBondContact O-N 2.77Å; A115-F118 HydrophobicContact CB-CD2 4.27Å; A115-F118 PolarHBondContact O-N 2.76Å
116	P	96.9	Very high	94.3	Very high	79 Å²	79	52.6 Å²	52.6	51%	0.513	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-53.9	-27.1	179.1	-29.2	35.4	0	0	0	115.2	F118 W119 N122	P116-F118 VanDerWaalsContact C-N 3.26Å; P116-F118 PolarHBondContact O-N 3.31Å; P116-W119 HydrophobicContact CB-CD2 4.05Å; P116-W119 HydrophobicContact CB-CE3 4.16Å; P116-W119 HydrophobicContact CB-CH2 4.45Å; P116-W119 HydrophobicContact CB-CZ2 4.3Å; P116-W119 HydrophobicContact CB-CZ3 4.37Å; P116-W119 HydrophobicContact CG-CH2 4.22Å; P116-W119 HydrophobicContact CG-CZ2 3.92Å; P116-W119 WeakPolarHBondContact O-CB 3.28Å; P116-W119 PolarHBondContact O-N 2.8Å; P116-N122 PolarHBondContact O-ND2 3.36Å
117	Y	95.7	Very high	94.2	Very high	145 Å²	145	55.4 Å²	55.4	57%	0.569	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-55.7	-39.7	172.6	175.5	-106.3	0	0	0	112.8	A115 W119 N122 W124	A115-Y117 PolarHBondContact O-N 2.77Å; Y117-W119 VanDerWaalsContact C-N 3.35Å; Y117-N122 PolarHBondContact O-ND2 2.87Å; Y117-W124 HydrophobicContact CD1-CZ2 4.24Å; Y117-W124 HydrophobicContact CD2-CZ2 4.15Å; Y117-W124 HydrophobicContact CE1-CH2 4Å; Y117-W124 AromaticContact CE1-CZ2 3.84Å; Y117-W124 HydrophobicContact CE1-CZ2 3.84Å; Y117-W124 AromaticContact CE2-CH2 3.86Å; Y117-W124 HydrophobicContact CE2-CH2 3.86Å; Y117-W124 AromaticContact CE2-CZ2 3.74Å; Y117-W124 HydrophobicContact CE2-CZ2 3.74Å; Y117-W124 HydrophobicContact CG-CZ2 4.4Å; Y117-W124 AromaticContact CZ-CH2 3.47Å; Y117-W124 VanDerWaalsContact CZ-CH2 3.47Å; Y117-W124 AromaticContact CZ-CZ2 3.59Å; Y117-W124 VanDerWaalsContact O-CZ2 3.31Å; Y117-W124 WeakPolarHBondContact O-CZ2 3.49Å; Y117-W124 PolarHBondContact O-NE1 2.65Å; Y117-W124 WeakPolarHBondContact OH-CH2 3.23Å
118	F	97.1	Very high	94.1	Very high	39 Å²	39	56 Å²	56	17%	0.171	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-90.7	7.5	-178.4	-66.6	-58.1	0	0	0	113.7	Q114 A115 P116 Q195 E196 F199	Q114-F118 HydrophobicContact CG-CB 3.71Å; A115-F118 HydrophobicContact CB-CD2 4.27Å; A115-F118 PolarHBondContact O-N 2.76Å; P116-F118 VanDerWaalsContact C-N 3.26Å; P116-F118 PolarHBondContact O-N 3.31Å; F118-Q195 HydrophobicContact CD2-CB 4.28Å; F118-Q195 HydrophobicContact CE2-CB 4.14Å; F118-E196 HydrophobicContact CZ-CB 4.49Å; F118-F199 HydrophobicContact CB-CB 4.35Å; F118-F199 HydrophobicContact CB-CD2 4.07Å; F118-F199 HydrophobicContact CD1-CB 3.83Å; F118-F199 HydrophobicContact CD1-CD1 4.45Å; F118-F199 AromaticContact CD1-CD2 3.51Å; F118-F199 HydrophobicContact CD1-CD2 3.51Å; F118-F199 HydrophobicContact CD1-CE2 4.15Å; F118-F199 AromaticContact CD1-CG 3.67Å; F118-F199 HydrophobicContact CD1-CG 3.67Å; F118-F199 HydrophobicContact CE1-CB 4.27Å; F118-F199 HydrophobicContact CE1-CD2 4.33Å; F118-F199 HydrophobicContact CE1-CG 4.13Å; F118-F199 HydrophobicContact CG-CB 4.1Å; F118-F199 HydrophobicContact CG-CD2 4.16Å; F118-F199 HydrophobicContact CG-CG 4.36Å
119	W	95.8	Very high	94.2	Very high	27 Å²	27	55.6 Å²	55.6	10%	0.102	28%	0.282	C	S	.	.			trans	-68.7	143.4	179	-70.7	-1.1	0	0	0	111.9	E30 I33 Y93 Q114 P116 Y117 S121 N122	E30-W119 HydrophobicContact CB-CE3 4.34Å; E30-W119 HydrophobicContact CB-CH2 4.32Å; E30-W119 HydrophobicContact CB-CZ3 3.83Å; E30-W119 HydrophobicContact CG-CD2 4.13Å; E30-W119 HydrophobicContact CG-CE3 3.45Å; E30-W119 VanDerWaalsContact CG-CE3 3.45Å; E30-W119 HydrophobicContact CG-CH2 4.13Å; E30-W119 HydrophobicContact CG-CZ3 3.44Å; E30-W119 VanDerWaalsContact CG-CZ3 3.44Å; I33-W119 HydrophobicContact CG2-CH2 4.39Å; I33-W119 HydrophobicContact CG2-CZ2 3.83Å; Y93-W119 AromaticContact CD1-CD1 3.72Å; Y93-W119 AromaticContact CD1-CD2 3.95Å; Y93-W119 HydrophobicContact CD1-CD2 3.95Å; Y93-W119 AromaticContact CD1-CE2 3.83Å; Y93-W119 AromaticContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CZ2 4.5Å; Y93-W119 AromaticContact CD1-NE1 3.71Å; Y93-W119 HydrophobicContact CE1-CB 3.91Å; Y93-W119 AromaticContact CE1-CD1 3.87Å; Y93-W119 AromaticContact CE1-CD2 3.62Å; Y93-W119 HydrophobicContact CE1-CD2 3.62Å; Y93-W119 AromaticContact CE1-CE2 4Å; Y93-W119 HydrophobicContact CE1-CE3 4.13Å; Y93-W119 AromaticContact CE1-CG 3.53Å; Y93-W119 HydrophobicContact CE1-CG 3.53Å; Q114-W119 PolarHBondContact O-NE1 3.28Å; P116-W119 HydrophobicContact CB-CD2 4.05Å; P116-W119 HydrophobicContact CB-CE3 4.16Å; P116-W119 HydrophobicContact CB-CH2 4.45Å; P116-W119 HydrophobicContact CB-CZ2 4.3Å; P116-W119 HydrophobicContact CB-CZ3 4.37Å; P116-W119 HydrophobicContact CG-CH2 4.22Å; P116-W119 HydrophobicContact CG-CZ2 3.92Å; P116-W119 WeakPolarHBondContact O-CB 3.28Å; P116-W119 PolarHBondContact O-N 2.8Å; Y117-W119 VanDerWaalsContact C-N 3.35Å; W119-S121 PolarHBondContact O-N 3.18Å; W119-N122 WeakPolarHBondContact O-CB 3.17Å; W119-N122 PolarHBondContact O-N 3.34Å; W119-N122 VanDerWaalsContact O-N 3.11Å
120	P	92	Very high	94.1	Very high	16 Å²	16	57.6 Å²	57.6	10%	0.104	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-66.4	-19.2	-177.7	27.5	-36.3	0	0	0	113.6	Y26 Y93 N122 C123	Y26-P120 HydrophobicContact CD1-CB 4.43Å; Y26-P120 HydrophobicContact CD1-CG 3.99Å; Y26-P120 HydrophobicContact CE1-CB 4.1Å; Y26-P120 HydrophobicContact CE1-CG 4.04Å; Y26-P120 HydrophobicContact CE2-CB 4.35Å; Y26-P120 HydrophobicContact CG-CG 4.41Å; Y93-P120 HydrophobicContact CE2-CG 3.64Å; Y93-P120 WeakPolarHBondContact OH-CG 3.45Å; P120-N122 PolarHBondContact O-N 3.02Å; P120-C123 PolarHBondContact O-N 2.85Å
121	S	90.8	Very high	94.2	Very high	20 Å²	20	55 Å²	55	14%	0.14	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62.3	-20.4	171.5	51.2	0	0	0	0	113.8	M23 E30 W119 C123	M23-S121 WeakPolarHBondContact CE-O 3.5Å; E30-S121 WeakPolarHBondContact OE1-CB 3.29Å; E30-S121 PolarHBondContact OE1-OG 2.88Å; W119-S121 PolarHBondContact O-N 3.18Å; S121-C123 PolarHBondContact O-N 3.28Å; S121-C123 VanDerWaalsContact O-N 3.17Å
122	N	88.8	Confident	94.2	Very high	86 Å²	86	55 Å²	55	46%	0.46	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-74	3.9	171.1	-63.6	-35.8	0	0	0	113	P116 Y117 W119 P120 W124	P116-N122 PolarHBondContact O-ND2 3.36Å; Y117-N122 PolarHBondContact O-ND2 2.87Å; W119-N122 WeakPolarHBondContact O-CB 3.17Å; W119-N122 PolarHBondContact O-N 3.34Å; W119-N122 VanDerWaalsContact O-N 3.11Å; P120-N122 PolarHBondContact O-N 3.02Å; N122-W124 PolarHBondContact O-N 3.36Å
123	C	83.1	Confident	94.2	Very high	74 Å²	74	54.5 Å²	54.5	50%	0.5	28%	0.278	S	S	.	.			trans	54.8	47.2	175.7	-64.5	0	0	0	0	113	P120 S121 E125	P120-C123 PolarHBondContact O-N 2.85Å; S121-C123 PolarHBondContact O-N 3.28Å; S121-C123 VanDerWaalsContact O-N 3.17Å; C123-E125 PolarHBondContact O-N 2.84Å
124	W	86.1	Confident	94.1	Very high	78 Å²	78	53.8 Å²	53.8	30%	0.295	28%	0.275	S	S	.	.			trans	-61.8	126.2	178.5	-74.4	107.7	0	0	0	112.7	Y117 N122 P126 F199 H203	Y117-W124 HydrophobicContact CD1-CZ2 4.24Å; Y117-W124 HydrophobicContact CD2-CZ2 4.15Å; Y117-W124 HydrophobicContact CE1-CH2 4Å; Y117-W124 AromaticContact CE1-CZ2 3.84Å; Y117-W124 HydrophobicContact CE1-CZ2 3.84Å; Y117-W124 AromaticContact CE2-CH2 3.86Å; Y117-W124 HydrophobicContact CE2-CH2 3.86Å; Y117-W124 AromaticContact CE2-CZ2 3.74Å; Y117-W124 HydrophobicContact CE2-CZ2 3.74Å; Y117-W124 HydrophobicContact CG-CZ2 4.4Å; Y117-W124 AromaticContact CZ-CH2 3.47Å; Y117-W124 VanDerWaalsContact CZ-CH2 3.47Å; Y117-W124 AromaticContact CZ-CZ2 3.59Å; Y117-W124 VanDerWaalsContact O-CZ2 3.31Å; Y117-W124 WeakPolarHBondContact O-CZ2 3.49Å; Y117-W124 PolarHBondContact O-NE1 2.65Å; Y117-W124 WeakPolarHBondContact OH-CH2 3.23Å; N122-W124 PolarHBondContact O-N 3.36Å; W124-P126 VanDerWaalsContact C-CD 3.48Å; W124-F199 HydrophobicContact CB-CE2 4.01Å; W124-F199 HydrophobicContact CB-CZ 4.33Å; W124-F199 AromaticContact CD1-CE2 3.91Å; W124-F199 AromaticContact CD2-CE2 3.84Å; W124-F199 HydrophobicContact CD2-CE2 3.84Å; W124-F199 HydrophobicContact CD2-CZ 4.13Å; W124-F199 HydrophobicContact CE3-CE2 4.37Å; W124-F199 HydrophobicContact CE3-CZ 4.2Å; W124-F199 AromaticContact CG-CE2 3.66Å; W124-F199 HydrophobicContact CG-CE2 3.66Å; W124-F199 HydrophobicContact CG-CZ 4.21Å; W124-H203 PolarHBondContact O-CE1 2.91Å
125	E	86.7	Confident	94.1	Very high	179 Å²	179	53.6 Å²	53.6	84%	0.836	27%	0.274	S	S	*	.			trans	-122.8	69.4	169.7	-66.5	-170.6	163	0	0	110.1	C123 E127	C123-E125 PolarHBondContact O-N 2.84Å; E125-E127 PolarHBondContact O-N 2.69Å
126	P	92.4	Very high	94.1	Very high	17 Å²	17	52.7 Å²	52.7	11%	0.11	27%	0.266	C	S	.	.			trans	-69.8	133.8	-172.4	27.8	-34	0	0	0	112.4	W124 F199 W200 H203 R204	W124-P126 VanDerWaalsContact C-CD 3.48Å; P126-F199 HydrophobicContact CB-CE1 4.17Å; P126-F199 HydrophobicContact CB-CZ 4.02Å; P126-F199 HydrophobicContact CG-CE1 4.25Å; P126-F199 HydrophobicContact CG-CZ 3.92Å; P126-W200 HydrophobicContact CB-CH2 3.66Å; P126-W200 HydrophobicContact CB-CZ3 3.82Å; P126-W200 HydrophobicContact CG-CH2 4.4Å; P126-W200 HydrophobicContact CG-CZ3 4.07Å; P126-H203 HydrophobicContact CG-CB 3.71Å; P126-H203 VanDerWaalsContact CG-CG 3.49Å; P126-R204 PolarHBondContact O-NH2 3.11Å
127	E	94.7	Very high	94	Very high	126 Å²	126	49.2 Å²	49.2	59%	0.589	24%	0.243	S	C	*	.			trans	-80.5	164	-176.7	-62.5	-170.7	178.9	0	0	112.1	E125 T129 D130 Y131	E125-E127 PolarHBondContact O-N 2.69Å; E127-T129 PolarHBondContact O-N 2.96Å; E127-D130 WeakPolarHBondContact CB-OD2 3.4Å; E127-D130 PolarHBondContact N-OD2 3.24Å; E127-D130 PolarHBondContact O-N 3.5Å; E127-Y131 PolarHBondContact O-N 3.42Å
128	N	96.5	Very high	94	Very high	79 Å²	79	42.9 Å²	42.9	42%	0.422	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-25.4	173.3	-73.8	-22	0	0	0	112.9	A132 L159 F163 R204	N128-A132 WeakPolarHBondContact O-CB 3.4Å; N128-A132 PolarHBondContact O-N 2.83Å; N128-L159 HydrophobicContact CB-CD2 3.85Å; N128-F163 HydrophobicContact CB-CE2 3.93Å; N128-F163 HydrophobicContact CB-CZ 3.83Å; N128-R204 PolarHBondContact OD1-NH2 3.39Å
129	T	96.9	Very high	93.9	Very high	45 Å²	45	44 Å²	44	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-45.1	174.3	-48.6	0	0	0	0	110.6	E127 Y131 A132 I133 I170	E127-T129 PolarHBondContact O-N 2.96Å; T129-Y131 VanDerWaalsContact C-N 3.32Å; T129-Y131 PolarHBondContact O-N 3.13Å; T129-A132 WeakPolarHBondContact O-CB 3.31Å; T129-A132 PolarHBondContact O-N 3.27Å; T129-I133 HydrophobicContact CG2-CD1 4.35Å; T129-I133 WeakPolarHBondContact O-CG1 3.44Å; T129-I133 PolarHBondContact O-N 3.36Å; T129-I170 HydrophobicContact CG2-CG1 4.35Å
130	D	96.6	Very high	93.7	Very high	73 Å²	73	44.7 Å²	44.7	39%	0.39	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-42.1	178.3	-56.8	-50.7	0	0	0	111.3	E127 A132 I133 Y134 W200	E127-D130 WeakPolarHBondContact CB-OD2 3.4Å; E127-D130 PolarHBondContact N-OD2 3.24Å; E127-D130 PolarHBondContact O-N 3.5Å; D130-A132 PolarHBondContact O-N 3.36Å; D130-I133 PolarHBondContact O-N 3.01Å; D130-Y134 PolarHBondContact O-N 3.05Å; D130-W200 HydrophobicContact CB-CH2 3.79Å; D130-W200 HydrophobicContact CB-CZ2 3.91Å
131	Y	98	Very high	93.3	Very high	4 Å²	4	45 Å²	45	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-38.7	177.4	-169.8	-136.3	0	0	0	112	E127 T129 I133 Y134 L135 N155 L159 W200 R204	E127-Y131 PolarHBondContact O-N 3.42Å; T129-Y131 VanDerWaalsContact C-N 3.32Å; T129-Y131 PolarHBondContact O-N 3.13Å; Y131-I133 PolarHBondContact O-N 3.29Å; Y131-Y134 AromaticContact CD2-CD1 3.95Å; Y131-Y134 HydrophobicContact CD2-CD1 3.95Å; Y131-Y134 AromaticContact CE2-CD1 3.93Å; Y131-Y134 HydrophobicContact CE2-CD1 3.93Å; Y131-Y134 HydrophobicContact CE2-CE1 4.31Å; Y131-Y134 PolarHBondContact O-N 2.82Å; Y131-L135 HydrophobicContact CD1-CD1 4Å; Y131-L135 HydrophobicContact CD2-CD1 4.41Å; Y131-L135 HydrophobicContact CD2-CG 4.2Å; Y131-L135 HydrophobicContact CE1-CD1 3.64Å; Y131-L135 HydrophobicContact CE1-CG 4.37Å; Y131-L135 HydrophobicContact CE2-CD1 4.08Å; Y131-L135 HydrophobicContact CE2-CD2 3.96Å; Y131-L135 HydrophobicContact CE2-CG 3.9Å; Y131-L135 HydrophobicContact CG-CD1 4.36Å; Y131-L135 WeakPolarHBondContact O-CG 3.46Å; Y131-L135 PolarHBondContact O-N 3.27Å; Y131-N155 HydrophobicContact CE1-CB 3.93Å; Y131-L159 HydrophobicContact CD1-CD1 3.69Å; Y131-L159 HydrophobicContact CE1-CD1 4.35Å; Y131-L159 HydrophobicContact CG-CD1 4.4Å; Y131-W200 VanDerWaalsContact CA-CH2 3.48Å; Y131-W200 AromaticContact CD2-CD2 3.56Å; Y131-W200 HydrophobicContact CD2-CD2 3.56Å; Y131-W200 AromaticContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CE3 3.4Å; Y131-W200 VanDerWaalsContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CG 4.09Å; Y131-W200 HydrophobicContact CD2-CH2 4.24Å; Y131-W200 HydrophobicContact CD2-CZ2 4.39Å; Y131-W200 AromaticContact CD2-CZ3 3.78Å; Y131-W200 HydrophobicContact CD2-CZ3 3.78Å; Y131-W200 HydrophobicContact CE2-CB 4.27Å; Y131-W200 HydrophobicContact CE2-CD2 4.15Å; Y131-W200 HydrophobicContact CE2-CE3 4.08Å; Y131-W200 HydrophobicContact CE2-CG 4.25Å; Y131-W200 HydrophobicContact CG-CE3 4.03Å; Y131-W200 HydrophobicContact CG-CH2 4.34Å; Y131-W200 AromaticContact CG-CZ3 3.95Å; Y131-W200 HydrophobicContact CG-CZ3 3.95Å; Y131-W200 VanDerWaalsContact N-CH2 3.3Å; Y131-R204 HydrophobicContact CD1-CG 3.85Å; Y131-R204 HydrophobicContact CD2-CG 4.02Å; Y131-R204 HydrophobicContact CE1-CB 4.06Å; Y131-R204 HydrophobicContact CE1-CG 3.83Å; Y131-R204 HydrophobicContact CE2-CB 4.03Å; Y131-R204 HydrophobicContact CE2-CG 4.02Å; Y131-R204 HydrophobicContact CG-CG 3.96Å
132	A	97.9	Very high	92.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-40.7	175.5	0	0	0	0	0	112	N128 T129 D130 C136 L159 F163 W167 I170	N128-A132 WeakPolarHBondContact O-CB 3.4Å; N128-A132 PolarHBondContact O-N 2.83Å; T129-A132 WeakPolarHBondContact O-CB 3.31Å; T129-A132 PolarHBondContact O-N 3.27Å; D130-A132 PolarHBondContact O-N 3.36Å; A132-C136 WeakPolarHBondContact O-CB 3.46Å; A132-C136 PolarHBondContact O-N 3.21Å; A132-L159 HydrophobicContact CB-CB 4.11Å; A132-L159 HydrophobicContact CB-CD1 3.95Å; A132-L159 HydrophobicContact CB-CG 4.49Å; A132-F163 HydrophobicContact CB-CD2 4.34Å; A132-W167 HydrophobicContact CB-CZ3 4.36Å; A132-I170 HydrophobicContact CB-CD1 4.1Å; A132-I170 HydrophobicContact CB-CG2 4.09Å
133	I	97.8	Very high	92.6	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.046	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-45.8	174.3	-63.8	161.9	0	0	0	110.2	T129 D130 Y131 C136 K137 I170 Q173 A174	T129-I133 HydrophobicContact CG2-CD1 4.35Å; T129-I133 WeakPolarHBondContact O-CG1 3.44Å; T129-I133 PolarHBondContact O-N 3.36Å; D130-I133 PolarHBondContact O-N 3.01Å; Y131-I133 PolarHBondContact O-N 3.29Å; I133-C136 PolarHBondContact O-N 3.5Å; I133-K137 WeakPolarHBondContact O-CB 3.36Å; I133-K137 PolarHBondContact O-N 3.49Å; I133-I170 HydrophobicContact CG1-CG2 3.94Å; I133-Q173 HydrophobicContact CD1-CB 4.29Å; I133-Q173 HydrophobicContact CG1-CB 4.39Å; I133-Q173 HydrophobicContact CG2-CB 4.44Å; I133-A174 HydrophobicContact CG2-CB 4.21Å
134	Y	97.6	Very high	92.7	Very high	7 Å²	7	50.2 Å²	50.2	3%	0.027	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-50.5	178.1	167.6	-104.2	0	0	0	112.6	D130 Y131 K137 R138 E196 R197 W200	D130-Y134 PolarHBondContact O-N 3.05Å; Y131-Y134 AromaticContact CD2-CD1 3.95Å; Y131-Y134 HydrophobicContact CD2-CD1 3.95Å; Y131-Y134 AromaticContact CE2-CD1 3.93Å; Y131-Y134 HydrophobicContact CE2-CD1 3.93Å; Y131-Y134 HydrophobicContact CE2-CE1 4.31Å; Y131-Y134 PolarHBondContact O-N 2.82Å; Y134-K137 WeakPolarHBondContact O-CB 3.45Å; Y134-K137 PolarHBondContact O-N 2.9Å; Y134-R138 HydrophobicContact CE2-CG 4.31Å; Y134-R138 PolarHBondContact O-N 2.97Å; Y134-R138 VanDerWaalsContact OH-CD 3.28Å; Y134-R138 WeakPolarHBondContact OH-CD 3.45Å; Y134-R138 PolarHBondContact OH-NH1 3.41Å; Y134-R138 VanDerWaalsContact OH-NH1 3.08Å; Y134-E196 HydrophobicContact CD2-CG 3.84Å; Y134-E196 HydrophobicContact CE2-CB 4.47Å; Y134-E196 HydrophobicContact CE2-CG 3.86Å; Y134-R197 VanDerWaalsContact OH-CA 3.29Å; Y134-R197 WeakPolarHBondContact OH-CA 3.26Å; Y134-R197 WeakPolarHBondContact OH-CB 3.34Å; Y134-W200 HydrophobicContact CD1-CB 4.42Å; Y134-W200 AromaticContact CD1-CD1 3.41Å; Y134-W200 VanDerWaalsContact CD1-CD1 3.41Å; Y134-W200 HydrophobicContact CD1-CD2 4.38Å; Y134-W200 AromaticContact CD1-CG 3.82Å; Y134-W200 HydrophobicContact CD1-CG 3.82Å; Y134-W200 AromaticContact CD1-NE1 3.73Å; Y134-W200 AromaticContact CD2-CD1 3.44Å; Y134-W200 VanDerWaalsContact CD2-CD1 3.44Å; Y134-W200 AromaticContact CD2-NE1 3.51Å; Y134-W200 HydrophobicContact CE1-CB 4.09Å; Y134-W200 AromaticContact CE1-CD1 3.6Å; Y134-W200 AromaticContact CE1-CG 3.94Å; Y134-W200 HydrophobicContact CE1-CG 3.94Å; Y134-W200 AromaticContact CE2-CD1 3.61Å; Y134-W200 AromaticContact CG-CD1 3.32Å; Y134-W200 HydrophobicContact CG-CG 4.14Å; Y134-W200 AromaticContact CG-NE1 3.25Å; Y134-W200 AromaticContact CZ-CD1 3.69Å
135	L	97.7	Very high	92.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-43.9	179.4	-67.7	177	0	0	0	111.5	Y131 K137 R138 T139 L148 E152 N155 L156 L159	Y131-L135 HydrophobicContact CD1-CD1 4Å; Y131-L135 HydrophobicContact CD2-CD1 4.41Å; Y131-L135 HydrophobicContact CD2-CG 4.2Å; Y131-L135 HydrophobicContact CE1-CD1 3.64Å; Y131-L135 HydrophobicContact CE1-CG 4.37Å; Y131-L135 HydrophobicContact CE2-CD1 4.08Å; Y131-L135 HydrophobicContact CE2-CD2 3.96Å; Y131-L135 HydrophobicContact CE2-CG 3.9Å; Y131-L135 HydrophobicContact CG-CD1 4.36Å; Y131-L135 WeakPolarHBondContact O-CG 3.46Å; Y131-L135 PolarHBondContact O-N 3.27Å; L135-K137 VanDerWaalsContact C-N 3.33Å; L135-K137 PolarHBondContact O-N 3.18Å; L135-R138 WeakPolarHBondContact O-CB 3.43Å; L135-R138 PolarHBondContact O-N 2.9Å; L135-T139 PolarHBondContact O-N 3.38Å; L135-T139 VanDerWaalsContact O-N 3.11Å; L135-L148 HydrophobicContact CD2-CD2 3.82Å; L135-E152 HydrophobicContact CD2-CB 3.94Å; L135-E152 HydrophobicContact CD2-CG 4.39Å; L135-N155 HydrophobicContact CD1-CB 4.24Å; L135-L156 HydrophobicContact CB-CB 4.4Å; L135-L156 HydrophobicContact CB-CD1 3.87Å; L135-L156 HydrophobicContact CD1-CB 4.01Å; L135-L159 HydrophobicContact CD1-CD1 4.04Å
136	C	96.8	Very high	92.5	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.02	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-41.9	175.5	-172.9	0	0	0	0	111.5	A132 I133 R138 T139 M140 W167 I170 A174	A132-C136 WeakPolarHBondContact O-CB 3.46Å; A132-C136 PolarHBondContact O-N 3.21Å; I133-C136 PolarHBondContact O-N 3.5Å; C136-R138 VanDerWaalsContact C-N 3.3Å; C136-R138 PolarHBondContact O-N 3.48Å; C136-T139 PolarHBondContact O-N 3.33Å; C136-T139 PolarHBondContact O-OG1 3.19Å; C136-M140 WeakPolarHBondContact O-CG 3.49Å; C136-M140 PolarHBondContact O-N 3.18Å; C136-W167 HydrophobicContact CB-CH2 4.28Å; C136-W167 HydrophobicContact CB-CZ2 4.37Å; C136-I170 HydrophobicContact CB-CG2 4.48Å; C136-A174 HydrophobicContact CB-CB 3.99Å
137	K	95.7	Very high	92.4	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-42.5	175.4	179.9	175.9	68.6	-176.4	0	111.1	I133 Y134 L135 M140 Q141 A174 Q177 V178 E196	I133-K137 WeakPolarHBondContact O-CB 3.36Å; I133-K137 PolarHBondContact O-N 3.49Å; Y134-K137 WeakPolarHBondContact O-CB 3.45Å; Y134-K137 PolarHBondContact O-N 2.9Å; L135-K137 VanDerWaalsContact C-N 3.33Å; L135-K137 PolarHBondContact O-N 3.18Å; K137-M140 PolarHBondContact O-N 3.04Å; K137-Q141 WeakPolarHBondContact O-CG 3.47Å; K137-A174 HydrophobicContact CB-CB 4.15Å; K137-Q177 HydrophobicContact CD-CB 3.76Å; K137-V178 HydrophobicContact CG-CG2 3.65Å; K137-E196 WeakPolarHBondContact CE-OE2 3.45Å; K137-E196 IonicContact NZ-OE1 2.82Å; K137-E196 PolarHBondContact NZ-OE1 3.39Å; K137-E196 IonicContact NZ-OE2 2.9Å; K137-E196 PolarHBondContact NZ-OE2 3.36Å
138	R	95	Very high	92.4	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.045	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-43.8	178.7	-82.4	-176.2	59.8	-167.7	-8.2	112.9	Y134 L135 C136 M140 Q141 L146 E147 L148 E152	Y134-R138 HydrophobicContact CE2-CG 4.31Å; Y134-R138 PolarHBondContact O-N 2.97Å; Y134-R138 VanDerWaalsContact OH-CD 3.28Å; Y134-R138 WeakPolarHBondContact OH-CD 3.45Å; Y134-R138 PolarHBondContact OH-NH1 3.41Å; Y134-R138 VanDerWaalsContact OH-NH1 3.08Å; L135-R138 WeakPolarHBondContact O-CB 3.43Å; L135-R138 PolarHBondContact O-N 2.9Å; C136-R138 VanDerWaalsContact C-N 3.3Å; C136-R138 PolarHBondContact O-N 3.48Å; R138-M140 PolarHBondContact O-N 2.92Å; R138-Q141 PolarHBondContact O-N 3.08Å; R138-L146 PolarHBondContact NE-O 3.35Å; R138-L146 PolarHBondContact NH2-O 3.42Å; R138-E147 PolarHBondContact NH2-O 3.22Å; R138-L148 HydrophobicContact CB-CD2 3.91Å; R138-E152 IonicContact CZ-OE1 2.72Å; R138-E152 IonicContact CZ-OE2 2.66Å; R138-E152 VanDerWaalsContact CZ-OE2 3.27Å; R138-E152 IonicContact NH1-OE1 3.44Å; R138-E152 PolarHBondContact NH1-OE1 2.97Å; R138-E152 IonicContact NH1-OE2 3.95Å; R138-E152 PolarHBondContact NH1-OE2 2.89Å; R138-E152 IonicContact NH2-OE1 3.08Å; R138-E152 IonicContact NH2-OE2 3.7Å; R138-E152 PolarHBondContact NH2-OE2 3.24Å
139	T	93.9	Very high	92.3	Very high	63 Å²	63	43 Å²	43	39%	0.387	23%	0.23	S	C	.	.	H	α-helix	trans	-63.2	-26.3	178.2	56.3	0	0	0	0	112.7	L135 C136 Q141 N142 L148 L156	L135-T139 PolarHBondContact O-N 3.38Å; L135-T139 VanDerWaalsContact O-N 3.11Å; C136-T139 PolarHBondContact O-N 3.33Å; C136-T139 PolarHBondContact O-OG1 3.19Å; T139-Q141 VanDerWaalsContact C-N 3.34Å; T139-Q141 PolarHBondContact O-N 2.98Å; T139-N142 PolarHBondContact O-OD1 2.98Å; T139-L148 HydrophobicContact CG2-CD1 3.5Å; T139-L148 HydrophobicContact CG2-CG 3.89Å; T139-L156 HydrophobicContact CG2-CD2 3.82Å
140	M	92.1	Very high	92.3	Very high	42 Å²	42	48 Å²	48	21%	0.207	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-11.7	-179.8	-65.1	171	82.8	0	0	114.4	C136 K137 R138 F171 A174 E175 V178	C136-M140 WeakPolarHBondContact O-CG 3.49Å; C136-M140 PolarHBondContact O-N 3.18Å; K137-M140 PolarHBondContact O-N 3.04Å; R138-M140 PolarHBondContact O-N 2.92Å; M140-F171 HydrophobicContact CE-CE1 4.18Å; M140-F171 HydrophobicContact CE-CE2 3.8Å; M140-F171 HydrophobicContact CE-CZ 3.61Å; M140-F171 HydrophobicContact CG-CE2 4.45Å; M140-F171 HydrophobicContact SD-CD2 4.38Å; M140-F171 HydrophobicContact SD-CE2 4.03Å; M140-F171 HydrophobicContact SD-CZ 4.44Å; M140-A174 HydrophobicContact SD-CB 4.04Å; M140-E175 HydrophobicContact CE-CB 3.69Å; M140-E175 HydrophobicContact CE-CG 3.67Å; M140-V178 HydrophobicContact CB-CG2 4.23Å
141	Q	84.5	Confident	92.3	Very high	23 Å²	23	45.8 Å²	45.8	11%	0.107	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-13.9	-174.1	-65.9	-157.5	36.9	0	0	114.3	K137 R138 T139 K143 L146	K137-Q141 WeakPolarHBondContact O-CG 3.47Å; R138-Q141 PolarHBondContact O-N 3.08Å; T139-Q141 VanDerWaalsContact C-N 3.34Å; T139-Q141 PolarHBondContact O-N 2.98Å; Q141-K143 VanDerWaalsContact C-N 3.33Å; Q141-K143 WeakPolarHBondContact O-CG 3.44Å; Q141-K143 PolarHBondContact O-N 3.32Å; Q141-L146 HydrophobicContact CB-CD1 3.64Å; Q141-L146 HydrophobicContact CG-CD1 3.95Å
142	N	81.1	Confident	92.2	Very high	150 Å²	150	45.7 Å²	45.7	80%	0.802	24%	0.241	S	C	*	.			trans	45.2	51	178.8	-64.6	-12.2	0	0	0	113.5	T139	T139-N142 PolarHBondContact O-OD1 2.98Å
143	K	84.4	Confident	92.2	Very high	62 Å²	62	47.8 Å²	47.8	27%	0.27	26%	0.258	S	S	.	.			trans	-129.3	129.4	177.2	-71	171.1	-168.1	159.5	0	109.3	Q141 R145 L146 E147	Q141-K143 VanDerWaalsContact C-N 3.33Å; Q141-K143 WeakPolarHBondContact O-CG 3.44Å; Q141-K143 PolarHBondContact O-N 3.32Å; K143-R145 VanDerWaalsContact C-N 3.27Å; K143-R145 HydrophobicContact CB-CG 4.41Å; K143-R145 PolarHBondContact O-N 2.76Å; K143-R145 VanDerWaalsContact O-N 3.15Å; K143-L146 HydrophobicContact CB-CB 4.45Å; K143-L146 HydrophobicContact CB-CD1 4.41Å; K143-L146 HydrophobicContact CB-CG 4.42Å; K143-L146 HydrophobicContact CD-CD1 4.16Å; K143-L146 WeakPolarHBondContact O-CA 3.38Å; K143-L146 PolarHBondContact O-N 3.17Å; K143-E147 PolarHBondContact O-N 2.59Å
144	A	83.6	Confident	92.2	Very high	76 Å²	76	54.1 Å²	54.1	63%	0.628	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-48.5	-45.1	178.9	0	0	0	0	0	113.7	L146 E147	A144-L146 PolarHBondContact O-N 2.94Å; A144-E147 WeakPolarHBondContact CA-OE1 3.31Å; A144-E147 WeakPolarHBondContact O-CB 3.42Å; A144-E147 PolarHBondContact O-N 3.07Å; A144-E147 VanDerWaalsContact O-N 3.11Å
145	R	82.3	Confident	92.2	Very high	110 Å²	110	55.1 Å²	55.1	42%	0.415	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-62.4	-12.5	177.9	78.2	179.7	176	92.7	11.3	115.6	K143 D193	K143-R145 VanDerWaalsContact C-N 3.27Å; K143-R145 HydrophobicContact CB-CG 4.41Å; K143-R145 PolarHBondContact O-N 2.76Å; K143-R145 VanDerWaalsContact O-N 3.15Å; R145-D193 IonicContact CZ-OD2 3.86Å; R145-D193 VanDerWaalsContact CZ-OD2 3.26Å; R145-D193 IonicContact NH1-OD2 3.89Å; R145-D193 PolarHBondContact NH1-OD2 3.5Å; R145-D193 IonicContact NH2-OD2 3.07Å; R145-D193 PolarHBondContact NH2-OD2 3.21Å
146	L	86.1	Confident	92.2	Very high	13 Å²	13	55.9 Å²	55.9	7%	0.068	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-115.7	1.5	-178.4	-64.8	-179.3	0	0	0	112	R138 Q141 K143 A144 D193	R138-L146 PolarHBondContact NE-O 3.35Å; R138-L146 PolarHBondContact NH2-O 3.42Å; Q141-L146 HydrophobicContact CB-CD1 3.64Å; Q141-L146 HydrophobicContact CG-CD1 3.95Å; K143-L146 HydrophobicContact CB-CB 4.45Å; K143-L146 HydrophobicContact CB-CD1 4.41Å; K143-L146 HydrophobicContact CB-CG 4.42Å; K143-L146 HydrophobicContact CD-CD1 4.16Å; K143-L146 WeakPolarHBondContact O-CA 3.38Å; K143-L146 PolarHBondContact O-N 3.17Å; A144-L146 PolarHBondContact O-N 2.94Å; L146-D193 HydrophobicContact CD2-CB 4.3Å
147	E	91.2	Very high	92.2	Very high	138 Å²	138	57.6 Å²	57.6	65%	0.645	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-54.4	141.9	173	-75.4	171.6	-174.5	0	0	109.5	R138 K143 A144	R138-E147 PolarHBondContact NH2-O 3.22Å; K143-E147 PolarHBondContact O-N 2.59Å; A144-E147 WeakPolarHBondContact CA-OE1 3.31Å; A144-E147 WeakPolarHBondContact O-CB 3.42Å; A144-E147 PolarHBondContact O-N 3.07Å; A144-E147 VanDerWaalsContact O-N 3.11Å
148	L	94.5	Very high	92.3	Very high	37 Å²	37	63.9 Å²	63.9	19%	0.194	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-72.3	136.2	179.6	-62.3	-172.1	0	0	0	108.9	L135 R138 T139 E152 A153 L156	L135-L148 HydrophobicContact CD2-CD2 3.82Å; R138-L148 HydrophobicContact CB-CD2 3.91Å; T139-L148 HydrophobicContact CG2-CD1 3.5Å; T139-L148 HydrophobicContact CG2-CG 3.89Å; L148-E152 HydrophobicContact CB-CB 4.02Å; L148-E152 HydrophobicContact CD2-CB 4.27Å; L148-A153 HydrophobicContact CB-CB 4.34Å; L148-L156 HydrophobicContact CD1-CB 4.31Å; L148-L156 HydrophobicContact CD1-CD2 3.62Å
149	A	94.9	Very high	92.5	Very high	31 Å²	31	63.7 Å²	63.7	26%	0.256	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-66.4	161.5	164.2	0	0	0	0	0	110.2	Y151 E152 A153	A149-Y151 VanDerWaalsContact C-N 3.3Å; A149-Y151 HydrophobicContact CB-CD1 3.67Å; A149-Y151 HydrophobicContact CB-CE1 3.53Å; A149-Y151 PolarHBondContact O-N 2.92Å; A149-E152 HydrophobicContact CB-CG 4.23Å; A149-E152 PolarHBondContact N-OE2 2.92Å; A149-E152 WeakPolarHBondContact O-CA 3.5Å; A149-E152 WeakPolarHBondContact O-CB 3.32Å; A149-E152 PolarHBondContact O-N 3.46Å; A149-A153 PolarHBondContact O-N 3.49Å
150	D	96.1	Very high	92.6	Very high	149 Å²	149	64.4 Å²	64.4	80%	0.797	33%	0.334	S	S	*	.	H	α-helix	trans	-55.5	-44.2	-176.3	-64.9	-29.9	0	0	0	112.6	E152 A153 E154	D150-E152 VanDerWaalsContact C-N 3.3Å; D150-E152 PolarHBondContact O-N 3.38Å; D150-A153 PolarHBondContact O-N 2.92Å; D150-E154 PolarHBondContact O-N 2.72Å
151	Y	96.4	Very high	92.9	Very high	27 Å²	27	71 Å²	71	11%	0.106	36%	0.356	C	S	.	.	H	α-helix	trans	-65.7	-32.1	177.4	80.6	-85.3	0	0	0	112.7	H100 A149 N155 V206 P207	H100-Y151 PolarHBondContact ND1-OH 2.99Å; A149-Y151 VanDerWaalsContact C-N 3.3Å; A149-Y151 HydrophobicContact CB-CD1 3.67Å; A149-Y151 HydrophobicContact CB-CE1 3.53Å; A149-Y151 PolarHBondContact O-N 2.92Å; Y151-N155 WeakPolarHBondContact O-CB 3.28Å; Y151-N155 VanDerWaalsContact O-CG 3.29Å; Y151-N155 PolarHBondContact O-N 3.47Å; Y151-N155 PolarHBondContact O-ND2 3.23Å; Y151-N155 VanDerWaalsContact O-ND2 3.08Å; Y151-V206 HydrophobicContact CE1-CG1 4.46Å; Y151-V206 HydrophobicContact CE1-CG2 4Å; Y151-P207 HydrophobicContact CD2-CG 4.45Å; Y151-P207 HydrophobicContact CG-CG 4.3Å
152	E	97.4	Very high	93.5	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-72.2	-39	175.8	-63.2	-173.5	118.5	0	0	111	H100 L135 R138 L148 A149 D150 N155 L156	H100-E152 IonicContact CE1-OE1 2.69Å; H100-E152 IonicContact CE1-OE2 2.68Å; H100-E152 IonicContact NE2-OE2 3.77Å; L135-E152 HydrophobicContact CD2-CB 3.94Å; L135-E152 HydrophobicContact CD2-CG 4.39Å; R138-E152 IonicContact CZ-OE1 2.72Å; R138-E152 IonicContact CZ-OE2 2.66Å; R138-E152 VanDerWaalsContact CZ-OE2 3.27Å; R138-E152 IonicContact NH1-OE1 3.44Å; R138-E152 PolarHBondContact NH1-OE1 2.97Å; R138-E152 IonicContact NH1-OE2 3.95Å; R138-E152 PolarHBondContact NH1-OE2 2.89Å; R138-E152 IonicContact NH2-OE1 3.08Å; R138-E152 IonicContact NH2-OE2 3.7Å; R138-E152 PolarHBondContact NH2-OE2 3.24Å; L148-E152 HydrophobicContact CB-CB 4.02Å; L148-E152 HydrophobicContact CD2-CB 4.27Å; A149-E152 HydrophobicContact CB-CG 4.23Å; A149-E152 PolarHBondContact N-OE2 2.92Å; A149-E152 WeakPolarHBondContact O-CA 3.5Å; A149-E152 WeakPolarHBondContact O-CB 3.32Å; A149-E152 PolarHBondContact O-N 3.46Å; D150-E152 VanDerWaalsContact C-N 3.3Å; D150-E152 PolarHBondContact O-N 3.38Å; E152-N155 WeakPolarHBondContact O-CB 3.45Å; E152-N155 PolarHBondContact O-N 3.39Å; E152-L156 WeakPolarHBondContact O-CB 3.49Å; E152-L156 PolarHBondContact O-N 3.28Å
153	A	97	Very high	94.3	Very high	44 Å²	44	68.3 Å²	68.3	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-65.4	-41.8	174.9	0	0	0	0	0	111.6	L148 A149 D150 L156 A157	L148-A153 HydrophobicContact CB-CB 4.34Å; A149-A153 PolarHBondContact O-N 3.49Å; D150-A153 PolarHBondContact O-N 2.92Å; A153-L156 PolarHBondContact O-N 3.25Å; A153-A157 PolarHBondContact O-N 3.48Å
154	E	97.4	Very high	94.9	Very high	143 Å²	143	68.7 Å²	68.7	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-61.7	-44.9	173.1	-172.1	-175.3	167.9	0	0	111.4	D150 L156 A157 R158	D150-E154 PolarHBondContact O-N 2.72Å; E154-L156 PolarHBondContact O-N 2.97Å; E154-A157 PolarHBondContact O-N 3.34Å; E154-R158 PolarHBondContact O-N 2.86Å
