A0A087YNR0_POEFO Loading...

Sestrin 1

AlphaFold DB , UniProt , Accession A0A087YNR0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 488 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	30.7	Very low	250 Å²	250	153.6 Å²	153.6	100%	1.232	83%	0.834	S	S	*	*				0	148.2	0	-96.3	176.6	175.1	0	0	108.4
2	R	37.2	Very low	30.5	Very low	228 Å²	228	154.6 Å²	154.6	86%	0.86	83%	0.829	S	S	*	*			trans	-47	155	-168.1	-66.3	171.9	175.4	176.5	-2.8	115.8
3	H	27.4	Very low	30.4	Very low	179 Å²	179	154.8 Å²	154.8	83%	0.829	83%	0.83	S	S	*	*			trans	157.7	110.1	132.6	-79.5	-62.8	0	0	0	106.2
4	A	29.3	Very low	30.2	Very low	83 Å²	83	153.6 Å²	153.6	69%	0.686	82%	0.824	S	S	*	*				69.8	114	51	0	0	0	0	0	114.2
5	I	29.8	Very low	30.2	Very low	160 Å²	160	150.9 Å²	150.9	82%	0.821	82%	0.821	S	S	*	*			trans	137	106.7	131.6	-67.2	160.6	0	0	0	113.9
6	A	29.3	Very low	30	Very low	87 Å²	87	150.4 Å²	150.4	72%	0.719	82%	0.816	S	S	*	*				48.8	169.9	128.5	0	0	0	0	0	122.7
7	P	35.5	Very low	30	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	80%	0.802	S	S	*	*			cis	-131.9	173	-35.9	26.7	-4.8	0	0	0	114.3
8	S	28.5	Very low	30	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	80%	0.798	S	S	*	*			trans	-1.9	122.5	160.7	57.5	0	0	0	0	120.8
9	E	29.2	Very low	30.3	Very low	194 Å²	194	142.7 Å²	142.7	91%	0.907	79%	0.793	S	S	*	*			trans	-126.5	131.7	145.2	-83.8	-173.8	161.7	0	0	109.9
10	N	29.1	Very low	30.6	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	79%	0.792	S	S	*	*			trans	-65	129.5	176.6	-77.1	-29.5	0	0	0	110.7
11	V	30.6	Very low	30.7	Very low	133 Å²	133	142.4 Å²	142.4	81%	0.806	79%	0.788	S	S	*	*			trans	-118.7	102.4	155.9	-179.4	0	0	0	0	107	N13	V11-N13 PolarHBondContact O-N 3.22Å; V11-N13 VanDerWaalsContact O-N 3.14Å
12	E	27.9	Very low	30.7	Very low	165 Å²	165	139.1 Å²	139.1	77%	0.771	77%	0.767	S	S	*	*			trans	-59	106.4	169.8	-70.1	175.1	154.7	0	0	109.3	N14	E12-N14 PolarHBondContact O-N 2.65Å
13	N	29.4	Very low	30.6	Very low	158 Å²	158	138.5 Å²	138.5	85%	0.845	77%	0.77	S	S	*	*			trans	-81.8	100.3	162.7	-110	-7.1	0	0	0	107.4	V11 S15	V11-N13 PolarHBondContact O-N 3.22Å; V11-N13 VanDerWaalsContact O-N 3.14Å; N13-S15 PolarHBondContact O-N 3.16Å
14	N	28.1	Very low	31.4	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	76%	0.757	S	S	*	*			trans	-60.5	93.5	172.1	-87.6	-29	0	0	0	110.7	E12 I16	E12-N14 PolarHBondContact O-N 2.65Å; N14-I16 PolarHBondContact O-N 3.24Å; N14-I16 VanDerWaalsContact O-N 3.12Å
15	S	29	Very low	32.5	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	74%	0.743	S	S	*	*			trans	-71.2	92.8	159	63.4	0	0	0	0	108.6	N13 A17	N13-S15 PolarHBondContact O-N 3.16Å; S15-A17 VanDerWaalsContact C-N 3.29Å; S15-A17 PolarHBondContact O-N 3.08Å; S15-A17 VanDerWaalsContact O-N 3.11Å
16	I	27.9	Very low	33.4	Very low	143 Å²	143	130.5 Å²	130.5	73%	0.733	73%	0.73	S	S	*	*			trans	-79.6	90.5	161.7	-59	177.4	0	0	0	106.4	N14 V18	N14-I16 PolarHBondContact O-N 3.24Å; N14-I16 VanDerWaalsContact O-N 3.12Å; I16-V18 HydrophobicContact CG2-CG2 3.9Å; I16-V18 PolarHBondContact O-N 2.9Å; I16-V18 VanDerWaalsContact O-N 3.1Å
17	A	29.6	Very low	34.2	Very low	71 Å²	71	132 Å²	132	59%	0.587	72%	0.722	S	S	*	*			trans	-65.6	101.1	163.1	0	0	0	0	0	107.8	S15 T19	S15-A17 VanDerWaalsContact C-N 3.29Å; S15-A17 PolarHBondContact O-N 3.08Å; S15-A17 VanDerWaalsContact O-N 3.11Å; A17-T19 PolarHBondContact O-N 3.04Å
18	V	29.3	Very low	34.8	Very low	118 Å²	118	128.1 Å²	128.1	72%	0.715	70%	0.697	S	S	*	*			trans	-81.8	70.4	165	-173.1	0	0	0	0	107.2	I16	I16-V18 HydrophobicContact CG2-CG2 3.9Å; I16-V18 PolarHBondContact O-N 2.9Å; I16-V18 VanDerWaalsContact O-N 3.1Å
19	T	37.2	Very low	35.7	Very low	115 Å²	115	127.7 Å²	127.7	71%	0.706	68%	0.683	S	S	*	*			trans	-96.1	8.2	179	26.7	0	0	0	0	114.3	A17	A17-T19 PolarHBondContact O-N 3.04Å
20	D	35.1	Very low	36.4	Very low	147 Å²	147	127.1 Å²	127.1	79%	0.786	67%	0.672	S	S	*	*	S	Bend	trans	-131.3	66.3	-175.7	-77.3	-46.4	0	0	0	113.4
21	L	33.4	Very low	37.3	Very low	132 Å²	132	125.2 Å²	125.2	69%	0.691	66%	0.662	S	S	*	*	S	Bend	trans	-152.6	16.8	164.9	-111.5	145.6	0	0	0	117.6
22	F	32.6	Very low	38	Very low	181 Å²	181	122.6 Å²	122.6	79%	0.794	65%	0.654	S	S	*	*			trans	-149.5	100.8	169.6	-62	-76.2	0	0	0	111.6	I24	F22-I24 PolarHBondContact O-N 3.16Å
23	K	34.5	Very low	38.7	Very low	215 Å²	215	123 Å²	123	94%	0.935	65%	0.653	S	S	*	*			trans	-83.5	99.1	170	-77	-174.6	178.8	176.9	0	109.6
24	I	44.4	Very low	39.5	Very low	108 Å²	108	123.5 Å²	123.5	55%	0.554	65%	0.648	S	S	*	*			trans	-67.1	130.9	161.5	-62.6	173.7	0	0	0	107.2	F22 C28 E29	F22-I24 PolarHBondContact O-N 3.16Å; I24-C28 HydrophobicContact CG2-CB 3.51Å; I24-E29 HydrophobicContact CB-CG 4.32Å; I24-E29 HydrophobicContact CG2-CG 3.92Å
25	C	52.7	Low	40.5	Very low	56 Å²	56	124.2 Å²	124.2	38%	0.378	65%	0.652	S	S	.	*			trans	-59.5	141.2	174.5	166.6	0	0	0	0	110.3	H27 C28 E29	C25-H27 PolarHBondContact O-N 3.2Å; C25-H27 PolarHBondContact SG-N 3.32Å; C25-H27 VanDerWaalsContact SG-N 3.42Å; C25-C28 WeakPolarHBondContact O-CA 3.37Å; C25-C28 WeakPolarHBondContact O-CB 3.43Å; C25-C28 PolarHBondContact O-N 3.03Å; C25-E29 PolarHBondContact O-N 3.17Å; C25-E29 VanDerWaalsContact O-N 3.11Å