155	N	97.2	Very high	95.5	Very high	28 Å²	28	76.8 Å²	76.8	15%	0.15	38%	0.38	C	S	.	.	H	α-helix	trans	-59.1	-45.8	174.6	-84.6	-40.2	0	0	0	111.8	Y131 L135 Y151 E152 A157 R158 L159	Y131-N155 HydrophobicContact CE1-CB 3.93Å; L135-N155 HydrophobicContact CD1-CB 4.24Å; Y151-N155 WeakPolarHBondContact O-CB 3.28Å; Y151-N155 VanDerWaalsContact O-CG 3.29Å; Y151-N155 PolarHBondContact O-N 3.47Å; Y151-N155 PolarHBondContact O-ND2 3.23Å; Y151-N155 VanDerWaalsContact O-ND2 3.08Å; E152-N155 WeakPolarHBondContact O-CB 3.45Å; E152-N155 PolarHBondContact O-N 3.39Å; N155-A157 PolarHBondContact O-N 3.14Å; N155-R158 WeakPolarHBondContact O-CB 3.45Å; N155-R158 PolarHBondContact O-N 3.33Å; N155-R158 PolarHBondContact OD1-NH2 3.11Å; N155-L159 VanDerWaalsContact O-CG 3.24Å; N155-L159 WeakPolarHBondContact O-CG 3.37Å; N155-L159 PolarHBondContact O-N 3.42Å
156	L	97.8	Very high	96.1	Very high	15 Å²	15	78.1 Å²	78.1	8%	0.079	39%	0.389	C	S	.	.	H	α-helix	trans	-58.5	-47.1	176.3	-178.9	58.4	0	0	0	111.2	L135 T139 L148 E152 A153 E154 R158 L159 Q160 W167	L135-L156 HydrophobicContact CB-CB 4.4Å; L135-L156 HydrophobicContact CB-CD1 3.87Å; L135-L156 HydrophobicContact CD1-CB 4.01Å; T139-L156 HydrophobicContact CG2-CD2 3.82Å; L148-L156 HydrophobicContact CD1-CB 4.31Å; L148-L156 HydrophobicContact CD1-CD2 3.62Å; E152-L156 WeakPolarHBondContact O-CB 3.49Å; E152-L156 PolarHBondContact O-N 3.28Å; A153-L156 PolarHBondContact O-N 3.25Å; E154-L156 PolarHBondContact O-N 2.97Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 3.49Å; L156-L159 PolarHBondContact O-N 3.28Å; L156-Q160 HydrophobicContact CD1-CG 4.34Å; L156-Q160 HydrophobicContact CG-CG 4.5Å; L156-Q160 WeakPolarHBondContact O-CB 3.13Å; L156-Q160 WeakPolarHBondContact O-CG 3.47Å; L156-Q160 PolarHBondContact O-N 2.97Å; L156-W167 HydrophobicContact CD1-CH2 3.6Å; L156-W167 HydrophobicContact CD1-CZ2 4.39Å; L156-W167 HydrophobicContact CD1-CZ3 4.43Å
157	A	98	Very high	96.6	Very high	39 Å²	39	80 Å²	80	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-37.2	178.1	0	0	0	0	0	112.3	A153 E154 N155 R161	A153-A157 PolarHBondContact O-N 3.48Å; E154-A157 PolarHBondContact O-N 3.34Å; N155-A157 PolarHBondContact O-N 3.14Å; A157-R161 PolarHBondContact O-N 3.45Å; A157-R161 PolarHBondContact O-NE 2.99Å
158	R	97.9	Very high	96.9	Very high	139 Å²	139	81.1 Å²	81.1	53%	0.525	40%	0.4	S	S	.	.	H	α-helix	trans	-66.4	-43.7	173.8	-176.7	176.7	63.1	171	-2.1	111.9	E154 N155 L156 R161 A162	E154-R158 PolarHBondContact O-N 2.86Å; N155-R158 WeakPolarHBondContact O-CB 3.45Å; N155-R158 PolarHBondContact O-N 3.33Å; N155-R158 PolarHBondContact OD1-NH2 3.11Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 3.49Å; R158-R161 PolarHBondContact O-N 3.26Å; R158-A162 WeakPolarHBondContact O-CB 3.42Å; R158-A162 PolarHBondContact O-N 2.84Å
159	L	97.9	Very high	97	Very high	7 Å²	7	85.9 Å²	85.9	4%	0.037	42%	0.419	C	S	.	.	H	α-helix	trans	-68	-38.9	179	-66.1	167.9	0	0	0	111.9	N128 Y131 A132 L135 N155 L156 R161 A162 F163	N128-L159 HydrophobicContact CB-CD2 3.85Å; Y131-L159 HydrophobicContact CD1-CD1 3.69Å; Y131-L159 HydrophobicContact CE1-CD1 4.35Å; Y131-L159 HydrophobicContact CG-CD1 4.4Å; A132-L159 HydrophobicContact CB-CB 4.11Å; A132-L159 HydrophobicContact CB-CD1 3.95Å; A132-L159 HydrophobicContact CB-CG 4.49Å; L135-L159 HydrophobicContact CD1-CD1 4.04Å; N155-L159 VanDerWaalsContact O-CG 3.24Å; N155-L159 WeakPolarHBondContact O-CG 3.37Å; N155-L159 PolarHBondContact O-N 3.42Å; L156-L159 PolarHBondContact O-N 3.28Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.31Å; L159-A162 PolarHBondContact O-N 3.11Å; L159-F163 HydrophobicContact CB-CD2 4.3Å; L159-F163 HydrophobicContact CD2-CD2 4.33Å; L159-F163 HydrophobicContact CD2-CE2 3.8Å; L159-F163 WeakPolarHBondContact O-CB 3.16Å; L159-F163 WeakPolarHBondContact O-CD2 3.09Å; L159-F163 PolarHBondContact O-N 3.41Å
160	Q	97.5	Very high	97.1	Very high	78 Å²	78	84.6 Å²	84.6	36%	0.364	41%	0.408	S	S	.	.	H	α-helix	trans	-58.1	-43.5	173.1	-79.1	176.2	-20.2	0	0	111.7	L156 A164 W167	L156-Q160 HydrophobicContact CD1-CG 4.34Å; L156-Q160 HydrophobicContact CG-CG 4.5Å; L156-Q160 WeakPolarHBondContact O-CB 3.13Å; L156-Q160 WeakPolarHBondContact O-CG 3.47Å; L156-Q160 PolarHBondContact O-N 2.97Å; Q160-A164 VanDerWaalsContact O-CA 3.29Å; Q160-A164 WeakPolarHBondContact O-CA 3.43Å; Q160-A164 PolarHBondContact O-N 3.08Å; Q160-W167 HydrophobicContact CB-CE3 4.34Å; Q160-W167 HydrophobicContact CB-CZ3 4.28Å; Q160-W167 HydrophobicContact CG-CD2 3.98Å; Q160-W167 HydrophobicContact CG-CE3 3.75Å; Q160-W167 HydrophobicContact CG-CH2 3.34Å; Q160-W167 HydrophobicContact CG-CZ2 3.54Å; Q160-W167 HydrophobicContact CG-CZ3 3.42Å; Q160-W167 VanDerWaalsContact CG-CZ3 3.42Å; Q160-W167 VanDerWaalsContact NE2-CZ2 3.3Å
161	R	97.7	Very high	97.2	Very high	180 Å²	180	82 Å²	82	68%	0.679	39%	0.39	S	S	*	.	H	α-helix	trans	-64.4	-46.2	173.7	-75.5	-178	-79.2	121.5	-9.9	111.9	A157 R158 L159 F163	A157-R161 PolarHBondContact O-N 3.45Å; A157-R161 PolarHBondContact O-NE 2.99Å; R158-R161 PolarHBondContact O-N 3.26Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.31Å; R161-F163 VanDerWaalsContact C-N 3.34Å; R161-F163 PolarHBondContact O-N 2.98Å
162	A	97.3	Very high	97.2	Very high	73 Å²	73	86.4 Å²	86.4	60%	0.603	41%	0.413	S	S	*	.	H	α-helix	trans	-65.6	-35.1	-178.9	0	0	0	0	0	113.2	R158 L159	R158-A162 WeakPolarHBondContact O-CB 3.42Å; R158-A162 PolarHBondContact O-N 2.84Å; L159-A162 PolarHBondContact O-N 3.11Å
163	F	97.4	Very high	97.2	Very high	45 Å²	45	91.2 Å²	91.2	20%	0.197	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	23.2	-175.6	-59.4	-52.4	0	0	0	113.8	N128 A132 L159 R161 R165 K166 W167 I170	N128-F163 HydrophobicContact CB-CE2 3.93Å; N128-F163 HydrophobicContact CB-CZ 3.83Å; A132-F163 HydrophobicContact CB-CD2 4.34Å; L159-F163 HydrophobicContact CB-CD2 4.3Å; L159-F163 HydrophobicContact CD2-CD2 4.33Å; L159-F163 HydrophobicContact CD2-CE2 3.8Å; L159-F163 WeakPolarHBondContact O-CB 3.16Å; L159-F163 WeakPolarHBondContact O-CD2 3.09Å; L159-F163 PolarHBondContact O-N 3.41Å; R161-F163 VanDerWaalsContact C-N 3.34Å; R161-F163 PolarHBondContact O-N 2.98Å; F163-R165 PolarHBondContact O-N 3.3Å; F163-K166 CarbonylContact O-C 3.57Å; F163-K166 WeakPolarHBondContact O-CA 2.9Å; F163-K166 PolarHBondContact O-N 3.03Å; F163-W167 PolarHBondContact O-N 3.47Å; F163-I170 HydrophobicContact CB-CD1 3.71Å; F163-I170 HydrophobicContact CD2-CD1 3.97Å; F163-I170 HydrophobicContact CG-CD1 4.03Å
164	A	97	Very high	97.2	Very high	69 Å²	69	89.1 Å²	89.1	57%	0.57	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-49.4	-41.4	-173.9	0	0	0	0	0	113.8	Q160 K166	Q160-A164 VanDerWaalsContact O-CA 3.29Å; Q160-A164 WeakPolarHBondContact O-CA 3.43Å; Q160-A164 PolarHBondContact O-N 3.08Å; A164-K166 VanDerWaalsContact C-N 3.34Å; A164-K166 PolarHBondContact O-N 3.33Å
165	R	96.2	Very high	97.2	Very high	247 Å²	247	85.7 Å²	85.7	93%	0.932	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-73.4	-20.6	179.1	-65.8	-177.4	177.5	173.8	-0.9	114.7	F163	F163-R165 PolarHBondContact O-N 3.3Å
166	K	95.3	Very high	97.2	Very high	138 Å²	138	86.6 Å²	86.6	60%	0.6	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-108.5	3.9	-179.7	-65.4	-176.6	178.1	-178.1	0	112.2	F163 A164 E168 F169 I170	F163-K166 CarbonylContact O-C 3.57Å; F163-K166 WeakPolarHBondContact O-CA 2.9Å; F163-K166 PolarHBondContact O-N 3.03Å; A164-K166 VanDerWaalsContact C-N 3.34Å; A164-K166 PolarHBondContact O-N 3.33Å; K166-E168 VanDerWaalsContact C-N 3.31Å; K166-E168 PolarHBondContact O-N 2.78Å; K166-F169 WeakPolarHBondContact O-CB 3.31Å; K166-F169 PolarHBondContact O-N 3.19Å; K166-F169 VanDerWaalsContact O-N 3.1Å; K166-I170 PolarHBondContact O-N 3.19Å
167	W	97.1	Very high	97	Very high	52 Å²	52	89 Å²	89	20%	0.197	42%	0.424	C	S	.	.	H	α-helix	trans	-62.2	-37.3	-170.6	-171.6	-103.9	0	0	0	112.9	A132 C136 L156 Q160 F163 F169 I170 F171	A132-W167 HydrophobicContact CB-CZ3 4.36Å; C136-W167 HydrophobicContact CB-CH2 4.28Å; C136-W167 HydrophobicContact CB-CZ2 4.37Å; L156-W167 HydrophobicContact CD1-CH2 3.6Å; L156-W167 HydrophobicContact CD1-CZ2 4.39Å; L156-W167 HydrophobicContact CD1-CZ3 4.43Å; Q160-W167 HydrophobicContact CB-CE3 4.34Å; Q160-W167 HydrophobicContact CB-CZ3 4.28Å; Q160-W167 HydrophobicContact CG-CD2 3.98Å; Q160-W167 HydrophobicContact CG-CE3 3.75Å; Q160-W167 HydrophobicContact CG-CH2 3.34Å; Q160-W167 HydrophobicContact CG-CZ2 3.54Å; Q160-W167 HydrophobicContact CG-CZ3 3.42Å; Q160-W167 VanDerWaalsContact CG-CZ3 3.42Å; Q160-W167 VanDerWaalsContact NE2-CZ2 3.3Å; F163-W167 PolarHBondContact O-N 3.47Å; W167-F169 VanDerWaalsContact C-N 3.28Å; W167-F169 PolarHBondContact O-N 3.02Å; W167-I170 HydrophobicContact CE3-CB 4.44Å; W167-I170 HydrophobicContact CE3-CD1 4.07Å; W167-I170 HydrophobicContact CE3-CG2 4.35Å; W167-I170 HydrophobicContact CH2-CG2 4.29Å; W167-I170 HydrophobicContact CZ3-CD1 4.29Å; W167-I170 HydrophobicContact CZ3-CG2 4.05Å; W167-I170 WeakPolarHBondContact O-CB 3.18Å; W167-I170 PolarHBondContact O-N 2.91Å; W167-F171 WeakPolarHBondContact O-CB 3.37Å; W167-F171 PolarHBondContact O-N 2.83Å
168	E	96.7	Very high	96.8	Very high	161 Å²	161	87.6 Å²	87.6	75%	0.752	41%	0.411	S	S	*	.	H	α-helix	trans	-59.5	-38.5	176.3	-66.6	-173.7	165.9	0	0	112.4	K166 F171 M172	K166-E168 VanDerWaalsContact C-N 3.31Å; K166-E168 PolarHBondContact O-N 2.78Å; E168-F171 PolarHBondContact O-N 3.47Å; E168-M172 WeakPolarHBondContact O-CB 3.33Å; E168-M172 PolarHBondContact O-N 3.37Å
169	F	97	Very high	96.7	Very high	138 Å²	138	86.3 Å²	86.3	61%	0.605	41%	0.41	S	S	*	.	H	α-helix	trans	-68.4	-41.5	176	-63.5	-73.1	0	0	0	111.9	K166 W167 F171 M172 Q173	K166-F169 WeakPolarHBondContact O-CB 3.31Å; K166-F169 PolarHBondContact O-N 3.19Å; K166-F169 VanDerWaalsContact O-N 3.1Å; W167-F169 VanDerWaalsContact C-N 3.28Å; W167-F169 PolarHBondContact O-N 3.02Å; F169-F171 VanDerWaalsContact C-N 3.34Å; F169-M172 PolarHBondContact O-N 2.69Å; F169-Q173 WeakPolarHBondContact O-CB 3.4Å; F169-Q173 WeakPolarHBondContact O-CG 3.33Å; F169-Q173 PolarHBondContact O-N 3.39Å
170	I	97.3	Very high	96.4	Very high	4 Å²	4	90.8 Å²	90.8	2%	0.021	43%	0.433	C	S	.	.	H	α-helix	trans	-60.1	-46.6	175.3	-67.7	171.6	0	0	0	109.9	T129 A132 I133 C136 F163 K166 W167 Q173 A174	T129-I170 HydrophobicContact CG2-CG1 4.35Å; A132-I170 HydrophobicContact CB-CD1 4.1Å; A132-I170 HydrophobicContact CB-CG2 4.09Å; I133-I170 HydrophobicContact CG1-CG2 3.94Å; C136-I170 HydrophobicContact CB-CG2 4.48Å; F163-I170 HydrophobicContact CB-CD1 3.71Å; F163-I170 HydrophobicContact CD2-CD1 3.97Å; F163-I170 HydrophobicContact CG-CD1 4.03Å; K166-I170 PolarHBondContact O-N 3.19Å; W167-I170 HydrophobicContact CE3-CB 4.44Å; W167-I170 HydrophobicContact CE3-CD1 4.07Å; W167-I170 HydrophobicContact CE3-CG2 4.35Å; W167-I170 HydrophobicContact CH2-CG2 4.29Å; W167-I170 HydrophobicContact CZ3-CD1 4.29Å; W167-I170 HydrophobicContact CZ3-CG2 4.05Å; W167-I170 WeakPolarHBondContact O-CB 3.18Å; W167-I170 PolarHBondContact O-N 2.91Å; I170-Q173 PolarHBondContact O-N 3Å; I170-A174 WeakPolarHBondContact O-CB 3.29Å; I170-A174 PolarHBondContact O-N 2.97Å
171	F	97.7	Very high	96.1	Very high	93 Å²	93	87.9 Å²	87.9	41%	0.408	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-45.5	177.7	-176	-91.1	0	0	0	111.8	M140 W167 E168 F169 Q173 A174 E175	M140-F171 HydrophobicContact CE-CE1 4.18Å; M140-F171 HydrophobicContact CE-CE2 3.8Å; M140-F171 HydrophobicContact CE-CZ 3.61Å; M140-F171 HydrophobicContact CG-CE2 4.45Å; M140-F171 HydrophobicContact SD-CD2 4.38Å; M140-F171 HydrophobicContact SD-CE2 4.03Å; M140-F171 HydrophobicContact SD-CZ 4.44Å; W167-F171 WeakPolarHBondContact O-CB 3.37Å; W167-F171 PolarHBondContact O-N 2.83Å; E168-F171 PolarHBondContact O-N 3.47Å; F169-F171 VanDerWaalsContact C-N 3.34Å; F171-Q173 VanDerWaalsContact C-N 3.35Å; F171-Q173 PolarHBondContact O-N 3.38Å; F171-A174 PolarHBondContact O-N 2.65Å; F171-E175 WeakPolarHBondContact O-CB 3.33Å; F171-E175 PolarHBondContact O-N 2.95Å
172	M	96.8	Very high	95.7	Very high	120 Å²	120	87.4 Å²	87.4	59%	0.591	42%	0.418	S	S	*	.	H	α-helix	trans	-62	-41.6	178.3	-170.6	-177	-61.1	0	0	112	E168 F169 E175 A176	E168-M172 WeakPolarHBondContact O-CB 3.33Å; E168-M172 PolarHBondContact O-N 3.37Å; F169-M172 PolarHBondContact O-N 2.69Å; M172-E175 PolarHBondContact O-N 3.34Å; M172-A176 WeakPolarHBondContact O-CB 3.23Å; M172-A176 PolarHBondContact O-N 3.3Å
173	Q	97.6	Very high	95.5	Very high	102 Å²	102	92.7 Å²	92.7	48%	0.477	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-44.2	175.4	-76.2	-174.9	-30	0	0	112	I133 F169 I170 F171 E175 A176 Q177	I133-Q173 HydrophobicContact CD1-CB 4.29Å; I133-Q173 HydrophobicContact CG1-CB 4.39Å; I133-Q173 HydrophobicContact CG2-CB 4.44Å; F169-Q173 WeakPolarHBondContact O-CB 3.4Å; F169-Q173 WeakPolarHBondContact O-CG 3.33Å; F169-Q173 PolarHBondContact O-N 3.39Å; I170-Q173 PolarHBondContact O-N 3Å; F171-Q173 VanDerWaalsContact C-N 3.35Å; F171-Q173 PolarHBondContact O-N 3.38Å; Q173-E175 PolarHBondContact O-N 3.15Å; Q173-A176 PolarHBondContact O-N 3.11Å; Q173-Q177 WeakPolarHBondContact O-CG 3.29Å; Q173-Q177 PolarHBondContact O-N 3.22Å
174	A	96.8	Very high	95.3	Very high	0 Å²	0	93.5 Å²	93.5	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-59.9	-45.5	175.2	0	0	0	0	0	111.3	I133 C136 K137 M140 I170 F171 A176 Q177 V178	I133-A174 HydrophobicContact CG2-CB 4.21Å; C136-A174 HydrophobicContact CB-CB 3.99Å; K137-A174 HydrophobicContact CB-CB 4.15Å; M140-A174 HydrophobicContact SD-CB 4.04Å; I170-A174 WeakPolarHBondContact O-CB 3.29Å; I170-A174 PolarHBondContact O-N 2.97Å; F171-A174 PolarHBondContact O-N 2.65Å; A174-A176 PolarHBondContact O-N 3.34Å; A174-Q177 PolarHBondContact O-N 3.23Å; A174-V178 WeakPolarHBondContact O-CG2 3.4Å; A174-V178 PolarHBondContact O-N 2.67Å
175	E	96.8	Very high	95.1	Very high	71 Å²	71	94.4 Å²	94.4	33%	0.332	43%	0.426	S	S	.	.	H	α-helix	trans	-60.7	-43.4	177.6	-160.3	-159.1	-167.2	0	0	112.1	M140 F171 M172 Q173 Q177 V178 K179	M140-E175 HydrophobicContact CE-CB 3.69Å; M140-E175 HydrophobicContact CE-CG 3.67Å; F171-E175 WeakPolarHBondContact O-CB 3.33Å; F171-E175 PolarHBondContact O-N 2.95Å; M172-E175 PolarHBondContact O-N 3.34Å; Q173-E175 PolarHBondContact O-N 3.15Å; E175-Q177 VanDerWaalsContact C-N 3.33Å; E175-Q177 PolarHBondContact O-N 2.75Å; E175-V178 PolarHBondContact O-N 3.39Å; E175-K179 WeakPolarHBondContact O-CG 3.33Å; E175-K179 PolarHBondContact O-N 2.8Å; E175-K179 WeakPolarHBondContact OE1-CE 3.33Å; E175-K179 IonicContact OE1-NZ 2.69Å; E175-K179 PolarHBondContact OE1-NZ 2.94Å; E175-K179 VanDerWaalsContact OE1-NZ 3.08Å; E175-K179 IonicContact OE2-NZ 3.26Å; E175-K179 PolarHBondContact OE2-NZ 3.22Å
176	A	96.8	Very high	94.8	Very high	47 Å²	47	89.7 Å²	89.7	39%	0.388	41%	0.412	S	S	.	.	H	α-helix	trans	-60.8	-42.1	176.6	0	0	0	0	0	111.6	M172 Q173 A174 K179 I180	M172-A176 WeakPolarHBondContact O-CB 3.23Å; M172-A176 PolarHBondContact O-N 3.3Å; Q173-A176 PolarHBondContact O-N 3.11Å; A174-A176 PolarHBondContact O-N 3.34Å; A176-K179 PolarHBondContact O-N 3.2Å; A176-I180 WeakPolarHBondContact O-CG1 3.17Å; A176-I180 PolarHBondContact O-N 3.02Å; A176-I180 VanDerWaalsContact O-N 3.12Å
177	Q	94.6	Very high	94.5	Very high	67 Å²	67	86.4 Å²	86.4	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-44.1	174.3	-69.2	-173.9	18.8	0	0	112	K137 Q173 A174 E175 K179 I180 D181	K137-Q177 HydrophobicContact CD-CB 3.76Å; Q173-Q177 WeakPolarHBondContact O-CG 3.29Å; Q173-Q177 PolarHBondContact O-N 3.22Å; A174-Q177 PolarHBondContact O-N 3.23Å; E175-Q177 VanDerWaalsContact C-N 3.33Å; E175-Q177 PolarHBondContact O-N 2.75Å; Q177-K179 VanDerWaalsContact C-N 3.28Å; Q177-K179 PolarHBondContact O-N 2.96Å; Q177-I180 WeakPolarHBondContact O-CB 3.43Å; Q177-I180 PolarHBondContact O-N 2.87Å; Q177-I180 VanDerWaalsContact O-N 3.07Å; Q177-D181 PolarHBondContact O-N 2.92Å
178	V	93.9	Very high	94.2	Very high	8 Å²	8	88 Å²	88	5%	0.048	41%	0.413	C	S	.	.	H	α-helix	trans	-57.2	-42.1	174.8	175.5	0	0	0	0	111.2	K137 M140 A174 E175 I180 D181 R182	K137-V178 HydrophobicContact CG-CG2 3.65Å; M140-V178 HydrophobicContact CB-CG2 4.23Å; A174-V178 WeakPolarHBondContact O-CG2 3.4Å; A174-V178 PolarHBondContact O-N 2.67Å; E175-V178 PolarHBondContact O-N 3.39Å; V178-I180 VanDerWaalsContact C-N 3.3Å; V178-I180 PolarHBondContact O-N 3.45Å; V178-D181 PolarHBondContact O-N 3Å; V178-R182 HydrophobicContact CG1-CG 4.31Å; V178-R182 WeakPolarHBondContact O-CB 3.23Å; V178-R182 VanDerWaalsContact O-CG 3.3Å; V178-R182 WeakPolarHBondContact O-CG 3.32Å; V178-R182 PolarHBondContact O-N 3.16Å
179	K	94.5	Very high	93.9	Very high	113 Å²	113	82.5 Å²	82.5	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-38.6	177.6	-74.5	168.1	-179.8	162.8	0	111.6	E175 A176 Q177	E175-K179 WeakPolarHBondContact O-CG 3.33Å; E175-K179 PolarHBondContact O-N 2.8Å; E175-K179 WeakPolarHBondContact OE1-CE 3.33Å; E175-K179 IonicContact OE1-NZ 2.69Å; E175-K179 PolarHBondContact OE1-NZ 2.94Å; E175-K179 VanDerWaalsContact OE1-NZ 3.08Å; E175-K179 IonicContact OE2-NZ 3.26Å; E175-K179 PolarHBondContact OE2-NZ 3.22Å; A176-K179 PolarHBondContact O-N 3.2Å; Q177-K179 VanDerWaalsContact C-N 3.28Å; Q177-K179 PolarHBondContact O-N 2.96Å
180	I	92.7	Very high	93.6	Very high	101 Å²	101	79.7 Å²	79.7	52%	0.518	37%	0.373	S	S	.	.	H	α-helix	trans	-68.2	-47.1	174.9	-66.4	166	0	0	0	110.5	A176 Q177 V178 R182 K183	A176-I180 WeakPolarHBondContact O-CG1 3.17Å; A176-I180 PolarHBondContact O-N 3.02Å; A176-I180 VanDerWaalsContact O-N 3.12Å; Q177-I180 WeakPolarHBondContact O-CB 3.43Å; Q177-I180 PolarHBondContact O-N 2.87Å; Q177-I180 VanDerWaalsContact O-N 3.07Å; V178-I180 VanDerWaalsContact C-N 3.3Å; V178-I180 PolarHBondContact O-N 3.45Å; I180-R182 VanDerWaalsContact C-N 3.27Å; I180-R182 PolarHBondContact O-N 3.15Å; I180-K183 WeakPolarHBondContact O-CB 3.13Å; I180-K183 PolarHBondContact O-N 3.08Å
181	D	90.5	Very high	93.3	Very high	16 Å²	16	81.2 Å²	81.2	9%	0.086	38%	0.381	C	S	.	.	H	α-helix	trans	-66.5	-28.7	-177.5	-68.9	-30.4	0	0	0	112.7	Q177 V178 K183 K184 R189	Q177-D181 PolarHBondContact O-N 2.92Å; V178-D181 PolarHBondContact O-N 3Å; D181-K183 PolarHBondContact O-N 3.41Å; D181-K184 PolarHBondContact O-N 3.46Å; D181-K184 IonicContact OD1-NZ 2.84Å; D181-K184 PolarHBondContact OD1-NZ 3.34Å; D181-R189 WeakPolarHBondContact O-CD 3.39Å
182	R	90.2	Very high	93.2	Very high	171 Å²	171	79.4 Å²	79.4	65%	0.645	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.7	172.9	-77	177.6	-178.2	-170.1	2.9	113.8	V178 I180	V178-R182 HydrophobicContact CG1-CG 4.31Å; V178-R182 WeakPolarHBondContact O-CB 3.23Å; V178-R182 VanDerWaalsContact O-CG 3.3Å; V178-R182 WeakPolarHBondContact O-CG 3.32Å; V178-R182 PolarHBondContact O-N 3.16Å; I180-R182 VanDerWaalsContact C-N 3.27Å; I180-R182 PolarHBondContact O-N 3.15Å
183	K	93.3	Very high	93	Very high	184 Å²	184	74.2 Å²	74.2	80%	0.8	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-18.9	176.4	-62.2	179.6	-178.7	-177.7	0	113.1	I180 D181	I180-K183 WeakPolarHBondContact O-CB 3.13Å; I180-K183 PolarHBondContact O-N 3.08Å; D181-K183 PolarHBondContact O-N 3.41Å
184	K	92.7	Very high	92.9	Very high	62 Å²	62	70 Å²	70	27%	0.27	33%	0.332	S	S	.	.	S	Bend	trans	-78.3	154.3	178	-60.4	179	-174.6	152.9	0	110.6	D181 R189 L192	D181-K184 PolarHBondContact O-N 3.46Å; D181-K184 IonicContact OD1-NZ 2.84Å; D181-K184 PolarHBondContact OD1-NZ 3.34Å; K184-R189 HydrophobicContact CB-CB 4.39Å; K184-L192 HydrophobicContact CD-CD1 3.51Å
185	D	93.6	Very high	92.9	Very high	88 Å²	88	71.4 Å²	71.4	47%	0.471	34%	0.338	S	S	.	.			trans	-67.2	161	176.5	82.7	77.4	0	0	0	111.4	T187 E188 R189	D185-T187 PolarHBondContact O-N 3.44Å; D185-T187 WeakPolarHBondContact OD1-CA 3.15Å; D185-T187 WeakPolarHBondContact OD1-CB 3.31Å; D185-T187 PolarHBondContact OD1-N 2.77Å; D185-E188 PolarHBondContact OD1-N 2.97Å; D185-E188 WeakPolarHBondContact OD2-CB 3.41Å; D185-R189 VanDerWaalsContact O-CB 3.26Å; D185-R189 WeakPolarHBondContact O-CB 3.47Å; D185-R189 PolarHBondContact O-N 3.05Å
186	K	89.3	Confident	92.9	Very high	148 Å²	148	69.8 Å²	69.8	64%	0.643	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-33.8	-173.7	-174.4	179.6	179.6	178	0	112.7	K190	K186-K190 WeakPolarHBondContact O-CG 3.41Å; K186-K190 PolarHBondContact O-N 3.27Å
187	T	88.4	Confident	93	Very high	68 Å²	68	68.8 Å²	68.8	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-77	-51.9	-177.7	-61.5	0	0	0	0	110.6	P57 D185 R189 K190 I191	P57-T187 HydrophobicContact CB-CG2 4.33Å; P57-T187 HydrophobicContact CG-CG2 3.4Å; D185-T187 PolarHBondContact O-N 3.44Å; D185-T187 WeakPolarHBondContact OD1-CA 3.15Å; D185-T187 WeakPolarHBondContact OD1-CB 3.31Å; D185-T187 PolarHBondContact OD1-N 2.77Å; T187-R189 VanDerWaalsContact C-N 3.32Å; T187-R189 PolarHBondContact O-N 3.07Å; T187-K190 WeakPolarHBondContact O-CB 3.41Å; T187-K190 PolarHBondContact O-N 3.47Å; T187-K190 VanDerWaalsContact O-N 3.11Å; T187-I191 HydrophobicContact CG2-CD1 4.27Å; T187-I191 PolarHBondContact O-N 3.11Å
188	E	90.7	Very high	93.1	Very high	87 Å²	87	65.6 Å²	65.6	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-56.7	-47.5	177.5	-177.2	-171.4	-164.4	0	0	111	D185 K190 I191 L192	D185-E188 PolarHBondContact OD1-N 2.97Å; D185-E188 WeakPolarHBondContact OD2-CB 3.41Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3.07Å; E188-I191 PolarHBondContact O-N 3.14Å; E188-I191 VanDerWaalsContact O-N 3.12Å; E188-L192 HydrophobicContact CG-CD1 3.92Å; E188-L192 HydrophobicContact CG-CG 4.45Å; E188-L192 WeakPolarHBondContact O-CG 3.45Å; E188-L192 PolarHBondContact O-N 3.32Å
189	R	91.9	Very high	93.3	Very high	45 Å²	45	65.8 Å²	65.8	17%	0.17	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-41.2	176.5	179.8	176.8	53.3	-168.4	-10.7	112.6	D181 K184 D185 T187 I191 L192 D193	D181-R189 WeakPolarHBondContact O-CD 3.39Å; K184-R189 HydrophobicContact CB-CB 4.39Å; D185-R189 VanDerWaalsContact O-CB 3.26Å; D185-R189 WeakPolarHBondContact O-CB 3.47Å; D185-R189 PolarHBondContact O-N 3.05Å; T187-R189 VanDerWaalsContact C-N 3.32Å; T187-R189 PolarHBondContact O-N 3.07Å; R189-I191 VanDerWaalsContact C-N 3.32Å; R189-I191 PolarHBondContact O-N 3.22Å; R189-L192 PolarHBondContact O-N 3.06Å; R189-D193 WeakPolarHBondContact O-CB 3.35Å; R189-D193 PolarHBondContact O-N 3.38Å
190	K	89.8	Confident	93.5	Very high	79 Å²	79	60.9 Å²	60.9	34%	0.343	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-38.4	178.5	-83.2	-178.2	174.6	-165.9	0	112.3	K186 T187 E188 S194	K186-K190 WeakPolarHBondContact O-CG 3.41Å; K186-K190 PolarHBondContact O-N 3.27Å; T187-K190 WeakPolarHBondContact O-CB 3.41Å; T187-K190 PolarHBondContact O-N 3.47Å; T187-K190 VanDerWaalsContact O-N 3.11Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3.07Å; K190-S194 PolarHBondContact O-N 3.45Å; K190-S194 PolarHBondContact O-OG 3.42Å
191	I	91.9	Very high	93.8	Very high	36 Å²	36	56.3 Å²	56.3	19%	0.185	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-50	178.4	-64.2	168.5	0	0	0	109.4	P57 T187 E188 R189 D193 S194 Q195	P57-I191 HydrophobicContact CG-CD1 4.3Å; T187-I191 HydrophobicContact CG2-CD1 4.27Å; T187-I191 PolarHBondContact O-N 3.11Å; E188-I191 PolarHBondContact O-N 3.14Å; E188-I191 VanDerWaalsContact O-N 3.12Å; R189-I191 VanDerWaalsContact C-N 3.32Å; R189-I191 PolarHBondContact O-N 3.22Å; I191-D193 PolarHBondContact O-N 3.17Å; I191-S194 PolarHBondContact O-N 3.48Å; I191-S194 PolarHBondContact O-OG 3.32Å; I191-Q195 HydrophobicContact CG2-CG 4.4Å; I191-Q195 WeakPolarHBondContact O-CG 3.5Å; I191-Q195 PolarHBondContact O-N 3.48Å
192	L	93.9	Very high	94.1	Very high	54 Å²	54	56 Å²	56	28%	0.283	26%	0.256	S	S	.	.	H	α-helix	trans	-60.4	-44.2	179.6	-69.9	172.5	0	0	0	112.3	K184 E188 R189 S194 Q195 E196	K184-L192 HydrophobicContact CD-CD1 3.51Å; E188-L192 HydrophobicContact CG-CD1 3.92Å; E188-L192 HydrophobicContact CG-CG 4.45Å; E188-L192 WeakPolarHBondContact O-CG 3.45Å; E188-L192 PolarHBondContact O-N 3.32Å; R189-L192 PolarHBondContact O-N 3.06Å; L192-S194 PolarHBondContact O-N 3.47Å; L192-Q195 PolarHBondContact O-N 3.48Å; L192-E196 WeakPolarHBondContact O-CB 3.22Å; L192-E196 PolarHBondContact O-N 3.37Å
193	D	93.5	Very high	94.4	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.059	23%	0.229	C	C	.	.	H	α-helix	trans	-57.3	-40.3	174.8	-66.7	-23	0	0	0	111.2	R145 L146 R189 I191 R197	R145-D193 IonicContact CZ-OD2 3.86Å; R145-D193 VanDerWaalsContact CZ-OD2 3.26Å; R145-D193 IonicContact NH1-OD2 3.89Å; R145-D193 PolarHBondContact NH1-OD2 3.5Å; R145-D193 IonicContact NH2-OD2 3.07Å; R145-D193 PolarHBondContact NH2-OD2 3.21Å; L146-D193 HydrophobicContact CD2-CB 4.3Å; R189-D193 WeakPolarHBondContact O-CB 3.35Å; R189-D193 PolarHBondContact O-N 3.38Å; I191-D193 PolarHBondContact O-N 3.17Å; D193-R197 WeakPolarHBondContact O-CB 3.44Å; D193-R197 PolarHBondContact O-N 3.05Å
194	S	95	Very high	94.6	Very high	15 Å²	15	42.5 Å²	42.5	11%	0.105	20%	0.201	C	C	.	.	H	α-helix	trans	-74	-34	-179.4	70	0	0	0	0	113.3	F95 K190 I191 L192 A198	F95-S194 WeakPolarHBondContact CE2-O 3.3Å; K190-S194 PolarHBondContact O-N 3.45Å; K190-S194 PolarHBondContact O-OG 3.42Å; I191-S194 PolarHBondContact O-N 3.48Å; I191-S194 PolarHBondContact O-OG 3.32Å; L192-S194 PolarHBondContact O-N 3.47Å; S194-A198 WeakPolarHBondContact O-CB 3.42Å; S194-A198 PolarHBondContact O-N 3.17Å
195	Q	97.3	Very high	94.8	Very high	28 Å²	28	41.1 Å²	41.1	13%	0.131	20%	0.198	C	C	.	.	H	α-helix	trans	-68.6	-43.5	175.3	-77	179.7	-28.8	0	0	111.6	F95 Q114 F118 I191 L192 A198 F199	F95-Q195 HydrophobicContact CE1-CG 4.16Å; F95-Q195 HydrophobicContact CZ-CB 4.44Å; F95-Q195 HydrophobicContact CZ-CG 3.82Å; Q114-Q195 PolarHBondContact NE2-O 3.46Å; Q114-Q195 VanDerWaalsContact OE1-CB 3.28Å; F118-Q195 HydrophobicContact CD2-CB 4.28Å; F118-Q195 HydrophobicContact CE2-CB 4.14Å; I191-Q195 HydrophobicContact CG2-CG 4.4Å; I191-Q195 WeakPolarHBondContact O-CG 3.5Å; I191-Q195 PolarHBondContact O-N 3.48Å; L192-Q195 PolarHBondContact O-N 3.48Å; Q195-A198 PolarHBondContact O-N 3.23Å; Q195-F199 PolarHBondContact O-N 3.29Å
196	E	97.2	Very high	94.9	Very high	37 Å²	37	38.3 Å²	38.3	17%	0.173	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-38.3	175.2	-170.4	-178.1	-163.7	0	0	111.5	F118 Y134 K137 L192 F199 W200	F118-E196 HydrophobicContact CZ-CB 4.49Å; Y134-E196 HydrophobicContact CD2-CG 3.84Å; Y134-E196 HydrophobicContact CE2-CB 4.47Å; Y134-E196 HydrophobicContact CE2-CG 3.86Å; K137-E196 WeakPolarHBondContact CE-OE2 3.45Å; K137-E196 IonicContact NZ-OE1 2.82Å; K137-E196 PolarHBondContact NZ-OE1 3.39Å; K137-E196 IonicContact NZ-OE2 2.9Å; K137-E196 PolarHBondContact NZ-OE2 3.36Å; L192-E196 WeakPolarHBondContact O-CB 3.22Å; L192-E196 PolarHBondContact O-N 3.37Å; E196-F199 WeakPolarHBondContact O-CB 3.33Å; E196-F199 PolarHBondContact O-N 2.91Å; E196-W200 PolarHBondContact O-N 3.36Å
197	R	97.4	Very high	95.3	Very high	26 Å²	26	35.9 Å²	35.9	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-57.3	-51.6	170.5	-179.3	-174.6	61.4	82.2	-14.4	111.4	P96 I97 D99 Y134 D193 F199 W200 D201	P96-R197 PolarHBondContact O-NH2 3.09Å; I97-R197 VanDerWaalsContact C-NH2 3.33Å; I97-R197 PolarHBondContact O-NH2 2.66Å; D99-R197 PolarHBondContact O-NH1 3.3Å; D99-R197 PolarHBondContact O-NH2 2.9Å; Y134-R197 VanDerWaalsContact OH-CA 3.29Å; Y134-R197 WeakPolarHBondContact OH-CA 3.26Å; Y134-R197 WeakPolarHBondContact OH-CB 3.34Å; D193-R197 WeakPolarHBondContact O-CB 3.44Å; D193-R197 PolarHBondContact O-N 3.05Å; R197-F199 VanDerWaalsContact C-N 3.26Å; R197-F199 PolarHBondContact O-N 3.39Å; R197-W200 CarbonylContact O-C 3.54Å; R197-W200 PolarHBondContact O-N 3.37Å; R197-D201 IonicContact CZ-OD2 2.7Å; R197-D201 IonicContact NH1-OD2 2.78Å; R197-D201 PolarHBondContact NH1-OD2 2.84Å; R197-D201 VanDerWaalsContact O-CG 3.3Å; R197-D201 PolarHBondContact O-N 3.21Å
198	A	98.1	Very high	95.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-33.5	-179.1	0	0	0	0	0	113.2	F95 S194 Q195 D201 V202	F95-A198 HydrophobicContact CB-CB 3.62Å; F95-A198 HydrophobicContact CD1-CB 3.37Å; F95-A198 HydrophobicContact CD2-CB 3.57Å; F95-A198 HydrophobicContact CE1-CB 3.82Å; F95-A198 HydrophobicContact CE2-CB 3.99Å; F95-A198 HydrophobicContact CG-CB 3.22Å; F95-A198 HydrophobicContact CZ-CB 4.1Å; S194-A198 WeakPolarHBondContact O-CB 3.42Å; S194-A198 PolarHBondContact O-N 3.17Å; Q195-A198 PolarHBondContact O-N 3.23Å; A198-D201 PolarHBondContact O-N 3.19Å; A198-V202 PolarHBondContact O-N 3.27Å
199	F	98.4	Very high	95.8	Very high	12 Å²	12	35 Å²	35	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-59.4	-48.2	170.6	170	-96.3	0	0	0	111.2	F118 W124 P126 Q195 E196 R197 D201 V202 H203	F118-F199 HydrophobicContact CB-CB 4.35Å; F118-F199 HydrophobicContact CB-CD2 4.07Å; F118-F199 HydrophobicContact CD1-CB 3.83Å; F118-F199 HydrophobicContact CD1-CD1 4.45Å; F118-F199 AromaticContact CD1-CD2 3.51Å; F118-F199 HydrophobicContact CD1-CD2 3.51Å; F118-F199 HydrophobicContact CD1-CE2 4.15Å; F118-F199 AromaticContact CD1-CG 3.67Å; F118-F199 HydrophobicContact CD1-CG 3.67Å; F118-F199 HydrophobicContact CE1-CB 4.27Å; F118-F199 HydrophobicContact CE1-CD2 4.33Å; F118-F199 HydrophobicContact CE1-CG 4.13Å; F118-F199 HydrophobicContact CG-CB 4.1Å; F118-F199 HydrophobicContact CG-CD2 4.16Å; F118-F199 HydrophobicContact CG-CG 4.36Å; W124-F199 HydrophobicContact CB-CE2 4.01Å; W124-F199 HydrophobicContact CB-CZ 4.33Å; W124-F199 AromaticContact CD1-CE2 3.91Å; W124-F199 AromaticContact CD2-CE2 3.84Å; W124-F199 HydrophobicContact CD2-CE2 3.84Å; W124-F199 HydrophobicContact CD2-CZ 4.13Å; W124-F199 HydrophobicContact CE3-CE2 4.37Å; W124-F199 HydrophobicContact CE3-CZ 4.2Å; W124-F199 AromaticContact CG-CE2 3.66Å; W124-F199 HydrophobicContact CG-CE2 3.66Å; W124-F199 HydrophobicContact CG-CZ 4.21Å; P126-F199 HydrophobicContact CB-CE1 4.17Å; P126-F199 HydrophobicContact CB-CZ 4.02Å; P126-F199 HydrophobicContact CG-CE1 4.25Å; P126-F199 HydrophobicContact CG-CZ 3.92Å; Q195-F199 PolarHBondContact O-N 3.29Å; E196-F199 WeakPolarHBondContact O-CB 3.33Å; E196-F199 PolarHBondContact O-N 2.91Å; R197-F199 VanDerWaalsContact C-N 3.26Å; R197-F199 PolarHBondContact O-N 3.39Å; F199-D201 VanDerWaalsContact C-N 3.34Å; F199-D201 PolarHBondContact O-N 2.96Å; F199-V202 WeakPolarHBondContact O-CB 3.3Å; F199-V202 PolarHBondContact O-N 3.04Å; F199-H203 AromaticContact CD2-CD2 3.63Å; F199-H203 AromaticContact CD2-NE2 3.78Å; F199-H203 AromaticContact CE1-CD2 3.94Å; F199-H203 AromaticContact CE2-CD2 3.29Å; F199-H203 WeakPolarHBondContact CE2-CD2 3.5Å; F199-H203 AromaticContact CE2-NE2 3.21Å; F199-H203 WeakPolarHBondContact CE2-NE2 3.3Å; F199-H203 AromaticContact CZ-CD2 3.47Å; F199-H203 VanDerWaalsContact CZ-CD2 3.47Å; F199-H203 WeakPolarHBondContact CZ-CD2 3.47Å; F199-H203 AromaticContact CZ-NE2 3.68Å; F199-H203 PolarHBondContact O-CD2 2.93Å; F199-H203 VanDerWaalsContact O-CD2 3.25Å; F199-H203 PolarHBondContact O-N 3.05Å
200	W	98.1	Very high	96	Very high	11 Å²	11	38.9 Å²	38.9	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-69.3	-30.3	177.7	-72.4	113.5	0	0	0	113.5	P126 D130 Y131 Y134 E196 R197 V202 H203 R204	P126-W200 HydrophobicContact CB-CH2 3.66Å; P126-W200 HydrophobicContact CB-CZ3 3.82Å; P126-W200 HydrophobicContact CG-CH2 4.4Å; P126-W200 HydrophobicContact CG-CZ3 4.07Å; D130-W200 HydrophobicContact CB-CH2 3.79Å; D130-W200 HydrophobicContact CB-CZ2 3.91Å; Y131-W200 VanDerWaalsContact CA-CH2 3.48Å; Y131-W200 AromaticContact CD2-CD2 3.56Å; Y131-W200 HydrophobicContact CD2-CD2 3.56Å; Y131-W200 AromaticContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CE3 3.4Å; Y131-W200 VanDerWaalsContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CG 4.09Å; Y131-W200 HydrophobicContact CD2-CH2 4.24Å; Y131-W200 HydrophobicContact CD2-CZ2 4.39Å; Y131-W200 AromaticContact CD2-CZ3 3.78Å; Y131-W200 HydrophobicContact CD2-CZ3 3.78Å; Y131-W200 HydrophobicContact CE2-CB 4.27Å; Y131-W200 HydrophobicContact CE2-CD2 4.15Å; Y131-W200 HydrophobicContact CE2-CE3 4.08Å; Y131-W200 HydrophobicContact CE2-CG 4.25Å; Y131-W200 HydrophobicContact CG-CE3 4.03Å; Y131-W200 HydrophobicContact CG-CH2 4.34Å; Y131-W200 AromaticContact CG-CZ3 3.95Å; Y131-W200 HydrophobicContact CG-CZ3 3.95Å; Y131-W200 VanDerWaalsContact N-CH2 3.3Å; Y134-W200 HydrophobicContact CD1-CB 4.42Å; Y134-W200 AromaticContact CD1-CD1 3.41Å; Y134-W200 VanDerWaalsContact CD1-CD1 3.41Å; Y134-W200 HydrophobicContact CD1-CD2 4.38Å; Y134-W200 AromaticContact CD1-CG 3.82Å; Y134-W200 HydrophobicContact CD1-CG 3.82Å; Y134-W200 AromaticContact CD1-NE1 3.73Å; Y134-W200 AromaticContact CD2-CD1 3.44Å; Y134-W200 VanDerWaalsContact CD2-CD1 3.44Å; Y134-W200 AromaticContact CD2-NE1 3.51Å; Y134-W200 HydrophobicContact CE1-CB 4.09Å; Y134-W200 AromaticContact CE1-CD1 3.6Å; Y134-W200 AromaticContact CE1-CG 3.94Å; Y134-W200 HydrophobicContact CE1-CG 3.94Å; Y134-W200 AromaticContact CE2-CD1 3.61Å; Y134-W200 AromaticContact CG-CD1 3.32Å; Y134-W200 HydrophobicContact CG-CG 4.14Å; Y134-W200 AromaticContact CG-NE1 3.25Å; Y134-W200 AromaticContact CZ-CD1 3.69Å; E196-W200 PolarHBondContact O-N 3.36Å; R197-W200 CarbonylContact O-C 3.54Å; R197-W200 PolarHBondContact O-N 3.37Å; W200-V202 PolarHBondContact O-N 2.73Å; W200-H203 HydrophobicContact CE3-CB 4.33Å; W200-H203 PolarHBondContact O-N 3.07Å; W200-R204 HydrophobicContact CE3-CG 3.83Å; W200-R204 HydrophobicContact CZ3-CG 4.11Å; W200-R204 CarbonylContact O-C 3.6Å; W200-R204 WeakPolarHBondContact O-CA 3.41Å; W200-R204 PolarHBondContact O-N 3.06Å
201	D	98.1	Very high	96.2	Very high	5 Å²	5	37 Å²	37	3%	0.027	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-25.2	174.1	-65.6	-26.5	0	0	0	112.2	H100 L102 R197 A198 F199 P205	H100-D201 IonicContact CE1-OD1 2.67Å; H100-D201 IonicContact CG-OD1 2.92Å; H100-D201 IonicContact ND1-OD1 2.96Å; H100-D201 PolarHBondContact ND1-OD1 2.71Å; H100-D201 IonicContact ND1-OD2 3.24Å; L102-D201 HydrophobicContact CD1-CB 3.9Å; L102-D201 HydrophobicContact CD2-CB 4.02Å; L102-D201 HydrophobicContact CG-CB 3.92Å; R197-D201 IonicContact CZ-OD2 2.7Å; R197-D201 IonicContact NH1-OD2 2.78Å; R197-D201 PolarHBondContact NH1-OD2 2.84Å; R197-D201 VanDerWaalsContact O-CG 3.3Å; R197-D201 PolarHBondContact O-N 3.21Å; A198-D201 PolarHBondContact O-N 3.19Å; F199-D201 VanDerWaalsContact C-N 3.34Å; F199-D201 PolarHBondContact O-N 2.96Å; D201-P205 VanDerWaalsContact O-CA 3.25Å; D201-P205 WeakPolarHBondContact O-CA 3.3Å; D201-P205 WeakPolarHBondContact O-CB 3.4Å
202	V	97.6	Very high	96.4	Very high	10 Å²	10	36.5 Å²	36.5	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-77.6	-50.4	170.3	175.7	0	0	0	0	111.4	G92 L102 A198 F199 W200 T213	G92-V202 VanDerWaalsContact CA-CG2 3.44Å; L102-V202 HydrophobicContact CD1-CB 4.45Å; L102-V202 HydrophobicContact CD1-CG2 3.46Å; L102-V202 VanDerWaalsContact CD1-CG2 3.46Å; A198-V202 PolarHBondContact O-N 3.27Å; F199-V202 WeakPolarHBondContact O-CB 3.3Å; F199-V202 PolarHBondContact O-N 3.04Å; W200-V202 PolarHBondContact O-N 2.73Å; V202-T213 HydrophobicContact CG1-CG2 3.93Å
203	H	96.8	Very high	96.2	Very high	16 Å²	16	36.9 Å²	36.9	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-84.4	-18.3	-170	-71.5	-76.8	0	0	0	114.4	W124 P126 F199 W200	W124-H203 PolarHBondContact O-CE1 2.91Å; P126-H203 HydrophobicContact CG-CB 3.71Å; P126-H203 VanDerWaalsContact CG-CG 3.49Å; F199-H203 AromaticContact CD2-CD2 3.63Å; F199-H203 AromaticContact CD2-NE2 3.78Å; F199-H203 AromaticContact CE1-CD2 3.94Å; F199-H203 AromaticContact CE2-CD2 3.29Å; F199-H203 WeakPolarHBondContact CE2-CD2 3.5Å; F199-H203 AromaticContact CE2-NE2 3.21Å; F199-H203 WeakPolarHBondContact CE2-NE2 3.3Å; F199-H203 AromaticContact CZ-CD2 3.47Å; F199-H203 VanDerWaalsContact CZ-CD2 3.47Å; F199-H203 WeakPolarHBondContact CZ-CD2 3.47Å; F199-H203 AromaticContact CZ-NE2 3.68Å; F199-H203 PolarHBondContact O-CD2 2.93Å; F199-H203 VanDerWaalsContact O-CD2 3.25Å; F199-H203 PolarHBondContact O-N 3.05Å; W200-H203 HydrophobicContact CE3-CB 4.33Å; W200-H203 PolarHBondContact O-N 3.07Å
204	R	97	Very high	96.1	Very high	54 Å²	54	43.4 Å²	43.4	20%	0.204	26%	0.258	C	S	.	.	S	Bend	trans	-139.9	65	178.1	-62.8	-64	-176.9	-75.4	-4	108.1	P126 N128 Y131 W200	P126-R204 PolarHBondContact O-NH2 3.11Å; N128-R204 PolarHBondContact OD1-NH2 3.39Å; Y131-R204 HydrophobicContact CD1-CG 3.85Å; Y131-R204 HydrophobicContact CD2-CG 4.02Å; Y131-R204 HydrophobicContact CE1-CB 4.06Å; Y131-R204 HydrophobicContact CE1-CG 3.83Å; Y131-R204 HydrophobicContact CE2-CB 4.03Å; Y131-R204 HydrophobicContact CE2-CG 4.02Å; Y131-R204 HydrophobicContact CG-CG 3.96Å; W200-R204 HydrophobicContact CE3-CG 3.83Å; W200-R204 HydrophobicContact CZ3-CG 4.11Å; W200-R204 CarbonylContact O-C 3.6Å; W200-R204 WeakPolarHBondContact O-CA 3.41Å; W200-R204 PolarHBondContact O-N 3.06Å
205	P	96.8	Very high	95.6	Very high	33 Å²	33	45.2 Å²	45.2	21%	0.214	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-64.7	158.2	-170.4	28.3	-36.1	0	0	0	112.4	D201 C209 N211	D201-P205 VanDerWaalsContact O-CA 3.25Å; D201-P205 WeakPolarHBondContact O-CA 3.3Å; D201-P205 WeakPolarHBondContact O-CB 3.4Å; P205-C209 HydrophobicContact CB-CB 4.18Å; P205-N211 HydrophobicContact CG-CB 4.14Å
206	V	96.8	Very high	95.2	Very high	29 Å²	29	46.9 Å²	46.9	18%	0.176	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-54.2	135.4	172.1	-177	0	0	0	0	109.3	H100 V101 Y151 G208 C209	H100-V206 HydrophobicContact CB-CG2 3.57Å; V101-V206 HydrophobicContact CG2-CB 4.47Å; V101-V206 HydrophobicContact CG2-CG2 4.21Å; Y151-V206 HydrophobicContact CE1-CG1 4.46Å; Y151-V206 HydrophobicContact CE1-CG2 4Å; V206-G208 PolarHBondContact O-N 3.25Å; V206-C209 VanDerWaalsContact O-CB 3.28Å; V206-C209 WeakPolarHBondContact O-CB 3.31Å; V206-C209 PolarHBondContact O-N 3.22Å
207	P	96.7	Very high	94.7	Very high	97 Å²	97	51.6 Å²	51.6	63%	0.63	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	130.1	176.9	-27.9	35.2	0	0	0	112.3	Y151	Y151-P207 HydrophobicContact CD2-CG 4.45Å; Y151-P207 HydrophobicContact CG-CG 4.3Å
208	G	94.8	Very high	94	Very high	87 Å²	87	58.8 Å²	58.8	90%	0.897	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.6	-15.8	-175.2	0	0	0	0	0	114.5	V206	V206-G208 PolarHBondContact O-N 3.25Å
209	C	95.8	Very high	93.3	Very high	51 Å²	51	61.8 Å²	61.8	35%	0.345	34%	0.341	S	S	.	.	S	Bend	trans	-78.4	149.3	169.3	-66.1	0	0	0	0	111.5	P205 V206 N211	P205-C209 HydrophobicContact CB-CB 4.18Å; V206-C209 VanDerWaalsContact O-CB 3.28Å; V206-C209 WeakPolarHBondContact O-CB 3.31Å; V206-C209 PolarHBondContact O-N 3.22Å; C209-N211 PolarHBondContact O-N 3.16Å
210	V	95.3	Very high	92.4	Very high	125 Å²	125	62.7 Å²	62.7	76%	0.758	35%	0.349	S	S	*	.			trans	-68	129.3	175	178.2	0	0	0	0	109.6	T212	V210-T212 PolarHBondContact O-N 3.43Å
211	N	94.9	Very high	91.2	Very high	41 Å²	41	70.9 Å²	70.9	22%	0.219	38%	0.379	C	S	.	.			trans	-80.3	101	172.1	-177	-5.2	0	0	0	110.2	P205 C209 T213 E214	P205-N211 HydrophobicContact CG-CB 4.14Å; C209-N211 PolarHBondContact O-N 3.16Å; N211-T213 PolarHBondContact O-N 2.78Å; N211-T213 WeakPolarHBondContact OD1-CB 3.21Å; N211-T213 PolarHBondContact OD1-N 3.3Å; N211-T213 VanDerWaalsContact OD1-N 3.11Å; N211-T213 PolarHBondContact OD1-OG1 2.85Å; N211-E214 HydrophobicContact CB-CG 3.92Å; N211-E214 WeakPolarHBondContact CB-OE1 3.33Å; N211-E214 PolarHBondContact ND2-OE1 3.22Å; N211-E214 PolarHBondContact O-N 3.22Å
212	T	94.1	Very high	89.9	Confident	25 Å²	25	76.2 Å²	76.2	15%	0.153	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	-176.9	50.9	0	0	0	0	114.1	A90 V210	A90-T212 HydrophobicContact CB-CG2 3.88Å; A90-T212 WeakPolarHBondContact O-CG2 3.29Å; A90-T212 PolarHBondContact O-OG1 3.34Å; V210-T212 PolarHBondContact O-N 3.43Å
213	T	91.1	Very high	88.5	Confident	62 Å²	62	79.6 Å²	79.6	38%	0.38	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.1	176.4	73.6	0	0	0	0	113.2	V202 N211 M215	V202-T213 HydrophobicContact CG1-CG2 3.93Å; N211-T213 PolarHBondContact O-N 2.78Å; N211-T213 WeakPolarHBondContact OD1-CB 3.21Å; N211-T213 PolarHBondContact OD1-N 3.3Å; N211-T213 VanDerWaalsContact OD1-N 3.11Å; N211-T213 PolarHBondContact OD1-OG1 2.85Å; T213-M215 PolarHBondContact O-N 3.36Å
214	E	90.5	Very high	87	Confident	147 Å²	147	87.6 Å²	87.6	69%	0.687	45%	0.451	S	S	*	.			trans	-67.7	132.7	177.1	-71.9	179.1	-166.6	0	0	111.2	N211	N211-E214 HydrophobicContact CB-CG 3.92Å; N211-E214 WeakPolarHBondContact CB-OE1 3.33Å; N211-E214 PolarHBondContact ND2-OE1 3.22Å; N211-E214 PolarHBondContact O-N 3.22Å
215	M	85.8	Confident	85.3	Confident	54 Å²	54	88 Å²	88	27%	0.266	46%	0.457	S	S	.	.			trans	-119.2	138.1	-177	-179.3	164.3	54.9	0	0	111	P21 T213 I217 K219 C220 L223	P21-M215 HydrophobicContact CB-SD 4.48Å; P21-M215 HydrophobicContact CG-SD 4.05Å; T213-M215 PolarHBondContact O-N 3.36Å; M215-I217 PolarHBondContact O-N 3.17Å; M215-K219 HydrophobicContact CG-CB 3.5Å; M215-K219 HydrophobicContact CG-CD 4.16Å; M215-K219 HydrophobicContact CG-CG 4.48Å; M215-K219 HydrophobicContact SD-CB 3.67Å; M215-C220 HydrophobicContact CE-CB 4.32Å; M215-C220 VanDerWaalsContact CE-SG 3.51Å; M215-L223 HydrophobicContact CE-CD2 4.17Å
216	D	88.1	Confident	83.4	Confident	63 Å²	63	89 Å²	89	34%	0.337	46%	0.464	S	S	.	.			trans	-52.1	132.4	174.5	-176.8	-62.2	0	0	0	110.8	R218 K219 C220	D216-R218 PolarHBondContact O-N 3.37Å; D216-R218 WeakPolarHBondContact OD1-CA 3.28Å; D216-R218 WeakPolarHBondContact OD1-CB 3.36Å; D216-R218 WeakPolarHBondContact OD1-CG 3.33Å; D216-R218 IonicContact OD1-CZ 2.76Å; D216-R218 PolarHBondContact OD1-N 2.97Å; D216-R218 IonicContact OD1-NE 2.72Å; D216-R218 PolarHBondContact OD1-NE 3.29Å; D216-R218 VanDerWaalsContact OD1-NE 3.07Å; D216-R218 IonicContact OD1-NH2 3.47Å; D216-R218 IonicContact OD2-CZ 3.01Å; D216-R218 IonicContact OD2-NE 3.73Å; D216-R218 PolarHBondContact OD2-NE 3.09Å; D216-R218 IonicContact OD2-NH2 3.61Å; D216-R218 PolarHBondContact OD2-NH2 3.37Å; D216-K219 HydrophobicContact CB-CB 4.35Å; D216-K219 HydrophobicContact CB-CD 4.22Å; D216-K219 HydrophobicContact CB-CG 4.29Å; D216-K219 WeakPolarHBondContact O-CA 3.47Å; D216-K219 VanDerWaalsContact O-CB 3.28Å; D216-K219 WeakPolarHBondContact O-CB 3.47Å; D216-K219 PolarHBondContact O-N 3.43Å; D216-C220 PolarHBondContact O-N 2.99Å; D216-C220 PolarHBondContact O-SG 3.38Å
217	I	86.8	Confident	81.4	Confident	136 Å²	136	93.1 Å²	93.1	70%	0.697	48%	0.481	S	S	*	.	H	α-helix	trans	-54.7	-31.5	-177	-171.8	58.2	0	0	0	113.3	M215 C220 R221	M215-I217 PolarHBondContact O-N 3.17Å; I217-C220 HydrophobicContact CD1-CB 4.47Å; I217-C220 PolarHBondContact O-N 3.01Å; I217-R221 PolarHBondContact O-N 2.95Å
218	R	82.8	Confident	79.2	Confident	176 Å²	176	95.6 Å²	95.6	66%	0.664	48%	0.482	S	S	*	.	H	α-helix	trans	-67.9	-41.8	175.2	-60.3	170.9	-74.8	-143.1	2.3	110.5	D216 R221 R222	D216-R218 PolarHBondContact O-N 3.37Å; D216-R218 WeakPolarHBondContact OD1-CA 3.28Å; D216-R218 WeakPolarHBondContact OD1-CB 3.36Å; D216-R218 WeakPolarHBondContact OD1-CG 3.33Å; D216-R218 IonicContact OD1-CZ 2.76Å; D216-R218 PolarHBondContact OD1-N 2.97Å; D216-R218 IonicContact OD1-NE 2.72Å; D216-R218 PolarHBondContact OD1-NE 3.29Å; D216-R218 VanDerWaalsContact OD1-NE 3.07Å; D216-R218 IonicContact OD1-NH2 3.47Å; D216-R218 IonicContact OD2-CZ 3.01Å; D216-R218 IonicContact OD2-NE 3.73Å; D216-R218 PolarHBondContact OD2-NE 3.09Å; D216-R218 IonicContact OD2-NH2 3.61Å; D216-R218 PolarHBondContact OD2-NH2 3.37Å; R218-R221 PolarHBondContact O-N 3.4Å; R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 2.96Å; R218-R222 VanDerWaalsContact O-N 3.1Å
219	K	82.3	Confident	77.1	Confident	63 Å²	63	94.7 Å²	94.7	27%	0.274	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-43.9	173.8	-76	177.6	171.1	-171.9	0	111	P21 N22 M215 D216 R221 R222 L223	P21-K219 HydrophobicContact CB-CB 4Å; P21-K219 HydrophobicContact CB-CD 3.88Å; P21-K219 HydrophobicContact CB-CG 3.79Å; P21-K219 HydrophobicContact CG-CB 3.94Å; P21-K219 HydrophobicContact CG-CG 4.27Å; N22-K219 PolarHBondContact OD1-NZ 3.08Å; M215-K219 HydrophobicContact CG-CB 3.5Å; M215-K219 HydrophobicContact CG-CD 4.16Å; M215-K219 HydrophobicContact CG-CG 4.48Å; M215-K219 HydrophobicContact SD-CB 3.67Å; D216-K219 HydrophobicContact CB-CB 4.35Å; D216-K219 HydrophobicContact CB-CD 4.22Å; D216-K219 HydrophobicContact CB-CG 4.29Å; D216-K219 WeakPolarHBondContact O-CA 3.47Å; D216-K219 VanDerWaalsContact O-CB 3.28Å; D216-K219 WeakPolarHBondContact O-CB 3.47Å; D216-K219 PolarHBondContact O-N 3.43Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 2.85Å; K219-R222 PolarHBondContact O-N 3.21Å; K219-R222 VanDerWaalsContact O-N 3.17Å; K219-L223 PolarHBondContact O-N 3.46Å
220	C	79.4	Confident	74.8	Confident	32 Å²	32	98.8 Å²	98.8	22%	0.216	47%	0.471	C	S	.	.	H	α-helix	trans	-58	-43.1	174.5	-60.2	0	0	0	0	112.6	M215 D216 I217 R222 L223 K224	M215-C220 HydrophobicContact CE-CB 4.32Å; M215-C220 VanDerWaalsContact CE-SG 3.51Å; D216-C220 PolarHBondContact O-N 2.99Å; D216-C220 PolarHBondContact O-SG 3.38Å; I217-C220 HydrophobicContact CD1-CB 4.47Å; I217-C220 PolarHBondContact O-N 3.01Å; C220-R222 VanDerWaalsContact C-N 3.35Å; C220-R222 PolarHBondContact O-N 2.82Å; C220-L223 PolarHBondContact O-N 3.31Å; C220-K224 PolarHBondContact O-N 3.03Å; C220-K224 VanDerWaalsContact O-N 3.14Å
221	R	73.1	Confident	72.6	Confident	182 Å²	182	99.4 Å²	99.4	69%	0.687	46%	0.463	S	S	*	.	H	α-helix	trans	-64.7	-38.3	177.6	-172	179.3	-177.4	-133.3	4.7	112.3	I217 R218 K219 K224 N225	I217-R221 PolarHBondContact O-N 2.95Å; R218-R221 PolarHBondContact O-N 3.4Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 2.85Å; R221-K224 PolarHBondContact O-N 2.86Å; R221-N225 PolarHBondContact O-N 3.45Å; R221-N225 VanDerWaalsContact O-N 3.17Å
222	R	70.7	Confident	70.1	Confident	118 Å²	118	101.8 Å²	101.8	45%	0.445	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-43.8	176.3	-67.6	-168.2	-74.6	-170.5	-2.4	111.5	R218 K219 C220 K224 N225 P226 V229	R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 2.96Å; R218-R222 VanDerWaalsContact O-N 3.1Å; K219-R222 PolarHBondContact O-N 3.21Å; K219-R222 VanDerWaalsContact O-N 3.17Å; C220-R222 VanDerWaalsContact C-N 3.35Å; C220-R222 PolarHBondContact O-N 2.82Å; R222-K224 VanDerWaalsContact C-N 3.3Å; R222-K224 PolarHBondContact O-N 3.36Å; R222-N225 CarbonylContact O-C 3.56Å; R222-N225 VanDerWaalsContact O-C 3.27Å; R222-N225 PolarHBondContact O-N 3.43Å; R222-N225 VanDerWaalsContact O-N 3.14Å; R222-P226 WeakPolarHBondContact O-CA 3.47Å; R222-P226 VanDerWaalsContact O-N 3.14Å; R222-V229 HydrophobicContact CB-CG2 4.04Å; R222-V229 HydrophobicContact CG-CG1 4.15Å; R222-V229 HydrophobicContact CG-CG2 3.6Å
223	L	69.1	Low	67.6	Low	80 Å²	80	106.3 Å²	106.3	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-40.6	177.5	-169.9	72.1	0	0	0	111.8	M215 K219 C220 N225	M215-L223 HydrophobicContact CE-CD2 4.17Å; K219-L223 PolarHBondContact O-N 3.46Å; C220-L223 PolarHBondContact O-N 3.31Å; L223-N225 VanDerWaalsContact C-N 3.32Å; L223-N225 PolarHBondContact O-N 3.37Å
224	K	66.3	Low	65.3	Low	185 Å²	185	113.8 Å²	113.8	80%	0.804	53%	0.533	S	S	*	.	H	α-helix	trans	-76.1	-14.3	178.4	-68.7	-177.6	178.3	-176.2	0	114.3	C220 R221 R222	C220-K224 PolarHBondContact O-N 3.03Å; C220-K224 VanDerWaalsContact O-N 3.14Å; R221-K224 PolarHBondContact O-N 2.86Å; R222-K224 VanDerWaalsContact C-N 3.3Å; R222-K224 PolarHBondContact O-N 3.36Å
225	N	61.2	Low	62.9	Low	62 Å²	62	109.3 Å²	109.3	33%	0.332	53%	0.527	S	S	.	.			trans	-153	65.4	-176.2	-149.5	-23.7	0	0	0	113	R221 R222 L223 Q227 K228	R221-N225 PolarHBondContact O-N 3.45Å; R221-N225 VanDerWaalsContact O-N 3.17Å; R222-N225 CarbonylContact O-C 3.56Å; R222-N225 VanDerWaalsContact O-C 3.27Å; R222-N225 PolarHBondContact O-N 3.43Å; R222-N225 VanDerWaalsContact O-N 3.14Å; L223-N225 VanDerWaalsContact C-N 3.32Å; L223-N225 PolarHBondContact O-N 3.37Å; N225-Q227 PolarHBondContact O-N 2.72Å; N225-Q227 VanDerWaalsContact O-N 3.12Å; N225-K228 WeakPolarHBondContact ND2-CD 3.15Å; N225-K228 WeakPolarHBondContact ND2-CE 3.43Å; N225-K228 PolarHBondContact O-N 3.23Å
226	P	56.4	Low	60.6	Low	55 Å²	55	113.1 Å²	113.1	36%	0.357	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-60	-27.6	-173.8	19.8	-30.6	0	0	0	113	R222 K228 V229	R222-P226 WeakPolarHBondContact O-CA 3.47Å; R222-P226 VanDerWaalsContact O-N 3.14Å; P226-K228 PolarHBondContact O-N 3.48Å; P226-V229 PolarHBondContact O-N 3.09Å
227	Q	55.3	Low	58.2	Low	115 Å²	115	115.7 Å²	115.7	54%	0.537	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-72.8	-24.9	-178.4	-60.1	-153.6	-5.2	0	0	114.6	N225 V229	N225-Q227 PolarHBondContact O-N 2.72Å; N225-Q227 VanDerWaalsContact O-N 3.12Å; Q227-V229 VanDerWaalsContact C-N 3.31Å; Q227-V229 PolarHBondContact O-N 3.48Å
228	K	50	Low	55.9	Low	148 Å²	148	114.2 Å²	114.2	64%	0.643	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-77.6	-15.3	179.1	-75	-170.4	-179.5	-177.3	0	113.8	N225 P226	N225-K228 WeakPolarHBondContact ND2-CD 3.15Å; N225-K228 WeakPolarHBondContact ND2-CE 3.43Å; N225-K228 PolarHBondContact O-N 3.23Å; P226-K228 PolarHBondContact O-N 3.48Å
229	V	50.2	Low	53.8	Low	68 Å²	68	114 Å²	114	41%	0.412	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.2	-15.8	-171.7	-169.3	0	0	0	0	112	R222 P226 Q227 K231	R222-V229 HydrophobicContact CB-CG2 4.04Å; R222-V229 HydrophobicContact CG-CG1 4.15Å; R222-V229 HydrophobicContact CG-CG2 3.6Å; P226-V229 PolarHBondContact O-N 3.09Å; Q227-V229 VanDerWaalsContact C-N 3.31Å; Q227-V229 PolarHBondContact O-N 3.48Å; V229-K231 PolarHBondContact O-N 3Å
230	K	48.1	Very low	51.8	Low	137 Å²	137	116.4 Å²	116.4	60%	0.596	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-4.5	176.8	-68.2	-176.2	179.1	174.9	0	114	E17	E17-K230 WeakPolarHBondContact OE1-CE 3.26Å; E17-K230 IonicContact OE1-NZ 3.62Å; E17-K230 PolarHBondContact OE1-NZ 3.33Å; E17-K230 IonicContact OE2-NZ 3.79Å; E17-K230 PolarHBondContact OE2-NZ 3.05Å
231	K	48.7	Very low	49.8	Very low	138 Å²	138	124.1 Å²	124.1	60%	0.6	62%	0.624	S	S	*	*	S	Bend	trans	-108.8	81	176	-69.9	-172	176.5	-174.2	0	111.2	V229	V229-K231 PolarHBondContact O-N 3Å
232	S	42.8	Very low	48.1	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	63%	0.629	S	S	*	*			trans	155.8	119.3	152.9	-177.8	0	0	0	0	107.9
233	V	41.4	Very low	46.5	Very low	119 Å²	119	124.4 Å²	124.4	72%	0.721	65%	0.651	S	S	*	*	S	Bend		-132.7	-6.8	78.9	173.3	0	0	0	0	114.5
234	Y	42.3	Very low	44.8	Very low	220 Å²	220	125.6 Å²	125.6	86%	0.863	67%	0.665	S	S	*	*	S	Bend	trans	-136.3	10.9	174.6	-71	-78.9	0	0	0	114.4
235	G	40	Very low	43.5	Very low	53 Å²	53	123 Å²	123	55%	0.546	67%	0.668	S	S	.	*	S	Bend	trans	-97.4	119.8	-179.3	0	0	0	0	0	111.6	T237	G235-T237 PolarHBondContact O-N 3.05Å
236	V	37.2	Very low	42.2	Very low	134 Å²	134	125.9 Å²	125.9	81%	0.812	69%	0.687	S	S	*	*			trans	-42.2	129	171.7	178.3	0	0	0	0	111.2	D238	V236-D238 PolarHBondContact O-N 3.46Å
237	T	37.9	Very low	41.5	Very low	117 Å²	117	132 Å²	132	72%	0.718	71%	0.71	S	S	*	*			trans	-65.1	113.5	171.1	25	0	0	0	0	110.3	G235	G235-T237 PolarHBondContact O-N 3.05Å
238	D	39.5	Very low	40.4	Very low	105 Å²	105	132.3 Å²	132.3	56%	0.561	72%	0.715	S	S	*	*			trans	-87.9	100	163	-115.1	-20.2	0	0	0	108.1	V236 T240	V236-D238 PolarHBondContact O-N 3.46Å; D238-T240 VanDerWaalsContact C-N 3.33Å; D238-T240 PolarHBondContact O-N 3.38Å
239	E	37.7	Very low	39.9	Very low	171 Å²	171	130 Å²	130	80%	0.799	72%	0.715	S	S	*	*			trans	-78.3	80.2	166.7	-78.3	-73.6	144.1	0	0	108.4
240	T	40.6	Very low	39.4	Very low	114 Å²	114	132.3 Å²	132.3	70%	0.699	73%	0.734	S	S	*	*			trans	-166.2	90.7	161.6	5.2	0	0	0	0	109	D238	D238-T240 VanDerWaalsContact C-N 3.33Å; D238-T240 PolarHBondContact O-N 3.38Å
241	Q	36.4	Very low	39.2	Very low	194 Å²	194	132 Å²	132	91%	0.907	73%	0.734	S	S	*	*			trans	-177.4	95.6	143.9	-101.4	164	29.2	0	0	110	Q243	Q241-Q243 PolarHBondContact O-N 2.83Å
242	S	39.3	Very low	39.1	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	74%	0.74	S	S	*	*			trans	-69	113.5	152.6	45.6	0	0	0	0	108.7
243	Q	36.2	Very low	39.4	Very low	192 Å²	192	133.6 Å²	133.6	90%	0.897	75%	0.747	S	S	*	*			trans	-162.5	139.9	155.3	-109.5	167.3	37.7	0	0	113.7	Q241	Q241-Q243 PolarHBondContact O-N 2.83Å
244	S	33.2	Very low	40.5	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	75%	0.748	S	S	*	*			trans	-55.5	162.8	-176.6	-79.6	0	0	0	0	116.2	V246	S244-V246 PolarHBondContact O-N 2.98Å; S244-V246 VanDerWaalsContact O-N 3.17Å
245	P	38.9	Very low	42	Very low	132 Å²	132	135.5 Å²	135.5	86%	0.857	75%	0.745	S	S	*	*			trans	-82.3	97.4	-175.5	33.3	-30.3	0	0	0	110.4
246	V	34.8	Very low	43.8	Very low	122 Å²	122	138.2 Å²	138.2	74%	0.739	75%	0.751	S	S	*	*			trans	-120.5	129.8	163.2	-177.3	0	0	0	0	108.3	S244 I248	S244-V246 PolarHBondContact O-N 2.98Å; S244-V246 VanDerWaalsContact O-N 3.17Å; V246-I248 PolarHBondContact O-N 3.08Å
247	H	39.9	Very low	46.3	Very low	182 Å²	182	134 Å²	134	84%	0.843	73%	0.725	S	S	*	*			trans	-49.9	120	178.3	-168.7	71.8	0	0	0	111
248	I	34.2	Very low	48.9	Very low	122 Å²	122	135.5 Å²	135.5	63%	0.626	72%	0.722	S	S	*	*			trans	-115	127.9	171	-57.7	176.9	0	0	0	107	V246 Q251	V246-I248 PolarHBondContact O-N 3.08Å; I248-Q251 HydrophobicContact CG2-CG 4.19Å
249	P	39	Very low	51.4	Low	101 Å²	101	134.8 Å²	134.8	66%	0.656	72%	0.718	S	S	*	*			trans	-63.8	148.9	175	-9.4	23.6	0	0	0	110.2	Q251	P249-Q251 PolarHBondContact O-N 3.4Å
250	S	39.6	Very low	53.8	Low	115 Å²	115	129.1 Å²	129.1	80%	0.804	69%	0.693	S	S	*	*			trans	-30.7	103.8	174.7	52.4	0	0	0	0	112.9
251	Q	43.7	Very low	56.2	Low	130 Å²	130	128 Å²	128	61%	0.607	68%	0.682	S	S	*	*			trans	-73	135.7	175.2	-74.8	-120.3	-19	0	0	109.7	I248 P249	I248-Q251 HydrophobicContact CG2-CG 4.19Å; P249-Q251 PolarHBondContact O-N 3.4Å
252	P	46.1	Very low	59	Low	110 Å²	110	124.9 Å²	124.9	71%	0.714	66%	0.662	S	S	*	*			trans	-63.4	151.4	177.9	26.7	-32.9	0	0	0	110.7	R254	P252-R254 PolarHBondContact O-N 3.39Å
253	I	50.3	Low	61.5	Low	154 Å²	154	125.9 Å²	125.9	79%	0.79	65%	0.652	S	S	*	*			trans	-37.3	111.3	176.2	-61.4	168.8	0	0	0	109.8	K255	I253-K255 PolarHBondContact O-N 3.14Å
254	R	63.5	Low	64.2	Low	195 Å²	195	121.5 Å²	121.5	74%	0.736	63%	0.632	S	S	*	*			trans	-58.9	113.3	-179.4	-173.7	179.9	-179	-172.2	-0.7	107.9	P252 T256	P252-R254 PolarHBondContact O-N 3.39Å; R254-T256 PolarHBondContact O-N 3.37Å
255	K	73.4	Confident	67.1	Low	185 Å²	185	120.7 Å²	120.7	80%	0.804	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-59	129.2	175.3	-67.4	-178.4	179.3	179	0	108.6	I253 T257	I253-K255 PolarHBondContact O-N 3.14Å; K255-T257 PolarHBondContact O-N 3.39Å
256	T	78.6	Confident	69.8	Low	110 Å²	110	119.1 Å²	119.1	68%	0.675	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-50.8	123	178.6	-50.2	0	0	0	0	110.1	R254 D260 I261	R254-T256 PolarHBondContact O-N 3.37Å; T256-D260 HydrophobicContact CG2-CB 4.06Å; T256-I261 HydrophobicContact CG2-CD1 4.46Å; T256-I261 HydrophobicContact CG2-CG1 3.92Å
257	T	90.3	Very high	72.6	Confident	45 Å²	45	117.8 Å²	117.8	28%	0.276	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-89.8	162.7	-178.5	70	0	0	0	0	111.2	K255 D259 D260 I261	K255-T257 PolarHBondContact O-N 3.39Å; T257-D259 PolarHBondContact O-N 3.5Å; T257-D260 WeakPolarHBondContact CB-OD2 3.46Å; T257-D260 PolarHBondContact N-OD2 3.45Å; T257-D260 PolarHBondContact O-N 3.17Å; T257-D260 VanDerWaalsContact O-N 3.17Å; T257-D260 PolarHBondContact OG1-N 3.3Å; T257-D260 PolarHBondContact OG1-OD2 3.14Å; T257-I261 PolarHBondContact O-N 3.4Å; T257-I261 VanDerWaalsContact O-N 3.15Å
258	K	91.1	Very high	75.2	Confident	149 Å²	149	113 Å²	113	65%	0.648	57%	0.571	S	S	*	*	H	α-helix	trans	-56.6	-35.1	173	-175.1	178.9	-178.3	178.3	0	112.1	I261 R262	K258-I261 PolarHBondContact O-N 3.12Å; K258-R262 WeakPolarHBondContact O-CG 3.45Å; K258-R262 PolarHBondContact O-N 3.01Å
259	D	92.5	Very high	78.1	Confident	89 Å²	89	111.4 Å²	111.4	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-74.4	-33	179.4	-66.5	-28.7	0	0	0	112.3	T257 I261 R262 K263	T257-D259 PolarHBondContact O-N 3.5Å; D259-I261 VanDerWaalsContact C-N 3.32Å; D259-R262 PolarHBondContact O-N 3.17Å; D259-R262 IonicContact OD1-CZ 2.97Å; D259-R262 IonicContact OD1-NH1 3.95Å; D259-R262 PolarHBondContact OD1-NH1 3.04Å; D259-K263 WeakPolarHBondContact O-CG 3.47Å; D259-K263 PolarHBondContact O-N 3.1Å
260	D	88.5	Confident	80.7	Confident	53 Å²	53	109 Å²	109	28%	0.283	55%	0.553	S	S	.	*	H	α-helix	trans	-62.7	-42.2	171.4	-58.8	-43.6	0	0	0	110.7	T256 T257 K263 Q264	T256-D260 HydrophobicContact CG2-CB 4.06Å; T257-D260 WeakPolarHBondContact CB-OD2 3.46Å; T257-D260 PolarHBondContact N-OD2 3.45Å; T257-D260 PolarHBondContact O-N 3.17Å; T257-D260 VanDerWaalsContact O-N 3.17Å; T257-D260 PolarHBondContact OG1-N 3.3Å; T257-D260 PolarHBondContact OG1-OD2 3.14Å; D260-K263 PolarHBondContact O-N 3.44Å; D260-Q264 WeakPolarHBondContact O-CB 3.34Å; D260-Q264 PolarHBondContact O-N 3Å
261	I	91.4	Very high	83.3	Confident	90 Å²	90	106 Å²	106	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-43.2	175.5	-63.8	172.1	0	0	0	110.8	T256 T257 K258 D259 Q264 I265	T256-I261 HydrophobicContact CG2-CD1 4.46Å; T256-I261 HydrophobicContact CG2-CG1 3.92Å; T257-I261 PolarHBondContact O-N 3.4Å; T257-I261 VanDerWaalsContact O-N 3.15Å; K258-I261 PolarHBondContact O-N 3.12Å; D259-I261 VanDerWaalsContact C-N 3.32Å; I261-Q264 WeakPolarHBondContact O-CB 3.37Å; I261-Q264 PolarHBondContact O-N 3.45Å; I261-I265 HydrophobicContact CG2-CD1 3.96Å; I261-I265 HydrophobicContact CG2-CG1 4.47Å; I261-I265 WeakPolarHBondContact O-CG1 3.38Å; I261-I265 PolarHBondContact O-N 3.21Å
262	R	94	Very high	85.7	Confident	129 Å²	129	106.1 Å²	106.1	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-60.4	-46.4	176.2	-75.3	169.3	171.6	164.2	-12.6	111.9	K258 D259 Q264 I265 T266	K258-R262 WeakPolarHBondContact O-CG 3.45Å; K258-R262 PolarHBondContact O-N 3.01Å; D259-R262 PolarHBondContact O-N 3.17Å; D259-R262 IonicContact OD1-CZ 2.97Å; D259-R262 IonicContact OD1-NH1 3.95Å; D259-R262 PolarHBondContact OD1-NH1 3.04Å; R262-Q264 VanDerWaalsContact C-N 3.29Å; R262-Q264 PolarHBondContact O-N 3.21Å; R262-I265 PolarHBondContact O-N 3.08Å; R262-T266 PolarHBondContact O-N 3.36Å; R262-T266 PolarHBondContact O-OG1 3Å
263	K	92.4	Very high	88	Confident	134 Å²	134	106.8 Å²	106.8	58%	0.583	53%	0.527	S	S	*	.	H	α-helix	trans	-59.2	-42	175.4	-73.8	178.7	178.6	-177.1	0	111.4	D259 D260 T266 F267	D259-K263 WeakPolarHBondContact O-CG 3.47Å; D259-K263 PolarHBondContact O-N 3.1Å; D260-K263 PolarHBondContact O-N 3.44Å; K263-T266 PolarHBondContact O-N 2.96Å; K263-F267 WeakPolarHBondContact O-CB 3.24Å; K263-F267 PolarHBondContact O-N 3.08Å
264	Q	91.9	Very high	90.1	Very high	101 Å²	101	106.2 Å²	106.2	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-42.7	176.6	-170.8	63.9	20.9	0	0	111.9	D260 I261 R262 F267 L268	D260-Q264 WeakPolarHBondContact O-CB 3.34Å; D260-Q264 PolarHBondContact O-N 3Å; I261-Q264 WeakPolarHBondContact O-CB 3.37Å; I261-Q264 PolarHBondContact O-N 3.45Å; R262-Q264 VanDerWaalsContact C-N 3.29Å; R262-Q264 PolarHBondContact O-N 3.21Å; Q264-F267 PolarHBondContact O-N 3.13Å; Q264-L268 HydrophobicContact CG-CD1 4Å; Q264-L268 HydrophobicContact CG-CG 4.39Å; Q264-L268 WeakPolarHBondContact O-CB 3.49Å; Q264-L268 VanDerWaalsContact O-CG 3.24Å; Q264-L268 WeakPolarHBondContact O-CG 3.33Å; Q264-L268 PolarHBondContact O-N 3.25Å
265	I	94.4	Very high	91.5	Very high	86 Å²	86	106.1 Å²	106.1	44%	0.441	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-48.5	175.8	-68.9	165.5	0	0	0	110.4	I261 R262 F267 L268 N269	I261-I265 HydrophobicContact CG2-CD1 3.96Å; I261-I265 HydrophobicContact CG2-CG1 4.47Å; I261-I265 WeakPolarHBondContact O-CG1 3.38Å; I261-I265 PolarHBondContact O-N 3.21Å; R262-I265 PolarHBondContact O-N 3.08Å; I265-F267 VanDerWaalsContact C-N 3.32Å; I265-F267 PolarHBondContact O-N 3.23Å; I265-L268 PolarHBondContact O-N 2.89Å; I265-N269 WeakPolarHBondContact O-CB 3.49Å; I265-N269 VanDerWaalsContact O-CG 3.31Å; I265-N269 PolarHBondContact O-N 3.15Å
266	T	95.6	Very high	92.5	Very high	99 Å²	99	102.8 Å²	102.8	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-58.3	-44.3	177.2	-58.8	0	0	0	0	111.6	R262 K263 A270	R262-T266 PolarHBondContact O-N 3.36Å; R262-T266 PolarHBondContact O-OG1 3Å; K263-T266 PolarHBondContact O-N 2.96Å; T266-A270 WeakPolarHBondContact O-CB 3.38Å; T266-A270 PolarHBondContact O-N 3.2Å
267	F	93.6	Very high	93.3	Very high	94 Å²	94	104.1 Å²	104.1	41%	0.412	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-44.3	177.1	172.7	-98.3	0	0	0	112.7	K263 Q264 I265 A270 Q271	K263-F267 WeakPolarHBondContact O-CB 3.24Å; K263-F267 PolarHBondContact O-N 3.08Å; Q264-F267 PolarHBondContact O-N 3.13Å; I265-F267 VanDerWaalsContact C-N 3.32Å; I265-F267 PolarHBondContact O-N 3.23Å; F267-A270 PolarHBondContact O-N 2.92Å; F267-Q271 HydrophobicContact CD1-CG 4.38Å; F267-Q271 HydrophobicContact CE1-CG 3.86Å; F267-Q271 HydrophobicContact CE2-CG 4.5Å; F267-Q271 VanDerWaalsContact CZ-CD 3.41Å; F267-Q271 HydrophobicContact CZ-CG 3.93Å; F267-Q271 WeakPolarHBondContact O-CB 3.31Å; F267-Q271 PolarHBondContact O-N 3.42Å; F267-Q271 PolarHBondContact O-NE2 3.01Å