26	T	47.7	Very low	41.8	Very low	90 Å²	90	125.3 Å²	125.3	55%	0.552	65%	0.648	S	S	*	*	H	α-helix	trans	-58.1	-16.5	-179.9	51.5	0	0	0	0	114	R30	T26-R30 WeakPolarHBondContact O-CG 3.35Å; T26-R30 PolarHBondContact O-NE 3.31Å
27	H	47	Very low	43.2	Very low	119 Å²	119	121.6 Å²	121.6	55%	0.551	65%	0.645	S	S	*	*	H	α-helix	trans	-75.8	-41.9	170.6	-170.9	75.3	0	0	0	112.4	C25 R30 L31	C25-H27 PolarHBondContact O-N 3.2Å; C25-H27 PolarHBondContact SG-N 3.32Å; C25-H27 VanDerWaalsContact SG-N 3.42Å; H27-R30 PolarHBondContact O-N 3.35Å; H27-L31 PolarHBondContact O-N 3.15Å; H27-L31 VanDerWaalsContact O-N 3.15Å
28	C	47.8	Very low	44.5	Very low	31 Å²	31	124.2 Å²	124.2	21%	0.209	65%	0.648	C	S	.	*	H	α-helix	trans	-70.7	-35.3	176.9	-64.8	0	0	0	0	112	I24 C25 R30 L31 A32	I24-C28 HydrophobicContact CG2-CB 3.51Å; C25-C28 WeakPolarHBondContact O-CA 3.37Å; C25-C28 WeakPolarHBondContact O-CB 3.43Å; C25-C28 PolarHBondContact O-N 3.03Å; C28-R30 PolarHBondContact O-N 3.04Å; C28-L31 PolarHBondContact O-N 3.32Å; C28-A32 WeakPolarHBondContact O-CB 3.49Å; C28-A32 PolarHBondContact O-N 2.68Å
29	E	48.1	Very low	46.2	Very low	99 Å²	99	128.1 Å²	128.1	46%	0.463	65%	0.65	S	S	.	*	H	α-helix	trans	-61.7	-32	170.5	-83.6	-169.9	145.8	0	0	112.9	I24 C25 K33	I24-E29 HydrophobicContact CB-CG 4.32Å; I24-E29 HydrophobicContact CG2-CG 3.92Å; C25-E29 PolarHBondContact O-N 3.17Å; C25-E29 VanDerWaalsContact O-N 3.11Å; E29-K33 WeakPolarHBondContact O-CG 3.43Å
30	R	43.4	Very low	47.7	Very low	182 Å²	182	128.4 Å²	128.4	69%	0.687	65%	0.646	S	S	*	*	H	α-helix	trans	-76.3	-36	177.3	-79.8	-177.1	-128.5	-175.1	-1.1	112.6	T26 H27 C28 K33	T26-R30 WeakPolarHBondContact O-CG 3.35Å; T26-R30 PolarHBondContact O-NE 3.31Å; H27-R30 PolarHBondContact O-N 3.35Å; C28-R30 PolarHBondContact O-N 3.04Å; R30-K33 PolarHBondContact O-N 2.79Å
31	L	47.2	Very low	49.4	Very low	115 Å²	115	124.3 Å²	124.3	60%	0.602	63%	0.627	S	S	*	*	H	α-helix	trans	-71.2	-37.4	176.5	-74.8	165.9	0	0	0	111.9	H27 C28 K33 K34	H27-L31 PolarHBondContact O-N 3.15Å; H27-L31 VanDerWaalsContact O-N 3.15Å; C28-L31 PolarHBondContact O-N 3.32Å; L31-K33 PolarHBondContact O-N 2.9Å; L31-K34 PolarHBondContact O-N 2.68Å
32	A	45	Very low	51.1	Low	79 Å²	79	122.3 Å²	122.3	65%	0.653	61%	0.61	S	S	*	*	H	α-helix	trans	-65.5	-22	175.4	0	0	0	0	0	113.6	C28	C28-A32 WeakPolarHBondContact O-CB 3.49Å; C28-A32 PolarHBondContact O-N 2.68Å
33	K	43	Very low	53	Low	173 Å²	173	117.8 Å²	117.8	75%	0.752	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-1	179.9	-76.7	179.4	-179.7	176.6	0	114.6	E29 R30 L31	E29-K33 WeakPolarHBondContact O-CG 3.43Å; R30-K33 PolarHBondContact O-N 2.79Å; L31-K33 PolarHBondContact O-N 2.9Å
34	K	46	Very low	54.6	Low	168 Å²	168	112.1 Å²	112.1	73%	0.73	58%	0.578	S	S	*	*			trans	-120.7	73.1	170.2	-76.9	-172.5	176.3	-177.4	0	109.5	L31 L36	L31-K34 PolarHBondContact O-N 2.68Å; K34-L36 PolarHBondContact O-N 3.29Å
35	D	50.7	Low	55.6	Low	154 Å²	154	108.4 Å²	108.4	82%	0.824	57%	0.567	S	S	*	*			trans	-71.6	84.7	170.9	-147.2	-2.9	0	0	0	108.4	G37	D35-G37 PolarHBondContact O-N 2.91Å
36	L	56.3	Low	56.5	Low	136 Å²	136	110.1 Å²	110.1	71%	0.712	58%	0.579	S	S	*	*			trans	-72.3	2	178.1	-78.2	161.5	0	0	0	112.1	K34 I38	K34-L36 PolarHBondContact O-N 3.29Å; L36-I38 HydrophobicContact CB-CD1 4.06Å; L36-I38 HydrophobicContact CB-CG1 4.12Å; L36-I38 PolarHBondContact O-N 3.45Å; L36-I38 VanDerWaalsContact O-N 3.14Å
37	G	55.3	Low	58.2	Low	64 Å²	64	106.7 Å²	106.7	66%	0.66	56%	0.562	S	S	*	*	S	Bend	trans	68.1	4.8	-175	0	0	0	0	0	114.2	D35	D35-G37 PolarHBondContact O-N 2.91Å
38	I	58.4	Low	60.3	Low	127 Å²	127	101.4 Å²	101.4	65%	0.651	54%	0.538	S	S	*	.			trans	-86.6	114.2	-178.6	-58.5	172.4	0	0	0	108.7	L36 I40	L36-I38 HydrophobicContact CB-CD1 4.06Å; L36-I38 HydrophobicContact CB-CG1 4.12Å; L36-I38 PolarHBondContact O-N 3.45Å; L36-I38 VanDerWaalsContact O-N 3.14Å; I38-I40 PolarHBondContact O-N 3.31Å
39	R	64.5	Low	62.4	Low	199 Å²	199	100.1 Å²	100.1	75%	0.751	53%	0.53	S	S	*	.			trans	-77	110.2	173.5	-63.2	-174.1	179.3	-168.6	0.3	109.3	F233	R39-F233 HydrophobicContact CB-CB 4.27Å; R39-F233 HydrophobicContact CB-CD1 3.58Å; R39-F233 HydrophobicContact CB-CE1 4.25Å; R39-F233 HydrophobicContact CB-CG 4.19Å
40	I	69.1	Low	64.5	Low	122 Å²	122	101 Å²	101	63%	0.626	53%	0.529	S	S	*	.			trans	-81.7	122.9	175.7	-60.9	173	0	0	0	108.6	I38	I38-I40 PolarHBondContact O-N 3.31Å
41	P	71.3	Confident	66.9	Low	60 Å²	60	92.7 Å²	92.7	39%	0.39	50%	0.498	S	S	.	.			trans	-66.2	133.9	174.6	26.6	-30.8	0	0	0	109.9	H231 F233	P41-H231 HydrophobicContact CB-CB 3.99Å; P41-F233 HydrophobicContact CB-CD1 4.29Å; P41-F233 HydrophobicContact CB-CE1 3.66Å; P41-F233 HydrophobicContact CB-CZ 4.06Å; P41-F233 HydrophobicContact CG-CE1 4.21Å