268	L	94.7	Very high	93.6	Very high	81 Å²	81	109.9 Å²	109.9	42%	0.424	54%	0.544	S	S	.	.	H	α-helix	trans	-68.1	-39.8	179.6	-72.3	174.2	0	0	0	112.1	Q264 I265 Q271 I272	Q264-L268 HydrophobicContact CG-CD1 4Å; Q264-L268 HydrophobicContact CG-CG 4.39Å; Q264-L268 WeakPolarHBondContact O-CB 3.49Å; Q264-L268 VanDerWaalsContact O-CG 3.24Å; Q264-L268 WeakPolarHBondContact O-CG 3.33Å; Q264-L268 PolarHBondContact O-N 3.25Å; I265-L268 PolarHBondContact O-N 2.89Å; L268-Q271 VanDerWaalsContact O-CB 3.26Å; L268-Q271 WeakPolarHBondContact O-CB 3.29Å; L268-Q271 PolarHBondContact O-N 2.88Å; L268-Q271 VanDerWaalsContact O-N 3.15Å; L268-I272 WeakPolarHBondContact O-CG1 3.4Å; L268-I272 PolarHBondContact O-N 2.9Å
269	N	95.8	Very high	93.9	Very high	89 Å²	89	109.2 Å²	109.2	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-60.9	-48.3	173.8	-72.7	-16.1	0	0	0	110.6	I265 Q271 I272 D273	I265-N269 WeakPolarHBondContact O-CB 3.49Å; I265-N269 VanDerWaalsContact O-CG 3.31Å; I265-N269 PolarHBondContact O-N 3.15Å; N269-Q271 PolarHBondContact O-N 2.96Å; N269-I272 PolarHBondContact O-N 2.64Å; N269-I272 VanDerWaalsContact O-N 3.08Å; N269-D273 PolarHBondContact O-N 3.33Å; N269-D273 VanDerWaalsContact O-N 3.13Å
270	A	93.9	Very high	94.2	Very high	52 Å²	52	108.1 Å²	108.1	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-60.7	-30.5	175.2	0	0	0	0	0	113	T266 F267 R274	T266-A270 WeakPolarHBondContact O-CB 3.38Å; T266-A270 PolarHBondContact O-N 3.2Å; F267-A270 PolarHBondContact O-N 2.92Å; A270-R274 WeakPolarHBondContact O-CG 3.36Å
271	Q	94.1	Very high	94.6	Very high	52 Å²	52	110.2 Å²	110.2	24%	0.243	55%	0.551	C	S	.	*	H	α-helix	trans	-69.7	-38.8	175.7	-99.5	20.6	-140.7	0	0	111.8	F267 L268 N269 R274	F267-Q271 HydrophobicContact CD1-CG 4.38Å; F267-Q271 HydrophobicContact CE1-CG 3.86Å; F267-Q271 HydrophobicContact CE2-CG 4.5Å; F267-Q271 VanDerWaalsContact CZ-CD 3.41Å; F267-Q271 HydrophobicContact CZ-CG 3.93Å; F267-Q271 WeakPolarHBondContact O-CB 3.31Å; F267-Q271 PolarHBondContact O-N 3.42Å; F267-Q271 PolarHBondContact O-NE2 3.01Å; L268-Q271 VanDerWaalsContact O-CB 3.26Å; L268-Q271 WeakPolarHBondContact O-CB 3.29Å; L268-Q271 PolarHBondContact O-N 2.88Å; L268-Q271 VanDerWaalsContact O-N 3.15Å; N269-Q271 PolarHBondContact O-N 2.96Å; Q271-R274 PolarHBondContact O-N 3Å
272	I	94	Very high	94.9	Very high	131 Å²	131	108.2 Å²	108.2	67%	0.672	54%	0.543	S	S	*	.	H	α-helix	trans	-68.5	-38	179.6	-70.2	164.7	0	0	0	110.8	L268 N269 R274	L268-I272 WeakPolarHBondContact O-CG1 3.4Å; L268-I272 PolarHBondContact O-N 2.9Å; N269-I272 PolarHBondContact O-N 2.64Å; N269-I272 VanDerWaalsContact O-N 3.08Å; I272-R274 PolarHBondContact O-N 3.15Å
273	D	94.4	Very high	95.1	Very high	124 Å²	124	103.8 Å²	103.8	66%	0.663	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-10.8	-179.1	-65.7	-25.8	0	0	0	113.2	N269 H275	N269-D273 PolarHBondContact O-N 3.33Å; N269-D273 VanDerWaalsContact O-N 3.13Å; D273-H275 PolarHBondContact O-N 3.43Å
274	R	93.9	Very high	95.4	Very high	143 Å²	143	102.3 Å²	102.3	54%	0.54	53%	0.529	S	S	.	.	S	Bend	trans	-72.7	123.7	177.8	-66	-169.8	-56.9	-153.7	0.7	111.3	A270 Q271 I272 C276	A270-R274 WeakPolarHBondContact O-CG 3.36Å; Q271-R274 PolarHBondContact O-N 3Å; I272-R274 PolarHBondContact O-N 3.15Å; R274-C276 PolarHBondContact O-N 3.03Å; R274-C276 VanDerWaalsContact O-N 3.08Å
275	H	93.6	Very high	95.6	Very high	193 Å²	193	101 Å²	101	89%	0.894	53%	0.531	S	S	*	.			trans	-68.9	105.9	173.5	-67.6	-59.6	0	0	0	111.8	D273	D273-H275 PolarHBondContact O-N 3.43Å
276	C	93.8	Very high	95.8	Very high	114 Å²	114	102 Å²	102	77%	0.77	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-91.1	149.6	174.7	-66.4	0	0	0	0	112.2	R274	R274-C276 PolarHBondContact O-N 3.03Å; R274-C276 VanDerWaalsContact O-N 3.08Å
277	L	94.8	Very high	95.9	Very high	139 Å²	139	101.9 Å²	101.9	73%	0.728	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-97.6	152.4	171.7	-69.8	169.4	0	0	0	110.5	V282	L277-V282 HydrophobicContact CB-CG2 3.75Å; L277-V282 HydrophobicContact CD1-CG2 4.49Å
278	K	97.8	Very high	96.1	Very high	166 Å²	166	99.3 Å²	99.3	72%	0.722	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-63	139.7	171.5	-67.7	-171.7	177.2	-172.8	0	109.9	S280 K281 V282	K278-S280 VanDerWaalsContact C-N 3.25Å; K278-S280 PolarHBondContact O-N 3.21Å; K278-K281 HydrophobicContact CB-CG 4.48Å; K278-K281 WeakPolarHBondContact O-CA 3.47Å; K278-K281 PolarHBondContact O-N 2.85Å; K278-V282 PolarHBondContact O-N 2.73Å; K278-V282 VanDerWaalsContact O-N 3.08Å
279	M	97.6	Very high	96.2	Very high	134 Å²	134	101.3 Å²	101.3	66%	0.66	53%	0.531	S	S	*	.	H	α-helix	trans	-57.3	-37.7	-178.7	-166.9	60.4	-123.2	0	0	112.8	K281 V282 A283	M279-K281 VanDerWaalsContact C-N 3.27Å; M279-K281 PolarHBondContact O-N 2.91Å; M279-V282 HydrophobicContact CE-CB 3.79Å; M279-V282 HydrophobicContact CE-CG1 3.75Å; M279-V282 PolarHBondContact O-N 3.04Å; M279-V282 HydrophobicContact SD-CB 4.46Å; M279-A283 HydrophobicContact CE-CB 4.27Å; M279-A283 WeakPolarHBondContact O-CB 3.48Å; M279-A283 PolarHBondContact O-N 3.36Å
280	S	97.7	Very high	96.3	Very high	67 Å²	67	101.2 Å²	101.2	47%	0.469	53%	0.533	S	S	.	.	H	α-helix	trans	-58.2	-39.4	174.3	53.2	0	0	0	0	112.7	K278 E284	K278-S280 VanDerWaalsContact C-N 3.25Å; K278-S280 PolarHBondContact O-N 3.21Å; S280-E284 WeakPolarHBondContact O-CB 3.24Å; S280-E284 WeakPolarHBondContact O-CG 3.49Å; S280-E284 PolarHBondContact O-N 3.07Å
281	K	97.6	Very high	96.5	Very high	97 Å²	97	105 Å²	105	42%	0.422	54%	0.542	S	S	.	.	H	α-helix	trans	-74	-33.8	178	-66.3	-65.5	164.4	-137.2	0	113	K278 M279 E284 S285	K278-K281 HydrophobicContact CB-CG 4.48Å; K278-K281 WeakPolarHBondContact O-CA 3.47Å; K278-K281 PolarHBondContact O-N 2.85Å; M279-K281 VanDerWaalsContact C-N 3.27Å; M279-K281 PolarHBondContact O-N 2.91Å; K281-E284 IonicContact NZ-OE1 3.7Å; K281-E284 PolarHBondContact NZ-OE1 2.93Å; K281-E284 IonicContact NZ-OE2 2.79Å; K281-E284 PolarHBondContact NZ-OE2 3.12Å; K281-S285 VanDerWaalsContact O-CB 3.32Å; K281-S285 WeakPolarHBondContact O-CB 3.49Å; K281-S285 PolarHBondContact O-N 3.01Å; K281-S285 VanDerWaalsContact O-N 3.12Å
282	V	98.1	Very high	96.6	Very high	48 Å²	48	105.6 Å²	105.6	29%	0.291	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-49.6	172.4	176.9	0	0	0	0	109.9	L277 K278 M279 S285 L286	L277-V282 HydrophobicContact CB-CG2 3.75Å; L277-V282 HydrophobicContact CD1-CG2 4.49Å; K278-V282 PolarHBondContact O-N 2.73Å; K278-V282 VanDerWaalsContact O-N 3.08Å; M279-V282 HydrophobicContact CE-CB 3.79Å; M279-V282 HydrophobicContact CE-CG1 3.75Å; M279-V282 PolarHBondContact O-N 3.04Å; M279-V282 HydrophobicContact SD-CB 4.46Å; V282-S285 PolarHBondContact O-N 2.85Å; V282-L286 HydrophobicContact CG1-CD1 3.9Å; V282-L286 HydrophobicContact CG1-CG 4.39Å; V282-L286 WeakPolarHBondContact O-CG 3.35Å; V282-L286 PolarHBondContact O-N 3.47Å
283	A	98.2	Very high	96.7	Very high	36 Å²	36	100.7 Å²	100.7	30%	0.298	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-50.3	179.4	0	0	0	0	0	112.2	M279 S285 L286 I287	M279-A283 HydrophobicContact CE-CB 4.27Å; M279-A283 WeakPolarHBondContact O-CB 3.48Å; M279-A283 PolarHBondContact O-N 3.36Å; A283-S285 VanDerWaalsContact C-N 3.26Å; A283-S285 PolarHBondContact O-N 3.29Å; A283-L286 PolarHBondContact O-N 3.14Å; A283-I287 WeakPolarHBondContact O-CB 3.3Å; A283-I287 VanDerWaalsContact O-CG1 3.3Å; A283-I287 WeakPolarHBondContact O-CG1 3.29Å; A283-I287 PolarHBondContact O-N 3.3Å
284	E	97.9	Very high	96.8	Very high	102 Å²	102	97.1 Å²	97.1	48%	0.477	50%	0.501	S	S	.	.	H	α-helix	trans	-53.8	-43.5	175.3	-76.9	169.9	-147.4	0	0	111.7	S280 K281 A288	S280-E284 WeakPolarHBondContact O-CB 3.24Å; S280-E284 WeakPolarHBondContact O-CG 3.49Å; S280-E284 PolarHBondContact O-N 3.07Å; K281-E284 IonicContact NZ-OE1 3.7Å; K281-E284 PolarHBondContact NZ-OE1 2.93Å; K281-E284 IonicContact NZ-OE2 2.79Å; K281-E284 PolarHBondContact NZ-OE2 3.12Å; E284-A288 VanDerWaalsContact O-CB 3.3Å; E284-A288 WeakPolarHBondContact O-CB 3.43Å; E284-A288 PolarHBondContact O-N 3.45Å
285	S	97.3	Very high	96.8	Very high	75 Å²	75	95.3 Å²	95.3	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-38.5	-179.1	-172.3	0	0	0	0	113.1	K281 V282 A283 Y289	K281-S285 VanDerWaalsContact O-CB 3.32Å; K281-S285 WeakPolarHBondContact O-CB 3.49Å; K281-S285 PolarHBondContact O-N 3.01Å; K281-S285 VanDerWaalsContact O-N 3.12Å; V282-S285 PolarHBondContact O-N 2.85Å; A283-S285 VanDerWaalsContact C-N 3.26Å; A283-S285 PolarHBondContact O-N 3.29Å; S285-Y289 WeakPolarHBondContact O-CB 3.41Å; S285-Y289 PolarHBondContact O-N 3.3Å
286	L	98.1	Very high	96.9	Very high	105 Å²	105	88.2 Å²	88.2	55%	0.55	46%	0.464	S	S	.	.	H	α-helix	trans	-69.5	-43.6	178.6	-71.2	174.1	0	0	0	110.9	V282 A283 Y289 T290	V282-L286 HydrophobicContact CG1-CD1 3.9Å; V282-L286 HydrophobicContact CG1-CG 4.39Å; V282-L286 WeakPolarHBondContact O-CG 3.35Å; V282-L286 PolarHBondContact O-N 3.47Å; A283-L286 PolarHBondContact O-N 3.14Å; L286-Y289 PolarHBondContact O-N 3.11Å; L286-T290 PolarHBondContact O-N 3.4Å; L286-T290 PolarHBondContact O-OG1 2.96Å; L286-T290 VanDerWaalsContact O-OG1 3.09Å
287	I	97.9	Very high	97	Very high	97 Å²	97	85.6 Å²	85.6	50%	0.497	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-51.9	176.2	-67.8	166	0	0	0	110.1	A283 Y289 T290 E291	A283-I287 WeakPolarHBondContact O-CB 3.3Å; A283-I287 VanDerWaalsContact O-CG1 3.3Å; A283-I287 WeakPolarHBondContact O-CG1 3.29Å; A283-I287 PolarHBondContact O-N 3.3Å; I287-Y289 VanDerWaalsContact C-N 3.28Å; I287-Y289 PolarHBondContact O-N 3.08Å; I287-T290 PolarHBondContact O-N 2.86Å; I287-T290 VanDerWaalsContact O-N 3.13Å; I287-E291 HydrophobicContact CG2-CG 4.23Å; I287-E291 WeakPolarHBondContact CG2-OE1 3.32Å; I287-E291 WeakPolarHBondContact O-CB 3.47Å; I287-E291 WeakPolarHBondContact O-CG 3.37Å; I287-E291 PolarHBondContact O-N 3.23Å
288	A	97.5	Very high	97	Very high	41 Å²	41	82.1 Å²	82.1	34%	0.339	43%	0.428	S	S	.	.	H	α-helix	trans	-61.4	-36.6	-179.8	0	0	0	0	0	112.6	E284 Q292	E284-A288 VanDerWaalsContact O-CB 3.3Å; E284-A288 WeakPolarHBondContact O-CB 3.43Å; E284-A288 PolarHBondContact O-N 3.45Å; A288-Q292 VanDerWaalsContact O-CB 3.31Å; A288-Q292 WeakPolarHBondContact O-CB 3.48Å; A288-Q292 PolarHBondContact O-N 3.29Å; A288-Q292 VanDerWaalsContact O-N 3.08Å
289	Y	97.3	Very high	96.9	Very high	123 Å²	123	83.5 Å²	83.5	48%	0.482	44%	0.435	S	S	.	.	H	α-helix	trans	-63.6	-51.4	173	-177	-91.3	0	0	0	110.5	S285 L286 I287 E291 Q292 Y293	S285-Y289 WeakPolarHBondContact O-CB 3.41Å; S285-Y289 PolarHBondContact O-N 3.3Å; L286-Y289 PolarHBondContact O-N 3.11Å; I287-Y289 VanDerWaalsContact C-N 3.28Å; I287-Y289 PolarHBondContact O-N 3.08Å; Y289-E291 PolarHBondContact O-N 3.47Å; Y289-Q292 WeakPolarHBondContact O-CB 3.48Å; Y289-Q292 PolarHBondContact O-N 2.84Å; Y289-Q292 VanDerWaalsContact O-N 3.11Å; Y289-Y293 HydrophobicContact CD1-CD2 4.29Å; Y289-Y293 HydrophobicContact CD2-CD2 4.22Å; Y289-Y293 AromaticContact CD2-CE2 3.76Å; Y289-Y293 HydrophobicContact CD2-CE2 3.76Å; Y289-Y293 HydrophobicContact CE1-CD2 4.03Å; Y289-Y293 HydrophobicContact CE1-CE2 4.18Å; Y289-Y293 AromaticContact CE2-CD2 3.96Å; Y289-Y293 HydrophobicContact CE2-CD2 3.96Å; Y289-Y293 AromaticContact CE2-CE2 3.3Å; Y289-Y293 HydrophobicContact CE2-CE2 3.3Å; Y289-Y293 AromaticContact CE2-CZ 3.94Å; Y289-Y293 HydrophobicContact CG-CD2 4.37Å; Y289-Y293 HydrophobicContact CG-CE2 4.36Å; Y289-Y293 AromaticContact CZ-CD2 3.85Å; Y289-Y293 AromaticContact CZ-CE2 3.53Å; Y289-Y293 VanDerWaalsContact O-CD2 3.3Å; Y289-Y293 WeakPolarHBondContact O-CD2 3.47Å; Y289-Y293 PolarHBondContact O-N 3.17Å
290	T	97.8	Very high	96.8	Very high	87 Å²	87	82.1 Å²	82.1	53%	0.534	43%	0.429	S	S	.	.	H	α-helix	trans	-59	-46	179.2	-58.7	0	0	0	0	112.2	L286 I287 Q292 Y293 V294	L286-T290 PolarHBondContact O-N 3.4Å; L286-T290 PolarHBondContact O-OG1 2.96Å; L286-T290 VanDerWaalsContact O-OG1 3.09Å; I287-T290 PolarHBondContact O-N 2.86Å; I287-T290 VanDerWaalsContact O-N 3.13Å; T290-Q292 PolarHBondContact O-N 3.36Å; T290-Y293 PolarHBondContact O-N 3.22Å; T290-Y293 VanDerWaalsContact O-N 3.14Å; T290-V294 PolarHBondContact O-N 3.37Å
291	E	96.8	Very high	96.7	Very high	132 Å²	132	81.3 Å²	81.3	62%	0.617	42%	0.421	S	S	*	.	H	α-helix	trans	-59.4	-35.3	176.6	-72.8	175.6	171.9	0	0	112.4	I287 Y289 Y293 V294	I287-E291 HydrophobicContact CG2-CG 4.23Å; I287-E291 WeakPolarHBondContact CG2-OE1 3.32Å; I287-E291 WeakPolarHBondContact O-CB 3.47Å; I287-E291 WeakPolarHBondContact O-CG 3.37Å; I287-E291 PolarHBondContact O-N 3.23Å; Y289-E291 PolarHBondContact O-N 3.47Å; E291-Y293 VanDerWaalsContact C-N 3.32Å; E291-Y293 PolarHBondContact O-N 2.75Å; E291-V294 VanDerWaalsContact O-CG1 3.31Å; E291-V294 WeakPolarHBondContact O-CG1 3.45Å
292	Q	96.1	Very high	96.4	Very high	64 Å²	64	82 Å²	82	30%	0.299	44%	0.435	S	S	.	.	H	α-helix	trans	-67.2	-31.5	178.3	-177.2	171.9	30.9	0	0	113	A288 Y289 T290 F335	A288-Q292 VanDerWaalsContact O-CB 3.31Å; A288-Q292 WeakPolarHBondContact O-CB 3.48Å; A288-Q292 PolarHBondContact O-N 3.29Å; A288-Q292 VanDerWaalsContact O-N 3.08Å; Y289-Q292 WeakPolarHBondContact O-CB 3.48Å; Y289-Q292 PolarHBondContact O-N 2.84Å; Y289-Q292 VanDerWaalsContact O-N 3.11Å; T290-Q292 PolarHBondContact O-N 3.36Å; Q292-F335 HydrophobicContact CG-CD1 3.96Å; Q292-F335 HydrophobicContact CG-CD2 3.8Å; Q292-F335 HydrophobicContact CG-CE1 3.91Å; Q292-F335 HydrophobicContact CG-CE2 3.77Å; Q292-F335 HydrophobicContact CG-CG 3.87Å; Q292-F335 HydrophobicContact CG-CZ 3.8Å; Q292-F335 VanDerWaalsContact NE2-CG 3.25Å; Q292-F335 VanDerWaalsContact O-CE2 3.3Å; Q292-F335 WeakPolarHBondContact O-CE2 3.47Å; Q292-F335 WeakPolarHBondContact O-CZ 3.49Å
293	Y	96.6	Very high	96	Very high	27 Å²	27	80.7 Å²	80.7	11%	0.106	43%	0.43	C	S	.	.	H	α-helix	trans	-102.6	-1.6	-177.5	-70.9	-95.8	0	0	0	113.9	Y289 T290 E291 E295 Y296 D297 R332 F335 E339	Y289-Y293 HydrophobicContact CD1-CD2 4.29Å; Y289-Y293 HydrophobicContact CD2-CD2 4.22Å; Y289-Y293 AromaticContact CD2-CE2 3.76Å; Y289-Y293 HydrophobicContact CD2-CE2 3.76Å; Y289-Y293 HydrophobicContact CE1-CD2 4.03Å; Y289-Y293 HydrophobicContact CE1-CE2 4.18Å; Y289-Y293 AromaticContact CE2-CD2 3.96Å; Y289-Y293 HydrophobicContact CE2-CD2 3.96Å; Y289-Y293 AromaticContact CE2-CE2 3.3Å; Y289-Y293 HydrophobicContact CE2-CE2 3.3Å; Y289-Y293 AromaticContact CE2-CZ 3.94Å; Y289-Y293 HydrophobicContact CG-CD2 4.37Å; Y289-Y293 HydrophobicContact CG-CE2 4.36Å; Y289-Y293 AromaticContact CZ-CD2 3.85Å; Y289-Y293 AromaticContact CZ-CE2 3.53Å; Y289-Y293 VanDerWaalsContact O-CD2 3.3Å; Y289-Y293 WeakPolarHBondContact O-CD2 3.47Å; Y289-Y293 PolarHBondContact O-N 3.17Å; T290-Y293 PolarHBondContact O-N 3.22Å; T290-Y293 VanDerWaalsContact O-N 3.14Å; E291-Y293 VanDerWaalsContact C-N 3.32Å; E291-Y293 PolarHBondContact O-N 2.75Å; Y293-E295 VanDerWaalsContact C-N 3.25Å; Y293-E295 PolarHBondContact O-N 2.91Å; Y293-Y296 CarbonylContact O-C 3.58Å; Y293-Y296 WeakPolarHBondContact O-CA 3.33Å; Y293-Y296 WeakPolarHBondContact O-CB 3.38Å; Y293-Y296 PolarHBondContact O-N 3.48Å; Y293-D297 PolarHBondContact O-N 3.09Å; Y293-R332 HydrophobicContact CE1-CG 4.37Å; Y293-F335 HydrophobicContact CD1-CD2 4.2Å; Y293-F335 HydrophobicContact CD1-CE2 4.27Å; Y293-F335 AromaticContact CE1-CD2 3.7Å; Y293-F335 HydrophobicContact CE1-CD2 3.7Å; Y293-F335 HydrophobicContact CE1-CE2 4.22Å; Y293-F335 HydrophobicContact CE2-CD2 4.03Å; Y293-F335 AromaticContact CZ-CD2 3.61Å; Y293-E339 HydrophobicContact CE1-CG 4.42Å; Y293-E339 WeakPolarHBondContact OH-CG 3.25Å
294	V	96.7	Very high	95.5	Very high	50 Å²	50	85.6 Å²	85.6	30%	0.303	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-58.4	-35.6	-176.9	76	0	0	0	0	113.1	T290 E291 Y296 D297 I300 T301	T290-V294 PolarHBondContact O-N 3.37Å; E291-V294 VanDerWaalsContact O-CG1 3.31Å; E291-V294 WeakPolarHBondContact O-CG1 3.45Å; V294-Y296 PolarHBondContact O-N 3.39Å; V294-D297 PolarHBondContact O-N 3.13Å; V294-I300 HydrophobicContact CG2-CB 4.28Å; V294-I300 HydrophobicContact CG2-CD1 4.13Å; V294-I300 HydrophobicContact CG2-CG2 3.66Å; V294-T301 WeakPolarHBondContact O-CB 3.49Å; V294-T301 PolarHBondContact O-OG1 3.03Å
295	E	94.6	Very high	95.2	Very high	104 Å²	104	84.4 Å²	84.4	49%	0.486	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-67.1	-14.2	175.4	-67.4	-176.4	167.1	0	0	113	Y293 K331	Y293-E295 VanDerWaalsContact C-N 3.25Å; Y293-E295 PolarHBondContact O-N 2.91Å; E295-K331 IonicContact OE2-NZ 3.66Å; E295-K331 PolarHBondContact OE2-NZ 3.18Å
296	Y	94.2	Very high	95	Very high	44 Å²	44	82.2 Å²	82.2	17%	0.173	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-110.6	1.4	-177.1	-59.5	-97.6	0	0	0	112.7	Y293 V294 P298 Q328 R332 F335	Y293-Y296 CarbonylContact O-C 3.58Å; Y293-Y296 WeakPolarHBondContact O-CA 3.33Å; Y293-Y296 WeakPolarHBondContact O-CB 3.38Å; Y293-Y296 PolarHBondContact O-N 3.48Å; V294-Y296 PolarHBondContact O-N 3.39Å; Y296-P298 WeakPolarHBondContact O-CD 3.41Å; Y296-Q328 HydrophobicContact CE1-CB 4.02Å; Y296-Q328 WeakPolarHBondContact CE1-O 3.33Å; Y296-Q328 PolarHBondContact OH-O 3.25Å; Y296-Q328 VanDerWaalsContact OH-O 3.11Å; Y296-R332 HydrophobicContact CE1-CB 3.85Å; Y296-R332 HydrophobicContact CE1-CG 4.36Å; Y296-F335 AromaticContact CD2-CE2 3.99Å; Y296-F335 HydrophobicContact CD2-CE2 3.99Å; Y296-F335 HydrophobicContact CD2-CZ 4.36Å; Y296-F335 AromaticContact CE2-CE2 3.45Å; Y296-F335 HydrophobicContact CE2-CE2 3.45Å; Y296-F335 VanDerWaalsContact CE2-CE2 3.45Å; Y296-F335 AromaticContact CE2-CZ 3.46Å; Y296-F335 HydrophobicContact CE2-CZ 3.46Å; Y296-F335 VanDerWaalsContact CE2-CZ 3.46Å; Y296-F335 AromaticContact CZ-CE2 3.96Å; Y296-F335 AromaticContact CZ-CZ 3.93Å
297	D	96.3	Very high	94.9	Very high	59 Å²	59	78.8 Å²	78.8	32%	0.316	42%	0.415	S	S	.	.			trans	-92.4	109.8	177.9	-170.1	-32.1	0	0	0	109.8	Y293 V294 F299 I300 T301	Y293-D297 PolarHBondContact O-N 3.09Å; V294-D297 PolarHBondContact O-N 3.13Å; D297-F299 PolarHBondContact O-N 2.92Å; D297-F299 VanDerWaalsContact O-N 3.12Å; D297-F299 WeakPolarHBondContact OD1-CB 3.38Å; D297-F299 PolarHBondContact OD1-N 3.31Å; D297-I300 HydrophobicContact CB-CB 4.36Å; D297-I300 HydrophobicContact CB-CD1 4.36Å; D297-I300 HydrophobicContact CB-CG1 4.37Å; D297-I300 PolarHBondContact O-N 3.33Å; D297-I300 VanDerWaalsContact O-N 3.07Å; D297-T301 PolarHBondContact O-N 3.04Å; D297-T301 VanDerWaalsContact O-O 3.13Å
298	P	94.2	Very high	94.8	Very high	66 Å²	66	74.6 Å²	74.6	43%	0.429	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.4	-177.1	-20.9	34.5	0	0	0	114.6	Y296 T301 A303	Y296-P298 WeakPolarHBondContact O-CD 3.41Å; P298-T301 WeakPolarHBondContact CA-O 3.28Å; P298-A303 HydrophobicContact CB-CB 4.43Å
299	F	96.3	Very high	94.8	Very high	195 Å²	195	82.1 Å²	82.1	86%	0.855	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-22.6	175.1	-65.9	-73.9	0	0	0	112.8	D297	D297-F299 PolarHBondContact O-N 2.92Å; D297-F299 VanDerWaalsContact O-N 3.12Å; D297-F299 WeakPolarHBondContact OD1-CB 3.38Å; D297-F299 PolarHBondContact OD1-N 3.31Å
300	I	96.3	Very high	94.7	Very high	106 Å²	106	83 Å²	83	54%	0.544	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-49.5	-177.8	-56.3	176.6	0	0	0	110.6	V294 D297	V294-I300 HydrophobicContact CG2-CB 4.28Å; V294-I300 HydrophobicContact CG2-CD1 4.13Å; V294-I300 HydrophobicContact CG2-CG2 3.66Å; D297-I300 HydrophobicContact CB-CB 4.36Å; D297-I300 HydrophobicContact CB-CD1 4.36Å; D297-I300 HydrophobicContact CB-CG1 4.37Å; D297-I300 PolarHBondContact O-N 3.33Å; D297-I300 VanDerWaalsContact O-N 3.07Å
301	T	94.8	Very high	94.7	Very high	49 Å²	49	81.4 Å²	81.4	30%	0.301	42%	0.417	S	S	.	.	S	Bend	trans	-107.6	125.3	180	-55.8	0	0	0	0	109	V294 D297 P298 A303	V294-T301 WeakPolarHBondContact O-CB 3.49Å; V294-T301 PolarHBondContact O-OG1 3.03Å; D297-T301 PolarHBondContact O-N 3.04Å; D297-T301 VanDerWaalsContact O-O 3.13Å; P298-T301 WeakPolarHBondContact CA-O 3.28Å; T301-A303 PolarHBondContact O-N 3.02Å
302	P	92.6	Very high	94.6	Very high	111 Å²	111	82.2 Å²	82.2	72%	0.721	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-54.9	127.5	177.1	-26.1	34.5	0	0	0	111.8
303	A	89.6	Confident	94.6	Very high	22 Å²	22	82 Å²	82	18%	0.182	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-70.9	137.2	177.1	0	0	0	0	0	110.9	P298 T301 P305 S306 L316	P298-A303 HydrophobicContact CB-CB 4.43Å; T301-A303 PolarHBondContact O-N 3.02Å; A303-P305 CarbonylContact O-C 3.38Å; A303-S306 CarbonylContact O-C 3.58Å; A303-S306 VanDerWaalsContact O-CA 3.22Å; A303-S306 WeakPolarHBondContact O-CA 3.42Å; A303-S306 PolarHBondContact O-N 2.81Å; A303-L316 HydrophobicContact CB-CD2 3.65Å
304	E	87.6	Confident	94.6	Very high	139 Å²	139	85.1 Å²	85.1	65%	0.65	44%	0.444	S	S	*	.	S	Bend	trans	-100.9	128.7	177.4	-67	-175.6	173.9	0	0	110.5	L316	E304-L316 VanDerWaalsContact O-CD1 3.29Å; E304-L316 WeakPolarHBondContact O-CD1 3.42Å
305	P	90.4	Very high	94.6	Very high	76 Å²	76	85.5 Å²	85.5	49%	0.494	45%	0.447	S	S	.	.	S	Bend	cis	-80	-32.4	10.3	29.8	-34.7	0	0	0	114.4	A303 T315	A303-P305 CarbonylContact O-C 3.38Å; P305-T315 HydrophobicContact CG-CG2 4.03Å
306	S	93.8	Very high	94.5	Very high	30 Å²	30	81.5 Å²	81.5	21%	0.21	43%	0.429	C	S	.	.			trans	-159.5	161.2	174.1	64.1	0	0	0	0	110.3	A303 P308 S311	A303-S306 CarbonylContact O-C 3.58Å; A303-S306 VanDerWaalsContact O-CA 3.22Å; A303-S306 WeakPolarHBondContact O-CA 3.42Å; A303-S306 PolarHBondContact O-N 2.81Å; S306-P308 WeakPolarHBondContact O-CD 3.48Å; S306-S311 WeakPolarHBondContact CB-OG 3.4Å; S306-S311 WeakPolarHBondContact OG-CB 3.25Å; S306-S311 PolarHBondContact OG-OG 2.95Å
307	N	95.3	Very high	94.5	Very high	33 Å²	33	83.9 Å²	83.9	18%	0.176	44%	0.437	C	S	.	.			trans	-77.1	116.6	172.5	-175.9	-24.8	0	0	0	109.5	W309 I310 S311	N307-W309 PolarHBondContact O-N 3.21Å; N307-W309 VanDerWaalsContact OD1-CD1 3.25Å; N307-W309 PolarHBondContact OD1-N 2.64Å; N307-W309 VanDerWaalsContact OD1-N 3.11Å; N307-I310 HydrophobicContact CB-CB 4.48Å; N307-I310 HydrophobicContact CB-CD1 4.09Å; N307-I310 HydrophobicContact CB-CG1 4.25Å; N307-I310 PolarHBondContact O-N 3.11Å; N307-S311 PolarHBondContact O-N 3.21Å; N307-S311 PolarHBondContact O-OG 3.21Å; N307-S311 VanDerWaalsContact O-OG 3.05Å
308	P	96.8	Very high	94.5	Very high	8 Å²	8	85.8 Å²	85.8	5%	0.052	45%	0.447	C	S	.	.	H	α-helix	trans	-57.4	-27.5	-175.3	-27.6	36.1	0	0	0	114.3	S306 I310 D312 D313 L316 W317	S306-P308 WeakPolarHBondContact O-CD 3.48Å; P308-I310 PolarHBondContact O-N 2.96Å; P308-D312 VanDerWaalsContact O-CA 3.31Å; P308-D312 WeakPolarHBondContact O-CA 3.3Å; P308-D312 PolarHBondContact O-N 3.24Å; P308-D313 WeakPolarHBondContact CA-O 3.5Å; P308-D313 WeakPolarHBondContact CB-O 3.16Å; P308-D313 WeakPolarHBondContact CG-O 3.48Å; P308-L316 HydrophobicContact CG-CB 3.96Å; P308-L316 HydrophobicContact CG-CD2 4.29Å; P308-W317 HydrophobicContact CB-CD2 4.25Å; P308-W317 HydrophobicContact CB-CE3 4.46Å; P308-W317 HydrophobicContact CB-CH2 4.1Å; P308-W317 HydrophobicContact CB-CZ2 3.85Å; P308-W317 HydrophobicContact CB-CZ3 4.4Å; P308-W317 HydrophobicContact CG-CD2 4.06Å; P308-W317 HydrophobicContact CG-CG 4.27Å; P308-W317 HydrophobicContact CG-CZ2 4.2Å
309	W	96.6	Very high	94.3	Very high	200 Å²	200	85.9 Å²	85.9	76%	0.758	44%	0.444	S	S	*	.	H	α-helix	trans	-73.9	-14.6	178.2	-58.2	108.3	0	0	0	114	N307 W317	N307-W309 PolarHBondContact O-N 3.21Å; N307-W309 VanDerWaalsContact OD1-CD1 3.25Å; N307-W309 PolarHBondContact OD1-N 2.64Å; N307-W309 VanDerWaalsContact OD1-N 3.11Å; W309-W317 HydrophobicContact CD2-CZ2 4.44Å; W309-W317 AromaticContact CE2-CZ2 3.73Å; W309-W317 HydrophobicContact CH2-CH2 4.19Å; W309-W317 HydrophobicContact CH2-CZ2 4.46Å; W309-W317 AromaticContact CZ2-CH2 3.93Å; W309-W317 HydrophobicContact CZ2-CH2 3.93Å; W309-W317 AromaticContact CZ2-CZ2 3.74Å; W309-W317 HydrophobicContact CZ2-CZ2 3.74Å; W309-W317 AromaticContact NE1-CZ2 3.82Å
310	I	96.4	Very high	94	Very high	142 Å²	142	82 Å²	82	73%	0.728	43%	0.428	S	S	*	.	H	α-helix	trans	-107.7	-38.9	-179.2	-58	177.3	0	0	0	110.4	N307 P308	N307-I310 HydrophobicContact CB-CB 4.48Å; N307-I310 HydrophobicContact CB-CD1 4.09Å; N307-I310 HydrophobicContact CB-CG1 4.25Å; N307-I310 PolarHBondContact O-N 3.11Å; P308-I310 PolarHBondContact O-N 2.96Å
311	S	96.3	Very high	93.7	Very high	52 Å²	52	84.5 Å²	84.5	36%	0.364	44%	0.44	S	S	.	.	H	α-helix	trans	-96.7	-11.8	-174.6	58	0	0	0	0	114.6	S306 N307 D313	S306-S311 WeakPolarHBondContact CB-OG 3.4Å; S306-S311 WeakPolarHBondContact OG-CB 3.25Å; S306-S311 PolarHBondContact OG-OG 2.95Å; N307-S311 PolarHBondContact O-N 3.21Å; N307-S311 PolarHBondContact O-OG 3.21Å; N307-S311 VanDerWaalsContact O-OG 3.05Å; S311-D313 PolarHBondContact O-N 3.28Å; S311-D313 VanDerWaalsContact O-N 3.15Å; S311-D313 PolarHBondContact OG-N 3.12Å
312	D	96.1	Very high	93.6	Very high	150 Å²	150	84.1 Å²	84.1	80%	0.802	44%	0.439	S	S	*	.			trans	55	21	-167.7	-62.7	-35.2	0	0	0	113.6	P308	P308-D312 VanDerWaalsContact O-CA 3.31Å; P308-D312 WeakPolarHBondContact O-CA 3.3Å; P308-D312 PolarHBondContact O-N 3.24Å
313	D	96	Very high	93.5	Very high	60 Å²	60	87.9 Å²	87.9	32%	0.321	44%	0.444	S	S	.	.			trans	-103.3	112.8	176.2	177.8	11.7	0	0	0	110.8	P308 S311 T315	P308-D313 WeakPolarHBondContact CA-O 3.5Å; P308-D313 WeakPolarHBondContact CB-O 3.16Å; P308-D313 WeakPolarHBondContact CG-O 3.48Å; S311-D313 PolarHBondContact O-N 3.28Å; S311-D313 VanDerWaalsContact O-N 3.15Å; S311-D313 PolarHBondContact OG-N 3.12Å; D313-T315 PolarHBondContact O-N 3.1Å; D313-T315 WeakPolarHBondContact OD1-CB 3.45Å; D313-T315 PolarHBondContact OD1-N 3.46Å; D313-T315 PolarHBondContact OD1-OG1 2.83Å; D313-T315 PolarHBondContact OD2-OG1 3.33Å
314	I	96.7	Very high	93.6	Very high	92 Å²	92	93.6 Å²	93.6	47%	0.472	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.4	-178.2	63.8	169.5	0	0	0	114	L316 W317 D318	I314-L316 PolarHBondContact O-N 2.95Å; I314-L316 VanDerWaalsContact O-N 3.07Å; I314-W317 HydrophobicContact CB-CE3 4.14Å; I314-W317 HydrophobicContact CG2-CE3 3.9Å; I314-W317 HydrophobicContact CG2-CZ3 3.97Å; I314-W317 PolarHBondContact O-N 3.24Å; I314-D318 PolarHBondContact O-N 3.32Å
315	T	95.5	Very high	93.7	Very high	58 Å²	58	88.3 Å²	88.3	36%	0.356	45%	0.445	S	S	.	.	H	α-helix	trans	-52.3	-36.1	-175.9	-62.9	0	0	0	0	112.8	P305 D313 D318 I319	P305-T315 HydrophobicContact CG-CG2 4.03Å; D313-T315 PolarHBondContact O-N 3.1Å; D313-T315 WeakPolarHBondContact OD1-CB 3.45Å; D313-T315 PolarHBondContact OD1-N 3.46Å; D313-T315 PolarHBondContact OD1-OG1 2.83Å; D313-T315 PolarHBondContact OD2-OG1 3.33Å; T315-D318 PolarHBondContact O-N 3.2Å; T315-I319 HydrophobicContact CG2-CD1 3.82Å; T315-I319 HydrophobicContact CG2-CG1 4.36Å; T315-I319 VanDerWaalsContact O-CG1 3.26Å; T315-I319 WeakPolarHBondContact O-CG1 3.37Å; T315-I319 PolarHBondContact O-N 2.95Å
316	L	93.1	Very high	93.7	Very high	19 Å²	19	86.8 Å²	86.8	10%	0.099	44%	0.436	C	S	.	.	H	α-helix	trans	-59.1	-47.5	175.6	174.9	63.2	0	0	0	112	A303 E304 P308 I314 D318 I319 E320	A303-L316 HydrophobicContact CB-CD2 3.65Å; E304-L316 VanDerWaalsContact O-CD1 3.29Å; E304-L316 WeakPolarHBondContact O-CD1 3.42Å; P308-L316 HydrophobicContact CG-CB 3.96Å; P308-L316 HydrophobicContact CG-CD2 4.29Å; I314-L316 PolarHBondContact O-N 2.95Å; I314-L316 VanDerWaalsContact O-N 3.07Å; L316-D318 VanDerWaalsContact C-N 3.32Å; L316-D318 PolarHBondContact O-N 3.08Å; L316-I319 PolarHBondContact O-N 3.32Å; L316-E320 HydrophobicContact CD1-CG 4.29Å; L316-E320 WeakPolarHBondContact O-CG 3.34Å; L316-E320 PolarHBondContact O-N 3.03Å
317	W	95.1	Very high	93.6	Very high	95 Å²	95	89.6 Å²	89.6	36%	0.36	45%	0.445	S	S	.	.	H	α-helix	trans	-64.8	-38.6	-179.9	-66.1	-24.7	0	0	0	111.7	P308 W309 I314 I319 E320 M321	P308-W317 HydrophobicContact CB-CD2 4.25Å; P308-W317 HydrophobicContact CB-CE3 4.46Å; P308-W317 HydrophobicContact CB-CH2 4.1Å; P308-W317 HydrophobicContact CB-CZ2 3.85Å; P308-W317 HydrophobicContact CB-CZ3 4.4Å; P308-W317 HydrophobicContact CG-CD2 4.06Å; P308-W317 HydrophobicContact CG-CG 4.27Å; P308-W317 HydrophobicContact CG-CZ2 4.2Å; W309-W317 HydrophobicContact CD2-CZ2 4.44Å; W309-W317 AromaticContact CE2-CZ2 3.73Å; W309-W317 HydrophobicContact CH2-CH2 4.19Å; W309-W317 HydrophobicContact CH2-CZ2 4.46Å; W309-W317 AromaticContact CZ2-CH2 3.93Å; W309-W317 HydrophobicContact CZ2-CH2 3.93Å; W309-W317 AromaticContact CZ2-CZ2 3.74Å; W309-W317 HydrophobicContact CZ2-CZ2 3.74Å; W309-W317 AromaticContact NE1-CZ2 3.82Å; I314-W317 HydrophobicContact CB-CE3 4.14Å; I314-W317 HydrophobicContact CG2-CE3 3.9Å; I314-W317 HydrophobicContact CG2-CZ3 3.97Å; I314-W317 PolarHBondContact O-N 3.24Å; W317-I319 VanDerWaalsContact C-N 3.33Å; W317-I319 PolarHBondContact O-N 2.92Å; W317-E320 PolarHBondContact O-N 3.48Å; W317-M321 WeakPolarHBondContact O-CB 3.2Å; W317-M321 WeakPolarHBondContact O-CG 3.34Å; W317-M321 PolarHBondContact O-N 2.8Å
318	D	94.4	Very high	93.4	Very high	98 Å²	98	92 Å²	92	52%	0.524	46%	0.456	S	S	.	.	H	α-helix	trans	-62.1	-41.6	174.7	-71.3	-26.2	0	0	0	111.6	I314 T315 L316 M321 S322	I314-D318 PolarHBondContact O-N 3.32Å; T315-D318 PolarHBondContact O-N 3.2Å; L316-D318 VanDerWaalsContact C-N 3.32Å; L316-D318 PolarHBondContact O-N 3.08Å; D318-M321 PolarHBondContact O-N 2.96Å; D318-S322 PolarHBondContact O-N 2.63Å
319	I	90.9	Very high	93.2	Very high	69 Å²	69	93.8 Å²	93.8	35%	0.354	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-43.2	174.6	-68.4	165.4	0	0	0	110.8	T315 L316 W317 S322	T315-I319 HydrophobicContact CG2-CD1 3.82Å; T315-I319 HydrophobicContact CG2-CG1 4.36Å; T315-I319 VanDerWaalsContact O-CG1 3.26Å; T315-I319 WeakPolarHBondContact O-CG1 3.37Å; T315-I319 PolarHBondContact O-N 2.95Å; L316-I319 PolarHBondContact O-N 3.32Å; W317-I319 VanDerWaalsContact C-N 3.33Å; W317-I319 PolarHBondContact O-N 2.92Å; I319-S322 VanDerWaalsContact O-CB 3.23Å; I319-S322 WeakPolarHBondContact O-CB 3.36Å; I319-S322 PolarHBondContact O-N 3.26Å
320	E	90.3	Very high	93.2	Very high	113 Å²	113	84.3 Å²	84.3	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-67.4	-34.4	179.1	-73.3	-173.5	158.9	0	0	112.9	L316 W317 S322 R329	L316-E320 HydrophobicContact CD1-CG 4.29Å; L316-E320 WeakPolarHBondContact O-CG 3.34Å; L316-E320 PolarHBondContact O-N 3.03Å; W317-E320 PolarHBondContact O-N 3.48Å; E320-S322 VanDerWaalsContact C-N 3.33Å; E320-R329 PolarHBondContact O-NH1 3.21Å
321	M	90.7	Very high	93.1	Very high	159 Å²	159	80 Å²	80	78%	0.783	40%	0.402	S	S	*	.	H	α-helix	trans	-81	-12.1	176.1	-70.2	-175.9	62.8	0	0	113.7	W317 D318	W317-M321 WeakPolarHBondContact O-CB 3.2Å; W317-M321 WeakPolarHBondContact O-CG 3.34Å; W317-M321 PolarHBondContact O-N 2.8Å; D318-M321 PolarHBondContact O-N 2.96Å
322	S	91.6	Very high	93.1	Very high	41 Å²	41	82 Å²	82	29%	0.287	40%	0.401	S	S	.	.			trans	-57.6	148.2	-179.4	-176.4	0	0	0	0	112.7	D318 I319 E320 E324 R329	D318-S322 PolarHBondContact O-N 2.63Å; I319-S322 VanDerWaalsContact O-CB 3.23Å; I319-S322 WeakPolarHBondContact O-CB 3.36Å; I319-S322 PolarHBondContact O-N 3.26Å; E320-S322 VanDerWaalsContact C-N 3.33Å; S322-E324 VanDerWaalsContact C-N 3.26Å; S322-E324 PolarHBondContact OG-N 2.91Å; S322-E324 PolarHBondContact OG-O 3.39Å; S322-R329 PolarHBondContact O-NH1 3.04Å
323	K	91.1	Very high	93.2	Very high	189 Å²	189	75 Å²	75	82%	0.822	36%	0.363	S	S	*	.	S	Bend	trans	-74.9	-18.5	168.7	-68.3	-176.7	179.6	179.5	0	112.4	P325	K323-P325 WeakPolarHBondContact O-CD 3.47Å
324	E	90.3	Very high	93.2	Very high	142 Å²	142	72.1 Å²	72.1	66%	0.664	35%	0.349	S	S	*	.	S	Bend	trans	-94.8	102.1	171.9	-66.9	-176.3	179.6	0	0	108.8	S322	S322-E324 VanDerWaalsContact C-N 3.26Å; S322-E324 PolarHBondContact OG-N 2.91Å; S322-E324 PolarHBondContact OG-O 3.39Å
325	P	91.1	Very high	93.1	Very high	29 Å²	29	68.5 Å²	68.5	19%	0.188	33%	0.329	C	S	.	.			trans	-74.5	140.8	-172.8	32.4	-34.6	0	0	0	110.5	K323 R329 V330 W333 V345	K323-P325 WeakPolarHBondContact O-CD 3.47Å; P325-R329 HydrophobicContact CB-CB 4.39Å; P325-R329 HydrophobicContact CB-CG 4.29Å; P325-V330 HydrophobicContact CB-CG2 3.82Å; P325-V330 HydrophobicContact CG-CG2 3.64Å; P325-W333 HydrophobicContact CB-CH2 4.07Å; P325-W333 HydrophobicContact CB-CZ2 3.95Å; P325-W333 HydrophobicContact CG-CH2 3.76Å; P325-W333 HydrophobicContact CG-CZ2 4.17Å; P325-V345 HydrophobicContact CB-CG1 4.46Å; P325-V345 HydrophobicContact CG-CG1 4.02Å
326	S	90.8	Very high	93.2	Very high	43 Å²	43	66.9 Å²	66.9	30%	0.301	32%	0.321	S	S	.	.			trans	-66.4	159.7	171.4	73.7	0	0	0	0	111.5	Q328 R329 V330	S326-Q328 VanDerWaalsContact C-N 3.25Å; S326-Q328 PolarHBondContact O-N 2.95Å; S326-R329 WeakPolarHBondContact O-CB 3.35Å; S326-R329 PolarHBondContact O-N 2.99Å; S326-R329 VanDerWaalsContact O-N 3.11Å; S326-R329 WeakPolarHBondContact OG-CB 3.48Å; S326-R329 PolarHBondContact OG-N 3.26Å; S326-V330 WeakPolarHBondContact O-CG2 3.49Å; S326-V330 PolarHBondContact O-N 3.49Å
327	Q	90.6	Very high	93.4	Very high	89 Å²	89	66 Å²	66	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-57.8	-38.8	177.2	-175	178.3	40.8	0	0	112.3	V330 K331 L451	Q327-V330 PolarHBondContact O-N 2.73Å; Q327-K331 WeakPolarHBondContact O-CB 3.49Å; Q327-K331 PolarHBondContact O-N 3.46Å; Q327-L451 HydrophobicContact CG-CD1 4.48Å; Q327-L451 PolarHBondContact NE2-O 3.08Å
328	Q	90.5	Very high	93.5	Very high	84 Å²	84	64.3 Å²	64.3	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-45.7	176.4	-71.4	179.9	-10.9	0	0	110.9	Y296 S326 V330 K331 R332	Y296-Q328 HydrophobicContact CE1-CB 4.02Å; Y296-Q328 WeakPolarHBondContact CE1-O 3.33Å; Y296-Q328 PolarHBondContact OH-O 3.25Å; Y296-Q328 VanDerWaalsContact OH-O 3.11Å; S326-Q328 VanDerWaalsContact C-N 3.25Å; S326-Q328 PolarHBondContact O-N 2.95Å; Q328-V330 VanDerWaalsContact C-N 3.33Å; Q328-V330 PolarHBondContact O-N 3.26Å; Q328-K331 PolarHBondContact O-N 2.97Å; Q328-R332 PolarHBondContact O-N 2.84Å
329	R	93.9	Very high	93.7	Very high	46 Å²	46	60 Å²	60	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-42.9	176.5	-173.6	171.9	172.6	-158.8	-8.3	111.9	E320 S322 P325 S326 R332 W333 D343	E320-R329 PolarHBondContact O-NH1 3.21Å; S322-R329 PolarHBondContact O-NH1 3.04Å; P325-R329 HydrophobicContact CB-CB 4.39Å; P325-R329 HydrophobicContact CB-CG 4.29Å; S326-R329 WeakPolarHBondContact O-CB 3.35Å; S326-R329 PolarHBondContact O-N 2.99Å; S326-R329 VanDerWaalsContact O-N 3.11Å; S326-R329 WeakPolarHBondContact OG-CB 3.48Å; S326-R329 PolarHBondContact OG-N 3.26Å; R329-R332 WeakPolarHBondContact O-CB 3.49Å; R329-R332 PolarHBondContact O-N 2.95Å; R329-W333 VanDerWaalsContact O-CD1 3.27Å; R329-W333 PolarHBondContact O-N 2.93Å; R329-W333 PolarHBondContact O-NE1 3.27Å; R329-D343 WeakPolarHBondContact CG-OD2 3.42Å; R329-D343 IonicContact CZ-OD1 3.03Å; R329-D343 IonicContact CZ-OD2 2.66Å; R329-D343 IonicContact NE-OD1 3.3Å; R329-D343 IonicContact NE-OD2 3.61Å; R329-D343 PolarHBondContact NE-OD2 3.48Å; R329-D343 IonicContact NH2-OD1 3.88Å; R329-D343 PolarHBondContact NH2-OD1 2.95Å; R329-D343 IonicContact NH2-OD2 2.71Å; R329-D343 PolarHBondContact NH2-OD2 3.28Å
330	V	95.6	Very high	94	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-44	175.3	179.1	0	0	0	0	111.9	P325 S326 Q327 Q328 R332 W333 Y447 L450 L451	P325-V330 HydrophobicContact CB-CG2 3.82Å; P325-V330 HydrophobicContact CG-CG2 3.64Å; S326-V330 WeakPolarHBondContact O-CG2 3.49Å; S326-V330 PolarHBondContact O-N 3.49Å; Q327-V330 PolarHBondContact O-N 2.73Å; Q328-V330 VanDerWaalsContact C-N 3.33Å; Q328-V330 PolarHBondContact O-N 3.26Å; V330-R332 PolarHBondContact O-N 3.22Å; V330-W333 HydrophobicContact CB-CE3 4.3Å; V330-W333 HydrophobicContact CB-CZ3 4.39Å; V330-W333 HydrophobicContact CG1-CE3 3.93Å; V330-W333 HydrophobicContact CG1-CZ3 4.1Å; V330-W333 HydrophobicContact CG2-CE3 4.32Å; V330-W333 HydrophobicContact CG2-CH2 4Å; V330-W333 HydrophobicContact CG2-CZ2 4.42Å; V330-W333 HydrophobicContact CG2-CZ3 3.94Å; V330-W333 VanDerWaalsContact O-CB 3.31Å; V330-W333 WeakPolarHBondContact O-CB 3.35Å; V330-W333 PolarHBondContact O-N 2.93Å; V330-W333 VanDerWaalsContact O-N 3.08Å; V330-Y447 HydrophobicContact CG1-CD2 4.2Å; V330-Y447 HydrophobicContact CG1-CE2 3.74Å; V330-Y447 PolarHBondContact O-OH 2.63Å; V330-L450 HydrophobicContact CG1-CB 4.05Å; V330-L450 HydrophobicContact CG2-CB 4.45Å; V330-L451 HydrophobicContact CG1-CB 4.28Å; V330-L451 HydrophobicContact CG1-CD1 4.24Å
331	K	95.1	Very high	94.3	Very high	51 Å²	51	51.8 Å²	51.8	22%	0.222	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-38.2	177.5	-178.5	-176	173.4	-165.7	0	111.3	E295 Q327 Q328 W333 G334 F335 L451 F470	E295-K331 IonicContact OE2-NZ 3.66Å; E295-K331 PolarHBondContact OE2-NZ 3.18Å; Q327-K331 WeakPolarHBondContact O-CB 3.49Å; Q327-K331 PolarHBondContact O-N 3.46Å; Q328-K331 PolarHBondContact O-N 2.97Å; K331-W333 VanDerWaalsContact C-N 3.32Å; K331-W333 PolarHBondContact O-N 3.43Å; K331-G334 PolarHBondContact O-N 2.86Å; K331-G334 VanDerWaalsContact O-N 3.16Å; K331-F335 HydrophobicContact CG-CE1 4.42Å; K331-L451 HydrophobicContact CB-CD1 3.92Å; K331-F470 HydrophobicContact CD-CZ 4.37Å; K331-F470 HydrophobicContact CG-CE1 3.81Å; K331-F470 HydrophobicContact CG-CE2 4.33Å; K331-F470 HydrophobicContact CG-CZ 3.62Å
332	R	96.1	Very high	94.5	Very high	94 Å²	94	50.5 Å²	50.5	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-63.3	-34.1	177.9	-171.6	174.4	169.2	171.9	-0	113	Y293 Y296 Q328 R329 V330 G334 F335 E339	Y293-R332 HydrophobicContact CE1-CG 4.37Å; Y296-R332 HydrophobicContact CE1-CB 3.85Å; Y296-R332 HydrophobicContact CE1-CG 4.36Å; Q328-R332 PolarHBondContact O-N 2.84Å; R329-R332 WeakPolarHBondContact O-CB 3.49Å; R329-R332 PolarHBondContact O-N 2.95Å; V330-R332 PolarHBondContact O-N 3.22Å; R332-G334 PolarHBondContact O-N 2.92Å; R332-G334 VanDerWaalsContact O-N 3.15Å; R332-F335 HydrophobicContact CB-CD2 4.42Å; R332-F335 HydrophobicContact CB-CE2 4.49Å; R332-F335 HydrophobicContact CG-CD2 3.96Å; R332-F335 HydrophobicContact CG-CE2 4.26Å; R332-F335 VanDerWaalsContact O-CB 3.29Å; R332-F335 WeakPolarHBondContact O-CB 3.18Å; R332-F335 WeakPolarHBondContact O-CG 3.42Å; R332-F335 PolarHBondContact O-N 3.34Å; R332-E339 HydrophobicContact CG-CG 4.34Å; R332-E339 IonicContact CZ-OE2 3.86Å; R332-E339 VanDerWaalsContact CZ-OE2 3.24Å; R332-E339 IonicContact NE-OE2 3.43Å; R332-E339 PolarHBondContact NE-OE2 3.3Å; R332-E339 IonicContact NH2-OE2 3.36Å; R332-E339 PolarHBondContact NH2-OE2 3.03Å; R332-E339 WeakPolarHBondContact O-CB 3.33Å
333	W	97.1	Very high	94.8	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-28.6	175	-58	-16.9	0	0	0	112.7	P325 R329 V330 K331 F335 I340 D343 V345 Q349 Y438 Y447 L450	P325-W333 HydrophobicContact CB-CH2 4.07Å; P325-W333 HydrophobicContact CB-CZ2 3.95Å; P325-W333 HydrophobicContact CG-CH2 3.76Å; P325-W333 HydrophobicContact CG-CZ2 4.17Å; R329-W333 VanDerWaalsContact O-CD1 3.27Å; R329-W333 PolarHBondContact O-N 2.93Å; R329-W333 PolarHBondContact O-NE1 3.27Å; V330-W333 HydrophobicContact CB-CE3 4.3Å; V330-W333 HydrophobicContact CB-CZ3 4.39Å; V330-W333 HydrophobicContact CG1-CE3 3.93Å; V330-W333 HydrophobicContact CG1-CZ3 4.1Å; V330-W333 HydrophobicContact CG2-CE3 4.32Å; V330-W333 HydrophobicContact CG2-CH2 4Å; V330-W333 HydrophobicContact CG2-CZ2 4.42Å; V330-W333 HydrophobicContact CG2-CZ3 3.94Å; V330-W333 VanDerWaalsContact O-CB 3.31Å; V330-W333 WeakPolarHBondContact O-CB 3.35Å; V330-W333 PolarHBondContact O-N 2.93Å; V330-W333 VanDerWaalsContact O-N 3.08Å; K331-W333 VanDerWaalsContact C-N 3.32Å; K331-W333 PolarHBondContact O-N 3.43Å; W333-F335 VanDerWaalsContact C-N 3.3Å; W333-F335 PolarHBondContact O-N 3.26Å; W333-I340 HydrophobicContact CB-CB 4.02Å; W333-I340 HydrophobicContact CB-CD1 4.46Å; W333-I340 HydrophobicContact CB-CG1 4.26Å; W333-I340 HydrophobicContact CG-CB 4.38Å; W333-I340 HydrophobicContact CG-CG1 4.34Å; W333-D343 PolarHBondContact NE1-OD2 3.38Å; W333-V345 HydrophobicContact CH2-CB 4.37Å; W333-V345 HydrophobicContact CH2-CG1 3.95Å; W333-V345 HydrophobicContact CZ2-CB 4.13Å; W333-V345 HydrophobicContact CZ2-CG1 4.2Å; W333-Q349 HydrophobicContact CH2-CG 4.36Å; W333-Q349 HydrophobicContact CZ3-CG 4.36Å; W333-Y438 PolarHBondContact O-OH 3.33Å; W333-Y447 HydrophobicContact CB-CE2 4.36Å; W333-Y447 HydrophobicContact CE3-CD2 4.49Å; W333-Y447 HydrophobicContact CE3-CE2 4.35Å; W333-L450 HydrophobicContact CZ3-CD1 4.21Å
334	G	96.3	Very high	95	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.01	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.5	176.9	0	0	0	0	0	114.8	K331 R332 Y438 V474	K331-G334 PolarHBondContact O-N 2.86Å; K331-G334 VanDerWaalsContact O-N 3.16Å; R332-G334 PolarHBondContact O-N 2.92Å; R332-G334 VanDerWaalsContact O-N 3.15Å; G334-Y438 VanDerWaalsContact C-OH 3.3Å; G334-Y438 WeakPolarHBondContact CA-OH 3.38Å; G334-Y438 PolarHBondContact O-OH 3.31Å; G334-V474 VanDerWaalsContact O-CG1 3.23Å; G334-V474 WeakPolarHBondContact O-CG1 3.45Å
335	F	95.9	Very high	95.3	Very high	15 Å²	15	39.4 Å²	39.4	7%	0.066	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-43.1	-175.3	-67.4	-9.3	0	0	0	112.3	Q292 Y293 Y296 K331 R332 W333 E339 F470	Q292-F335 HydrophobicContact CG-CD1 3.96Å; Q292-F335 HydrophobicContact CG-CD2 3.8Å; Q292-F335 HydrophobicContact CG-CE1 3.91Å; Q292-F335 HydrophobicContact CG-CE2 3.77Å; Q292-F335 HydrophobicContact CG-CG 3.87Å; Q292-F335 HydrophobicContact CG-CZ 3.8Å; Q292-F335 VanDerWaalsContact NE2-CG 3.25Å; Q292-F335 VanDerWaalsContact O-CE2 3.3Å; Q292-F335 WeakPolarHBondContact O-CE2 3.47Å; Q292-F335 WeakPolarHBondContact O-CZ 3.49Å; Y293-F335 HydrophobicContact CD1-CD2 4.2Å; Y293-F335 HydrophobicContact CD1-CE2 4.27Å; Y293-F335 AromaticContact CE1-CD2 3.7Å; Y293-F335 HydrophobicContact CE1-CD2 3.7Å; Y293-F335 HydrophobicContact CE1-CE2 4.22Å; Y293-F335 HydrophobicContact CE2-CD2 4.03Å; Y293-F335 AromaticContact CZ-CD2 3.61Å; Y296-F335 AromaticContact CD2-CE2 3.99Å; Y296-F335 HydrophobicContact CD2-CE2 3.99Å; Y296-F335 HydrophobicContact CD2-CZ 4.36Å; Y296-F335 AromaticContact CE2-CE2 3.45Å; Y296-F335 HydrophobicContact CE2-CE2 3.45Å; Y296-F335 VanDerWaalsContact CE2-CE2 3.45Å; Y296-F335 AromaticContact CE2-CZ 3.46Å; Y296-F335 HydrophobicContact CE2-CZ 3.46Å; Y296-F335 VanDerWaalsContact CE2-CZ 3.46Å; Y296-F335 AromaticContact CZ-CE2 3.96Å; Y296-F335 AromaticContact CZ-CZ 3.93Å; K331-F335 HydrophobicContact CG-CE1 4.42Å; R332-F335 HydrophobicContact CB-CD2 4.42Å; R332-F335 HydrophobicContact CB-CE2 4.49Å; R332-F335 HydrophobicContact CG-CD2 3.96Å; R332-F335 HydrophobicContact CG-CE2 4.26Å; R332-F335 VanDerWaalsContact O-CB 3.29Å; R332-F335 WeakPolarHBondContact O-CB 3.18Å; R332-F335 WeakPolarHBondContact O-CG 3.42Å; R332-F335 PolarHBondContact O-N 3.34Å; W333-F335 VanDerWaalsContact C-N 3.3Å; W333-F335 PolarHBondContact O-N 3.26Å; F335-E339 HydrophobicContact CB-CG 4.29Å; F335-F470 HydrophobicContact CD1-CZ 4.12Å; F335-F470 AromaticContact CE1-CE2 3.88Å; F335-F470 HydrophobicContact CE1-CE2 3.88Å; F335-F470 AromaticContact CE1-CZ 3.68Å; F335-F470 HydrophobicContact CE1-CZ 3.68Å
336	S	96.8	Very high	95.5	Very high	25 Å²	25	38 Å²	38	18%	0.175	18%	0.18	C	C	.	.			trans	-158.3	158.1	176.7	77.7	0	0	0	0	111.1	D338 E339 Y438	S336-D338 PolarHBondContact O-N 3.03Å; S336-D338 PolarHBondContact OG-N 3.49Å; S336-E339 PolarHBondContact O-N 2.92Å; S336-E339 PolarHBondContact OG-N 3.24Å; S336-Y438 VanDerWaalsContact C-OH 3.24Å; S336-Y438 PolarHBondContact O-OH 3.31Å
337	F	97.8	Very high	95.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.5	-28.7	174.7	-172	-136.9	0	0	0	112.4	E339 I340 L341 F350 Y430 M433 K434 Y438	F337-E339 VanDerWaalsContact C-N 3.34Å; F337-I340 HydrophobicContact CD2-CG2 3.75Å; F337-I340 HydrophobicContact CE2-CG2 4.26Å; F337-I340 WeakPolarHBondContact O-CG2 3.22Å; F337-L341 HydrophobicContact CD1-CD1 3.81Å; F337-L341 HydrophobicContact CD2-CD1 4.35Å; F337-L341 HydrophobicContact CD2-CG 4.22Å; F337-L341 HydrophobicContact CE1-CD1 3.54Å; F337-L341 HydrophobicContact CE1-CG 4.3Å; F337-L341 HydrophobicContact CE2-CD1 4.09Å; F337-L341 HydrophobicContact CE2-CD2 4.11Å; F337-L341 HydrophobicContact CE2-CG 3.95Å; F337-L341 HydrophobicContact CG-CD1 4.23Å; F337-L341 HydrophobicContact CZ-CD1 3.69Å; F337-L341 HydrophobicContact CZ-CD2 4.07Å; F337-L341 HydrophobicContact CZ-CG 4Å; F337-L341 WeakPolarHBondContact O-CB 3.22Å; F337-L341 VanDerWaalsContact O-CG 3.28Å; F337-L341 WeakPolarHBondContact O-CG 3.43Å; F337-L341 PolarHBondContact O-N 3.21Å; F337-L341 VanDerWaalsContact O-N 3.13Å; F337-F350 HydrophobicContact CE2-CD1 4.19Å; F337-F350 AromaticContact CE2-CE1 3.52Å; F337-F350 HydrophobicContact CE2-CE1 3.52Å; F337-F350 AromaticContact CE2-CZ 3.87Å; F337-F350 HydrophobicContact CE2-CZ 3.87Å; F337-F350 AromaticContact CZ-CE1 3.92Å; F337-F350 HydrophobicContact CZ-CE1 3.92Å; F337-F350 HydrophobicContact CZ-CZ 4.38Å; F337-Y430 AromaticContact CD1-CD2 3.87Å; F337-Y430 HydrophobicContact CD1-CD2 3.87Å; F337-Y430 HydrophobicContact CD1-CE1 4.38Å; F337-Y430 AromaticContact CD1-CE2 3.49Å; F337-Y430 HydrophobicContact CD1-CE2 3.49Å; F337-Y430 VanDerWaalsContact CD1-CE2 3.49Å; F337-Y430 HydrophobicContact CD1-CG 4.48Å; F337-Y430 AromaticContact CD1-CZ 3.76Å; F337-Y430 AromaticContact CE1-CD2 3.74Å; F337-Y430 HydrophobicContact CE1-CD2 3.74Å; F337-Y430 AromaticContact CE1-CE2 3.84Å; F337-Y430 HydrophobicContact CE1-CE2 3.84Å; F337-Y430 HydrophobicContact CE1-CG 4.32Å; F337-M433 HydrophobicContact CE1-CB 3.89Å; F337-M433 HydrophobicContact CE1-CE 4.32Å; F337-M433 HydrophobicContact CE2-CB 4.46Å; F337-M433 HydrophobicContact CZ-CB 3.55Å; F337-M433 HydrophobicContact CZ-CE 4.02Å; F337-M433 HydrophobicContact CZ-SD 4.34Å; F337-K434 HydrophobicContact CB-CB 4.31Å; F337-K434 HydrophobicContact CB-CD 4.14Å; F337-K434 HydrophobicContact CB-CG 3.88Å; F337-K434 HydrophobicContact CD1-CB 3.6Å; F337-K434 HydrophobicContact CD1-CD 4.3Å; F337-K434 HydrophobicContact CD1-CG 4.08Å; F337-K434 HydrophobicContact CE1-CB 4.16Å; F337-K434 HydrophobicContact CG-CB 4.13Å; F337-K434 HydrophobicContact CG-CG 4.26Å; F337-Y438 HydrophobicContact CB-CD1 3.95Å; F337-Y438 HydrophobicContact CB-CD2 4.49Å; F337-Y438 HydrophobicContact CB-CE1 4.11Å; F337-Y438 HydrophobicContact CB-CG 4.15Å; F337-Y438 HydrophobicContact CD2-CD1 4.19Å; F337-Y438 AromaticContact CD2-CD2 3.55Å; F337-Y438 HydrophobicContact CD2-CD2 3.55Å; F337-Y438 HydrophobicContact CD2-CE2 4.23Å; F337-Y438 AromaticContact CD2-CG 3.52Å; F337-Y438 HydrophobicContact CD2-CG 3.52Å; F337-Y438 HydrophobicContact CE2-CD2 4.26Å; F337-Y438 HydrophobicContact CE2-CG 4.25Å; F337-Y438 HydrophobicContact CG-CD1 4.38Å; F337-Y438 HydrophobicContact CG-CD2 4.45Å; F337-Y438 HydrophobicContact CG-CG 4.13Å
338	D	97.1	Very high	96.2	Very high	59 Å²	59	36.9 Å²	36.9	32%	0.316	17%	0.17	S	C	.	.	H	α-helix	trans	-69	-32.2	176.6	-56.5	-71.8	0	0	0	112.2	S336 L341 K342 Y430 K434	S336-D338 PolarHBondContact O-N 3.03Å; S336-D338 PolarHBondContact OG-N 3.49Å; D338-L341 PolarHBondContact O-N 3.32Å; D338-K342 WeakPolarHBondContact O-CB 3.5Å; D338-K342 WeakPolarHBondContact O-CD 3.43Å; D338-K342 WeakPolarHBondContact O-CG 3.46Å; D338-K342 PolarHBondContact O-N 2.91Å; D338-Y430 PolarHBondContact OD1-OH 2.91Å; D338-Y430 PolarHBondContact OD2-OH 3.5Å; D338-K434 IonicContact OD2-NZ 3.27Å; D338-K434 PolarHBondContact OD2-NZ 3.17Å
339	E	97.7	Very high	96.5	Very high	9 Å²	9	34.9 Å²	34.9	4%	0.042	16%	0.161	C	C	.	.	H	α-helix	trans	-67.6	-44.7	178.9	-69	-54.4	113.9	0	0	111.7	Y293 R332 F335 S336 F337 L341 K342 D343	Y293-E339 HydrophobicContact CE1-CG 4.42Å; Y293-E339 WeakPolarHBondContact OH-CG 3.25Å; R332-E339 HydrophobicContact CG-CG 4.34Å; R332-E339 IonicContact CZ-OE2 3.86Å; R332-E339 VanDerWaalsContact CZ-OE2 3.24Å; R332-E339 IonicContact NE-OE2 3.43Å; R332-E339 PolarHBondContact NE-OE2 3.3Å; R332-E339 IonicContact NH2-OE2 3.36Å; R332-E339 PolarHBondContact NH2-OE2 3.03Å; R332-E339 WeakPolarHBondContact O-CB 3.33Å; F335-E339 HydrophobicContact CB-CG 4.29Å; S336-E339 PolarHBondContact O-N 2.92Å; S336-E339 PolarHBondContact OG-N 3.24Å; F337-E339 VanDerWaalsContact C-N 3.34Å; E339-L341 VanDerWaalsContact C-N 3.34Å; E339-L341 PolarHBondContact O-N 2.85Å; E339-K342 PolarHBondContact O-N 2.94Å; E339-K342 IonicContact OE1-NZ 2.81Å; E339-K342 PolarHBondContact OE1-NZ 2.85Å; E339-D343 PolarHBondContact O-N 3.39Å
340	I	97.2	Very high	96.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.3	-35.6	175.6	-168.3	168.5	0	0	0	112.2	W333 F337 D343 G346 R347 F350 Y438 F441	W333-I340 HydrophobicContact CB-CB 4.02Å; W333-I340 HydrophobicContact CB-CD1 4.46Å; W333-I340 HydrophobicContact CB-CG1 4.26Å; W333-I340 HydrophobicContact CG-CB 4.38Å; W333-I340 HydrophobicContact CG-CG1 4.34Å; F337-I340 HydrophobicContact CD2-CG2 3.75Å; F337-I340 HydrophobicContact CE2-CG2 4.26Å; F337-I340 WeakPolarHBondContact O-CG2 3.22Å; I340-D343 VanDerWaalsContact O-O 3.14Å; I340-G346 WeakPolarHBondContact CG1-O 3.41Å; I340-R347 PolarHBondContact O-N 2.97Å; I340-F350 HydrophobicContact CD1-CB 3.77Å; I340-F350 HydrophobicContact CD1-CD2 4.49Å; I340-F350 HydrophobicContact CD1-CG 4.21Å; I340-F350 HydrophobicContact CG1-CB 4.35Å; I340-Y438 HydrophobicContact CB-CE2 4.41Å; I340-Y438 HydrophobicContact CG2-CD2 3.9Å; I340-Y438 HydrophobicContact CG2-CE2 3.65Å; I340-F441 HydrophobicContact CD1-CD1 3.72Å; I340-F441 HydrophobicContact CD1-CE1 3.22Å; I340-F441 HydrophobicContact CD1-CZ 3.84Å
341	L	97	Very high	96.8	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-73.2	-25.4	178.2	-72.4	-179.6	0	0	0	113.3	F337 D338 E339 R347 L363 W366 Y430	F337-L341 HydrophobicContact CD1-CD1 3.81Å; F337-L341 HydrophobicContact CD2-CD1 4.35Å; F337-L341 HydrophobicContact CD2-CG 4.22Å; F337-L341 HydrophobicContact CE1-CD1 3.54Å; F337-L341 HydrophobicContact CE1-CG 4.3Å; F337-L341 HydrophobicContact CE2-CD1 4.09Å; F337-L341 HydrophobicContact CE2-CD2 4.11Å; F337-L341 HydrophobicContact CE2-CG 3.95Å; F337-L341 HydrophobicContact CG-CD1 4.23Å; F337-L341 HydrophobicContact CZ-CD1 3.69Å; F337-L341 HydrophobicContact CZ-CD2 4.07Å; F337-L341 HydrophobicContact CZ-CG 4Å; F337-L341 WeakPolarHBondContact O-CB 3.22Å; F337-L341 VanDerWaalsContact O-CG 3.28Å; F337-L341 WeakPolarHBondContact O-CG 3.43Å; F337-L341 PolarHBondContact O-N 3.21Å; F337-L341 VanDerWaalsContact O-N 3.13Å; D338-L341 PolarHBondContact O-N 3.32Å; E339-L341 VanDerWaalsContact C-N 3.34Å; E339-L341 PolarHBondContact O-N 2.85Å; L341-R347 VanDerWaalsContact O-CD 3.25Å; L341-R347 WeakPolarHBondContact O-CD 3.42Å; L341-R347 WeakPolarHBondContact O-CG 3.47Å; L341-R347 PolarHBondContact O-NH1 3.38Å; L341-L363 HydrophobicContact CD2-CD1 3.59Å; L341-W366 HydrophobicContact CB-CH2 4.24Å; L341-W366 HydrophobicContact CB-CZ3 4.36Å; L341-W366 HydrophobicContact CD1-CE3 4.4Å; L341-W366 HydrophobicContact CD1-CH2 3.8Å; L341-W366 HydrophobicContact CD1-CZ2 3.92Å; L341-W366 HydrophobicContact CD1-CZ3 4.05Å; L341-W366 HydrophobicContact CD2-CE3 4.38Å; L341-W366 HydrophobicContact CD2-CZ3 4.18Å; L341-W366 HydrophobicContact CG-CH2 4.49Å; L341-W366 HydrophobicContact CG-CZ3 4.44Å; L341-Y430 HydrophobicContact CD1-CD2 4.02Å; L341-Y430 HydrophobicContact CD1-CE2 3.8Å
342	K	95.9	Very high	96.8	Very high	132 Å²	132	38.5 Å²	38.5	57%	0.574	18%	0.176	S	C	*	.	H	α-helix	trans	-75.8	-36.3	173.9	-73.9	166.2	-165.3	167.9	0	112	D338 E339 R347	D338-K342 WeakPolarHBondContact O-CB 3.5Å; D338-K342 WeakPolarHBondContact O-CD 3.43Å; D338-K342 WeakPolarHBondContact O-CG 3.46Å; D338-K342 PolarHBondContact O-N 2.91Å; E339-K342 PolarHBondContact O-N 2.94Å; E339-K342 IonicContact OE1-NZ 2.81Å; E339-K342 PolarHBondContact OE1-NZ 2.85Å; K342-R347 PolarHBondContact O-NH1 3.05Å
343	D	96.6	Very high	96.9	Very high	24 Å²	24	34.9 Å²	34.9	13%	0.128	16%	0.162	C	C	.	.	S	Bend	trans	-77.1	124.8	-178.6	-167.3	-52.9	0	0	0	112.1	R329 W333 E339 I340 V345 G346 R347	R329-D343 WeakPolarHBondContact CG-OD2 3.42Å; R329-D343 IonicContact CZ-OD1 3.03Å; R329-D343 IonicContact CZ-OD2 2.66Å; R329-D343 IonicContact NE-OD1 3.3Å; R329-D343 IonicContact NE-OD2 3.61Å; R329-D343 PolarHBondContact NE-OD2 3.48Å; R329-D343 IonicContact NH2-OD1 3.88Å; R329-D343 PolarHBondContact NH2-OD1 2.95Å; R329-D343 IonicContact NH2-OD2 2.71Å; R329-D343 PolarHBondContact NH2-OD2 3.28Å; W333-D343 PolarHBondContact NE1-OD2 3.38Å; E339-D343 PolarHBondContact O-N 3.39Å; I340-D343 VanDerWaalsContact O-O 3.14Å; D343-V345 PolarHBondContact OD1-N 2.84Å; D343-G346 PolarHBondContact O-N 2.89Å; D343-G346 PolarHBondContact OD1-N 3.21Å; D343-R347 WeakPolarHBondContact O-CG 3.29Å; D343-R347 PolarHBondContact O-N 2.9Å
344	Q	95.6	Very high	96.9	Very high	101 Å²	101	34.8 Å²	34.8	47%	0.472	16%	0.162	S	C	.	.	H	α-helix	trans	-61.8	-45.5	178.8	-178.8	63.2	57.4	0	0	112.8	G346 R347 D348	Q344-G346 VanDerWaalsContact C-N 3.31Å; Q344-R347 PolarHBondContact O-N 3.32Å; Q344-D348 PolarHBondContact NE2-OD1 3.44Å; Q344-D348 PolarHBondContact O-N 2.81Å
345	V	96.3	Very high	96.9	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.085	18%	0.178	C	C	.	.	H	α-helix	trans	-69.4	-37.5	179.9	-177.6	0	0	0	0	109.6	P325 W333 D343 D348 Q349	P325-V345 HydrophobicContact CB-CG1 4.46Å; P325-V345 HydrophobicContact CG-CG1 4.02Å; W333-V345 HydrophobicContact CH2-CB 4.37Å; W333-V345 HydrophobicContact CH2-CG1 3.95Å; W333-V345 HydrophobicContact CZ2-CB 4.13Å; W333-V345 HydrophobicContact CZ2-CG1 4.2Å; D343-V345 PolarHBondContact OD1-N 2.84Å; V345-D348 PolarHBondContact O-N 2.97Å; V345-Q349 HydrophobicContact CG1-CG 4.44Å; V345-Q349 WeakPolarHBondContact O-CG 3.39Å; V345-Q349 PolarHBondContact O-N 3.13Å
346	G	96.6	Very high	96.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.2	-47.5	172.9	0	0	0	0	0	112.4	I340 D343 Q344 D348 Q349 F350	I340-G346 WeakPolarHBondContact CG1-O 3.41Å; D343-G346 PolarHBondContact O-N 2.89Å; D343-G346 PolarHBondContact OD1-N 3.21Å; Q344-G346 VanDerWaalsContact C-N 3.31Å; G346-D348 PolarHBondContact O-N 3.27Å; G346-Q349 PolarHBondContact O-N 3.43Å; G346-F350 WeakPolarHBondContact O-CB 3.21Å; G346-F350 PolarHBondContact O-N 2.83Å
347	R	97.6	Very high	96.7	Very high	49 Å²	49	43.8 Å²	43.8	19%	0.185	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-45.8	173.7	-75	-168.3	-64.1	-90.6	5	112.1	I340 L341 K342 D343 Q344 Q349 F350 L351	I340-R347 PolarHBondContact O-N 2.97Å; L341-R347 VanDerWaalsContact O-CD 3.25Å; L341-R347 WeakPolarHBondContact O-CD 3.42Å; L341-R347 WeakPolarHBondContact O-CG 3.47Å; L341-R347 PolarHBondContact O-NH1 3.38Å; K342-R347 PolarHBondContact O-NH1 3.05Å; D343-R347 WeakPolarHBondContact O-CG 3.29Å; D343-R347 PolarHBondContact O-N 2.9Å; Q344-R347 PolarHBondContact O-N 3.32Å; R347-Q349 PolarHBondContact O-N 2.93Å; R347-F350 PolarHBondContact O-N 3.11Å; R347-L351 VanDerWaalsContact O-CB 3.32Å; R347-L351 WeakPolarHBondContact O-CB 3.3Å; R347-L351 PolarHBondContact O-N 3.36Å
348	D	96.9	Very high	96.4	Very high	60 Å²	60	52.6 Å²	52.6	32%	0.321	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-42.3	-178.3	-63.5	-14.9	0	0	0	111.4	Q344 V345 G346 L351 R352	Q344-D348 PolarHBondContact NE2-OD1 3.44Å; Q344-D348 PolarHBondContact O-N 2.81Å; V345-D348 PolarHBondContact O-N 2.97Å; G346-D348 PolarHBondContact O-N 3.27Å; D348-L351 PolarHBondContact O-N 2.79Å; D348-R352 WeakPolarHBondContact O-CG 3.45Å; D348-R352 PolarHBondContact O-N 3.38Å
349	Q	96.7	Very high	96.3	Very high	42 Å²	42	50.6 Å²	50.6	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-68.2	-39.5	176.7	-64.2	-63	-3	0	0	112.1	W333 V345 G346 R347 R352 F353 F441 L450	W333-Q349 HydrophobicContact CH2-CG 4.36Å; W333-Q349 HydrophobicContact CZ3-CG 4.36Å; V345-Q349 HydrophobicContact CG1-CG 4.44Å; V345-Q349 WeakPolarHBondContact O-CG 3.39Å; V345-Q349 PolarHBondContact O-N 3.13Å; G346-Q349 PolarHBondContact O-N 3.43Å; R347-Q349 PolarHBondContact O-N 2.93Å; Q349-R352 VanDerWaalsContact NE2-NH1 3.1Å; Q349-F353 PolarHBondContact O-N 3.45Å; Q349-F353 VanDerWaalsContact O-N 3.11Å; Q349-F441 HydrophobicContact CB-CZ 4.38Å; Q349-L450 HydrophobicContact CB-CD1 4.33Å; Q349-L450 HydrophobicContact CG-CD1 3.83Å
350	F	97.8	Very high	96.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.6	-41.4	175.2	-173.2	-128.3	0	0	0	111.6	F337 I340 G346 R347 F353 L354 L363 M433 F441	F337-F350 HydrophobicContact CE2-CD1 4.19Å; F337-F350 AromaticContact CE2-CE1 3.52Å; F337-F350 HydrophobicContact CE2-CE1 3.52Å; F337-F350 AromaticContact CE2-CZ 3.87Å; F337-F350 HydrophobicContact CE2-CZ 3.87Å; F337-F350 AromaticContact CZ-CE1 3.92Å; F337-F350 HydrophobicContact CZ-CE1 3.92Å; F337-F350 HydrophobicContact CZ-CZ 4.38Å; I340-F350 HydrophobicContact CD1-CB 3.77Å; I340-F350 HydrophobicContact CD1-CD2 4.49Å; I340-F350 HydrophobicContact CD1-CG 4.21Å; I340-F350 HydrophobicContact CG1-CB 4.35Å; G346-F350 WeakPolarHBondContact O-CB 3.21Å; G346-F350 PolarHBondContact O-N 2.83Å; R347-F350 PolarHBondContact O-N 3.11Å; F350-F353 HydrophobicContact CD2-CD1 4.32Å; F350-F353 HydrophobicContact CE2-CD1 4.29Å; F350-F353 WeakPolarHBondContact O-CB 3.31Å; F350-F353 PolarHBondContact O-N 3.08Å; F350-L354 HydrophobicContact CD1-CD1 4.1Å; F350-L354 HydrophobicContact CE1-CD1 3.74Å; F350-L354 HydrophobicContact CE1-CG 4.35Å; F350-L354 HydrophobicContact CE2-CD1 4.49Å; F350-L354 HydrophobicContact CE2-CD2 4.13Å; F350-L354 HydrophobicContact CE2-CG 4.24Å; F350-L354 HydrophobicContact CZ-CD1 3.96Å; F350-L354 HydrophobicContact CZ-CD2 3.99Å; F350-L354 HydrophobicContact CZ-CG 4.15Å; F350-L354 WeakPolarHBondContact O-CG 3.36Å; F350-L354 PolarHBondContact O-N 3.48Å; F350-L363 HydrophobicContact CD1-CD1 4.34Å; F350-L363 HydrophobicContact CD1-CD2 3.69Å; F350-L363 HydrophobicContact CE1-CD1 4.47Å; F350-L363 HydrophobicContact CE1-CD2 4.28Å; F350-M433 HydrophobicContact CE1-SD 4.33Å; F350-F441 HydrophobicContact CD2-CB 3.75Å; F350-F441 HydrophobicContact CD2-CD1 4.12Å; F350-F441 AromaticContact CD2-CD2 3.93Å; F350-F441 HydrophobicContact CD2-CD2 3.93Å; F350-F441 AromaticContact CD2-CG 3.65Å; F350-F441 HydrophobicContact CD2-CG 3.65Å; F350-F441 HydrophobicContact CE2-CB 3.75Å; F350-F441 HydrophobicContact CE2-CG 4.18Å
351	L	97.8	Very high	96.3	Very high	38 Å²	38	52.9 Å²	52.9	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-48	176	-178.1	62.9	0	0	0	111.5	R347 D348 F353 L354 E355 L363 R364	R347-L351 VanDerWaalsContact O-CB 3.32Å; R347-L351 WeakPolarHBondContact O-CB 3.3Å; R347-L351 PolarHBondContact O-N 3.36Å; D348-L351 PolarHBondContact O-N 2.79Å; L351-F353 VanDerWaalsContact C-N 3.27Å; L351-F353 PolarHBondContact O-N 2.66Å; L351-L354 PolarHBondContact O-N 3.39Å; L351-L354 VanDerWaalsContact O-N 3.09Å; L351-E355 WeakPolarHBondContact O-CG 3.43Å; L351-E355 PolarHBondContact O-N 3.35Å; L351-L363 HydrophobicContact CB-CD2 3.82Å; L351-L363 HydrophobicContact CD1-CB 4.5Å; L351-L363 HydrophobicContact CD1-CD2 4.02Å; L351-R364 HydrophobicContact CD1-CG 4.15Å
352	R	96.9	Very high	96.3	Very high	136 Å²	136	53 Å²	53	51%	0.513	25%	0.253	S	S	.	.	H	α-helix	trans	-58.1	-40.2	176.3	-73.2	176	-169.8	143.4	3.7	112.4	D348 Q349 E355 S356	D348-R352 WeakPolarHBondContact O-CG 3.45Å; D348-R352 PolarHBondContact O-N 3.38Å; Q349-R352 VanDerWaalsContact NE2-NH1 3.1Å; R352-E355 PolarHBondContact O-N 3.18Å; R352-S356 PolarHBondContact O-N 3.42Å
353	F	97.4	Very high	96.3	Very high	18 Å²	18	46.8 Å²	46.8	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-46.9	174.4	169.4	-99.5	0	0	0	111.3	Q349 F350 L351 E355 S356 E357 R440 F441	Q349-F353 PolarHBondContact O-N 3.45Å; Q349-F353 VanDerWaalsContact O-N 3.11Å; F350-F353 HydrophobicContact CD2-CD1 4.32Å; F350-F353 HydrophobicContact CE2-CD1 4.29Å; F350-F353 WeakPolarHBondContact O-CB 3.31Å; F350-F353 PolarHBondContact O-N 3.08Å; L351-F353 VanDerWaalsContact C-N 3.27Å; L351-F353 PolarHBondContact O-N 2.66Å; F353-E355 VanDerWaalsContact C-N 3.32Å; F353-E355 PolarHBondContact O-N 2.85Å; F353-S356 PolarHBondContact O-N 3.07Å; F353-S356 PolarHBondContact O-OG 3.33Å; F353-E357 HydrophobicContact CE2-CG 4.37Å; F353-E357 HydrophobicContact CZ-CG 4.24Å; F353-E357 VanDerWaalsContact CZ-OE1 3.26Å; F353-E357 WeakPolarHBondContact CZ-OE1 3.41Å; F353-E357 WeakPolarHBondContact CZ-OE2 3.06Å; F353-E357 PolarHBondContact O-N 3.2Å; F353-R440 HydrophobicContact CE1-CB 4.41Å; F353-R440 HydrophobicContact CZ-CB 4.01Å; F353-F441 HydrophobicContact CB-CD2 3.67Å; F353-F441 HydrophobicContact CB-CE2 4.14Å; F353-F441 HydrophobicContact CD1-CB 3.76Å; F353-F441 AromaticContact CD1-CD2 3.89Å; F353-F441 HydrophobicContact CD1-CD2 3.89Å; F353-F441 HydrophobicContact CD1-CG 4.31Å; F353-F441 HydrophobicContact CD2-CD2 4.27Å; F353-F441 HydrophobicContact CE1-CB 3.82Å; F353-F441 HydrophobicContact CG-CB 4.31Å; F353-F441 AromaticContact CG-CD2 3.67Å; F353-F441 HydrophobicContact CG-CD2 3.67Å; F353-F441 HydrophobicContact CG-CG 4.48Å; F353-F441 HydrophobicContact CZ-CB 4.41Å