42	R	69.1	Low	69.2	Low	91 Å²	91	87.4 Å²	87.4	34%	0.343	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.9	179.2	-59.9	177.5	-176.9	-133.5	2	109.9	L44 H231 T232 P236	R42-L44 PolarHBondContact O-N 2.98Å; R42-H231 CarbonylContact O-C 3.42Å; R42-H231 WeakPolarHBondContact O-CA 3.46Å; R42-H231 WeakPolarHBondContact O-CB 3.24Å; R42-T232 HydrophobicContact CB-CG2 4.22Å; R42-T232 WeakPolarHBondContact CB-O 3.4Å; R42-T232 PolarHBondContact N-O 3.29Å; R42-T232 PolarHBondContact O-N 3.48Å; R42-P236 VanDerWaalsContact NH1-CG 3.3Å
43	P	71.2	Confident	71.4	Confident	85 Å²	85	86.6 Å²	86.6	55%	0.552	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	138	175.2	-21.7	30.8	0	0	0	111.6	I225 G230	P43-I225 HydrophobicContact CG-CD1 3.86Å; P43-I225 HydrophobicContact CG-CG1 4.45Å; P43-G230 WeakPolarHBondContact CA-O 3.45Å
44	L	67.4	Low	73.5	Confident	96 Å²	96	82.1 Å²	82.1	50%	0.503	44%	0.44	S	S	.	.	S	Bend	trans	-82.2	-17	175.2	-85.8	169	0	0	0	113.3	R42 G229 G230 H231 T232	R42-L44 PolarHBondContact O-N 2.98Å; L44-G229 WeakPolarHBondContact CD1-O 3.28Å; L44-G230 PolarHBondContact N-O 2.66Å; L44-H231 VanDerWaalsContact CD1-O 3.29Å; L44-H231 WeakPolarHBondContact CD1-O 3.11Å; L44-T232 HydrophobicContact CD2-CG2 3.8Å; L44-T232 HydrophobicContact CG-CG2 4.26Å
45	G	66.3	Low	75.4	Confident	31 Å²	31	81 Å²	81	32%	0.32	44%	0.435	S	S	.	.	S	Bend	trans	-122.9	160.7	179.2	0	0	0	0	0	113.3	G47	G45-G47 PolarHBondContact O-N 3.33Å
46	S	70.7	Confident	77.1	Confident	91 Å²	91	77 Å²	77	64%	0.636	41%	0.411	S	S	*	.	S	Bend	trans	-90.3	77.4	170	57.2	0	0	0	0	109.7	E54	S46-E54 WeakPolarHBondContact O-CB 3.48Å
47	G	84.6	Confident	78.4	Confident	19 Å²	19	70.7 Å²	70.7	20%	0.196	38%	0.378	C	S	.	.	S	Bend	trans	98.9	-172.6	172.5	0	0	0	0	0	116.9	G45 S49	G45-G47 PolarHBondContact O-N 3.33Å; G47-S49 VanDerWaalsContact C-N 3.32Å; G47-S49 PolarHBondContact O-N 2.99Å
48	P	90.3	Very high	79.3	Confident	7 Å²	7	71.3 Å²	71.3	5%	0.045	37%	0.366	C	S	.	.	S	Bend	trans	-71.2	-16.6	-169.2	-24.6	37.2	0	0	0	116.1	I57 N83 L86 V87 I221 M222	P48-I57 HydrophobicContact CB-CD1 4.18Å; P48-I57 HydrophobicContact CG-CD1 4.29Å; P48-I57 HydrophobicContact CG-CG2 4.02Å; P48-N83 HydrophobicContact CB-CB 3.85Å; P48-N83 WeakPolarHBondContact CB-OD1 3.47Å; P48-L86 HydrophobicContact CB-CB 4.13Å; P48-L86 HydrophobicContact CB-CD1 4.28Å; P48-L86 HydrophobicContact CG-CB 3.97Å; P48-L86 HydrophobicContact CG-CD1 3.6Å; P48-L86 HydrophobicContact CG-CG 4.43Å; P48-V87 HydrophobicContact CB-CG2 4.08Å; P48-I221 WeakPolarHBondContact O-CA 3.27Å; P48-M222 PolarHBondContact O-N 3.48Å
49	S	93.3	Very high	79.9	Confident	4 Å²	4	71.2 Å²	71.2	3%	0.028	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-135.9	143.7	-177.7	172.6	0	0	0	0	111.1	G47 F51 I52 C219 G220	G47-S49 VanDerWaalsContact C-N 3.32Å; G47-S49 PolarHBondContact O-N 2.99Å; S49-F51 PolarHBondContact OG-N 2.75Å; S49-I52 PolarHBondContact OG-N 3.37Å; S49-I52 VanDerWaalsContact OG-N 3.09Å; S49-C219 WeakPolarHBondContact CB-O 3.3Å; S49-C219 PolarHBondContact OG-O 3.38Å; S49-G220 CarbonylContact C-O 3.45Å; S49-G220 WeakPolarHBondContact CA-O 3.45Å
50	R	92.3	Very high	79.9	Confident	118 Å²	118	63 Å²	63	45%	0.445	34%	0.335	S	S	.	.	S	Bend	trans	-83.5	-12.9	169.7	71.6	-158.3	160	162.2	-9	113.6	G220 M222 K445	R50-G220 WeakPolarHBondContact CG-O 3.34Å; R50-G220 PolarHBondContact N-O 3Å; R50-M222 HydrophobicContact CB-CG 4.39Å; R50-M222 HydrophobicContact CB-SD 3.79Å; R50-K445 PolarHBondContact O-NZ 3.36Å
51	F	93.9	Very high	79.2	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.035	32%	0.322	C	S	.	.	S	Bend	trans	-97.6	-35	-178.3	-61.6	-11.4	0	0	0	112	S49 F217 G218 T443 K445 Y448	S49-F51 PolarHBondContact OG-N 2.75Å; F51-F217 WeakPolarHBondContact CE2-O 3.49Å; F51-G218 VanDerWaalsContact CD2-O 3.29Å; F51-G218 WeakPolarHBondContact CD2-O 3.47Å; F51-G218 WeakPolarHBondContact CE2-O 3.2Å; F51-T443 HydrophobicContact CE2-CG2 4.28Å; F51-T443 HydrophobicContact CZ-CG2 4.5Å; F51-K445 HydrophobicContact CD1-CB 3.67Å; F51-K445 HydrophobicContact CD1-CD 4.28Å; F51-K445 HydrophobicContact CD1-CG 3.87Å; F51-K445 VanDerWaalsContact CE1-CA 3.5Å; F51-K445 HydrophobicContact CE1-CB 3.61Å; F51-K445 HydrophobicContact CE1-CG 4.34Å; F51-Y448 HydrophobicContact CB-CD1 3.82Å; F51-Y448 HydrophobicContact CB-CD2 4.48Å; F51-Y448 HydrophobicContact CB-CE1 3.87Å; F51-Y448 HydrophobicContact CB-CG 4.13Å; F51-Y448 HydrophobicContact CD2-CD1 4.35Å; F51-Y448 AromaticContact CD2-CD2 3.85Å; F51-Y448 HydrophobicContact CD2-CD2 3.85Å; F51-Y448 HydrophobicContact CD2-CE2 4.45Å; F51-Y448 AromaticContact CD2-CG 3.79Å; F51-Y448 HydrophobicContact CD2-CG 3.79Å; F51-Y448 HydrophobicContact CG-CD1 4.25Å; F51-Y448 HydrophobicContact CG-CG 4.13Å
52	I	93.7	Very high	78.7	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	34%	0.341	C	S	.	.	S	Bend	trans	-106.3	132	-174	-55.1	168.8	0	0	0	109.5	S49 E54 E56 I57 V87 F90 Y448 H457 V461	S49-I52 PolarHBondContact OG-N 3.37Å; S49-I52 VanDerWaalsContact OG-N 3.09Å; I52-E54 PolarHBondContact O-N 2.92Å; I52-E56 HydrophobicContact CG2-CB 4.34Å; I52-I57 HydrophobicContact CB-CD1 4.07Å; I52-I57 HydrophobicContact CB-CG1 4.34Å; I52-I57 HydrophobicContact CG2-CD1 4.07Å; I52-I57 HydrophobicContact CG2-CG1 3.79Å; I52-V87 HydrophobicContact CD1-CG1 4.14Å; I52-F90 HydrophobicContact CD1-CE2 4.22Å; I52-F90 HydrophobicContact CG2-CE2 4.31Å; I52-F90 HydrophobicContact CG2-CZ 4.19Å; I52-Y448 WeakPolarHBondContact CG1-OH 3.17Å; I52-H457 HydrophobicContact CG1-CB 4.21Å; I52-H457 HydrophobicContact CG2-CB 4.02Å; I52-V461 HydrophobicContact CD1-CG2 3.59Å
53	P	91.6	Very high	78.4	Confident	62 Å²	62	64.8 Å²	64.8	40%	0.403	35%	0.347	S	S	.	.			trans	-58.4	133.1	175.5	-25.6	36.4	0	0	0	112.8	K55 E56 I57	P53-K55 PolarHBondContact O-N 2.8Å; P53-K55 VanDerWaalsContact O-N 3.12Å; P53-E56 HydrophobicContact CB-CG 4.43Å; P53-E56 WeakPolarHBondContact CG-OE1 3.35Å; P53-E56 WeakPolarHBondContact O-CB 3.37Å; P53-E56 PolarHBondContact O-N 2.97Å; P53-I57 PolarHBondContact O-N 3.06Å
54	E	86.9	Confident	78.3	Confident	78 Å²	78	64.6 Å²	64.6	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-52.4	-39.3	-179.1	-173.8	176.3	-174.6	0	0	113.1	S46 I52 E56 I57 L58	S46-E54 WeakPolarHBondContact O-CB 3.48Å; I52-E54 PolarHBondContact O-N 2.92Å; E54-E56 PolarHBondContact O-N 3.35Å; E54-I57 PolarHBondContact O-N 2.99Å; E54-L58 HydrophobicContact CG-CD1 3.72Å; E54-L58 HydrophobicContact CG-CG 4.03Å; E54-L58 WeakPolarHBondContact O-CB 3.2Å; E54-L58 VanDerWaalsContact O-CG 3.32Å; E54-L58 WeakPolarHBondContact O-CG 3.33Å; E54-L58 PolarHBondContact O-N 3.46Å
55	K	86.1	Confident	78.7	Confident	144 Å²	144	64 Å²	64	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-60.4	-32.5	-179.7	-65.6	-176.4	-177.8	179.9	0	112.5	P53 Q59	P53-K55 PolarHBondContact O-N 2.8Å; P53-K55 VanDerWaalsContact O-N 3.12Å; K55-Q59 WeakPolarHBondContact O-CB 3.48Å; K55-Q59 WeakPolarHBondContact O-CG 3.37Å; K55-Q59 PolarHBondContact O-N 2.95Å
56	E	87.3	Confident	79.2	Confident	71 Å²	71	65.9 Å²	65.9	33%	0.332	36%	0.359	S	S	.	.	H	α-helix	trans	-74.9	-42.7	178.7	-68.2	-178.9	-127	0	0	111	I52 P53 E54 L58 Q59 V60 F90 H457	I52-E56 HydrophobicContact CG2-CB 4.34Å; P53-E56 HydrophobicContact CB-CG 4.43Å; P53-E56 WeakPolarHBondContact CG-OE1 3.35Å; P53-E56 WeakPolarHBondContact O-CB 3.37Å; P53-E56 PolarHBondContact O-N 2.97Å; E54-E56 PolarHBondContact O-N 3.35Å; E56-L58 PolarHBondContact O-N 3.01Å; E56-Q59 WeakPolarHBondContact O-CB 3.11Å; E56-Q59 PolarHBondContact O-N 3.29Å; E56-V60 PolarHBondContact O-N 2.88Å; E56-F90 HydrophobicContact CB-CZ 4.44Å; E56-H457 IonicContact OE1-CD2 2.87Å; E56-H457 IonicContact OE2-CD2 2.63Å; E56-H457 PolarHBondContact OE2-CD2 3.33Å; E56-H457 VanDerWaalsContact OE2-CD2 3.27Å; E56-H457 IonicContact OE2-CG 3.64Å
57	I	83.9	Confident	79.7	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-44	175.3	-59.1	165.4	0	0	0	110.4	P48 I52 P53 E54 Q59 V60 S61 L86 V87 F90	P48-I57 HydrophobicContact CB-CD1 4.18Å; P48-I57 HydrophobicContact CG-CD1 4.29Å; P48-I57 HydrophobicContact CG-CG2 4.02Å; I52-I57 HydrophobicContact CB-CD1 4.07Å; I52-I57 HydrophobicContact CB-CG1 4.34Å; I52-I57 HydrophobicContact CG2-CD1 4.07Å; I52-I57 HydrophobicContact CG2-CG1 3.79Å; P53-I57 PolarHBondContact O-N 3.06Å; E54-I57 PolarHBondContact O-N 2.99Å; I57-Q59 VanDerWaalsContact C-N 3.3Å; I57-Q59 PolarHBondContact O-N 3.14Å; I57-V60 WeakPolarHBondContact O-CB 3.44Å; I57-V60 PolarHBondContact O-N 3.19Å; I57-S61 PolarHBondContact O-N 2.99Å; I57-S61 VanDerWaalsContact O-N 3.16Å; I57-L86 HydrophobicContact CG2-CB 4.34Å; I57-V87 HydrophobicContact CD1-CG2 4.15Å; I57-F90 HydrophobicContact CG1-CE2 3.95Å; I57-F90 HydrophobicContact CG1-CZ 4.25Å
58	L	73.3	Confident	79.6	Confident	78 Å²	78	66 Å²	66	41%	0.408	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-29.1	177.6	-69.6	179.1	0	0	0	112.6	E54 E56 V60 S61 K62	E54-L58 HydrophobicContact CG-CD1 3.72Å; E54-L58 HydrophobicContact CG-CG 4.03Å; E54-L58 WeakPolarHBondContact O-CB 3.2Å; E54-L58 VanDerWaalsContact O-CG 3.32Å; E54-L58 WeakPolarHBondContact O-CG 3.33Å; E54-L58 PolarHBondContact O-N 3.46Å; E56-L58 PolarHBondContact O-N 3.01Å; L58-V60 VanDerWaalsContact C-N 3.3Å; L58-S61 WeakPolarHBondContact CA-OG 3.33Å; L58-S61 PolarHBondContact O-N 2.93Å; L58-S61 PolarHBondContact O-OG 3.47Å; L58-K62 WeakPolarHBondContact O-CG 3.5Å; L58-K62 PolarHBondContact O-N 2.88Å
59	Q	71.3	Confident	79.4	Confident	125 Å²	125	67.5 Å²	67.5	58%	0.584	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-36.2	173.3	-84.2	174.2	36.3	0	0	111.6	K55 E56 I57 K62 V63	K55-Q59 WeakPolarHBondContact O-CB 3.48Å; K55-Q59 WeakPolarHBondContact O-CG 3.37Å; K55-Q59 PolarHBondContact O-N 2.95Å; E56-Q59 WeakPolarHBondContact O-CB 3.11Å; E56-Q59 PolarHBondContact O-N 3.29Å; I57-Q59 VanDerWaalsContact C-N 3.3Å; I57-Q59 PolarHBondContact O-N 3.14Å; Q59-K62 WeakPolarHBondContact O-CB 3.3Å; Q59-K62 PolarHBondContact O-N 3.09Å; Q59-K62 VanDerWaalsContact O-N 3.17Å; Q59-V63 WeakPolarHBondContact O-CG2 3.09Å