354	L	96.8	Very high	96.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-35.8	177.5	-64.5	175.2	0	0	0	112.8	F350 L351 S356 E357 F358 S359 L363	F350-L354 HydrophobicContact CD1-CD1 4.1Å; F350-L354 HydrophobicContact CE1-CD1 3.74Å; F350-L354 HydrophobicContact CE1-CG 4.35Å; F350-L354 HydrophobicContact CE2-CD1 4.49Å; F350-L354 HydrophobicContact CE2-CD2 4.13Å; F350-L354 HydrophobicContact CE2-CG 4.24Å; F350-L354 HydrophobicContact CZ-CD1 3.96Å; F350-L354 HydrophobicContact CZ-CD2 3.99Å; F350-L354 HydrophobicContact CZ-CG 4.15Å; F350-L354 WeakPolarHBondContact O-CG 3.36Å; F350-L354 PolarHBondContact O-N 3.48Å; L351-L354 PolarHBondContact O-N 3.39Å; L351-L354 VanDerWaalsContact O-N 3.09Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-E357 CarbonylContact O-C 3.27Å; L354-E357 PolarHBondContact O-N 3.49Å; L354-F358 PolarHBondContact O-N 3.04Å; L354-S359 PolarHBondContact O-N 2.86Å; L354-S359 PolarHBondContact O-OG 2.91Å; L354-L363 HydrophobicContact CD1-CB 3.53Å; L354-L363 HydrophobicContact CD1-CD2 3.92Å; L354-L363 HydrophobicContact CD1-CG 4.36Å
355	E	96.6	Very high	96.5	Very high	76 Å²	76	45.3 Å²	45.3	36%	0.355	21%	0.214	S	C	.	.	H	α-helix	trans	-62.8	-40	174.2	-73.4	173.8	165.8	0	0	111.3	L351 R352 F353 E357 F358 R364	L351-E355 WeakPolarHBondContact O-CG 3.43Å; L351-E355 PolarHBondContact O-N 3.35Å; R352-E355 PolarHBondContact O-N 3.18Å; F353-E355 VanDerWaalsContact C-N 3.32Å; F353-E355 PolarHBondContact O-N 2.85Å; E355-E357 PolarHBondContact O-N 2.82Å; E355-F358 PolarHBondContact O-N 3.3Å; E355-F358 VanDerWaalsContact O-N 3.12Å; E355-R364 IonicContact OE1-CZ 3.94Å; E355-R364 IonicContact OE1-NH2 2.99Å; E355-R364 PolarHBondContact OE1-NH2 3.35Å
356	S	94.9	Very high	96.6	Very high	84 Å²	84	46 Å²	46	59%	0.587	22%	0.215	S	C	*	.	H	α-helix	trans	-65.3	-22.2	175.3	77.9	0	0	0	0	113.7	R352 F353 L354	R352-S356 PolarHBondContact O-N 3.42Å; F353-S356 PolarHBondContact O-N 3.07Å; F353-S356 PolarHBondContact O-OG 3.33Å; L354-S356 VanDerWaalsContact C-N 3.33Å
357	E	94.3	Very high	96.6	Very high	69 Å²	69	48.7 Å²	48.7	32%	0.322	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	10.8	176.1	-63.2	-169.1	148	0	0	113	F353 L354 E355 S359 R440	F353-E357 HydrophobicContact CE2-CG 4.37Å; F353-E357 HydrophobicContact CZ-CG 4.24Å; F353-E357 VanDerWaalsContact CZ-OE1 3.26Å; F353-E357 WeakPolarHBondContact CZ-OE1 3.41Å; F353-E357 WeakPolarHBondContact CZ-OE2 3.06Å; F353-E357 PolarHBondContact O-N 3.2Å; L354-E357 CarbonylContact O-C 3.27Å; L354-E357 PolarHBondContact O-N 3.49Å; E355-E357 PolarHBondContact O-N 2.82Å; E357-S359 VanDerWaalsContact C-N 3.27Å; E357-S359 PolarHBondContact O-N 3.3Å; E357-R440 IonicContact OE1-NH1 2.63Å; E357-R440 PolarHBondContact OE1-NH1 3.39Å; E357-R440 IonicContact OE2-CZ 3.87Å; E357-R440 IonicContact OE2-NH1 2.63Å; E357-R440 PolarHBondContact OE2-NH1 3.46Å; E357-R440 IonicContact OE2-NH2 2.96Å
358	F	91.5	Very high	96.7	Very high	186 Å²	186	47.1 Å²	47.1	82%	0.816	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	41.5	-178.6	-54.8	-86.6	0	0	0	113.9	L354 E355	L354-F358 PolarHBondContact O-N 3.04Å; E355-F358 PolarHBondContact O-N 3.3Å; E355-F358 VanDerWaalsContact O-N 3.12Å
359	S	94.9	Very high	96.7	Very high	16 Å²	16	44.2 Å²	44.2	11%	0.112	21%	0.21	C	C	.	.			trans	-132.9	20.2	-178.2	60.6	0	0	0	0	114.1	L354 E357 E361 N362	L354-S359 PolarHBondContact O-N 2.86Å; L354-S359 PolarHBondContact O-OG 2.91Å; E357-S359 VanDerWaalsContact C-N 3.27Å; E357-S359 PolarHBondContact O-N 3.3Å; S359-E361 VanDerWaalsContact C-N 3.31Å; S359-E361 WeakPolarHBondContact CA-OE1 3.47Å; S359-E361 WeakPolarHBondContact CA-OE2 3.48Å; S359-E361 PolarHBondContact O-N 3.31Å; S359-N362 PolarHBondContact O-ND2 3.02Å; S359-N362 VanDerWaalsContact O-ND2 3.16Å
360	S	96.4	Very high	96.7	Very high	14 Å²	14	44.8 Å²	44.8	10%	0.098	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-22.2	-175.2	69.7	0	0	0	0	114.7	N362 L363 R364	S360-N362 PolarHBondContact O-N 3.29Å; S360-L363 PolarHBondContact O-N 3.23Å; S360-L363 VanDerWaalsContact O-N 3.17Å; S360-R364 WeakPolarHBondContact O-CG 3.3Å; S360-R364 PolarHBondContact O-N 3.5Å
361	E	97.1	Very high	96.7	Very high	43 Å²	43	47.7 Å²	47.7	20%	0.201	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-35.2	179.3	67.3	-68.4	158.4	0	0	112.1	S359 L363 R364 F365 I400	S359-E361 VanDerWaalsContact C-N 3.31Å; S359-E361 WeakPolarHBondContact CA-OE1 3.47Å; S359-E361 WeakPolarHBondContact CA-OE2 3.48Å; S359-E361 PolarHBondContact O-N 3.31Å; E361-L363 PolarHBondContact O-N 3.17Å; E361-R364 PolarHBondContact O-N 3.46Å; E361-F365 VanDerWaalsContact O-CB 3.31Å; E361-F365 WeakPolarHBondContact O-CB 3.42Å; E361-F365 PolarHBondContact O-N 2.86Å; E361-I400 HydrophobicContact CB-CG2 4.09Å; E361-I400 HydrophobicContact CG-CG2 3.82Å
362	N	96.7	Very high	96.7	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.064	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-44.9	178.8	-62.3	-58.8	0	0	0	112.4	S359 S360 W366 I429 M433	S359-N362 PolarHBondContact O-ND2 3.02Å; S359-N362 VanDerWaalsContact O-ND2 3.16Å; S360-N362 PolarHBondContact O-N 3.29Å; N362-W366 WeakPolarHBondContact O-CB 3.28Å; N362-W366 PolarHBondContact O-N 3.45Å; N362-W366 VanDerWaalsContact O-N 3.07Å; N362-I429 HydrophobicContact CB-CG2 3.87Å; N362-I429 VanDerWaalsContact O-CG2 3.28Å; N362-I429 WeakPolarHBondContact O-CG2 3.28Å; N362-M433 HydrophobicContact CB-CG 3.95Å; N362-M433 HydrophobicContact CB-SD 3.76Å
363	L	97.6	Very high	96.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-73.3	-39.6	178.9	-178.9	61.3	0	0	0	111.1	L341 F350 L351 L354 S360 E361 W366 L367 M433	L341-L363 HydrophobicContact CD2-CD1 3.59Å; F350-L363 HydrophobicContact CD1-CD1 4.34Å; F350-L363 HydrophobicContact CD1-CD2 3.69Å; F350-L363 HydrophobicContact CE1-CD1 4.47Å; F350-L363 HydrophobicContact CE1-CD2 4.28Å; L351-L363 HydrophobicContact CB-CD2 3.82Å; L351-L363 HydrophobicContact CD1-CB 4.5Å; L351-L363 HydrophobicContact CD1-CD2 4.02Å; L354-L363 HydrophobicContact CD1-CB 3.53Å; L354-L363 HydrophobicContact CD1-CD2 3.92Å; L354-L363 HydrophobicContact CD1-CG 4.36Å; S360-L363 PolarHBondContact O-N 3.23Å; S360-L363 VanDerWaalsContact O-N 3.17Å; E361-L363 PolarHBondContact O-N 3.17Å; L363-W366 PolarHBondContact O-N 3.25Å; L363-L367 HydrophobicContact CD1-CD1 4.21Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.95Å; L363-L367 HydrophobicContact CG-CG 4.34Å; L363-L367 WeakPolarHBondContact O-CB 3.38Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.32Å; L363-L367 PolarHBondContact O-N 3.29Å; L363-M433 HydrophobicContact CB-SD 3.95Å; L363-M433 HydrophobicContact CD1-CE 4.44Å; L363-M433 HydrophobicContact CD1-SD 4.43Å
364	R	98	Very high	96.6	Very high	94 Å²	94	48.4 Å²	48.4	36%	0.355	23%	0.233	S	C	.	.	H	α-helix	trans	-62.2	-42.8	176.8	-69.1	179.2	-174.5	177.3	3.4	111.9	L351 E355 S360 E361 S368 F391	L351-R364 HydrophobicContact CD1-CG 4.15Å; E355-R364 IonicContact OE1-CZ 3.94Å; E355-R364 IonicContact OE1-NH2 2.99Å; E355-R364 PolarHBondContact OE1-NH2 3.35Å; S360-R364 WeakPolarHBondContact O-CG 3.3Å; S360-R364 PolarHBondContact O-N 3.5Å; E361-R364 PolarHBondContact O-N 3.46Å; R364-S368 WeakPolarHBondContact O-CB 3.24Å; R364-S368 PolarHBondContact O-N 3.02Å; R364-S368 PolarHBondContact O-OG 3.5Å; R364-F391 HydrophobicContact CB-CE1 3.93Å; R364-F391 HydrophobicContact CB-CZ 3.92Å
365	F	98.3	Very high	96.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-52	171.9	171.6	-104.4	0	0	0	110.9	E361 L367 S368 V369 I387 F391 L392 I400 F422 A425 I429	E361-F365 VanDerWaalsContact O-CB 3.31Å; E361-F365 WeakPolarHBondContact O-CB 3.42Å; E361-F365 PolarHBondContact O-N 2.86Å; F365-L367 VanDerWaalsContact C-N 3.3Å; F365-L367 PolarHBondContact O-N 3.37Å; F365-S368 PolarHBondContact O-N 3.24Å; F365-S368 VanDerWaalsContact O-N 3.12Å; F365-V369 HydrophobicContact CD2-CG2 4.22Å; F365-V369 HydrophobicContact CE1-CG2 4.13Å; F365-V369 HydrophobicContact CE2-CG2 3.76Å; F365-V369 HydrophobicContact CZ-CG2 3.71Å; F365-V369 WeakPolarHBondContact O-CG2 3.37Å; F365-V369 PolarHBondContact O-N 3.21Å; F365-I387 HydrophobicContact CD2-CG2 4.07Å; F365-I387 HydrophobicContact CE2-CG2 3.88Å; F365-F391 HydrophobicContact CB-CB 4.49Å; F365-F391 HydrophobicContact CB-CD1 3.72Å; F365-F391 HydrophobicContact CB-CD2 4.29Å; F365-F391 HydrophobicContact CB-CE1 3.97Å; F365-F391 HydrophobicContact CB-CG 3.91Å; F365-F391 HydrophobicContact CB-CZ 4.37Å; F365-F391 HydrophobicContact CD2-CB 3.69Å; F365-F391 HydrophobicContact CD2-CD1 4.4Å; F365-F391 AromaticContact CD2-CD2 3.85Å; F365-F391 HydrophobicContact CD2-CD2 3.85Å; F365-F391 AromaticContact CD2-CG 3.72Å; F365-F391 HydrophobicContact CD2-CG 3.72Å; F365-F391 HydrophobicContact CE2-CB 4.41Å; F365-F391 HydrophobicContact CG-CB 4.45Å; F365-F391 HydrophobicContact CG-CG 4.28Å; F365-L392 HydrophobicContact CE2-CD1 4.12Å; F365-L392 HydrophobicContact CZ-CD1 4.44Å; F365-I400 HydrophobicContact CB-CD1 4.31Å; F365-I400 HydrophobicContact CB-CG2 4Å; F365-I400 HydrophobicContact CD1-CD1 3.55Å; F365-I400 HydrophobicContact CD2-CD1 3.85Å; F365-I400 HydrophobicContact CE1-CD1 3.7Å; F365-I400 HydrophobicContact CE2-CD1 4Å; F365-I400 HydrophobicContact CG-CD1 3.62Å; F365-I400 HydrophobicContact CG-CG2 4.47Å; F365-I400 HydrophobicContact CZ-CD1 3.92Å; F365-F422 HydrophobicContact CE2-CD1 4.16Å; F365-F422 HydrophobicContact CZ-CB 4.21Å; F365-F422 HydrophobicContact CZ-CD1 4.25Å; F365-F422 HydrophobicContact CZ-CG 4.48Å; F365-A425 HydrophobicContact CE1-CB 4.07Å; F365-A425 HydrophobicContact CZ-CB 3.73Å; F365-I429 HydrophobicContact CD1-CB 4.22Å; F365-I429 HydrophobicContact CD1-CG1 3.9Å; F365-I429 HydrophobicContact CD1-CG2 4.24Å; F365-I429 HydrophobicContact CE1-CB 4.44Å; F365-I429 HydrophobicContact CE1-CG1 4.01Å
366	W	97.8	Very high	96.6	Very high	30 Å²	30	50.1 Å²	50.1	11%	0.114	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-42.6	-177.9	-174.4	91.2	0	0	0	112.3	L341 N362 L363 V369 Q370 Q426 Y430 M433	L341-W366 HydrophobicContact CB-CH2 4.24Å; L341-W366 HydrophobicContact CB-CZ3 4.36Å; L341-W366 HydrophobicContact CD1-CE3 4.4Å; L341-W366 HydrophobicContact CD1-CH2 3.8Å; L341-W366 HydrophobicContact CD1-CZ2 3.92Å; L341-W366 HydrophobicContact CD1-CZ3 4.05Å; L341-W366 HydrophobicContact CD2-CE3 4.38Å; L341-W366 HydrophobicContact CD2-CZ3 4.18Å; L341-W366 HydrophobicContact CG-CH2 4.49Å; L341-W366 HydrophobicContact CG-CZ3 4.44Å; N362-W366 WeakPolarHBondContact O-CB 3.28Å; N362-W366 PolarHBondContact O-N 3.45Å; N362-W366 VanDerWaalsContact O-N 3.07Å; L363-W366 PolarHBondContact O-N 3.25Å; W366-V369 PolarHBondContact O-N 3.31Å; W366-Q370 HydrophobicContact CD2-CG 4.06Å; W366-Q370 HydrophobicContact CE3-CG 3.82Å; W366-Q370 HydrophobicContact CH2-CG 3.55Å; W366-Q370 HydrophobicContact CZ2-CG 3.79Å; W366-Q370 VanDerWaalsContact CZ2-NE2 3.33Å; W366-Q370 HydrophobicContact CZ3-CG 3.57Å; W366-Q370 WeakPolarHBondContact O-CG 3.48Å; W366-Q370 PolarHBondContact O-N 3Å; W366-Q426 VanDerWaalsContact CD1-CG 3.41Å; W366-Q426 HydrophobicContact CG-CG 4.28Å; W366-Q426 PolarHBondContact O-NE2 3Å; W366-Y430 HydrophobicContact CZ2-CD2 4.26Å; W366-Y430 AromaticContact NE1-CD2 3.63Å; W366-M433 HydrophobicContact CB-CE 3.87Å; W366-M433 HydrophobicContact CG-CE 4.11Å
367	L	97.6	Very high	96.7	Very high	55 Å²	55	52.6 Å²	52.6	29%	0.288	25%	0.253	S	S	.	.	H	α-helix	trans	-66.8	-40.4	176.4	-69.4	172.1	0	0	0	112.2	L363 F365 V369 Q370 D371	L363-L367 HydrophobicContact CD1-CD1 4.21Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.95Å; L363-L367 HydrophobicContact CG-CG 4.34Å; L363-L367 WeakPolarHBondContact O-CB 3.38Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.32Å; L363-L367 PolarHBondContact O-N 3.29Å; F365-L367 VanDerWaalsContact C-N 3.3Å; F365-L367 PolarHBondContact O-N 3.37Å; L367-V369 VanDerWaalsContact C-N 3.31Å; L367-V369 PolarHBondContact O-N 2.92Å; L367-Q370 WeakPolarHBondContact O-CB 3.36Å; L367-Q370 PolarHBondContact O-N 2.98Å; L367-D371 WeakPolarHBondContact O-CB 3.5Å; L367-D371 PolarHBondContact O-N 3.11Å
368	S	97.8	Very high	96.7	Very high	16 Å²	16	57.1 Å²	57.1	11%	0.112	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-38.7	175.8	-65.2	0	0	0	0	112.1	R364 F365 D371 L372 I387	R364-S368 WeakPolarHBondContact O-CB 3.24Å; R364-S368 PolarHBondContact O-N 3.02Å; R364-S368 PolarHBondContact O-OG 3.5Å; F365-S368 PolarHBondContact O-N 3.24Å; F365-S368 VanDerWaalsContact O-N 3.12Å; S368-D371 PolarHBondContact O-N 2.86Å; S368-L372 PolarHBondContact O-N 3.26Å; S368-I387 WeakPolarHBondContact O-CD1 3.42Å
369	V	97.8	Very high	97	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-70.4	-35.6	174.2	180	0	0	0	0	112	F365 W366 L367 D371 L372 K373 I387 F422 Q426	F365-V369 HydrophobicContact CD2-CG2 4.22Å; F365-V369 HydrophobicContact CE1-CG2 4.13Å; F365-V369 HydrophobicContact CE2-CG2 3.76Å; F365-V369 HydrophobicContact CZ-CG2 3.71Å; F365-V369 WeakPolarHBondContact O-CG2 3.37Å; F365-V369 PolarHBondContact O-N 3.21Å; W366-V369 PolarHBondContact O-N 3.31Å; L367-V369 VanDerWaalsContact C-N 3.31Å; L367-V369 PolarHBondContact O-N 2.92Å; V369-D371 VanDerWaalsContact C-N 3.31Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 3.11Å; V369-K373 PolarHBondContact O-N 3.29Å; V369-I387 HydrophobicContact CG2-CG2 4.33Å; V369-F422 HydrophobicContact CB-CB 4.42Å; V369-F422 HydrophobicContact CG1-CB 3.81Å; V369-F422 HydrophobicContact CG2-CB 3.63Å; V369-F422 HydrophobicContact CG2-CD2 4.12Å; V369-F422 HydrophobicContact CG2-CG 3.97Å; V369-Q426 HydrophobicContact CB-CB 4.47Å; V369-Q426 HydrophobicContact CB-CG 4.33Å; V369-Q426 HydrophobicContact CG1-CB 4.03Å; V369-Q426 VanDerWaalsContact CG1-CD 3.43Å; V369-Q426 HydrophobicContact CG1-CG 4.11Å
370	Q	96.8	Very high	97.1	Very high	53 Å²	53	50.5 Å²	50.5	25%	0.248	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-37.9	172.2	-73.7	-61.8	-31.2	0	0	112.3	W366 L367	W366-Q370 HydrophobicContact CD2-CG 4.06Å; W366-Q370 HydrophobicContact CE3-CG 3.82Å; W366-Q370 HydrophobicContact CH2-CG 3.55Å; W366-Q370 HydrophobicContact CZ2-CG 3.79Å; W366-Q370 VanDerWaalsContact CZ2-NE2 3.33Å; W366-Q370 HydrophobicContact CZ3-CG 3.57Å; W366-Q370 WeakPolarHBondContact O-CG 3.48Å; W366-Q370 PolarHBondContact O-N 3Å; L367-Q370 WeakPolarHBondContact O-CB 3.36Å; L367-Q370 PolarHBondContact O-N 2.98Å
371	D	96.9	Very high	97	Very high	61 Å²	61	53 Å²	53	33%	0.326	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-46.3	174.9	178.2	70.3	0	0	0	111.3	L367 S368 V369 K373 K374 Q375 R383	L367-D371 WeakPolarHBondContact O-CB 3.5Å; L367-D371 PolarHBondContact O-N 3.11Å; S368-D371 PolarHBondContact O-N 2.86Å; V369-D371 VanDerWaalsContact C-N 3.31Å; D371-K373 PolarHBondContact O-N 2.91Å; D371-K374 WeakPolarHBondContact O-CA 3.28Å; D371-K374 WeakPolarHBondContact O-CB 3.28Å; D371-K374 PolarHBondContact O-N 2.98Å; D371-Q375 VanDerWaalsContact CG-NE2 3.34Å; D371-Q375 PolarHBondContact O-N 2.9Å; D371-Q375 PolarHBondContact OD1-NE2 2.91Å; D371-Q375 PolarHBondContact OD2-NE2 3.25Å; D371-R383 IonicContact OD2-NE 2.72Å; D371-R383 PolarHBondContact OD2-NE 3.17Å; D371-R383 IonicContact OD2-NH2 3.81Å
372	L	97.8	Very high	97	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-50	-44.3	175	174.1	67.6	0	0	0	112.5	S368 V369 K374 Q375 V380 R383 V384 I387 F422	S368-L372 PolarHBondContact O-N 3.26Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 3.11Å; L372-K374 PolarHBondContact O-N 3.23Å; L372-K374 VanDerWaalsContact O-N 3.15Å; L372-Q375 PolarHBondContact O-N 2.91Å; L372-V380 HydrophobicContact CD1-CB 4.49Å; L372-V380 HydrophobicContact CD1-CG1 4.11Å; L372-R383 HydrophobicContact CB-CG 4.24Å; L372-R383 HydrophobicContact CD1-CB 3.67Å; L372-R383 HydrophobicContact CD1-CG 3.68Å; L372-V384 HydrophobicContact CD1-CG2 3.91Å; L372-V384 HydrophobicContact CD2-CG2 3.82Å; L372-I387 HydrophobicContact CB-CD1 3.89Å; L372-I387 HydrophobicContact CD2-CD1 4.23Å; L372-F422 HydrophobicContact CD2-CD2 3.6Å; L372-F422 HydrophobicContact CD2-CE2 3.82Å
373	K	96.9	Very high	97	Very high	48 Å²	48	59.3 Å²	59.3	21%	0.209	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.7	179.8	-74	174.6	172.9	-175.7	0	113.1	V369 D371 R419 E423	V369-K373 PolarHBondContact O-N 3.29Å; D371-K373 PolarHBondContact O-N 2.91Å; K373-R419 VanDerWaalsContact CG-O 3.31Å; K373-R419 WeakPolarHBondContact CG-O 3.48Å; K373-R419 PolarHBondContact O-NH1 2.8Å; K373-E423 WeakPolarHBondContact CE-OE1 3.41Å; K373-E423 IonicContact NZ-OE1 3.43Å; K373-E423 PolarHBondContact NZ-OE1 3.01Å
374	K	96.4	Very high	97	Very high	160 Å²	160	59.4 Å²	59.4	70%	0.696	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-11.7	-178.9	-60.6	173.6	-171.9	175.1	0	113.5	D371 L372	D371-K374 WeakPolarHBondContact O-CA 3.28Å; D371-K374 WeakPolarHBondContact O-CB 3.28Å; D371-K374 PolarHBondContact O-N 2.98Å; L372-K374 PolarHBondContact O-N 3.23Å; L372-K374 VanDerWaalsContact O-N 3.15Å
375	Q	96.7	Very high	96.9	Very high	47 Å²	47	59.2 Å²	59.2	22%	0.22	30%	0.296	C	S	.	.	S	Bend	trans	-62.5	150.9	-179.1	-69.4	-59.7	-29.4	0	0	112.5	D371 L372 V380 R383 R419	D371-Q375 VanDerWaalsContact CG-NE2 3.34Å; D371-Q375 PolarHBondContact O-N 2.9Å; D371-Q375 PolarHBondContact OD1-NE2 2.91Å; D371-Q375 PolarHBondContact OD2-NE2 3.25Å; L372-Q375 PolarHBondContact O-N 2.91Å; Q375-V380 HydrophobicContact CB-CG2 4.35Å; Q375-R383 HydrophobicContact CG-CG 4.27Å; Q375-R419 PolarHBondContact O-NH1 3.49Å; Q375-R419 PolarHBondContact O-NH2 3.16Å
376	P	96.7	Very high	96.9	Very high	65 Å²	65	62.7 Å²	62.7	42%	0.422	31%	0.313	S	S	.	.			trans	-57.5	146.5	165.9	-21.8	34.3	0	0	0	110.9	Q378 D379 V380	P376-Q378 HydrophobicContact CB-CG 4.2Å; P376-Q378 PolarHBondContact O-N 3.29Å; P376-Q378 VanDerWaalsContact O-N 3.12Å; P376-D379 PolarHBondContact O-N 3.11Å; P376-V380 PolarHBondContact O-N 3.47Å
377	L	95.9	Very high	96.9	Very high	135 Å²	135	61.3 Å²	61.3	71%	0.707	31%	0.307	S	S	*	.	H	α-helix	trans	-57.4	-34.3	-173.1	-173.7	64.1	0	0	0	113.2	D379 V380	L377-D379 VanDerWaalsContact C-N 3.26Å; L377-D379 PolarHBondContact O-N 2.73Å; L377-V380 PolarHBondContact O-N 2.91Å
378	Q	95.9	Very high	96.8	Very high	164 Å²	164	60.1 Å²	60.1	77%	0.766	30%	0.299	S	S	*	.	H	α-helix	trans	-63.2	-28.2	178.3	69.1	-172.4	22.4	0	0	113.7	P376	P376-Q378 HydrophobicContact CB-CG 4.2Å; P376-Q378 PolarHBondContact O-N 3.29Å; P376-Q378 VanDerWaalsContact O-N 3.12Å
379	D	96.3	Very high	96.8	Very high	59 Å²	59	63.9 Å²	63.9	32%	0.316	32%	0.315	S	S	.	.	H	α-helix	trans	-95.8	-12.6	-175.2	-59.9	-50.3	0	0	0	112.2	P376 L377 A381 K382 R383	P376-D379 PolarHBondContact O-N 3.11Å; L377-D379 VanDerWaalsContact C-N 3.26Å; L377-D379 PolarHBondContact O-N 2.73Å; D379-A381 PolarHBondContact O-N 2.84Å; D379-K382 PolarHBondContact O-N 2.75Å; D379-R383 WeakPolarHBondContact O-CB 3.13Å; D379-R383 PolarHBondContact O-N 3.04Å
380	V	96.9	Very high	96.8	Very high	4 Å²	4	67 Å²	67	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-57.4	-49.2	-176.4	169	0	0	0	0	111.5	L372 Q375 P376 L377 K382 R383 V384 R419	L372-V380 HydrophobicContact CD1-CB 4.49Å; L372-V380 HydrophobicContact CD1-CG1 4.11Å; Q375-V380 HydrophobicContact CB-CG2 4.35Å; P376-V380 PolarHBondContact O-N 3.47Å; L377-V380 PolarHBondContact O-N 2.91Å; V380-K382 VanDerWaalsContact C-N 3.34Å; V380-K382 PolarHBondContact O-N 2.76Å; V380-R383 PolarHBondContact O-N 2.85Å; V380-V384 HydrophobicContact CG1-CG2 4.31Å; V380-V384 VanDerWaalsContact O-CG2 3.32Å; V380-V384 WeakPolarHBondContact O-CG2 3.29Å; V380-V384 PolarHBondContact O-N 3.01Å; V380-R419 HydrophobicContact CG1-CG 4.36Å; V380-R419 HydrophobicContact CG2-CG 3.92Å
381	A	95.4	Very high	96.9	Very high	67 Å²	67	64.5 Å²	64.5	55%	0.554	32%	0.318	S	S	*	.	H	α-helix	trans	-61	-44	-177.2	0	0	0	0	0	111.9	D379 V384 E385	D379-A381 PolarHBondContact O-N 2.84Å; A381-V384 PolarHBondContact O-N 3.47Å; A381-E385 PolarHBondContact O-N 2.84Å
382	K	96	Very high	96.8	Very high	139 Å²	139	62 Å²	62	60%	0.604	31%	0.305	S	S	*	.	H	α-helix	trans	-63	-45.7	175.9	-174.9	-173.2	176.7	-159.9	0	111.2	D379 V380 V384 E385 E386	D379-K382 PolarHBondContact O-N 2.75Å; V380-K382 VanDerWaalsContact C-N 3.34Å; V380-K382 PolarHBondContact O-N 2.76Å; K382-V384 VanDerWaalsContact C-N 3.31Å; K382-V384 PolarHBondContact O-N 2.95Å; K382-E385 PolarHBondContact O-N 3.4Å; K382-E386 WeakPolarHBondContact CE-OE1 3.35Å; K382-E386 IonicContact NZ-OE1 3.69Å; K382-E386 WeakPolarHBondContact O-CG 3.49Å; K382-E386 PolarHBondContact O-N 3.27Å
383	R	97.6	Very high	96.7	Very high	48 Å²	48	62.5 Å²	62.5	18%	0.181	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-34	-179.1	-171.7	63.8	176.5	142.9	9.2	112.4	D371 L372 Q375 D379 V380 E386 I387	D371-R383 IonicContact OD2-NE 2.72Å; D371-R383 PolarHBondContact OD2-NE 3.17Å; D371-R383 IonicContact OD2-NH2 3.81Å; L372-R383 HydrophobicContact CB-CG 4.24Å; L372-R383 HydrophobicContact CD1-CB 3.67Å; L372-R383 HydrophobicContact CD1-CG 3.68Å; Q375-R383 HydrophobicContact CG-CG 4.27Å; D379-R383 WeakPolarHBondContact O-CB 3.13Å; D379-R383 PolarHBondContact O-N 3.04Å; V380-R383 PolarHBondContact O-N 2.85Å; R383-E386 WeakPolarHBondContact CD-OE2 3.43Å; R383-E386 IonicContact CZ-OE2 2.78Å; R383-E386 IonicContact NH1-OE2 3.37Å; R383-E386 PolarHBondContact NH1-OE2 3.11Å; R383-E386 PolarHBondContact O-N 3.46Å; R383-I387 HydrophobicContact CG-CD1 4.06Å; R383-I387 VanDerWaalsContact O-CG1 3.26Å; R383-I387 WeakPolarHBondContact O-CG1 3.35Å; R383-I387 PolarHBondContact O-N 3.33Å; R383-I387 VanDerWaalsContact O-N 3.08Å
384	V	97.7	Very high	96.5	Very high	3 Å²	3	66 Å²	66	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-47.9	172.7	167.2	0	0	0	0	110.7	L372 V380 A381 K382 I387 W388 V414 T421 F422	L372-V384 HydrophobicContact CD1-CG2 3.91Å; L372-V384 HydrophobicContact CD2-CG2 3.82Å; V380-V384 HydrophobicContact CG1-CG2 4.31Å; V380-V384 VanDerWaalsContact O-CG2 3.32Å; V380-V384 WeakPolarHBondContact O-CG2 3.29Å; V380-V384 PolarHBondContact O-N 3.01Å; A381-V384 PolarHBondContact O-N 3.47Å; K382-V384 VanDerWaalsContact C-N 3.31Å; K382-V384 PolarHBondContact O-N 2.95Å; V384-I387 PolarHBondContact O-N 3.49Å; V384-W388 WeakPolarHBondContact O-CB 3.46Å; V384-W388 PolarHBondContact O-N 3.33Å; V384-V414 HydrophobicContact CG1-CB 4.47Å; V384-V414 HydrophobicContact CG1-CG1 4.15Å; V384-V414 HydrophobicContact CG1-CG2 4.13Å; V384-T421 HydrophobicContact CG1-CG2 3.98Å; V384-F422 HydrophobicContact CB-CE2 4.24Å; V384-F422 HydrophobicContact CG1-CE2 4Å; V384-F422 HydrophobicContact CG1-CZ 3.99Å; V384-F422 HydrophobicContact CG2-CE2 4.13Å; V384-F422 WeakPolarHBondContact O-CZ 3.29Å
385	E	96.3	Very high	96.2	Very high	89 Å²	89	62.3 Å²	62.3	42%	0.416	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-44.7	179.1	-172.1	59.3	-146.3	0	0	111.7	A381 K382 I387 W388 Q389	A381-E385 PolarHBondContact O-N 2.84Å; K382-E385 PolarHBondContact O-N 3.4Å; E385-I387 PolarHBondContact O-N 3.19Å; E385-W388 PolarHBondContact O-N 2.87Å; E385-Q389 HydrophobicContact CG-CG 4.41Å; E385-Q389 VanDerWaalsContact O-CG 3.31Å; E385-Q389 WeakPolarHBondContact O-CG 3.47Å; E385-Q389 PolarHBondContact O-N 3.29Å; E385-Q389 WeakPolarHBondContact OE1-CG 2.96Å; E385-Q389 PolarHBondContact OE1-NE2 3.22Å
386	E	97.3	Very high	96.2	Very high	74 Å²	74	60.7 Å²	60.7	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-56.8	-47.5	176.7	-70.8	172.1	-178.1	0	0	112.2	K382 R383 W388 Q389 E390	K382-E386 WeakPolarHBondContact CE-OE1 3.35Å; K382-E386 IonicContact NZ-OE1 3.69Å; K382-E386 WeakPolarHBondContact O-CG 3.49Å; K382-E386 PolarHBondContact O-N 3.27Å; R383-E386 WeakPolarHBondContact CD-OE2 3.43Å; R383-E386 IonicContact CZ-OE2 2.78Å; R383-E386 IonicContact NH1-OE2 3.37Å; R383-E386 PolarHBondContact NH1-OE2 3.11Å; R383-E386 PolarHBondContact O-N 3.46Å; E386-W388 VanDerWaalsContact C-N 3.35Å; E386-Q389 PolarHBondContact O-N 2.88Å; E386-E390 WeakPolarHBondContact O-CB 3.4Å; E386-E390 PolarHBondContact O-N 3.32Å
387	I	97.9	Very high	96	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-40.6	179.3	-67.2	170.4	0	0	0	110.8	F365 S368 V369 L372 R383 V384 E385 E390 F391 F422	F365-I387 HydrophobicContact CD2-CG2 4.07Å; F365-I387 HydrophobicContact CE2-CG2 3.88Å; S368-I387 WeakPolarHBondContact O-CD1 3.42Å; V369-I387 HydrophobicContact CG2-CG2 4.33Å; L372-I387 HydrophobicContact CB-CD1 3.89Å; L372-I387 HydrophobicContact CD2-CD1 4.23Å; R383-I387 HydrophobicContact CG-CD1 4.06Å; R383-I387 VanDerWaalsContact O-CG1 3.26Å; R383-I387 WeakPolarHBondContact O-CG1 3.35Å; R383-I387 PolarHBondContact O-N 3.33Å; R383-I387 VanDerWaalsContact O-N 3.08Å; V384-I387 PolarHBondContact O-N 3.49Å; E385-I387 PolarHBondContact O-N 3.19Å; I387-E390 PolarHBondContact O-N 3.42Å; I387-F391 HydrophobicContact CG2-CD2 4.09Å; I387-F391 WeakPolarHBondContact O-CD2 3.41Å; I387-F391 PolarHBondContact O-N 2.68Å; I387-F391 VanDerWaalsContact O-N 3.13Å; I387-F422 HydrophobicContact CB-CE2 3.91Å; I387-F422 HydrophobicContact CB-CZ 3.89Å; I387-F422 HydrophobicContact CD1-CE2 4.3Å; I387-F422 HydrophobicContact CG2-CD1 4.39Å; I387-F422 HydrophobicContact CG2-CD2 4.19Å; I387-F422 HydrophobicContact CG2-CE1 4.01Å; I387-F422 HydrophobicContact CG2-CE2 3.75Å; I387-F422 HydrophobicContact CG2-CG 4.49Å; I387-F422 HydrophobicContact CG2-CZ 3.67Å
388	W	97	Very high	96	Very high	30 Å²	30	58 Å²	58	11%	0.114	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-50	176.4	176	-101.2	0	0	0	111	V384 E385 E386 E390 L392 A393 Y407 T410 V414 F422	V384-W388 WeakPolarHBondContact O-CB 3.46Å; V384-W388 PolarHBondContact O-N 3.33Å; E385-W388 PolarHBondContact O-N 2.87Å; E386-W388 VanDerWaalsContact C-N 3.35Å; W388-E390 VanDerWaalsContact C-N 3.34Å; W388-E390 PolarHBondContact O-N 3.03Å; W388-L392 HydrophobicContact CD2-CB 4.13Å; W388-L392 HydrophobicContact CE3-CB 3.57Å; W388-L392 HydrophobicContact CE3-CD1 3.98Å; W388-L392 HydrophobicContact CE3-CG 4.43Å; W388-L392 HydrophobicContact CH2-CB 4.37Å; W388-L392 HydrophobicContact CZ3-CB 3.72Å; W388-L392 HydrophobicContact CZ3-CD1 4.09Å; W388-L392 CarbonylContact O-C 3.51Å; W388-L392 PolarHBondContact O-N 2.84Å; W388-A393 PolarHBondContact O-N 2.92Å; W388-Y407 HydrophobicContact CH2-CE1 4.43Å; W388-Y407 HydrophobicContact CH2-CE2 4.1Å; W388-Y407 AromaticContact CH2-CZ 3.83Å; W388-T410 HydrophobicContact CE3-CG2 4.49Å; W388-T410 HydrophobicContact CZ3-CG2 4.23Å; W388-V414 HydrophobicContact CB-CG1 4.4Å; W388-V414 HydrophobicContact CD2-CG1 4.32Å; W388-V414 HydrophobicContact CD2-CG2 4.22Å; W388-V414 HydrophobicContact CE3-CB 4.5Å; W388-V414 HydrophobicContact CE3-CG2 3.72Å; W388-V414 HydrophobicContact CG-CG1 4.21Å; W388-V414 HydrophobicContact CZ3-CG2 4.3Å; W388-F422 HydrophobicContact CB-CZ 4.38Å; W388-F422 HydrophobicContact CE3-CE1 4.44Å
389	Q	97.3	Very high	95.9	Very high	95 Å²	95	53.2 Å²	53.2	44%	0.444	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-35.7	-179.3	-66.3	-60.6	-27.6	0	0	113	E385 E386 A396 P397	E385-Q389 HydrophobicContact CG-CG 4.41Å; E385-Q389 VanDerWaalsContact O-CG 3.31Å; E385-Q389 WeakPolarHBondContact O-CG 3.47Å; E385-Q389 PolarHBondContact O-N 3.29Å; E385-Q389 WeakPolarHBondContact OE1-CG 2.96Å; E385-Q389 PolarHBondContact OE1-NE2 3.22Å; E386-Q389 PolarHBondContact O-N 2.88Å; Q389-A396 WeakPolarHBondContact O-CB 3.49Å; Q389-P397 WeakPolarHBondContact O-CD 3.47Å
390	E	97.8	Very high	95.9	Very high	66 Å²	66	51.2 Å²	51.2	31%	0.308	31%	0.307	S	S	.	.	H	α-helix	trans	-75.3	-37.1	-177.8	-173	177.4	173.7	0	0	113.4	E386 I387 W388 A396 P397 S398	E386-E390 WeakPolarHBondContact O-CB 3.4Å; E386-E390 PolarHBondContact O-N 3.32Å; I387-E390 PolarHBondContact O-N 3.42Å; W388-E390 VanDerWaalsContact C-N 3.34Å; W388-E390 PolarHBondContact O-N 3.03Å; E390-A396 WeakPolarHBondContact O-CB 3.19Å; E390-P397 WeakPolarHBondContact O-CD 3.48Å; E390-S398 CarbonylContact O-C 3.52Å; E390-S398 WeakPolarHBondContact O-CA 3.42Å; E390-S398 PolarHBondContact O-N 3.38Å
391	F	97.6	Very high	95.5	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-120.2	-23.7	-167.2	-61.7	-76.4	0	0	0	115.8	R364 F365 I387 S398 A399 I400	R364-F391 HydrophobicContact CB-CE1 3.93Å; R364-F391 HydrophobicContact CB-CZ 3.92Å; F365-F391 HydrophobicContact CB-CB 4.49Å; F365-F391 HydrophobicContact CB-CD1 3.72Å; F365-F391 HydrophobicContact CB-CD2 4.29Å; F365-F391 HydrophobicContact CB-CE1 3.97Å; F365-F391 HydrophobicContact CB-CG 3.91Å; F365-F391 HydrophobicContact CB-CZ 4.37Å; F365-F391 HydrophobicContact CD2-CB 3.69Å; F365-F391 HydrophobicContact CD2-CD1 4.4Å; F365-F391 AromaticContact CD2-CD2 3.85Å; F365-F391 HydrophobicContact CD2-CD2 3.85Å; F365-F391 AromaticContact CD2-CG 3.72Å; F365-F391 HydrophobicContact CD2-CG 3.72Å; F365-F391 HydrophobicContact CE2-CB 4.41Å; F365-F391 HydrophobicContact CG-CB 4.45Å; F365-F391 HydrophobicContact CG-CG 4.28Å; I387-F391 HydrophobicContact CG2-CD2 4.09Å; I387-F391 WeakPolarHBondContact O-CD2 3.41Å; I387-F391 PolarHBondContact O-N 2.68Å; I387-F391 VanDerWaalsContact O-N 3.13Å; F391-S398 VanDerWaalsContact CD1-O 3.29Å; F391-S398 WeakPolarHBondContact CD1-O 3.39Å; F391-A399 WeakPolarHBondContact O-CA 3.41Å; F391-I400 HydrophobicContact CB-CG1 4.32Å; F391-I400 HydrophobicContact CD1-CG2 4.11Å; F391-I400 WeakPolarHBondContact O-CG1 3.42Å; F391-I400 PolarHBondContact O-N 3.01Å
392	L	96.1	Very high	95.3	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.047	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	-19.9	-167	-68.6	176.7	0	0	0	115.5	F365 W388 I400 L402 Y407 T410 F422	F365-L392 HydrophobicContact CE2-CD1 4.12Å; F365-L392 HydrophobicContact CZ-CD1 4.44Å; W388-L392 HydrophobicContact CD2-CB 4.13Å; W388-L392 HydrophobicContact CE3-CB 3.57Å; W388-L392 HydrophobicContact CE3-CD1 3.98Å; W388-L392 HydrophobicContact CE3-CG 4.43Å; W388-L392 HydrophobicContact CH2-CB 4.37Å; W388-L392 HydrophobicContact CZ3-CB 3.72Å; W388-L392 HydrophobicContact CZ3-CD1 4.09Å; W388-L392 CarbonylContact O-C 3.51Å; W388-L392 PolarHBondContact O-N 2.84Å; L392-I400 HydrophobicContact CD2-CD1 3.75Å; L392-I400 HydrophobicContact CD2-CG1 3.53Å; L392-I400 HydrophobicContact CG-CD1 4.38Å; L392-I400 HydrophobicContact CG-CG1 4.32Å; L392-L402 HydrophobicContact CD1-CD1 4.26Å; L392-L402 HydrophobicContact CD2-CD1 3.37Å; L392-L402 HydrophobicContact CD2-CG 4.1Å; L392-L402 HydrophobicContact CG-CD1 4.46Å; L392-Y407 HydrophobicContact CB-CE2 4.37Å; L392-Y407 HydrophobicContact CD2-CD2 4.3Å; L392-Y407 HydrophobicContact CD2-CE2 4.4Å; L392-Y407 VanDerWaalsContact O-CE2 3.3Å; L392-Y407 WeakPolarHBondContact O-CE2 3.42Å; L392-Y407 PolarHBondContact O-OH 3.24Å; L392-Y407 VanDerWaalsContact O-OH 3.06Å; L392-T410 HydrophobicContact CD1-CG2 3.84Å; L392-F422 HydrophobicContact CD1-CD1 4.01Å; L392-F422 HydrophobicContact CD1-CE1 3.95Å