60	V	63.6	Low	79.1	Confident	26 Å²	26	69 Å²	69	16%	0.158	36%	0.364	C	S	.	.	H	α-helix	trans	-67.5	-36.4	173.2	-177.1	0	0	0	0	111.6	E56 I57 L58 K62 V63 S89 F90	E56-V60 PolarHBondContact O-N 2.88Å; I57-V60 WeakPolarHBondContact O-CB 3.44Å; I57-V60 PolarHBondContact O-N 3.19Å; L58-V60 VanDerWaalsContact C-N 3.3Å; V60-K62 PolarHBondContact O-N 3.38Å; V60-K62 VanDerWaalsContact O-N 3.15Å; V60-V63 WeakPolarHBondContact O-CB 3.29Å; V60-V63 WeakPolarHBondContact O-CG2 3.46Å; V60-V63 PolarHBondContact O-N 2.62Å; V60-V63 VanDerWaalsContact O-N 3.14Å; V60-S89 WeakPolarHBondContact CG1-O 3.19Å; V60-S89 WeakPolarHBondContact CG1-OG 3.29Å; V60-F90 HydrophobicContact CG2-CD1 3.47Å; V60-F90 VanDerWaalsContact CG2-CD1 3.47Å; V60-F90 HydrophobicContact CG2-CE1 3.41Å; V60-F90 VanDerWaalsContact CG2-CE1 3.41Å; V60-F90 HydrophobicContact CG2-CG 4.18Å; V60-F90 HydrophobicContact CG2-CZ 4.06Å
61	S	55.2	Low	78.7	Confident	52 Å²	52	64.7 Å²	64.7	36%	0.364	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.3	173.4	75.4	0	0	0	0	114.2	I57 L58 V63	I57-S61 PolarHBondContact O-N 2.99Å; I57-S61 VanDerWaalsContact O-N 3.16Å; L58-S61 WeakPolarHBondContact CA-OG 3.33Å; L58-S61 PolarHBondContact O-N 2.93Å; L58-S61 PolarHBondContact O-OG 3.47Å; S61-V63 VanDerWaalsContact C-N 3.34Å
62	K	60.3	Low	78.3	Confident	181 Å²	181	69.5 Å²	69.5	79%	0.787	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	12	173.9	-69.9	179.8	179.4	-176.7	0	113.2	L58 Q59 V60	L58-K62 WeakPolarHBondContact O-CG 3.5Å; L58-K62 PolarHBondContact O-N 2.88Å; Q59-K62 WeakPolarHBondContact O-CB 3.3Å; Q59-K62 PolarHBondContact O-N 3.09Å; Q59-K62 VanDerWaalsContact O-N 3.17Å; V60-K62 PolarHBondContact O-N 3.38Å; V60-K62 VanDerWaalsContact O-N 3.15Å
63	V	62.4	Low	77.9	Confident	78 Å²	78	74.9 Å²	74.9	47%	0.473	40%	0.4	S	S	.	.			trans	-116	133.7	-168.4	-164.9	0	0	0	0	112.7	Q59 V60 S61 T67	Q59-V63 WeakPolarHBondContact O-CG2 3.09Å; V60-V63 WeakPolarHBondContact O-CB 3.29Å; V60-V63 WeakPolarHBondContact O-CG2 3.46Å; V60-V63 PolarHBondContact O-N 2.62Å; V60-V63 VanDerWaalsContact O-N 3.14Å; S61-V63 VanDerWaalsContact C-N 3.34Å; V63-T67 WeakPolarHBondContact O-CB 3.48Å
64	D	69.2	Low	77.5	Confident	80 Å²	80	72.2 Å²	72.2	43%	0.428	38%	0.384	S	S	.	.			trans	47.1	144.6	165.2	97.5	66	0	0	0	120.4	S66 T67 Q68	D64-S66 PolarHBondContact O-N 2.83Å; D64-S66 VanDerWaalsContact OD1-CA 3.23Å; D64-S66 WeakPolarHBondContact OD1-CA 3.46Å; D64-S66 WeakPolarHBondContact OD1-CB 3.29Å; D64-S66 PolarHBondContact OD1-N 3.23Å; D64-S66 PolarHBondContact OD1-OG 3.4Å; D64-T67 PolarHBondContact O-N 3.41Å; D64-T67 PolarHBondContact OD1-N 3.45Å; D64-T67 PolarHBondContact OD2-OG1 3.38Å; D64-Q68 PolarHBondContact O-N 3.46Å
65	A	75.8	Confident	77.3	Confident	83 Å²	83	74.4 Å²	74.4	69%	0.686	39%	0.392	S	S	*	.	H	α-helix	trans	-63.4	-24.4	-176.8	0	0	0	0	0	114.2	A69	A65-A69 WeakPolarHBondContact O-CB 3.41Å; A65-A69 PolarHBondContact O-N 3.31Å; A65-A69 VanDerWaalsContact O-N 3.12Å
66	S	78.7	Confident	77.2	Confident	71 Å²	71	70.8 Å²	70.8	50%	0.497	39%	0.389	S	S	.	.	H	α-helix	trans	-77	-40.5	177.9	76.7	0	0	0	0	112.2	D64 Q68 A69 I70	D64-S66 PolarHBondContact O-N 2.83Å; D64-S66 VanDerWaalsContact OD1-CA 3.23Å; D64-S66 WeakPolarHBondContact OD1-CA 3.46Å; D64-S66 WeakPolarHBondContact OD1-CB 3.29Å; D64-S66 PolarHBondContact OD1-N 3.23Å; D64-S66 PolarHBondContact OD1-OG 3.4Å; S66-Q68 VanDerWaalsContact C-N 3.34Å; S66-A69 PolarHBondContact O-N 3.42Å; S66-I70 WeakPolarHBondContact O-CG1 3.48Å; S66-I70 PolarHBondContact O-N 2.96Å; S66-I70 VanDerWaalsContact O-N 3.08Å
67	T	80.5	Confident	76.7	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.012	39%	0.389	C	S	.	.	H	α-helix	trans	-66.7	-39.2	174.6	-57.3	0	0	0	0	110.8	V63 D64 A69 I70 F71 P92	V63-T67 WeakPolarHBondContact O-CB 3.48Å; D64-T67 PolarHBondContact O-N 3.41Å; D64-T67 PolarHBondContact OD1-N 3.45Å; D64-T67 PolarHBondContact OD2-OG1 3.38Å; T67-A69 PolarHBondContact O-N 3.42Å; T67-I70 PolarHBondContact O-N 3.04Å; T67-F71 HydrophobicContact CG2-CD2 4.47Å; T67-F71 HydrophobicContact CG2-CE2 3.95Å; T67-F71 HydrophobicContact CG2-CZ 4.07Å; T67-F71 PolarHBondContact O-N 3.07Å; T67-F71 VanDerWaalsContact O-N 3.13Å; T67-P92 HydrophobicContact CG2-CB 4.35Å; T67-P92 HydrophobicContact CG2-CG 4.13Å; T67-P92 WeakPolarHBondContact OG1-CB 3.49Å; T67-P92 WeakPolarHBondContact OG1-CG 3.23Å
68	Q	82.6	Confident	76.2	Confident	110 Å²	110	70.6 Å²	70.6	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-44.6	172.9	-174.9	178.3	-14.5	0	0	112	D64 S66 I70 F71 E72	D64-Q68 PolarHBondContact O-N 3.46Å; S66-Q68 VanDerWaalsContact C-N 3.34Å; Q68-I70 VanDerWaalsContact C-N 3.31Å; Q68-I70 PolarHBondContact O-N 2.95Å; Q68-F71 PolarHBondContact O-N 3.41Å; Q68-F71 VanDerWaalsContact O-N 3.14Å; Q68-E72 HydrophobicContact CG-CG 4.46Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.45Å; Q68-E72 PolarHBondContact NE2-OE1 3.22Å; Q68-E72 WeakPolarHBondContact O-CG 3.34Å; Q68-E72 PolarHBondContact O-N 2.87Å
69	A	85.9	Confident	76.2	Confident	39 Å²	39	74.2 Å²	74.2	32%	0.322	41%	0.41	S	S	.	.	H	α-helix	trans	-60	-40.7	176.5	0	0	0	0	0	112.1	A65 S66 T67 F71 E72 D73	A65-A69 WeakPolarHBondContact O-CB 3.41Å; A65-A69 PolarHBondContact O-N 3.31Å; A65-A69 VanDerWaalsContact O-N 3.12Å; S66-A69 PolarHBondContact O-N 3.42Å; T67-A69 PolarHBondContact O-N 3.42Å; A69-F71 VanDerWaalsContact C-N 3.32Å; A69-F71 PolarHBondContact O-N 3.27Å; A69-E72 PolarHBondContact O-N 3.36Å; A69-D73 WeakPolarHBondContact O-CB 3.47Å; A69-D73 PolarHBondContact O-N 3.48Å
70	I	85.9	Confident	76.4	Confident	35 Å²	35	71.2 Å²	71.2	18%	0.179	39%	0.394	C	S	.	.	H	α-helix	trans	-59.7	-42.8	175.2	-66.8	167.2	0	0	0	110.9	S66 T67 Q68 A74 P92 L95 L99	S66-I70 WeakPolarHBondContact O-CG1 3.48Å; S66-I70 PolarHBondContact O-N 2.96Å; S66-I70 VanDerWaalsContact O-N 3.08Å; T67-I70 PolarHBondContact O-N 3.04Å; Q68-I70 VanDerWaalsContact C-N 3.31Å; Q68-I70 PolarHBondContact O-N 2.95Å; I70-A74 VanDerWaalsContact O-CB 3.22Å; I70-A74 WeakPolarHBondContact O-CB 3.37Å; I70-A74 PolarHBondContact O-N 3.06Å; I70-P92 HydrophobicContact CD1-CB 4.15Å; I70-P92 WeakPolarHBondContact CD1-O 3.43Å; I70-L95 HydrophobicContact CG2-CD2 3.97Å; I70-L95 HydrophobicContact CG2-CG 4.01Å; I70-L99 HydrophobicContact CG2-CD1 3.75Å
71	F	85.1	Confident	77.3	Confident	28 Å²	28	72.4 Å²	72.4	12%	0.123	40%	0.399	C	S	.	.	H	α-helix	trans	-68.4	-38.8	177.3	-66.8	-29.9	0	0	0	113.1	T67 Q68 A69 A74 F75 L81 S89 L95	T67-F71 HydrophobicContact CG2-CD2 4.47Å; T67-F71 HydrophobicContact CG2-CE2 3.95Å; T67-F71 HydrophobicContact CG2-CZ 4.07Å; T67-F71 PolarHBondContact O-N 3.07Å; T67-F71 VanDerWaalsContact O-N 3.13Å; Q68-F71 PolarHBondContact O-N 3.41Å; Q68-F71 VanDerWaalsContact O-N 3.14Å; A69-F71 VanDerWaalsContact C-N 3.32Å; A69-F71 PolarHBondContact O-N 3.27Å; F71-A74 PolarHBondContact O-N 3.37Å; F71-F75 VanDerWaalsContact O-CB 3.28Å; F71-F75 WeakPolarHBondContact O-CB 3.42Å; F71-F75 PolarHBondContact O-N 2.74Å; F71-L81 HydrophobicContact CB-CD2 4.3Å; F71-L81 HydrophobicContact CD1-CD1 3.61Å; F71-L81 HydrophobicContact CD1-CD2 3.88Å; F71-L81 HydrophobicContact CD1-CG 4.41Å; F71-L81 HydrophobicContact CD2-CD2 4.42Å; F71-L81 HydrophobicContact CE1-CD1 4.1Å; F71-L81 HydrophobicContact CE1-CD2 4.22Å; F71-L81 HydrophobicContact CG-CD1 4.34Å; F71-L81 HydrophobicContact CG-CD2 3.98Å; F71-S89 VanDerWaalsContact CZ-CB 3.44Å; F71-L95 HydrophobicContact CD1-CD2 4.25Å; F71-L95 HydrophobicContact CE1-CD2 3.68Å
72	E	84.9	Confident	78.9	Confident	110 Å²	110	70.1 Å²	70.1	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-62.5	-46	175.7	-72.4	174.7	-172.6	0	0	110.8	Q68 A69 F75 A76	Q68-E72 HydrophobicContact CG-CG 4.46Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.45Å; Q68-E72 PolarHBondContact NE2-OE1 3.22Å; Q68-E72 WeakPolarHBondContact O-CG 3.34Å; Q68-E72 PolarHBondContact O-N 2.87Å; A69-E72 PolarHBondContact O-N 3.36Å; E72-F75 PolarHBondContact O-N 2.95Å; E72-A76 WeakPolarHBondContact O-CB 3.17Å; E72-A76 PolarHBondContact O-N 3.41Å
73	D	85	Confident	80.3	Confident	116 Å²	116	62.5 Å²	62.5	62%	0.62	35%	0.35	S	S	*	.	H	α-helix	trans	-63.6	-44.5	175.4	-73.2	-17	0	0	0	111.5	A69 F75 A76 A77	A69-D73 WeakPolarHBondContact O-CB 3.47Å; A69-D73 PolarHBondContact O-N 3.48Å; D73-F75 VanDerWaalsContact C-N 3.34Å; D73-F75 PolarHBondContact O-N 3.43Å; D73-A76 PolarHBondContact O-N 2.94Å; D73-A77 VanDerWaalsContact O-CB 3.28Å; D73-A77 WeakPolarHBondContact O-CB 3.32Å; D73-A77 PolarHBondContact O-N 2.77Å
74	A	83	Confident	81.9	Confident	6 Å²	6	58.9 Å²	58.9	5%	0.05	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-46.6	176.7	0	0	0	0	0	111.2	I70 F71 A77 L78 L81 L99	I70-A74 VanDerWaalsContact O-CB 3.22Å; I70-A74 WeakPolarHBondContact O-CB 3.37Å; I70-A74 PolarHBondContact O-N 3.06Å; F71-A74 PolarHBondContact O-N 3.37Å; A74-A77 PolarHBondContact O-N 3.08Å; A74-L78 VanDerWaalsContact O-CB 3.29Å; A74-L78 WeakPolarHBondContact O-CB 3.47Å; A74-L78 PolarHBondContact O-N 3.48Å; A74-L81 HydrophobicContact CB-CD1 4.3Å; A74-L99 HydrophobicContact CB-CD1 3.66Å; A74-L99 HydrophobicContact CB-CD2 4.44Å
75	F	84.1	Confident	83	Confident	124 Å²	124	55.1 Å²	55.1	54%	0.544	31%	0.309	S	S	.	.	H	α-helix	trans	-66.7	-39.2	179	-172.8	-94.1	0	0	0	111.6	F71 E72 D73 A77 H79	F71-F75 VanDerWaalsContact O-CB 3.28Å; F71-F75 WeakPolarHBondContact O-CB 3.42Å; F71-F75 PolarHBondContact O-N 2.74Å; E72-F75 PolarHBondContact O-N 2.95Å; D73-F75 VanDerWaalsContact C-N 3.34Å; D73-F75 PolarHBondContact O-N 3.43Å; F75-A77 VanDerWaalsContact C-N 3.34Å; F75-H79 WeakPolarHBondContact O-CA 3.37Å; F75-H79 PolarHBondContact O-N 3.31Å
76	A	83.3	Confident	83.7	Confident	68 Å²	68	53 Å²	53	56%	0.562	29%	0.285	S	S	*	.	H	α-helix	trans	-63.7	-40.2	175.7	0	0	0	0	0	112.1	E72 D73	E72-A76 WeakPolarHBondContact O-CB 3.17Å; E72-A76 PolarHBondContact O-N 3.41Å; D73-A76 PolarHBondContact O-N 2.94Å
77	A	76.2	Confident	84.5	Confident	39 Å²	39	49.6 Å²	49.6	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-84.9	-35.4	-175	0	0	0	0	0	114.3	D73 A74 F75	D73-A77 VanDerWaalsContact O-CB 3.28Å; D73-A77 WeakPolarHBondContact O-CB 3.32Å; D73-A77 PolarHBondContact O-N 2.77Å; A74-A77 PolarHBondContact O-N 3.08Å; F75-A77 VanDerWaalsContact C-N 3.34Å