393	A	94.4	Very high	95.1	Very high	9 Å²	9	51.6 Å²	51.6	7%	0.074	31%	0.306	C	S	.	.	S	Bend	trans	-61.7	150.5	175.9	0	0	0	0	0	111.1	W388 G395 A396	W388-A393 PolarHBondContact O-N 2.92Å; A393-G395 PolarHBondContact O-N 3.29Å; A393-G395 VanDerWaalsContact O-N 3.14Å; A393-A396 WeakPolarHBondContact O-CB 3.26Å; A393-A396 PolarHBondContact O-N 2.96Å
394	P	92.4	Very high	94.7	Very high	121 Å²	121	53.4 Å²	53.4	79%	0.786	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	120.6	172.4	-24	34.2	0	0	0	110.9
395	G	92.1	Very high	94.4	Very high	84 Å²	84	59 Å²	59	87%	0.866	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	17.7	-175.5	0	0	0	0	0	114.7	A393	A393-G395 PolarHBondContact O-N 3.29Å; A393-G395 VanDerWaalsContact O-N 3.14Å
396	A	95	Very high	94.2	Very high	13 Å²	13	55.3 Å²	55.3	11%	0.107	34%	0.336	C	S	.	.			trans	-52.8	137.8	176.6	0	0	0	0	0	112.3	Q389 E390 A393 S398 A399	Q389-A396 WeakPolarHBondContact O-CB 3.49Å; E390-A396 WeakPolarHBondContact O-CB 3.19Å; A393-A396 WeakPolarHBondContact O-CB 3.26Å; A393-A396 PolarHBondContact O-N 2.96Å; A396-S398 VanDerWaalsContact C-N 3.25Å; A396-S398 PolarHBondContact O-N 2.96Å; A396-A399 HydrophobicContact CB-CB 4.2Å; A396-A399 PolarHBondContact O-N 3.02Å
397	P	94	Very high	94	Very high	113 Å²	113	55.3 Å²	55.3	73%	0.734	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.8	-176.2	26.9	-35.4	0	0	0	113.4	Q389 E390	Q389-P397 WeakPolarHBondContact O-CD 3.47Å; E390-P397 WeakPolarHBondContact O-CD 3.48Å
398	S	95.1	Very high	93.8	Very high	29 Å²	29	60.7 Å²	60.7	20%	0.203	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	49.7	176.5	-67.6	0	0	0	0	110.6	E390 F391 A396 I400	E390-S398 CarbonylContact O-C 3.52Å; E390-S398 WeakPolarHBondContact O-CA 3.42Å; E390-S398 PolarHBondContact O-N 3.38Å; F391-S398 VanDerWaalsContact CD1-O 3.29Å; F391-S398 WeakPolarHBondContact CD1-O 3.39Å; A396-S398 VanDerWaalsContact C-N 3.25Å; A396-S398 PolarHBondContact O-N 2.96Å; S398-I400 PolarHBondContact O-N 3.33Å
399	A	94.1	Very high	93.5	Very high	64 Å²	64	61.2 Å²	61.2	53%	0.529	36%	0.363	S	S	.	.			trans	-55.1	121.7	-176.3	0	0	0	0	0	112.8	F391 A396	F391-A399 WeakPolarHBondContact O-CA 3.41Å; A396-A399 HydrophobicContact CB-CB 4.2Å; A396-A399 PolarHBondContact O-N 3.02Å
400	I	95.1	Very high	93.4	Very high	17 Å²	17	56.7 Å²	56.7	9%	0.087	34%	0.342	C	S	.	.			trans	-90.1	151	175.4	56.7	163.9	0	0	0	111.3	E361 F365 F391 L392 S398 L402 I429	E361-I400 HydrophobicContact CB-CG2 4.09Å; E361-I400 HydrophobicContact CG-CG2 3.82Å; F365-I400 HydrophobicContact CB-CD1 4.31Å; F365-I400 HydrophobicContact CB-CG2 4Å; F365-I400 HydrophobicContact CD1-CD1 3.55Å; F365-I400 HydrophobicContact CD2-CD1 3.85Å; F365-I400 HydrophobicContact CE1-CD1 3.7Å; F365-I400 HydrophobicContact CE2-CD1 4Å; F365-I400 HydrophobicContact CG-CD1 3.62Å; F365-I400 HydrophobicContact CG-CG2 4.47Å; F365-I400 HydrophobicContact CZ-CD1 3.92Å; F391-I400 HydrophobicContact CB-CG1 4.32Å; F391-I400 HydrophobicContact CD1-CG2 4.11Å; F391-I400 WeakPolarHBondContact O-CG1 3.42Å; F391-I400 PolarHBondContact O-N 3.01Å; L392-I400 HydrophobicContact CD2-CD1 3.75Å; L392-I400 HydrophobicContact CD2-CG1 3.53Å; L392-I400 HydrophobicContact CG-CD1 4.38Å; L392-I400 HydrophobicContact CG-CG1 4.32Å; S398-I400 PolarHBondContact O-N 3.33Å; I400-L402 HydrophobicContact CD1-CD1 4.03Å; I400-L402 HydrophobicContact CD1-CD2 4.07Å; I400-L402 HydrophobicContact CD1-CG 3.83Å; I400-L402 HydrophobicContact CG1-CG 4.22Å; I400-L402 PolarHBondContact O-N 3.01Å; I400-I429 HydrophobicContact CB-CD1 4.27Å; I400-I429 HydrophobicContact CD1-CD1 3.92Å; I400-I429 HydrophobicContact CD1-CG1 3.83Å
401	N	89.1	Confident	93.1	Very high	131 Å²	131	55.5 Å²	55.5	70%	0.701	34%	0.341	S	S	*	.			trans	-85.6	110.7	174.4	-170.4	9.4	0	0	0	110.4
402	L	91.6	Very high	92.9	Very high	22 Å²	22	61.7 Å²	61.7	12%	0.115	37%	0.37	C	S	.	.			trans	-116.7	149.3	174.1	-73.1	-175.9	0	0	0	110.9	L392 I400 A425 H428 I429	L392-L402 HydrophobicContact CD1-CD1 4.26Å; L392-L402 HydrophobicContact CD2-CD1 3.37Å; L392-L402 HydrophobicContact CD2-CG 4.1Å; L392-L402 HydrophobicContact CG-CD1 4.46Å; I400-L402 HydrophobicContact CD1-CD1 4.03Å; I400-L402 HydrophobicContact CD1-CD2 4.07Å; I400-L402 HydrophobicContact CD1-CG 3.83Å; I400-L402 HydrophobicContact CG1-CG 4.22Å; I400-L402 PolarHBondContact O-N 3.01Å; L402-A425 HydrophobicContact CD1-CB 3.62Å; L402-A425 HydrophobicContact CD2-CB 4.22Å; L402-H428 HydrophobicContact CD2-CB 4.17Å; L402-I429 HydrophobicContact CD2-CD1 3.74Å; L402-I429 HydrophobicContact CD2-CG1 3.69Å
403	D	90.9	Very high	92.7	Very high	65 Å²	65	64 Å²	64	35%	0.348	38%	0.382	S	S	.	.			trans	-66.1	154.3	167	65.1	44.1	0	0	0	111.7	H405 S406 Y407 H428	D403-H405 PolarHBondContact O-N 2.95Å; D403-H405 PolarHBondContact OD1-N 2.72Å; D403-S406 PolarHBondContact O-N 3.3Å; D403-S406 WeakPolarHBondContact OD1-CB 3Å; D403-S406 PolarHBondContact OD1-N 3.08Å; D403-S406 PolarHBondContact OD1-OG 3.46Å; D403-Y407 PolarHBondContact O-N 3.26Å; D403-H428 IonicContact OD2-CE1 3.42Å; D403-H428 PolarHBondContact OD2-CE1 3.4Å; D403-H428 IonicContact OD2-ND1 3.74Å; D403-H428 PolarHBondContact OD2-ND1 3.15Å
404	S	90.7	Very high	92.6	Very high	87 Å²	87	64.6 Å²	64.6	61%	0.608	39%	0.385	S	S	*	.	H	α-helix	trans	-58.3	-37.5	-174.8	58.1	0	0	0	0	112.4	Y407 E408	S404-Y407 PolarHBondContact O-N 3.46Å; S404-E408 WeakPolarHBondContact O-CB 3.45Å; S404-E408 VanDerWaalsContact O-CG 3.27Å; S404-E408 WeakPolarHBondContact O-CG 3.38Å; S404-E408 PolarHBondContact O-N 2.94Å
405	H	90.9	Very high	92.5	Very high	120 Å²	120	67.4 Å²	67.4	56%	0.556	39%	0.385	S	S	*	.	H	α-helix	trans	-64.6	-49.2	-179.3	-176.1	57.7	0	0	0	112.4	D403 Y407 E408 I409	D403-H405 PolarHBondContact O-N 2.95Å; D403-H405 PolarHBondContact OD1-N 2.72Å; H405-Y407 VanDerWaalsContact C-N 3.3Å; H405-Y407 PolarHBondContact O-N 3.49Å; H405-E408 PolarHBondContact O-N 3.22Å; H405-I409 WeakPolarHBondContact NE2-CD1 3.46Å; H405-I409 WeakPolarHBondContact O-CG1 3.21Å; H405-I409 PolarHBondContact O-N 3.44Å; H405-I409 VanDerWaalsContact O-N 3.1Å
406	S	91.8	Very high	92.4	Very high	11 Å²	11	70.4 Å²	70.4	8%	0.077	38%	0.381	C	S	.	.	H	α-helix	trans	-66	-36.4	178.7	-52.6	0	0	0	0	111.1	D403 T410	D403-S406 PolarHBondContact O-N 3.3Å; D403-S406 WeakPolarHBondContact OD1-CB 3Å; D403-S406 PolarHBondContact OD1-N 3.08Å; D403-S406 PolarHBondContact OD1-OG 3.46Å; S406-T410 VanDerWaalsContact O-CB 3.28Å; S406-T410 WeakPolarHBondContact O-CB 3.45Å; S406-T410 PolarHBondContact O-N 2.95Å; S406-T410 PolarHBondContact O-OG1 2.69Å
407	Y	93.5	Very high	92	Very high	75 Å²	75	71.1 Å²	71.1	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-47.2	175.1	-172.2	-92.5	0	0	0	112	W388 L392 D403 S404 H405 T410 S411	W388-Y407 HydrophobicContact CH2-CE1 4.43Å; W388-Y407 HydrophobicContact CH2-CE2 4.1Å; W388-Y407 AromaticContact CH2-CZ 3.83Å; L392-Y407 HydrophobicContact CB-CE2 4.37Å; L392-Y407 HydrophobicContact CD2-CD2 4.3Å; L392-Y407 HydrophobicContact CD2-CE2 4.4Å; L392-Y407 VanDerWaalsContact O-CE2 3.3Å; L392-Y407 WeakPolarHBondContact O-CE2 3.42Å; L392-Y407 PolarHBondContact O-OH 3.24Å; L392-Y407 VanDerWaalsContact O-OH 3.06Å; D403-Y407 PolarHBondContact O-N 3.26Å; S404-Y407 PolarHBondContact O-N 3.46Å; H405-Y407 VanDerWaalsContact C-N 3.3Å; H405-Y407 PolarHBondContact O-N 3.49Å; Y407-T410 PolarHBondContact O-N 2.78Å; Y407-S411 VanDerWaalsContact O-CB 3.25Å; Y407-S411 WeakPolarHBondContact O-CB 3.47Å; Y407-S411 PolarHBondContact O-N 3.29Å
408	E	92.7	Very high	92	Very high	112 Å²	112	67 Å²	67	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-46.9	179.1	-77.2	169.7	-160.2	0	0	112.3	S404 H405 S411 Q412	S404-E408 WeakPolarHBondContact O-CB 3.45Å; S404-E408 VanDerWaalsContact O-CG 3.27Å; S404-E408 WeakPolarHBondContact O-CG 3.38Å; S404-E408 PolarHBondContact O-N 2.94Å; H405-E408 PolarHBondContact O-N 3.22Å; E408-S411 PolarHBondContact O-N 2.86Å; E408-Q412 WeakPolarHBondContact O-CG 3.23Å; E408-Q412 PolarHBondContact O-N 2.87Å; E408-Q412 VanDerWaalsContact O-N 3.1Å
409	I	92.4	Very high	92	Very high	41 Å²	41	69.3 Å²	69.3	21%	0.21	37%	0.372	C	S	.	.	H	α-helix	trans	-60.5	-49	176.9	-68.8	169	0	0	0	110.2	H405 S411 Q412 N413 D424	H405-I409 WeakPolarHBondContact NE2-CD1 3.46Å; H405-I409 WeakPolarHBondContact O-CG1 3.21Å; H405-I409 PolarHBondContact O-N 3.44Å; H405-I409 VanDerWaalsContact O-N 3.1Å; I409-S411 VanDerWaalsContact C-N 3.34Å; I409-S411 PolarHBondContact O-N 2.7Å; I409-Q412 PolarHBondContact O-N 3.06Å; I409-N413 WeakPolarHBondContact CG2-ND2 3.32Å; I409-N413 PolarHBondContact O-N 3.41Å; I409-N413 PolarHBondContact O-OD1 3.48Å; I409-D424 HydrophobicContact CG2-CB 4.47Å; I409-D424 WeakPolarHBondContact CG2-OD2 3.31Å
410	T	93.3	Very high	92.1	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.2	-42.7	-179.2	-55.8	0	0	0	0	111.2	W388 L392 S406 Y407 Q412 N413 V414 F422	W388-T410 HydrophobicContact CE3-CG2 4.49Å; W388-T410 HydrophobicContact CZ3-CG2 4.23Å; L392-T410 HydrophobicContact CD1-CG2 3.84Å; S406-T410 VanDerWaalsContact O-CB 3.28Å; S406-T410 WeakPolarHBondContact O-CB 3.45Å; S406-T410 PolarHBondContact O-N 2.95Å; S406-T410 PolarHBondContact O-OG1 2.69Å; Y407-T410 PolarHBondContact O-N 2.78Å; T410-Q412 VanDerWaalsContact C-N 3.28Å; T410-Q412 PolarHBondContact O-N 2.87Å; T410-N413 PolarHBondContact O-N 3.33Å; T410-N413 VanDerWaalsContact O-N 3.16Å; T410-V414 HydrophobicContact CG2-CG2 4.31Å; T410-V414 VanDerWaalsContact O-CG2 3.26Å; T410-V414 WeakPolarHBondContact O-CG2 3.39Å; T410-V414 PolarHBondContact O-N 3.2Å; T410-F422 HydrophobicContact CG2-CD1 3.45Å; T410-F422 VanDerWaalsContact CG2-CD1 3.45Å; T410-F422 HydrophobicContact CG2-CE1 3.79Å; T410-F422 HydrophobicContact CG2-CG 4.47Å
411	S	92.8	Very high	92.2	Very high	42 Å²	42	73 Å²	73	29%	0.294	37%	0.374	S	S	.	.	H	α-helix	trans	-59.9	-36.1	177	-175	0	0	0	0	112.7	Y407 E408 I409	Y407-S411 VanDerWaalsContact O-CB 3.25Å; Y407-S411 WeakPolarHBondContact O-CB 3.47Å; Y407-S411 PolarHBondContact O-N 3.29Å; E408-S411 PolarHBondContact O-N 2.86Å; I409-S411 VanDerWaalsContact C-N 3.34Å; I409-S411 PolarHBondContact O-N 2.7Å
412	Q	92.9	Very high	92.6	Very high	130 Å²	130	66.8 Å²	66.8	61%	0.607	34%	0.34	S	S	*	.	H	α-helix	trans	-71.9	-45.2	173.2	-68.6	178.2	14.8	0	0	111.7	E408 I409 T410 V414 K415	E408-Q412 WeakPolarHBondContact O-CG 3.23Å; E408-Q412 PolarHBondContact O-N 2.87Å; E408-Q412 VanDerWaalsContact O-N 3.1Å; I409-Q412 PolarHBondContact O-N 3.06Å; T410-Q412 VanDerWaalsContact C-N 3.28Å; T410-Q412 PolarHBondContact O-N 2.87Å; Q412-V414 VanDerWaalsContact C-N 3.28Å; Q412-V414 PolarHBondContact O-N 3.09Å; Q412-K415 WeakPolarHBondContact O-CB 3.43Å; Q412-K415 PolarHBondContact O-N 2.93Å
413	N	92.5	Very high	92.8	Very high	57 Å²	57	69.9 Å²	69.9	31%	0.305	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-28.7	-178.5	-68.1	-13.1	0	0	0	113.4	I409 T410 K415 D416 T421	I409-N413 WeakPolarHBondContact CG2-ND2 3.32Å; I409-N413 PolarHBondContact O-N 3.41Å; I409-N413 PolarHBondContact O-OD1 3.48Å; T410-N413 PolarHBondContact O-N 3.33Å; T410-N413 VanDerWaalsContact O-N 3.16Å; N413-K415 PolarHBondContact O-N 3.32Å; N413-D416 CarbonylContact O-C 3.58Å; N413-D416 VanDerWaalsContact O-C 3.29Å; N413-D416 PolarHBondContact O-N 3.33Å; N413-T421 HydrophobicContact CB-CG2 3.91Å; N413-T421 PolarHBondContact ND2-O 3.03Å; N413-T421 PolarHBondContact O-OG1 2.78Å
414	V	92.7	Very high	92.9	Very high	23 Å²	23	69.8 Å²	69.8	14%	0.139	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-66.9	-24.9	177.9	168.2	0	0	0	0	111.9	V384 W388 T410 Q412 D416 T421 F422	V384-V414 HydrophobicContact CG1-CB 4.47Å; V384-V414 HydrophobicContact CG1-CG1 4.15Å; V384-V414 HydrophobicContact CG1-CG2 4.13Å; W388-V414 HydrophobicContact CB-CG1 4.4Å; W388-V414 HydrophobicContact CD2-CG1 4.32Å; W388-V414 HydrophobicContact CD2-CG2 4.22Å; W388-V414 HydrophobicContact CE3-CB 4.5Å; W388-V414 HydrophobicContact CE3-CG2 3.72Å; W388-V414 HydrophobicContact CG-CG1 4.21Å; W388-V414 HydrophobicContact CZ3-CG2 4.3Å; T410-V414 HydrophobicContact CG2-CG2 4.31Å; T410-V414 VanDerWaalsContact O-CG2 3.26Å; T410-V414 WeakPolarHBondContact O-CG2 3.39Å; T410-V414 PolarHBondContact O-N 3.2Å; Q412-V414 VanDerWaalsContact C-N 3.28Å; Q412-V414 PolarHBondContact O-N 3.09Å; V414-D416 PolarHBondContact O-N 3.28Å; V414-T421 HydrophobicContact CB-CG2 4.23Å; V414-T421 HydrophobicContact CG2-CG2 3.43Å; V414-T421 VanDerWaalsContact CG2-CG2 3.43Å; V414-F422 HydrophobicContact CG2-CE1 4.01Å; V414-F422 HydrophobicContact CG2-CZ 4.12Å
415	K	90.5	Very high	93.2	Very high	179 Å²	179	65.7 Å²	65.7	78%	0.778	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-63.8	-29.8	178	-61.5	179.6	-177.9	177.6	0	113	Q412 N413	Q412-K415 WeakPolarHBondContact O-CB 3.43Å; Q412-K415 PolarHBondContact O-N 2.93Å; N413-K415 PolarHBondContact O-N 3.32Å
416	D	88.9	Confident	93.5	Very high	148 Å²	148	60.5 Å²	60.5	79%	0.791	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-127.5	71.4	172.6	-171.8	20.6	0	0	0	108.7	N413 V414 G418	N413-D416 CarbonylContact O-C 3.58Å; N413-D416 VanDerWaalsContact O-C 3.29Å; N413-D416 PolarHBondContact O-N 3.33Å; V414-D416 PolarHBondContact O-N 3.28Å; D416-G418 PolarHBondContact O-N 3.05Å
417	G	87.6	Confident	93.6	Very high	28 Å²	28	64.9 Å²	64.9	29%	0.289	32%	0.32	S	S	.	.			trans	-63.3	125.3	-169.6	0	0	0	0	0	113.9	T421	G417-T421 WeakPolarHBondContact CA-OG1 3.48Å
418	G	92.9	Very high	93.7	Very high	27 Å²	27	63.7 Å²	63.7	28%	0.278	32%	0.317	S	S	.	.			trans	-135.5	-179.1	174.9	0	0	0	0	0	112.6	D416 Y420 T421	D416-G418 PolarHBondContact O-N 3.05Å; G418-Y420 PolarHBondContact O-N 2.87Å; G418-T421 PolarHBondContact N-OG1 3.12Å; G418-T421 WeakPolarHBondContact O-CB 3.38Å; G418-T421 PolarHBondContact O-N 2.56Å; G418-T421 PolarHBondContact O-OG1 3.45Å; G418-T421 VanDerWaalsContact O-OG1 3.09Å
419	R	96.2	Very high	93.9	Very high	76 Å²	76	58.3 Å²	58.3	29%	0.287	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.8	-178.8	-66.7	-178.5	-173.7	-115.1	-6.9	114	K373 Q375 V380	K373-R419 VanDerWaalsContact CG-O 3.31Å; K373-R419 WeakPolarHBondContact CG-O 3.48Å; K373-R419 PolarHBondContact O-NH1 2.8Å; Q375-R419 PolarHBondContact O-NH1 3.49Å; Q375-R419 PolarHBondContact O-NH2 3.16Å; V380-R419 HydrophobicContact CG1-CG 4.36Å; V380-R419 HydrophobicContact CG2-CG 3.92Å
420	Y	96.3	Very high	94.1	Very high	153 Å²	153	58.1 Å²	58.1	60%	0.6	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	9.1	-173.2	-58.4	-67	0	0	0	112.7	G418 F422 E423	G418-Y420 PolarHBondContact O-N 2.87Å; Y420-F422 PolarHBondContact O-N 2.58Å; Y420-F422 VanDerWaalsContact O-N 3.16Å; Y420-E423 HydrophobicContact CD1-CG 3.97Å; Y420-E423 WeakPolarHBondContact CD1-OE1 3.45Å; Y420-E423 HydrophobicContact CG-CG 4.42Å; Y420-E423 WeakPolarHBondContact O-CG 3.28Å; Y420-E423 PolarHBondContact O-N 2.84Å
421	T	96.3	Very high	94.2	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.043	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-36.8	-176.9	-72.5	0	0	0	0	113.7	V384 N413 V414 G417 G418	V384-T421 HydrophobicContact CG1-CG2 3.98Å; N413-T421 HydrophobicContact CB-CG2 3.91Å; N413-T421 PolarHBondContact ND2-O 3.03Å; N413-T421 PolarHBondContact O-OG1 2.78Å; V414-T421 HydrophobicContact CB-CG2 4.23Å; V414-T421 HydrophobicContact CG2-CG2 3.43Å; V414-T421 VanDerWaalsContact CG2-CG2 3.43Å; G417-T421 WeakPolarHBondContact CA-OG1 3.48Å; G418-T421 PolarHBondContact N-OG1 3.12Å; G418-T421 WeakPolarHBondContact O-CB 3.38Å; G418-T421 PolarHBondContact O-N 2.56Å; G418-T421 PolarHBondContact O-OG1 3.45Å; G418-T421 VanDerWaalsContact O-OG1 3.09Å
422	F	97.3	Very high	94.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	18.2	-176.4	-56.9	-77.9	0	0	0	113.8	F365 V369 L372 V384 I387 W388 L392 T410 V414 Y420 D424 A425 Q426	F365-F422 HydrophobicContact CE2-CD1 4.16Å; F365-F422 HydrophobicContact CZ-CB 4.21Å; F365-F422 HydrophobicContact CZ-CD1 4.25Å; F365-F422 HydrophobicContact CZ-CG 4.48Å; V369-F422 HydrophobicContact CB-CB 4.42Å; V369-F422 HydrophobicContact CG1-CB 3.81Å; V369-F422 HydrophobicContact CG2-CB 3.63Å; V369-F422 HydrophobicContact CG2-CD2 4.12Å; V369-F422 HydrophobicContact CG2-CG 3.97Å; L372-F422 HydrophobicContact CD2-CD2 3.6Å; L372-F422 HydrophobicContact CD2-CE2 3.82Å; V384-F422 HydrophobicContact CB-CE2 4.24Å; V384-F422 HydrophobicContact CG1-CE2 4Å; V384-F422 HydrophobicContact CG1-CZ 3.99Å; V384-F422 HydrophobicContact CG2-CE2 4.13Å; V384-F422 WeakPolarHBondContact O-CZ 3.29Å; I387-F422 HydrophobicContact CB-CE2 3.91Å; I387-F422 HydrophobicContact CB-CZ 3.89Å; I387-F422 HydrophobicContact CD1-CE2 4.3Å; I387-F422 HydrophobicContact CG2-CD1 4.39Å; I387-F422 HydrophobicContact CG2-CD2 4.19Å; I387-F422 HydrophobicContact CG2-CE1 4.01Å; I387-F422 HydrophobicContact CG2-CE2 3.75Å; I387-F422 HydrophobicContact CG2-CG 4.49Å; I387-F422 HydrophobicContact CG2-CZ 3.67Å; W388-F422 HydrophobicContact CB-CZ 4.38Å; W388-F422 HydrophobicContact CE3-CE1 4.44Å; L392-F422 HydrophobicContact CD1-CD1 4.01Å; L392-F422 HydrophobicContact CD1-CE1 3.95Å; T410-F422 HydrophobicContact CG2-CD1 3.45Å; T410-F422 VanDerWaalsContact CG2-CD1 3.45Å; T410-F422 HydrophobicContact CG2-CE1 3.79Å; T410-F422 HydrophobicContact CG2-CG 4.47Å; V414-F422 HydrophobicContact CG2-CE1 4.01Å; V414-F422 HydrophobicContact CG2-CZ 4.12Å; Y420-F422 PolarHBondContact O-N 2.58Å; Y420-F422 VanDerWaalsContact O-N 3.16Å; F422-D424 PolarHBondContact O-N 2.8Å; F422-A425 PolarHBondContact O-N 3.04Å; F422-Q426 WeakPolarHBondContact O-CB 3.33Å; F422-Q426 PolarHBondContact O-N 3.28Å
423	E	95.4	Very high	94.5	Very high	87 Å²	87	57.5 Å²	57.5	41%	0.407	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-47.9	-175.7	-74.8	-134.3	132.2	0	0	113.4	K373 Y420 Q426 E427	K373-E423 WeakPolarHBondContact CE-OE1 3.41Å; K373-E423 IonicContact NZ-OE1 3.43Å; K373-E423 PolarHBondContact NZ-OE1 3.01Å; Y420-E423 HydrophobicContact CD1-CG 3.97Å; Y420-E423 WeakPolarHBondContact CD1-OE1 3.45Å; Y420-E423 HydrophobicContact CG-CG 4.42Å; Y420-E423 WeakPolarHBondContact O-CG 3.28Å; Y420-E423 PolarHBondContact O-N 2.84Å; E423-Q426 PolarHBondContact O-N 3.43Å; E423-E427 WeakPolarHBondContact O-CB 3.5Å; E423-E427 PolarHBondContact O-N 3.28Å
424	D	93.8	Very high	94.7	Very high	63 Å²	63	57.9 Å²	57.9	34%	0.337	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-48.1	179.7	-60.6	-84.2	0	0	0	111.6	I409 F422 Q426 E427 H428	I409-D424 HydrophobicContact CG2-CB 4.47Å; I409-D424 WeakPolarHBondContact CG2-OD2 3.31Å; F422-D424 PolarHBondContact O-N 2.8Å; D424-Q426 PolarHBondContact O-N 3.06Å; D424-E427 PolarHBondContact O-N 2.82Å; D424-H428 PolarHBondContact O-N 3.34Å
425	A	96.1	Very high	94.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-43.8	175.9	0	0	0	0	0	112.1	F365 L402 F422 E427 H428 I429	F365-A425 HydrophobicContact CE1-CB 4.07Å; F365-A425 HydrophobicContact CZ-CB 3.73Å; L402-A425 HydrophobicContact CD1-CB 3.62Å; L402-A425 HydrophobicContact CD2-CB 4.22Å; F422-A425 PolarHBondContact O-N 3.04Å; A425-E427 PolarHBondContact O-N 2.91Å; A425-H428 PolarHBondContact O-N 3.15Å; A425-I429 VanDerWaalsContact O-CG1 3.3Å; A425-I429 WeakPolarHBondContact O-CG1 3.46Å; A425-I429 PolarHBondContact O-N 2.96Å
426	Q	96.9	Very high	95	Very high	11 Å²	11	55 Å²	55	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-41.3	178.1	-175	-179.6	47.8	0	0	111.5	W366 V369 F422 E423 D424 Y430	W366-Q426 VanDerWaalsContact CD1-CG 3.41Å; W366-Q426 HydrophobicContact CG-CG 4.28Å; W366-Q426 PolarHBondContact O-NE2 3Å; V369-Q426 HydrophobicContact CB-CB 4.47Å; V369-Q426 HydrophobicContact CB-CG 4.33Å; V369-Q426 HydrophobicContact CG1-CB 4.03Å; V369-Q426 VanDerWaalsContact CG1-CD 3.43Å; V369-Q426 HydrophobicContact CG1-CG 4.11Å; F422-Q426 WeakPolarHBondContact O-CB 3.33Å; F422-Q426 PolarHBondContact O-N 3.28Å; E423-Q426 PolarHBondContact O-N 3.43Å; D424-Q426 PolarHBondContact O-N 3.06Å; Q426-Y430 VanDerWaalsContact O-CB 3.23Å; Q426-Y430 WeakPolarHBondContact O-CB 3.39Å; Q426-Y430 PolarHBondContact O-N 2.69Å
427	E	95.6	Very high	95.4	Very high	103 Å²	103	48.2 Å²	48.2	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-66.8	-40.9	178.3	-158.4	-160.6	-174.4	0	0	111.4	E423 D424 A425 Y430 K431	E423-E427 WeakPolarHBondContact O-CB 3.5Å; E423-E427 PolarHBondContact O-N 3.28Å; D424-E427 PolarHBondContact O-N 2.82Å; A425-E427 PolarHBondContact O-N 2.91Å; E427-Y430 PolarHBondContact O-N 2.9Å; E427-K431 VanDerWaalsContact CD-CE 3.44Å; E427-K431 HydrophobicContact CG-CD 4.35Å; E427-K431 WeakPolarHBondContact O-CB 3.37Å; E427-K431 VanDerWaalsContact O-CG 3.31Å; E427-K431 WeakPolarHBondContact O-CG 3.5Å; E427-K431 PolarHBondContact O-N 3.4Å; E427-K431 WeakPolarHBondContact OE1-CE 3.39Å; E427-K431 IonicContact OE1-NZ 2.77Å; E427-K431 PolarHBondContact OE1-NZ 3.13Å; E427-K431 IonicContact OE2-NZ 2.85Å; E427-K431 PolarHBondContact OE2-NZ 2.95Å
428	H	95.3	Very high	95.9	Very high	50 Å²	50	46.9 Å²	46.9	23%	0.231	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-54.2	174.4	-176	97.2	0	0	0	111.1	L402 D403 D424 A425 Y430 K431 L432	L402-H428 HydrophobicContact CD2-CB 4.17Å; D403-H428 IonicContact OD2-CE1 3.42Å; D403-H428 PolarHBondContact OD2-CE1 3.4Å; D403-H428 IonicContact OD2-ND1 3.74Å; D403-H428 PolarHBondContact OD2-ND1 3.15Å; D424-H428 PolarHBondContact O-N 3.34Å; A425-H428 PolarHBondContact O-N 3.15Å; H428-Y430 VanDerWaalsContact C-N 3.34Å; H428-Y430 PolarHBondContact O-N 3.38Å; H428-K431 PolarHBondContact O-N 2.96Å; H428-L432 WeakPolarHBondContact O-CB 3.49Å; H428-L432 PolarHBondContact O-N 3.26Å
429	I	96.6	Very high	96	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-38.9	-178.9	-66	-63.5	0	0	0	111.8	N362 F365 I400 L402 A425 L432 M433	N362-I429 HydrophobicContact CB-CG2 3.87Å; N362-I429 VanDerWaalsContact O-CG2 3.28Å; N362-I429 WeakPolarHBondContact O-CG2 3.28Å; F365-I429 HydrophobicContact CD1-CB 4.22Å; F365-I429 HydrophobicContact CD1-CG1 3.9Å; F365-I429 HydrophobicContact CD1-CG2 4.24Å; F365-I429 HydrophobicContact CE1-CB 4.44Å; F365-I429 HydrophobicContact CE1-CG1 4.01Å; I400-I429 HydrophobicContact CB-CD1 4.27Å; I400-I429 HydrophobicContact CD1-CD1 3.92Å; I400-I429 HydrophobicContact CD1-CG1 3.83Å; L402-I429 HydrophobicContact CD2-CD1 3.74Å; L402-I429 HydrophobicContact CD2-CG1 3.69Å; A425-I429 VanDerWaalsContact O-CG1 3.3Å; A425-I429 WeakPolarHBondContact O-CG1 3.46Å; A425-I429 PolarHBondContact O-N 2.96Å; I429-L432 HydrophobicContact CD1-CD2 4.41Å; I429-L432 PolarHBondContact O-N 3.39Å; I429-M433 HydrophobicContact CG2-CE 3.85Å; I429-M433 HydrophobicContact CG2-SD 4.49Å; I429-M433 WeakPolarHBondContact O-CG 3.33Å; I429-M433 PolarHBondContact O-N 3.18Å
430	Y	97	Very high	96.1	Very high	36 Å²	36	46.8 Å²	46.8	14%	0.141	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-47.6	173.7	175.4	-86.3	0	0	0	111.7	F337 D338 L341 W366 Q426 E427 H428 L432 M433 K434	F337-Y430 AromaticContact CD1-CD2 3.87Å; F337-Y430 HydrophobicContact CD1-CD2 3.87Å; F337-Y430 HydrophobicContact CD1-CE1 4.38Å; F337-Y430 AromaticContact CD1-CE2 3.49Å; F337-Y430 HydrophobicContact CD1-CE2 3.49Å; F337-Y430 VanDerWaalsContact CD1-CE2 3.49Å; F337-Y430 HydrophobicContact CD1-CG 4.48Å; F337-Y430 AromaticContact CD1-CZ 3.76Å; F337-Y430 AromaticContact CE1-CD2 3.74Å; F337-Y430 HydrophobicContact CE1-CD2 3.74Å; F337-Y430 AromaticContact CE1-CE2 3.84Å; F337-Y430 HydrophobicContact CE1-CE2 3.84Å; F337-Y430 HydrophobicContact CE1-CG 4.32Å; D338-Y430 PolarHBondContact OD1-OH 2.91Å; D338-Y430 PolarHBondContact OD2-OH 3.5Å; L341-Y430 HydrophobicContact CD1-CD2 4.02Å; L341-Y430 HydrophobicContact CD1-CE2 3.8Å; W366-Y430 HydrophobicContact CZ2-CD2 4.26Å; W366-Y430 AromaticContact NE1-CD2 3.63Å; Q426-Y430 VanDerWaalsContact O-CB 3.23Å; Q426-Y430 WeakPolarHBondContact O-CB 3.39Å; Q426-Y430 PolarHBondContact O-N 2.69Å; E427-Y430 PolarHBondContact O-N 2.9Å; H428-Y430 VanDerWaalsContact C-N 3.34Å; H428-Y430 PolarHBondContact O-N 3.38Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.71Å; Y430-M433 PolarHBondContact O-N 2.98Å; Y430-K434 HydrophobicContact CD1-CD 4.45Å; Y430-K434 HydrophobicContact CE1-CB 4.49Å; Y430-K434 HydrophobicContact CE1-CD 3.56Å; Y430-K434 WeakPolarHBondContact O-CB 3.34Å; Y430-K434 PolarHBondContact O-N 2.95Å; Y430-K434 PolarHBondContact OH-NZ 3.47Å
431	K	95.4	Very high	96.1	Very high	98 Å²	98	39.6 Å²	39.6	43%	0.426	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-39.8	178.7	-74.7	167.9	-178.4	162.6	0	111.4	E427 H428 S435	E427-K431 VanDerWaalsContact CD-CE 3.44Å; E427-K431 HydrophobicContact CG-CD 4.35Å; E427-K431 WeakPolarHBondContact O-CB 3.37Å; E427-K431 VanDerWaalsContact O-CG 3.31Å; E427-K431 WeakPolarHBondContact O-CG 3.5Å; E427-K431 PolarHBondContact O-N 3.4Å; E427-K431 WeakPolarHBondContact OE1-CE 3.39Å; E427-K431 IonicContact OE1-NZ 2.77Å; E427-K431 PolarHBondContact OE1-NZ 3.13Å; E427-K431 IonicContact OE2-NZ 2.85Å; E427-K431 PolarHBondContact OE2-NZ 2.95Å; H428-K431 PolarHBondContact O-N 2.96Å; K431-S435 WeakPolarHBondContact O-CB 3.47Å; K431-S435 PolarHBondContact O-N 3.4Å; K431-S435 VanDerWaalsContact O-N 3.08Å; K431-S435 PolarHBondContact O-OG 3.01Å
432	L	94.9	Very high	96.1	Very high	62 Å²	62	39.6 Å²	39.6	33%	0.325	20%	0.197	S	C	.	.	H	α-helix	trans	-58.2	-59.5	175.5	179.1	63.8	0	0	0	110.5	H428 I429 Y430 K434 S435 D436	H428-L432 WeakPolarHBondContact O-CB 3.49Å; H428-L432 PolarHBondContact O-N 3.26Å; I429-L432 HydrophobicContact CD1-CD2 4.41Å; I429-L432 PolarHBondContact O-N 3.39Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.71Å; L432-K434 VanDerWaalsContact C-N 3.33Å; L432-K434 PolarHBondContact O-N 2.89Å; L432-S435 PolarHBondContact O-N 2.92Å; L432-S435 PolarHBondContact O-OG 3.31Å; L432-D436 PolarHBondContact O-N 3.06Å
433	M	96.4	Very high	96	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.9	-42.3	179.6	-69.5	-171.1	-66.5	0	0	112.3	F337 F350 N362 L363 W366 I429 Y430 S435 S437 Y438	F337-M433 HydrophobicContact CE1-CB 3.89Å; F337-M433 HydrophobicContact CE1-CE 4.32Å; F337-M433 HydrophobicContact CE2-CB 4.46Å; F337-M433 HydrophobicContact CZ-CB 3.55Å; F337-M433 HydrophobicContact CZ-CE 4.02Å; F337-M433 HydrophobicContact CZ-SD 4.34Å; F350-M433 HydrophobicContact CE1-SD 4.33Å; N362-M433 HydrophobicContact CB-CG 3.95Å; N362-M433 HydrophobicContact CB-SD 3.76Å; L363-M433 HydrophobicContact CB-SD 3.95Å; L363-M433 HydrophobicContact CD1-CE 4.44Å; L363-M433 HydrophobicContact CD1-SD 4.43Å; W366-M433 HydrophobicContact CB-CE 3.87Å; W366-M433 HydrophobicContact CG-CE 4.11Å; I429-M433 HydrophobicContact CG2-CE 3.85Å; I429-M433 HydrophobicContact CG2-SD 4.49Å; I429-M433 WeakPolarHBondContact O-CG 3.33Å; I429-M433 PolarHBondContact O-N 3.18Å; Y430-M433 PolarHBondContact O-N 2.98Å; M433-S435 VanDerWaalsContact C-N 3.3Å; M433-S435 PolarHBondContact O-N 3.24Å; M433-S437 PolarHBondContact O-N 3.44Å; M433-Y438 VanDerWaalsContact O-CB 3.29Å; M433-Y438 WeakPolarHBondContact O-CB 3.48Å; M433-Y438 PolarHBondContact O-N 2.87Å
434	K	96.6	Very high	96	Very high	64 Å²	64	43.3 Å²	43.3	28%	0.278	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-40	179.4	-175.9	164.6	-169.5	157.8	0	112.7	F337 D338 Y430 L432	F337-K434 HydrophobicContact CB-CB 4.31Å; F337-K434 HydrophobicContact CB-CD 4.14Å; F337-K434 HydrophobicContact CB-CG 3.88Å; F337-K434 HydrophobicContact CD1-CB 3.6Å; F337-K434 HydrophobicContact CD1-CD 4.3Å; F337-K434 HydrophobicContact CD1-CG 4.08Å; F337-K434 HydrophobicContact CE1-CB 4.16Å; F337-K434 HydrophobicContact CG-CB 4.13Å; F337-K434 HydrophobicContact CG-CG 4.26Å; D338-K434 IonicContact OD2-NZ 3.27Å; D338-K434 PolarHBondContact OD2-NZ 3.17Å; Y430-K434 HydrophobicContact CD1-CD 4.45Å; Y430-K434 HydrophobicContact CE1-CB 4.49Å; Y430-K434 HydrophobicContact CE1-CD 3.56Å; Y430-K434 WeakPolarHBondContact O-CB 3.34Å; Y430-K434 PolarHBondContact O-N 2.95Å; Y430-K434 PolarHBondContact OH-NZ 3.47Å; L432-K434 VanDerWaalsContact C-N 3.33Å; L432-K434 PolarHBondContact O-N 2.89Å
435	S	94.6	Very high	96	Very high	77 Å²	77	46.3 Å²	46.3	54%	0.538	23%	0.225	S	C	.	.	H	α-helix	trans	-87.4	-24.8	-174.3	67	0	0	0	0	114.1	K431 L432 M433	K431-S435 WeakPolarHBondContact O-CB 3.47Å; K431-S435 PolarHBondContact O-N 3.4Å; K431-S435 VanDerWaalsContact O-N 3.08Å; K431-S435 PolarHBondContact O-OG 3.01Å; L432-S435 PolarHBondContact O-N 2.92Å; L432-S435 PolarHBondContact O-OG 3.31Å; M433-S435 VanDerWaalsContact C-N 3.3Å; M433-S435 PolarHBondContact O-N 3.24Å
436	D	95.1	Very high	95.8	Very high	65 Å²	65	48.6 Å²	48.6	35%	0.348	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-77.1	-177.6	-178.4	45	0	0	0	112.6	L432 Y438 A439 R440	L432-D436 PolarHBondContact O-N 3.06Å; D436-Y438 PolarHBondContact O-N 3.18Å; D436-A439 WeakPolarHBondContact O-CB 3.35Å; D436-A439 PolarHBondContact O-N 2.96Å; D436-R440 PolarHBondContact O-N 2.87Å; D436-R440 IonicContact OD1-CZ 3.04Å; D436-R440 IonicContact OD1-NE 3.44Å; D436-R440 PolarHBondContact OD1-NE 2.94Å; D436-R440 IonicContact OD1-NH2 3.98Å; D436-R440 IonicContact OD2-CZ 2.74Å; D436-R440 IonicContact OD2-NE 2.84Å; D436-R440 PolarHBondContact OD2-NE 3.44Å; D436-R440 IonicContact OD2-NH2 2.74Å; D436-R440 PolarHBondContact OD2-NH2 3.07Å
437	S	96.5	Very high	95.7	Very high	5 Å²	5	48.3 Å²	48.3	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-41.1	-170.4	-40	0	0	0	0	113.6	M433 R440 F441	M433-S437 PolarHBondContact O-N 3.44Å; S437-R440 PolarHBondContact O-N 3.45Å; S437-F441 WeakPolarHBondContact O-CB 3.43Å; S437-F441 PolarHBondContact O-N 2.88Å