78	L	73	Confident	85.1	Confident	32 Å²	32	49.5 Å²	49.5	17%	0.168	26%	0.261	C	S	.	.	H	α-helix	trans	-111.4	-5.5	-173.1	-57.1	176.4	0	0	0	113	A74 R80 L99 Q107	A74-L78 VanDerWaalsContact O-CB 3.29Å; A74-L78 WeakPolarHBondContact O-CB 3.47Å; A74-L78 PolarHBondContact O-N 3.48Å; L78-R80 PolarHBondContact O-N 2.85Å; L78-L99 HydrophobicContact CD1-CD2 3.88Å; L78-Q107 HydrophobicContact CD2-CG 4.5Å
79	H	74.5	Confident	85.6	Confident	154 Å²	154	44.3 Å²	44.3	71%	0.713	24%	0.237	S	C	*	.	S	Bend	trans	58.3	9.4	-177.5	-56	-50.6	0	0	0	115.4	F75	F75-H79 WeakPolarHBondContact O-CA 3.37Å; F75-H79 PolarHBondContact O-N 3.31Å
80	R	75	Confident	85.9	Confident	62 Å²	62	43.8 Å²	43.8	23%	0.234	23%	0.227	C	C	.	.			trans	-153.6	153.3	176	67	-179.5	-177.5	-137.3	-12.8	110.2	L78 L136 D140	L78-R80 PolarHBondContact O-N 2.85Å; R80-L136 VanDerWaalsContact NH2-CD1 3.28Å; R80-D140 IonicContact CZ-OD1 3.47Å; R80-D140 IonicContact CZ-OD2 3.65Å; R80-D140 IonicContact NH1-OD1 2.78Å; R80-D140 PolarHBondContact NH1-OD1 2.96Å; R80-D140 IonicContact NH1-OD2 3.66Å; R80-D140 IonicContact NH2-OD1 3.38Å; R80-D140 PolarHBondContact NH2-OD1 3.45Å; R80-D140 IonicContact NH2-OD2 2.78Å; R80-D140 PolarHBondContact NH2-OD2 2.76Å
81	L	82.1	Confident	86.3	Confident	51 Å²	51	42.2 Å²	42.2	27%	0.267	22%	0.219	S	C	.	.			trans	-112.9	108	164.5	-172.5	68.2	0	0	0	106.9	F71 A74 L86	F71-L81 HydrophobicContact CB-CD2 4.3Å; F71-L81 HydrophobicContact CD1-CD1 3.61Å; F71-L81 HydrophobicContact CD1-CD2 3.88Å; F71-L81 HydrophobicContact CD1-CG 4.41Å; F71-L81 HydrophobicContact CD2-CD2 4.42Å; F71-L81 HydrophobicContact CE1-CD1 4.1Å; F71-L81 HydrophobicContact CE1-CD2 4.22Å; F71-L81 HydrophobicContact CG-CD1 4.34Å; F71-L81 HydrophobicContact CG-CD2 3.98Å; A74-L81 HydrophobicContact CB-CD1 4.3Å; L81-L86 HydrophobicContact CD2-CD2 3.58Å; L81-L86 HydrophobicContact CD2-CG 4.34Å; L81-L86 HydrophobicContact CG-CD2 4.11Å; L81-L86 HydrophobicContact CG-CG 4.34Å
82	D	88.4	Confident	86.6	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.222	C	C	.	.			trans	-86.4	163.6	-175.2	62.2	25.1	0	0	0	112.3	I84 S85 L86	D82-I84 PolarHBondContact O-N 3.38Å; D82-S85 WeakPolarHBondContact O-CB 3.39Å; D82-S85 PolarHBondContact O-N 2.86Å; D82-S85 VanDerWaalsContact O-N 3.07Å; D82-S85 VanDerWaalsContact OD1-CB 3.24Å; D82-S85 WeakPolarHBondContact OD1-CB 3.48Å; D82-S85 PolarHBondContact OD1-N 3.41Å; D82-S85 PolarHBondContact OD1-OG 2.98Å; D82-L86 PolarHBondContact O-N 2.84Å
83	N	91.7	Very high	86.9	Confident	20 Å²	20	43.1 Å²	43.1	11%	0.107	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-28.6	-179.1	-74	-29.8	0	0	0	112.6	P48 L86 V87 Y132 I221 M222 E224	P48-N83 HydrophobicContact CB-CB 3.85Å; P48-N83 WeakPolarHBondContact CB-OD1 3.47Å; N83-L86 PolarHBondContact O-N 3.06Å; N83-V87 WeakPolarHBondContact O-CG2 3.31Å; N83-V87 PolarHBondContact O-N 3.17Å; N83-Y132 HydrophobicContact CB-CE2 4.45Å; N83-Y132 PolarHBondContact N-OH 3.26Å; N83-I221 HydrophobicContact CB-CG2 3.77Å; N83-M222 PolarHBondContact ND2-O 2.86Å; N83-E224 VanDerWaalsContact CB-OE1 3.3Å; N83-E224 WeakPolarHBondContact CB-OE1 3.28Å; N83-E224 PolarHBondContact N-OE1 2.63Å; N83-E224 PolarHBondContact ND2-OE1 3.23Å
84	I	94.3	Very high	87.5	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-50.8	171.5	-70.1	-178.2	0	0	0	110	D82 L86 V87 M88 F98 Y132 L133 L212 F215 I221	D82-I84 PolarHBondContact O-N 3.38Å; I84-L86 VanDerWaalsContact C-N 3.29Å; I84-L86 PolarHBondContact O-N 3.34Å; I84-V87 PolarHBondContact O-N 3.21Å; I84-M88 HydrophobicContact CG2-CE 3.73Å; I84-M88 HydrophobicContact CG2-CG 4.28Å; I84-M88 HydrophobicContact CG2-SD 3.91Å; I84-M88 WeakPolarHBondContact O-CB 3.24Å; I84-M88 WeakPolarHBondContact O-CG 3.35Å; I84-M88 PolarHBondContact O-N 3.48Å; I84-F98 HydrophobicContact CG2-CE1 4.41Å; I84-F98 HydrophobicContact CG2-CZ 4.41Å; I84-Y132 HydrophobicContact CD1-CD1 4.04Å; I84-Y132 HydrophobicContact CD1-CE1 3.44Å; I84-Y132 VanDerWaalsContact CD1-CE1 3.44Å; I84-Y132 HydrophobicContact CG1-CD1 4.49Å; I84-Y132 HydrophobicContact CG1-CE1 3.66Å; I84-L133 HydrophobicContact CD1-CD2 3.74Å; I84-L212 HydrophobicContact CD1-CD1 4.1Å; I84-L212 HydrophobicContact CD1-CD2 4.12Å; I84-L212 HydrophobicContact CD1-CG 4.08Å; I84-L212 HydrophobicContact CG2-CD1 4.14Å; I84-F215 HydrophobicContact CG2-CD1 4.33Å; I84-F215 HydrophobicContact CG2-CE1 4.16Å; I84-I221 HydrophobicContact CG1-CG1 4.24Å; I84-I221 HydrophobicContact CG1-CG2 4.11Å
85	S	92.3	Very high	88	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-39.3	179.2	-57.4	0	0	0	0	111.6	D82 M88 S89	D82-S85 WeakPolarHBondContact O-CB 3.39Å; D82-S85 PolarHBondContact O-N 2.86Å; D82-S85 VanDerWaalsContact O-N 3.07Å; D82-S85 VanDerWaalsContact OD1-CB 3.24Å; D82-S85 WeakPolarHBondContact OD1-CB 3.48Å; D82-S85 PolarHBondContact OD1-N 3.41Å; D82-S85 PolarHBondContact OD1-OG 2.98Å; S85-M88 PolarHBondContact O-N 3.38Å; S85-S89 PolarHBondContact O-N 2.95Å