438	Y	97.9	Very high	95.6	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-42.1	176	173.3	-113.4	0	0	0	112	W333 G334 S336 F337 I340 M433 D436 R440 F441 L442	W333-Y438 PolarHBondContact O-OH 3.33Å; G334-Y438 VanDerWaalsContact C-OH 3.3Å; G334-Y438 WeakPolarHBondContact CA-OH 3.38Å; G334-Y438 PolarHBondContact O-OH 3.31Å; S336-Y438 VanDerWaalsContact C-OH 3.24Å; S336-Y438 PolarHBondContact O-OH 3.31Å; F337-Y438 HydrophobicContact CB-CD1 3.95Å; F337-Y438 HydrophobicContact CB-CD2 4.49Å; F337-Y438 HydrophobicContact CB-CE1 4.11Å; F337-Y438 HydrophobicContact CB-CG 4.15Å; F337-Y438 HydrophobicContact CD2-CD1 4.19Å; F337-Y438 AromaticContact CD2-CD2 3.55Å; F337-Y438 HydrophobicContact CD2-CD2 3.55Å; F337-Y438 HydrophobicContact CD2-CE2 4.23Å; F337-Y438 AromaticContact CD2-CG 3.52Å; F337-Y438 HydrophobicContact CD2-CG 3.52Å; F337-Y438 HydrophobicContact CE2-CD2 4.26Å; F337-Y438 HydrophobicContact CE2-CG 4.25Å; F337-Y438 HydrophobicContact CG-CD1 4.38Å; F337-Y438 HydrophobicContact CG-CD2 4.45Å; F337-Y438 HydrophobicContact CG-CG 4.13Å; I340-Y438 HydrophobicContact CB-CE2 4.41Å; I340-Y438 HydrophobicContact CG2-CD2 3.9Å; I340-Y438 HydrophobicContact CG2-CE2 3.65Å; M433-Y438 VanDerWaalsContact O-CB 3.29Å; M433-Y438 WeakPolarHBondContact O-CB 3.48Å; M433-Y438 PolarHBondContact O-N 2.87Å; D436-Y438 PolarHBondContact O-N 3.18Å; Y438-R440 VanDerWaalsContact C-N 3.27Å; Y438-R440 PolarHBondContact O-N 3.36Å; Y438-F441 WeakPolarHBondContact O-CB 3.41Å; Y438-F441 PolarHBondContact O-N 2.82Å; Y438-L442 HydrophobicContact CD1-CD1 4.49Å; Y438-L442 HydrophobicContact CD2-CG 4.38Å; Y438-L442 HydrophobicContact CE1-CD1 3.8Å; Y438-L442 HydrophobicContact CE1-CG 4.4Å; Y438-L442 HydrophobicContact CE2-CD1 4.13Å; Y438-L442 HydrophobicContact CE2-CD2 3.9Å; Y438-L442 HydrophobicContact CE2-CG 3.95Å; Y438-L442 WeakPolarHBondContact O-CG 3.37Å; Y438-L442 PolarHBondContact O-N 3Å
439	A	96.3	Very high	95.5	Very high	22 Å²	22	47.7 Å²	47.7	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-30.1	176.8	0	0	0	0	0	112.3	D436 R443	D436-A439 WeakPolarHBondContact O-CB 3.35Å; D436-A439 PolarHBondContact O-N 2.96Å; A439-R443 PolarHBondContact O-NE 3.46Å
440	R	97.1	Very high	95.3	Very high	79 Å²	79	49.8 Å²	49.8	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-73.5	-43.9	171	-69.9	-168.3	-80.4	132.1	-0.2	111.6	F353 E357 D436 S437 Y438 L442 R443 S444	F353-R440 HydrophobicContact CE1-CB 4.41Å; F353-R440 HydrophobicContact CZ-CB 4.01Å; E357-R440 IonicContact OE1-NH1 2.63Å; E357-R440 PolarHBondContact OE1-NH1 3.39Å; E357-R440 IonicContact OE2-CZ 3.87Å; E357-R440 IonicContact OE2-NH1 2.63Å; E357-R440 PolarHBondContact OE2-NH1 3.46Å; E357-R440 IonicContact OE2-NH2 2.96Å; D436-R440 PolarHBondContact O-N 2.87Å; D436-R440 IonicContact OD1-CZ 3.04Å; D436-R440 IonicContact OD1-NE 3.44Å; D436-R440 PolarHBondContact OD1-NE 2.94Å; D436-R440 IonicContact OD1-NH2 3.98Å; D436-R440 IonicContact OD2-CZ 2.74Å; D436-R440 IonicContact OD2-NE 2.84Å; D436-R440 PolarHBondContact OD2-NE 3.44Å; D436-R440 IonicContact OD2-NH2 2.74Å; D436-R440 PolarHBondContact OD2-NH2 3.07Å; S437-R440 PolarHBondContact O-N 3.45Å; Y438-R440 VanDerWaalsContact C-N 3.27Å; Y438-R440 PolarHBondContact O-N 3.36Å; R440-L442 PolarHBondContact O-N 2.77Å; R440-R443 CarbonylContact O-C 3.45Å; R440-R443 WeakPolarHBondContact O-CA 3.48Å; R440-R443 PolarHBondContact O-N 3.3Å; R440-S444 PolarHBondContact O-N 3.18Å
441	F	97.5	Very high	95	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-54	-49.1	175.2	172.9	-103.2	0	0	0	112.3	I340 Q349 F350 F353 S437 Y438 R443 S444 Y447	I340-F441 HydrophobicContact CD1-CD1 3.72Å; I340-F441 HydrophobicContact CD1-CE1 3.22Å; I340-F441 HydrophobicContact CD1-CZ 3.84Å; Q349-F441 HydrophobicContact CB-CZ 4.38Å; F350-F441 HydrophobicContact CD2-CB 3.75Å; F350-F441 HydrophobicContact CD2-CD1 4.12Å; F350-F441 AromaticContact CD2-CD2 3.93Å; F350-F441 HydrophobicContact CD2-CD2 3.93Å; F350-F441 AromaticContact CD2-CG 3.65Å; F350-F441 HydrophobicContact CD2-CG 3.65Å; F350-F441 HydrophobicContact CE2-CB 3.75Å; F350-F441 HydrophobicContact CE2-CG 4.18Å; F353-F441 HydrophobicContact CB-CD2 3.67Å; F353-F441 HydrophobicContact CB-CE2 4.14Å; F353-F441 HydrophobicContact CD1-CB 3.76Å; F353-F441 AromaticContact CD1-CD2 3.89Å; F353-F441 HydrophobicContact CD1-CD2 3.89Å; F353-F441 HydrophobicContact CD1-CG 4.31Å; F353-F441 HydrophobicContact CD2-CD2 4.27Å; F353-F441 HydrophobicContact CE1-CB 3.82Å; F353-F441 HydrophobicContact CG-CB 4.31Å; F353-F441 AromaticContact CG-CD2 3.67Å; F353-F441 HydrophobicContact CG-CD2 3.67Å; F353-F441 HydrophobicContact CG-CG 4.48Å; F353-F441 HydrophobicContact CZ-CB 4.41Å; S437-F441 WeakPolarHBondContact O-CB 3.43Å; S437-F441 PolarHBondContact O-N 2.88Å; Y438-F441 WeakPolarHBondContact O-CB 3.41Å; Y438-F441 PolarHBondContact O-N 2.82Å; F441-R443 PolarHBondContact O-N 3.18Å; F441-R443 VanDerWaalsContact O-N 3.11Å; F441-S444 VanDerWaalsContact O-CB 3.3Å; F441-S444 WeakPolarHBondContact O-CB 3.29Å; F441-S444 PolarHBondContact O-N 3.25Å; F441-S444 PolarHBondContact O-OG 2.81Å; F441-Y447 HydrophobicContact CD1-CD2 4.42Å; F441-Y447 AromaticContact CE1-CD2 3.58Å; F441-Y447 HydrophobicContact CE1-CD2 3.58Å; F441-Y447 HydrophobicContact CE1-CE2 4.41Å; F441-Y447 HydrophobicContact CE1-CG 4.05Å; F441-Y447 AromaticContact CZ-CD2 3.94Å; F441-Y447 HydrophobicContact CZ-CD2 3.94Å; F441-Y447 HydrophobicContact CZ-CG 4.37Å; F441-Y447 VanDerWaalsContact O-CB 3.28Å; F441-Y447 WeakPolarHBondContact O-CB 3.25Å
442	L	96.1	Very high	94.5	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.042	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.9	178.8	-66.1	-175.2	0	0	0	114	Y438 R440 Y447 Q448 V474	Y438-L442 HydrophobicContact CD1-CD1 4.49Å; Y438-L442 HydrophobicContact CD2-CG 4.38Å; Y438-L442 HydrophobicContact CE1-CD1 3.8Å; Y438-L442 HydrophobicContact CE1-CG 4.4Å; Y438-L442 HydrophobicContact CE2-CD1 4.13Å; Y438-L442 HydrophobicContact CE2-CD2 3.9Å; Y438-L442 HydrophobicContact CE2-CG 3.95Å; Y438-L442 WeakPolarHBondContact O-CG 3.37Å; Y438-L442 PolarHBondContact O-N 3Å; R440-L442 PolarHBondContact O-N 2.77Å; L442-Y447 HydrophobicContact CB-CD1 4.48Å; L442-Y447 HydrophobicContact CD2-CD1 4.13Å; L442-Y447 HydrophobicContact CD2-CD2 4.22Å; L442-Y447 HydrophobicContact CD2-CE1 3.88Å; L442-Y447 HydrophobicContact CD2-CE2 3.98Å; L442-Y447 HydrophobicContact CD2-CG 4.28Å; L442-Y447 VanDerWaalsContact O-CD1 3.32Å; L442-Y447 WeakPolarHBondContact O-CD1 3.37Å; L442-Q448 PolarHBondContact O-NE2 2.83Å; L442-V474 HydrophobicContact CD1-CG1 4.38Å
443	R	94.9	Very high	93.6	Very high	147 Å²	147	48.5 Å²	48.5	56%	0.555	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-9.6	176.3	-70	-179.8	-71.2	178.9	2.2	113.1	A439 R440 F441 L475	A439-R443 PolarHBondContact O-NE 3.46Å; R440-R443 CarbonylContact O-C 3.45Å; R440-R443 WeakPolarHBondContact O-CA 3.48Å; R440-R443 PolarHBondContact O-N 3.3Å; F441-R443 PolarHBondContact O-N 3.18Å; F441-R443 VanDerWaalsContact O-N 3.11Å; R443-L475 HydrophobicContact CG-CD1 4.04Å; R443-L475 HydrophobicContact CG-CD2 4.18Å
444	S	95.6	Very high	91.8	Very high	18 Å²	18	54.8 Å²	54.8	13%	0.126	29%	0.291	C	S	.	.	S	Bend	trans	-71.5	151.9	-178.6	74.9	0	0	0	0	111.3	R440 F441 A446 Y447 Q448	R440-S444 PolarHBondContact O-N 3.18Å; F441-S444 VanDerWaalsContact O-CB 3.3Å; F441-S444 WeakPolarHBondContact O-CB 3.29Å; F441-S444 PolarHBondContact O-N 3.25Å; F441-S444 PolarHBondContact O-OG 2.81Å; S444-A446 PolarHBondContact O-N 3.08Å; S444-Y447 PolarHBondContact O-N 3.29Å; S444-Y447 PolarHBondContact OG-N 3.34Å; S444-Q448 WeakPolarHBondContact O-CG 3.35Å; S444-Q448 PolarHBondContact O-N 2.94Å; S444-Q448 VanDerWaalsContact O-N 3.14Å
445	N	93.6	Very high	89.7	Confident	125 Å²	125	60.4 Å²	60.4	67%	0.668	32%	0.315	S	S	*	.	H	α-helix	trans	-59.3	-34.4	172.5	-66.4	-19.5	0	0	0	111.1	Y447 Q448 D449	N445-Y447 VanDerWaalsContact C-N 3.32Å; N445-Y447 PolarHBondContact O-N 3.01Å; N445-Q448 PolarHBondContact O-N 3.14Å; N445-D449 VanDerWaalsContact O-CB 3.27Å; N445-D449 WeakPolarHBondContact O-CB 3.47Å; N445-D449 PolarHBondContact O-N 3.48Å
446	A	91.4	Very high	86.6	Confident	49 Å²	49	66.4 Å²	66.4	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-55	-44.1	177.9	0	0	0	0	0	113	S444 L450	S444-A446 PolarHBondContact O-N 3.08Å; A446-L450 WeakPolarHBondContact O-CD1 3.34Å; A446-L450 VanDerWaalsContact O-CG 3.31Å; A446-L450 WeakPolarHBondContact O-CG 3.32Å
447	Y	94.8	Very high	83.7	Confident	5 Å²	5	68.5 Å²	68.5	2%	0.02	35%	0.349	C	S	.	.	H	α-helix	trans	-76.5	-41.5	175.9	176.3	-102.2	0	0	0	112.4	V330 W333 F441 L442 S444 N445 D449 L450 L451	V330-Y447 HydrophobicContact CG1-CD2 4.2Å; V330-Y447 HydrophobicContact CG1-CE2 3.74Å; V330-Y447 PolarHBondContact O-OH 2.63Å; W333-Y447 HydrophobicContact CB-CE2 4.36Å; W333-Y447 HydrophobicContact CE3-CD2 4.49Å; W333-Y447 HydrophobicContact CE3-CE2 4.35Å; F441-Y447 HydrophobicContact CD1-CD2 4.42Å; F441-Y447 AromaticContact CE1-CD2 3.58Å; F441-Y447 HydrophobicContact CE1-CD2 3.58Å; F441-Y447 HydrophobicContact CE1-CE2 4.41Å; F441-Y447 HydrophobicContact CE1-CG 4.05Å; F441-Y447 AromaticContact CZ-CD2 3.94Å; F441-Y447 HydrophobicContact CZ-CD2 3.94Å; F441-Y447 HydrophobicContact CZ-CG 4.37Å; F441-Y447 VanDerWaalsContact O-CB 3.28Å; F441-Y447 WeakPolarHBondContact O-CB 3.25Å; L442-Y447 HydrophobicContact CB-CD1 4.48Å; L442-Y447 HydrophobicContact CD2-CD1 4.13Å; L442-Y447 HydrophobicContact CD2-CD2 4.22Å; L442-Y447 HydrophobicContact CD2-CE1 3.88Å; L442-Y447 HydrophobicContact CD2-CE2 3.98Å; L442-Y447 HydrophobicContact CD2-CG 4.28Å; L442-Y447 VanDerWaalsContact O-CD1 3.32Å; L442-Y447 WeakPolarHBondContact O-CD1 3.37Å; S444-Y447 PolarHBondContact O-N 3.29Å; S444-Y447 PolarHBondContact OG-N 3.34Å; N445-Y447 VanDerWaalsContact C-N 3.32Å; N445-Y447 PolarHBondContact O-N 3.01Å; Y447-D449 VanDerWaalsContact C-N 3.34Å; Y447-D449 PolarHBondContact O-N 2.83Å; Y447-L450 PolarHBondContact O-N 3.08Å; Y447-L451 HydrophobicContact CE1-CD2 4.03Å; Y447-L451 WeakPolarHBondContact O-CB 3.39Å; Y447-L451 PolarHBondContact O-N 3.28Å
448	Q	94.6	Very high	80.8	Confident	37 Å²	37	77 Å²	77	17%	0.173	39%	0.389	C	S	.	.	H	α-helix	trans	-64.9	-37.9	-178.3	-64.8	-61.2	-41.5	0	0	112.1	L442 S444 N445 L451 L452	L442-Q448 PolarHBondContact O-NE2 2.83Å; S444-Q448 WeakPolarHBondContact O-CG 3.35Å; S444-Q448 PolarHBondContact O-N 2.94Å; S444-Q448 VanDerWaalsContact O-N 3.14Å; N445-Q448 PolarHBondContact O-N 3.14Å; Q448-L451 PolarHBondContact O-N 2.94Å; Q448-L452 WeakPolarHBondContact O-CB 3.3Å; Q448-L452 VanDerWaalsContact O-CG 3.23Å; Q448-L452 WeakPolarHBondContact O-CG 3.46Å; Q448-L452 PolarHBondContact O-N 3.37Å
449	D	92.6	Very high	77.9	Confident	103 Å²	103	82.1 Å²	82.1	55%	0.551	42%	0.424	S	S	*	.	H	α-helix	trans	-66.5	-41.4	177.4	-66.5	-22.5	0	0	0	111.1	N445 Y447 L451 L452 A453	N445-D449 VanDerWaalsContact O-CB 3.27Å; N445-D449 WeakPolarHBondContact O-CB 3.47Å; N445-D449 PolarHBondContact O-N 3.48Å; Y447-D449 VanDerWaalsContact C-N 3.34Å; Y447-D449 PolarHBondContact O-N 2.83Å; D449-L451 VanDerWaalsContact C-N 3.33Å; D449-L451 PolarHBondContact O-N 3.5Å; D449-L452 PolarHBondContact O-N 2.66Å; D449-A453 WeakPolarHBondContact O-CB 3.26Å; D449-A453 PolarHBondContact O-N 3.07Å
450	L	92	Very high	75	Confident	44 Å²	44	89.5 Å²	89.5	23%	0.23	46%	0.455	C	S	.	.	H	α-helix	trans	-63.7	-38.4	173.4	-71	172.1	0	0	0	112.2	V330 W333 Q349 A446 Y447 L452	V330-L450 HydrophobicContact CG1-CB 4.05Å; V330-L450 HydrophobicContact CG2-CB 4.45Å; W333-L450 HydrophobicContact CZ3-CD1 4.21Å; Q349-L450 HydrophobicContact CB-CD1 4.33Å; Q349-L450 HydrophobicContact CG-CD1 3.83Å; A446-L450 WeakPolarHBondContact O-CD1 3.34Å; A446-L450 VanDerWaalsContact O-CG 3.31Å; A446-L450 WeakPolarHBondContact O-CG 3.32Å; Y447-L450 PolarHBondContact O-N 3.08Å; L450-L452 VanDerWaalsContact C-N 3.3Å; L450-L452 PolarHBondContact O-N 3.19Å
451	L	90.3	Very high	72.3	Confident	2 Å²	2	95.6 Å²	95.6	1%	0.01	49%	0.487	C	S	.	.	H	α-helix	trans	-70.4	-28.6	177.7	-170.9	63.2	0	0	0	112.2	Q327 V330 K331 Y447 Q448 D449 L467	Q327-L451 HydrophobicContact CG-CD1 4.48Å; Q327-L451 PolarHBondContact NE2-O 3.08Å; V330-L451 HydrophobicContact CG1-CB 4.28Å; V330-L451 HydrophobicContact CG1-CD1 4.24Å; K331-L451 HydrophobicContact CB-CD1 3.92Å; Y447-L451 HydrophobicContact CE1-CD2 4.03Å; Y447-L451 WeakPolarHBondContact O-CB 3.39Å; Y447-L451 PolarHBondContact O-N 3.28Å; Q448-L451 PolarHBondContact O-N 2.94Å; D449-L451 VanDerWaalsContact C-N 3.33Å; D449-L451 PolarHBondContact O-N 3.5Å; L451-L467 HydrophobicContact CD2-CD1 3.81Å; L451-L467 HydrophobicContact CD2-CD2 4.36Å; L451-L467 HydrophobicContact CD2-CG 4.31Å; L451-L467 HydrophobicContact CG-CD1 4.15Å; L451-L467 HydrophobicContact CG-CD2 4.49Å
452	L	86.7	Confident	69.7	Low	100 Å²	100	98.8 Å²	98.8	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-92.5	-12.5	-179.5	-72.4	172.1	0	0	0	114	Q448 D449 L450 K454 L467	Q448-L452 WeakPolarHBondContact O-CB 3.3Å; Q448-L452 VanDerWaalsContact O-CG 3.23Å; Q448-L452 WeakPolarHBondContact O-CG 3.46Å; Q448-L452 PolarHBondContact O-N 3.37Å; D449-L452 PolarHBondContact O-N 2.66Å; L450-L452 VanDerWaalsContact C-N 3.3Å; L450-L452 PolarHBondContact O-N 3.19Å; L452-K454 VanDerWaalsContact C-N 3.27Å; L452-K454 PolarHBondContact O-N 3.23Å; L452-L467 HydrophobicContact CD2-CD2 3.38Å; L452-L467 HydrophobicContact CG-CD2 4.14Å
453	A	75.3	Confident	67.4	Low	66 Å²	66	108.2 Å²	108.2	55%	0.545	56%	0.555	S	S	.	*			trans	-63.9	83	179.1	0	0	0	0	0	111.2	D449	D449-A453 WeakPolarHBondContact O-CB 3.26Å; D449-A453 PolarHBondContact O-N 3.07Å
454	K	57.7	Low	64.9	Low	132 Å²	132	111.8 Å²	111.8	57%	0.574	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-72.1	130.4	164.1	-80.4	-168.9	172.3	-169	0	108.5	L452 K456	L452-K454 VanDerWaalsContact C-N 3.27Å; L452-K454 PolarHBondContact O-N 3.23Å; K454-K456 PolarHBondContact O-N 3.08Å
455	K	52.2	Low	62.2	Low	182 Å²	182	115.4 Å²	115.4	79%	0.791	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-57	121.8	146.2	-78.8	-174	175.9	179.2	0	105.9	P457	K455-P457 WeakPolarHBondContact O-CD 3.47Å
456	K	30.2	Very low	60.1	Low	203 Å²	203	113.5 Å²	113.5	88%	0.883	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-61.2	121	172.5	-81.8	-178.9	174	-179.7	0	108.6	K454	K454-K456 PolarHBondContact O-N 3.08Å
457	P	34.7	Very low	58.2	Low	110 Å²	110	113.2 Å²	113.2	71%	0.714	58%	0.578	S	S	*	*				-108.7	145.8	125.5	33.6	-30.7	0	0	0	108.1	K455	K455-P457 WeakPolarHBondContact O-CD 3.47Å
458	E	35.3	Very low	56	Low	184 Å²	184	119.3 Å²	119.3	86%	0.86	61%	0.606	S	S	*	*	S	Bend	trans	-61	148.9	-179.1	-69.3	179.7	147	0	0	111.9
459	S	36.3	Very low	54	Low	108 Å²	108	124.9 Å²	124.9	76%	0.755	63%	0.63	S	S	*	*			trans	81.1	110	176.9	77.2	0	0	0	0	118.2
460	E	35.7	Very low	52.4	Low	177 Å²	177	122.1 Å²	122.1	83%	0.827	61%	0.613	S	S	*	*				158.5	113	115.3	-85.3	-166.3	160.6	0	0	110.7
461	Q	39.9	Very low	50.7	Low	207 Å²	207	121.4 Å²	121.4	97%	0.967	61%	0.611	S	S	*	*			trans	-74.8	120.6	170.3	-93.5	137.8	-35	0	0	109.9
462	G	43.8	Very low	49	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	64%	0.644	S	S	*	*			trans	170.9	-18.9	170.2	0	0	0	0	0	118.2
463	R	47.1	Very low	47.5	Very low	207 Å²	207	129.1 Å²	129.1	78%	0.781	64%	0.644	S	S	*	*			trans	-91.2	3.1	-167.6	-74.9	-175.8	179.7	175.8	1.8	117.6	T465 S466	R463-T465 PolarHBondContact O-N 2.73Å; R463-T465 VanDerWaalsContact O-N 3.16Å; R463-S466 PolarHBondContact O-N 2.69Å
464	R	43.2	Very low	46.6	Very low	221 Å²	221	126.9 Å²	126.9	83%	0.834	62%	0.624	S	S	*	*	H	α-helix	trans	-63.4	-24.9	-171.7	-150.1	171.5	-175.4	160.8	1.3	114
465	T	38.6	Very low	46.4	Very low	95 Å²	95	123.1 Å²	123.1	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-86.2	-17.2	-174.9	52.5	0	0	0	0	115.3	R463 K469	R463-T465 PolarHBondContact O-N 2.73Å; R463-T465 VanDerWaalsContact O-N 3.16Å; T465-K469 WeakPolarHBondContact O-CG 3.48Å
466	S	50.2	Low	46.3	Very low	85 Å²	85	120.5 Å²	120.5	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-81.6	-34.4	179.6	-177	0	0	0	0	112.2	R463 K469 F470	R463-S466 PolarHBondContact O-N 2.69Å; S466-K469 WeakPolarHBondContact O-CB 3.3Å; S466-K469 PolarHBondContact O-N 3.03Å; S466-F470 PolarHBondContact O-N 3.02Å
467	L	52.2	Low	47.2	Very low	43 Å²	43	116.9 Å²	116.9	23%	0.225	59%	0.588	C	S	.	*	H	α-helix	trans	-73	-39.8	-176.7	-163.7	67.1	0	0	0	112.9	L451 L452 K469 F470 T471	L451-L467 HydrophobicContact CD2-CD1 3.81Å; L451-L467 HydrophobicContact CD2-CD2 4.36Å; L451-L467 HydrophobicContact CD2-CG 4.31Å; L451-L467 HydrophobicContact CG-CD1 4.15Å; L451-L467 HydrophobicContact CG-CD2 4.49Å; L452-L467 HydrophobicContact CD2-CD2 3.38Å; L452-L467 HydrophobicContact CG-CD2 4.14Å; L467-K469 VanDerWaalsContact C-N 3.25Å; L467-K469 PolarHBondContact O-N 2.87Å; L467-F470 PolarHBondContact O-N 2.93Å; L467-T471 PolarHBondContact O-N 3.11Å; L467-T471 PolarHBondContact O-OG1 3.44Å
468	E	47.5	Very low	47.8	Very low	132 Å²	132	114 Å²	114	62%	0.617	57%	0.565	S	S	*	*	H	α-helix	trans	-62.9	-34.2	173.7	-70.7	-178.3	170	0	0	112	R472	E468-R472 VanDerWaalsContact O-CB 3.3Å; E468-R472 WeakPolarHBondContact O-CB 3.38Å; E468-R472 WeakPolarHBondContact O-CG 3.47Å; E468-R472 PolarHBondContact O-N 2.99Å
469	K	52.2	Low	48.1	Very low	154 Å²	154	106.9 Å²	106.9	67%	0.67	54%	0.541	S	S	*	.	H	α-helix	trans	-68.2	-40.7	173.4	-70.7	177.5	-177.7	178.9	0	111.6	T465 S466 L467 S473	T465-K469 WeakPolarHBondContact O-CG 3.48Å; S466-K469 WeakPolarHBondContact O-CB 3.3Å; S466-K469 PolarHBondContact O-N 3.03Å; L467-K469 VanDerWaalsContact C-N 3.25Å; L467-K469 PolarHBondContact O-N 2.87Å; K469-S473 VanDerWaalsContact O-CB 3.29Å; K469-S473 WeakPolarHBondContact O-CB 3.5Å; K469-S473 PolarHBondContact O-N 3.23Å
470	F	58.9	Low	48	Very low	46 Å²	46	109.8 Å²	109.8	20%	0.202	54%	0.535	C	S	.	.	H	α-helix	trans	-63	-51.7	175.9	175.9	-100.7	0	0	0	111.8	K331 F335 S466 L467 R472 S473 V474	K331-F470 HydrophobicContact CD-CZ 4.37Å; K331-F470 HydrophobicContact CG-CE1 3.81Å; K331-F470 HydrophobicContact CG-CE2 4.33Å; K331-F470 HydrophobicContact CG-CZ 3.62Å; F335-F470 HydrophobicContact CD1-CZ 4.12Å; F335-F470 AromaticContact CE1-CE2 3.88Å; F335-F470 HydrophobicContact CE1-CE2 3.88Å; F335-F470 AromaticContact CE1-CZ 3.68Å; F335-F470 HydrophobicContact CE1-CZ 3.68Å; S466-F470 PolarHBondContact O-N 3.02Å; L467-F470 PolarHBondContact O-N 2.93Å; F470-R472 VanDerWaalsContact C-N 3.32Å; F470-R472 PolarHBondContact O-N 3.48Å; F470-S473 WeakPolarHBondContact O-CB 3.46Å; F470-S473 PolarHBondContact O-N 3.34Å; F470-S473 VanDerWaalsContact O-N 3.09Å; F470-V474 HydrophobicContact CD2-CG2 4.43Å; F470-V474 HydrophobicContact CE1-CG2 4.17Å; F470-V474 HydrophobicContact CE2-CG2 4Å; F470-V474 HydrophobicContact CZ-CG2 3.86Å; F470-V474 WeakPolarHBondContact O-CG2 3.43Å; F470-V474 PolarHBondContact O-N 3.29Å
471	T	56.5	Low	48	Very low	29 Å²	29	105 Å²	105	18%	0.178	52%	0.515	C	S	.	.	H	α-helix	trans	-61	-40.8	178.1	-52.9	0	0	0	0	111	L467 L475	L467-T471 PolarHBondContact O-N 3.11Å; L467-T471 PolarHBondContact O-OG1 3.44Å; T471-L475 HydrophobicContact CG2-CD1 3.94Å; T471-L475 WeakPolarHBondContact O-CB 3.42Å; T471-L475 WeakPolarHBondContact O-CD1 3.1Å; T471-L475 WeakPolarHBondContact O-CG 3.17Å; T471-L475 PolarHBondContact O-N 3.21Å; T471-L475 VanDerWaalsContact O-N 3.08Å
472	R	55.3	Low	47.9	Very low	189 Å²	189	98.7 Å²	98.7	71%	0.713	49%	0.493	S	S	*	.	H	α-helix	trans	-64.3	-39.6	172.6	-82.7	-177	174.9	-170.3	0.9	113.3	E468 F470 L475 L476	E468-R472 VanDerWaalsContact O-CB 3.3Å; E468-R472 WeakPolarHBondContact O-CB 3.38Å; E468-R472 WeakPolarHBondContact O-CG 3.47Å; E468-R472 PolarHBondContact O-N 2.99Å; F470-R472 VanDerWaalsContact C-N 3.32Å; F470-R472 PolarHBondContact O-N 3.48Å; R472-L475 PolarHBondContact O-N 2.8Å; R472-L476 VanDerWaalsContact O-CB 3.29Å; R472-L476 WeakPolarHBondContact O-CB 3.34Å; R472-L476 WeakPolarHBondContact O-CG 3.21Å; R472-L476 PolarHBondContact O-N 3.41Å
473	S	54.4	Low	47.4	Very low	75 Å²	75	103.1 Å²	103.1	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-64.7	-47.8	179.7	-175.2	0	0	0	0	111.9	K469 F470 L475 L476 F477	K469-S473 VanDerWaalsContact O-CB 3.29Å; K469-S473 WeakPolarHBondContact O-CB 3.5Å; K469-S473 PolarHBondContact O-N 3.23Å; F470-S473 WeakPolarHBondContact O-CB 3.46Å; F470-S473 PolarHBondContact O-N 3.34Å; F470-S473 VanDerWaalsContact O-N 3.09Å; S473-L475 VanDerWaalsContact C-N 3.34Å; S473-L475 PolarHBondContact O-N 3.12Å; S473-L476 PolarHBondContact O-N 3.18Å; S473-F477 PolarHBondContact O-N 3.32Å
474	V	57.3	Low	47.2	Very low	19 Å²	19	98.2 Å²	98.2	12%	0.115	48%	0.478	C	S	.	.	H	α-helix	trans	-60	-44.6	175.6	174	0	0	0	0	110.9	G334 L442 F470 F477 Q478	G334-V474 VanDerWaalsContact O-CG1 3.23Å; G334-V474 WeakPolarHBondContact O-CG1 3.45Å; L442-V474 HydrophobicContact CD1-CG1 4.38Å; F470-V474 HydrophobicContact CD2-CG2 4.43Å; F470-V474 HydrophobicContact CE1-CG2 4.17Å; F470-V474 HydrophobicContact CE2-CG2 4Å; F470-V474 HydrophobicContact CZ-CG2 3.86Å; F470-V474 WeakPolarHBondContact O-CG2 3.43Å; F470-V474 PolarHBondContact O-N 3.29Å; V474-F477 PolarHBondContact O-N 3.25Å; V474-Q478 VanDerWaalsContact O-CG 3.31Å; V474-Q478 WeakPolarHBondContact O-CG 3.38Å; V474-Q478 PolarHBondContact O-N 3.09Å
475	L	53.4	Low	47.2	Very low	53 Å²	53	95 Å²	95	28%	0.277	47%	0.47	S	S	.	.	H	α-helix	trans	-68.7	-36.4	178.5	-69.9	172	0	0	0	113	R443 T471 R472 S473 G479	R443-L475 HydrophobicContact CG-CD1 4.04Å; R443-L475 HydrophobicContact CG-CD2 4.18Å; T471-L475 HydrophobicContact CG2-CD1 3.94Å; T471-L475 WeakPolarHBondContact O-CB 3.42Å; T471-L475 WeakPolarHBondContact O-CD1 3.1Å; T471-L475 WeakPolarHBondContact O-CG 3.17Å; T471-L475 PolarHBondContact O-N 3.21Å; T471-L475 VanDerWaalsContact O-N 3.08Å; R472-L475 PolarHBondContact O-N 2.8Å; S473-L475 VanDerWaalsContact C-N 3.34Å; S473-L475 PolarHBondContact O-N 3.12Å; L475-G479 PolarHBondContact O-N 3.04Å
476	L	50	Low	47	Very low	127 Å²	127	97.6 Å²	97.6	67%	0.665	47%	0.473	S	S	*	.	H	α-helix	trans	-64.1	-43.2	173.9	-80	167.5	0	0	0	110.6	R472 S473 G479 W480	R472-L476 VanDerWaalsContact O-CB 3.29Å; R472-L476 WeakPolarHBondContact O-CB 3.34Å; R472-L476 WeakPolarHBondContact O-CG 3.21Å; R472-L476 PolarHBondContact O-N 3.41Å; S473-L476 PolarHBondContact O-N 3.18Å; L476-G479 PolarHBondContact O-N 3.31Å; L476-W480 WeakPolarHBondContact O-CB 3.4Å; L476-W480 PolarHBondContact O-N 3.45Å
477	F	48.4	Very low	46.2	Very low	126 Å²	126	100.6 Å²	100.6	55%	0.553	48%	0.476	S	S	*	.	H	α-helix	trans	-63.4	-45	177.8	-165.9	-99.5	0	0	0	112.2	S473 V474 W480 N481	S473-F477 PolarHBondContact O-N 3.32Å; V474-F477 PolarHBondContact O-N 3.25Å; F477-W480 PolarHBondContact O-N 3.24Å; F477-N481 PolarHBondContact O-N 3.05Å
478	Q	47.8	Very low	45.7	Very low	51 Å²	51	106.4 Å²	106.4	24%	0.238	50%	0.499	C	S	.	.	H	α-helix	trans	-64	-44.8	174.7	-68.6	-76.2	-10.5	0	0	111.9	V474 W480 N481 C482	V474-Q478 VanDerWaalsContact O-CG 3.31Å; V474-Q478 WeakPolarHBondContact O-CG 3.38Å; V474-Q478 PolarHBondContact O-N 3.09Å; Q478-W480 PolarHBondContact O-N 3.25Å; Q478-N481 PolarHBondContact O-N 3.33Å; Q478-C482 PolarHBondContact O-N 3.1Å; Q478-C482 VanDerWaalsContact O-N 3.08Å
479	G	40.4	Very low	45.4	Very low	34 Å²	34	108.6 Å²	108.6	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-34.4	178.1	0	0	0	0	0	113.8	L475 L476 C482 K483	L475-G479 PolarHBondContact O-N 3.04Å; L476-G479 PolarHBondContact O-N 3.31Å; G479-C482 PolarHBondContact O-N 2.82Å; G479-K483 PolarHBondContact O-N 3.2Å
480	W	35.1	Very low	44.8	Very low	168 Å²	168	107.8 Å²	107.8	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-41.5	175.4	-135.5	56.1	0	0	0	111.8	L476 F477 Q478 C482 K483 K484	L476-W480 WeakPolarHBondContact O-CB 3.4Å; L476-W480 PolarHBondContact O-N 3.45Å; F477-W480 PolarHBondContact O-N 3.24Å; Q478-W480 PolarHBondContact O-N 3.25Å; W480-C482 VanDerWaalsContact C-N 3.34Å; W480-K483 PolarHBondContact O-N 3.28Å; W480-K484 VanDerWaalsContact CZ3-NZ 3.31Å; W480-K484 PolarHBondContact O-N 3.06Å; W480-K484 VanDerWaalsContact O-N 3.09Å
481	N	35.7	Very low	43.9	Very low	76 Å²	76	113.6 Å²	113.6	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-37.9	174.7	-81.5	-28.6	0	0	0	112.2	F477 Q478 K485	F477-N481 PolarHBondContact O-N 3.05Å; Q478-N481 PolarHBondContact O-N 3.33Å; N481-K485 PolarHBondContact O-N 2.88Å
482	C	38.3	Very low	43	Very low	75 Å²	75	115.9 Å²	115.9	51%	0.507	56%	0.555	S	S	.	*	H	α-helix	trans	-68.9	-43	177	-156.5	0	0	0	0	112.6	Q478 G479 W480 K484 K485 K486	Q478-C482 PolarHBondContact O-N 3.1Å; Q478-C482 VanDerWaalsContact O-N 3.08Å; G479-C482 PolarHBondContact O-N 2.82Å; W480-C482 VanDerWaalsContact C-N 3.34Å; C482-K484 PolarHBondContact O-N 2.86Å; C482-K485 PolarHBondContact O-N 3.13Å; C482-K486 PolarHBondContact O-N 3.46Å; C482-K486 VanDerWaalsContact O-N 3.07Å
483	K	32.8	Very low	41.9	Very low	161 Å²	161	110.6 Å²	110.6	70%	0.7	55%	0.552	S	S	*	*	H	α-helix	trans	-64.2	-37.1	176	-76.4	-175.8	179.5	180	0	112.9	G479 W480 K486 K487	G479-K483 PolarHBondContact O-N 3.2Å; W480-K483 PolarHBondContact O-N 3.28Å; K483-K486 PolarHBondContact O-N 2.84Å; K483-K487 PolarHBondContact O-N 2.92Å; K483-K487 VanDerWaalsContact O-N 3.08Å
484	K	42.3	Very low	41.1	Very low	104 Å²	104	113 Å²	113	45%	0.452	57%	0.566	S	S	.	*	H	α-helix	trans	-65	-38	174.3	-79.6	-175	-178.8	170.7	0	112.7	W480 C482 K488	W480-K484 VanDerWaalsContact CZ3-NZ 3.31Å; W480-K484 PolarHBondContact O-N 3.06Å; W480-K484 VanDerWaalsContact O-N 3.09Å; C482-K484 PolarHBondContact O-N 2.86Å; K484-K488 PolarHBondContact O-N 2.9Å
485	K	43.1	Very low	39.9	Very low	153 Å²	153	117.7 Å²	117.7	67%	0.665	60%	0.599	S	S	*	*	H	α-helix	trans	-66.9	-39.7	174.8	-79.4	-174.9	175.7	-178.7	0	112.3	N481 C482 K488 K489	N481-K485 PolarHBondContact O-N 2.88Å; C482-K485 PolarHBondContact O-N 3.13Å; K485-K488 PolarHBondContact O-N 3.01Å; K485-K489 PolarHBondContact O-N 3.14Å; K485-K489 VanDerWaalsContact O-N 3.11Å
486	K	35.6	Very low	39.1	Very low	150 Å²	150	120 Å²	120	65%	0.652	63%	0.626	S	S	*	*	H	α-helix	trans	-64.7	-44.1	177.4	-141.2	177.3	-176	-177.2	0	112	C482 K483 K488 K489 E490	C482-K486 PolarHBondContact O-N 3.46Å; C482-K486 VanDerWaalsContact O-N 3.07Å; K483-K486 PolarHBondContact O-N 2.84Å; K486-K488 VanDerWaalsContact C-N 3.33Å; K486-K488 PolarHBondContact O-N 2.76Å; K486-K489 PolarHBondContact O-N 3.31Å; K486-K489 VanDerWaalsContact O-N 3.14Å; K486-E490 PolarHBondContact O-N 3.26Å
487	K	33.9	Very low	38.3	Very low	147 Å²	147	122.9 Å²	122.9	64%	0.639	64%	0.636	S	S	*	*	H	α-helix	trans	-60.8	-36	173.5	-100.6	-172.4	173.5	-175.8	0	113.8	K483 Q491	K483-K487 PolarHBondContact O-N 2.92Å; K483-K487 VanDerWaalsContact O-N 3.08Å; K487-Q491 WeakPolarHBondContact O-CG 3.34Å; K487-Q491 PolarHBondContact O-N 3.02Å
488	K	41.2	Very low	37.6	Very low	165 Å²	165	120.8 Å²	120.8	72%	0.717	65%	0.65	S	S	*	*	H	α-helix	trans	-70.6	-31.9	174.8	-90.2	-170.5	171.8	-170.5	0	113.1	K484 K485 K486	K484-K488 PolarHBondContact O-N 2.9Å; K485-K488 PolarHBondContact O-N 3.01Å; K486-K488 VanDerWaalsContact C-N 3.33Å; K486-K488 PolarHBondContact O-N 2.76Å
489	K	40.9	Very low	36.8	Very low	178 Å²	178	124.1 Å²	124.1	77%	0.774	68%	0.679	S	S	*	*	H	α-helix	trans	-73	-38.6	175.6	-109.9	-174.7	175.2	-173.5	0	112.2	K485 K486 Q491 A492	K485-K489 PolarHBondContact O-N 3.14Å; K485-K489 VanDerWaalsContact O-N 3.11Å; K486-K489 PolarHBondContact O-N 3.31Å; K486-K489 VanDerWaalsContact O-N 3.14Å; K489-Q491 VanDerWaalsContact C-N 3.33Å; K489-Q491 PolarHBondContact O-N 3.32Å; K489-A492 PolarHBondContact O-N 2.65Å
490	E	39.8	Very low	36.6	Very low	138 Å²	138	132 Å²	132	65%	0.645	71%	0.707	S	S	*	*	H	α-helix	trans	-68.8	-28.4	176.7	-79.7	168.9	171.1	0	0	113.2	K486 A492	K486-E490 PolarHBondContact O-N 3.26Å; E490-A492 VanDerWaalsContact C-N 3.3Å; E490-A492 PolarHBondContact O-N 2.98Å
491	Q	38.8	Very low	36.4	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-4.2	176.1	-74.7	179.2	-8.1	0	0	114.4	K487 K489	K487-Q491 WeakPolarHBondContact O-CG 3.34Å; K487-Q491 PolarHBondContact O-N 3.02Å; K489-Q491 VanDerWaalsContact C-N 3.33Å; K489-Q491 PolarHBondContact O-N 3.32Å
492	A	37.9	Very low	36.3	Very low	78 Å²	78	138.7 Å²	138.7	65%	0.645	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	6.3	-175.8	0	0	0	0	0	114.3	K489 E490	K489-A492 PolarHBondContact O-N 2.65Å; E490-A492 VanDerWaalsContact C-N 3.3Å; E490-A492 PolarHBondContact O-N 2.98Å
493	A	32.6	Very low	36.1	Very low	78 Å²	78	139.5 Å²	139.5	65%	0.645	76%	0.756	S	S	*	*			trans	-88.3	121.7	174	0	0	0	0	0	110.3
494	P	37.5	Very low	36	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	76%	0.764	S	S	*	*			trans	-78.1	129.7	176.2	30.1	-29.9	0	0	0	110.5	A496	P494-A496 PolarHBondContact O-N 3.24Å
495	S	32.8	Very low	36.3	Very low	116 Å²	116	144.8 Å²	144.8	81%	0.811	80%	0.801	S	S	*	*			trans	-72.4	114.2	170.1	59.3	0	0	0	0	109.5	E497	S495-E497 PolarHBondContact O-N 2.78Å
496	A	37	Very low	36	Very low	103 Å²	103	144.4 Å²	144.4	85%	0.851	81%	0.808	S	S	*	*			trans	-84.5	97.3	168.4	0	0	0	0	0	109.4	P494	P494-A496 PolarHBondContact O-N 3.24Å
497	E	32.2	Very low	36	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	82%	0.816	S	S	*	*			trans	-129.8	120.4	157.3	-82.9	-172	162.8	0	0	108.8	S495	S495-E497 PolarHBondContact O-N 2.78Å
498	G	34.3	Very low	36.1	Very low	81 Å²	81	143.9 Å²	143.9	84%	0.835	83%	0.826	S	S	*	*			trans	-75.6	152.3	-173.4	0	0	0	0	0	113.3
499	S	31.6	Very low	35.8	Very low	122 Å²	122	142.7 Å²	142.7	85%	0.853	83%	0.833	S	S	*	*			trans	-126.3	107.6	166.8	-70	0	0	0	0	109
500	Q	34.7	Very low	35.5	Very low	199 Å²	199	140.5 Å²	140.5	93%	0.93	84%	0.836	S	S	*	*			trans	-69.5	123.6	167.4	-77.6	174.7	-34.4	0	0	109.5
501	L	32.4	Very low	35.2	Very low	176 Å²	176	140.7 Å²	140.7	92%	0.921	85%	0.849	S	S	*	*			trans	-88.6	114.2	167.6	-92.2	146.5	0	0	0	109.4
502	K	31.7	Very low	34.9	Very low	208 Å²	208	138.8 Å²	138.8	90%	0.904	85%	0.854	S	S	*	*			trans	-83.7	128.8	163.8	-88.3	-178.9	174.3	179	0	109
503	A	34.9	Very low	34.7	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	87%	0.87	S	S	*	*			trans	-106.2	133.1	165.2	0	0	0	0	0	109.4
504	Q	29.9	Very low	34.9	Very low	186 Å²	186	148.9 Å²	148.9	87%	0.869	89%	0.889	S	S	*	*			trans	164.4	161.1	143.5	-95.9	-173.6	-4.7	0	0	110.5
505	P	49.7	Very low	34.6	Very low	191 Å²	191	151 Å²	151	100%	1.24	90%	0.895	S	S	*	*			cis	-99.7	0	-1.9	6.5	15.2	0	0	0	114.4

Retrieved 505 of 505 residues in 189.2 ms (Link to these results)

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