86	L	91.1	Very high	88.4	Confident	38 Å²	38	32.3 Å²	32.3	20%	0.199	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-41.3	175.8	-69.6	175.5	0	0	0	112.4	P48 I57 L81 D82 N83 I84 S89	P48-L86 HydrophobicContact CB-CB 4.13Å; P48-L86 HydrophobicContact CB-CD1 4.28Å; P48-L86 HydrophobicContact CG-CB 3.97Å; P48-L86 HydrophobicContact CG-CD1 3.6Å; P48-L86 HydrophobicContact CG-CG 4.43Å; I57-L86 HydrophobicContact CG2-CB 4.34Å; L81-L86 HydrophobicContact CD2-CD2 3.58Å; L81-L86 HydrophobicContact CD2-CG 4.34Å; L81-L86 HydrophobicContact CG-CD2 4.11Å; L81-L86 HydrophobicContact CG-CG 4.34Å; D82-L86 PolarHBondContact O-N 2.84Å; N83-L86 PolarHBondContact O-N 3.06Å; I84-L86 VanDerWaalsContact C-N 3.29Å; I84-L86 PolarHBondContact O-N 3.34Å; L86-S89 WeakPolarHBondContact O-CB 3.19Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.29Å
87	V	94.7	Very high	88.9	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-75.3	-38.6	176.7	176.5	0	0	0	0	111.5	P48 I52 I57 N83 I84 S89 F90 F215 C219 I221 V461	P48-V87 HydrophobicContact CB-CG2 4.08Å; I52-V87 HydrophobicContact CD1-CG1 4.14Å; I57-V87 HydrophobicContact CD1-CG2 4.15Å; N83-V87 WeakPolarHBondContact O-CG2 3.31Å; N83-V87 PolarHBondContact O-N 3.17Å; I84-V87 PolarHBondContact O-N 3.21Å; V87-S89 PolarHBondContact O-N 3.47Å; V87-S89 VanDerWaalsContact O-N 3.12Å; V87-F90 VanDerWaalsContact O-CD2 3.24Å; V87-F90 WeakPolarHBondContact O-CD2 3.12Å; V87-F90 PolarHBondContact O-N 3.12Å; V87-F215 HydrophobicContact CG1-CZ 4.21Å; V87-C219 HydrophobicContact CG1-CB 4.03Å; V87-I221 HydrophobicContact CB-CD1 3.79Å; V87-I221 HydrophobicContact CG1-CD1 4.23Å; V87-I221 HydrophobicContact CG2-CD1 3.51Å; V87-V461 HydrophobicContact CG1-CG1 4.19Å; V87-V461 HydrophobicContact CG1-CG2 3.82Å
88	M	94.9	Very high	89.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-17.9	174.6	-75.2	-173.2	177.7	0	0	113	I84 S85 F90 H91 Y94 L95 F98 L212 F215 L465 M468	I84-M88 HydrophobicContact CG2-CE 3.73Å; I84-M88 HydrophobicContact CG2-CG 4.28Å; I84-M88 HydrophobicContact CG2-SD 3.91Å; I84-M88 WeakPolarHBondContact O-CB 3.24Å; I84-M88 WeakPolarHBondContact O-CG 3.35Å; I84-M88 PolarHBondContact O-N 3.48Å; S85-M88 PolarHBondContact O-N 3.38Å; M88-F90 PolarHBondContact O-N 2.64Å; M88-F90 VanDerWaalsContact O-N 3.13Å; M88-H91 CarbonylContact O-C 3.57Å; M88-H91 PolarHBondContact O-N 3.3Å; M88-Y94 HydrophobicContact CE-CE1 4.33Å; M88-Y94 HydrophobicContact SD-CE1 4.11Å; M88-L95 HydrophobicContact CB-CB 4.35Å; M88-L95 HydrophobicContact CB-CD1 3.83Å; M88-F98 HydrophobicContact CE-CD1 4.43Å; M88-F98 HydrophobicContact CE-CD2 4.06Å; M88-F98 HydrophobicContact CE-CE1 4.29Å; M88-F98 HydrophobicContact CE-CE2 3.9Å; M88-F98 HydrophobicContact CE-CG 4.33Å; M88-F98 HydrophobicContact CE-CZ 4.03Å; M88-F98 HydrophobicContact SD-CB 4.38Å; M88-F98 HydrophobicContact SD-CD1 3.57Å; M88-F98 VanDerWaalsContact SD-CD1 3.57Å; M88-F98 HydrophobicContact SD-CD2 4.09Å; M88-F98 HydrophobicContact SD-CE1 3.79Å; M88-F98 HydrophobicContact SD-CE2 4.28Å; M88-F98 HydrophobicContact SD-CG 3.74Å; M88-F98 HydrophobicContact SD-CZ 4.14Å; M88-L212 HydrophobicContact CE-CD1 3.85Å; M88-F215 HydrophobicContact CE-CD1 3.74Å; M88-F215 HydrophobicContact CE-CD2 4.32Å; M88-F215 HydrophobicContact CE-CE1 3.69Å; M88-F215 HydrophobicContact CE-CE2 4.29Å; M88-F215 HydrophobicContact CE-CG 4.06Å; M88-F215 HydrophobicContact CE-CZ 3.97Å; M88-F215 HydrophobicContact CG-CE1 3.72Å; M88-F215 HydrophobicContact CG-CE2 4.31Å; M88-F215 HydrophobicContact CG-CZ 3.49Å; M88-F215 VanDerWaalsContact CG-CZ 3.49Å; M88-L465 HydrophobicContact CE-CD2 4.3Å; M88-L465 HydrophobicContact CG-CD2 4.3Å; M88-M468 HydrophobicContact CE-CE 3.86Å; M88-M468 HydrophobicContact CE-SD 4.21Å
89	S	92.3	Very high	90.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.007	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.6	177.7	78.4	0	0	0	0	114.9	V60 F71 S85 L86 V87 H91 P92	V60-S89 WeakPolarHBondContact CG1-O 3.19Å; V60-S89 WeakPolarHBondContact CG1-OG 3.29Å; F71-S89 VanDerWaalsContact CZ-CB 3.44Å; S85-S89 PolarHBondContact O-N 2.95Å; L86-S89 WeakPolarHBondContact O-CB 3.19Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.29Å; V87-S89 PolarHBondContact O-N 3.47Å; V87-S89 VanDerWaalsContact O-N 3.12Å; S89-H91 PolarHBondContact O-N 2.63Å; S89-P92 VanDerWaalsContact O-CD 3.3Å; S89-P92 WeakPolarHBondContact O-CD 3.33Å; S89-P92 WeakPolarHBondContact O-CG 3.28Å
90	F	92.8	Very high	91.7	Very high	27 Å²	27	26.2 Å²	26.2	12%	0.118	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.1	165.9	-80	-74.8	0	0	0	112.1	I52 E56 I57 V60 V87 M88 V461	I52-F90 HydrophobicContact CD1-CE2 4.22Å; I52-F90 HydrophobicContact CG2-CE2 4.31Å; I52-F90 HydrophobicContact CG2-CZ 4.19Å; E56-F90 HydrophobicContact CB-CZ 4.44Å; I57-F90 HydrophobicContact CG1-CE2 3.95Å; I57-F90 HydrophobicContact CG1-CZ 4.25Å; V60-F90 HydrophobicContact CG2-CD1 3.47Å; V60-F90 VanDerWaalsContact CG2-CD1 3.47Å; V60-F90 HydrophobicContact CG2-CE1 3.41Å; V60-F90 VanDerWaalsContact CG2-CE1 3.41Å; V60-F90 HydrophobicContact CG2-CG 4.18Å; V60-F90 HydrophobicContact CG2-CZ 4.06Å; V87-F90 VanDerWaalsContact O-CD2 3.24Å; V87-F90 WeakPolarHBondContact O-CD2 3.12Å; V87-F90 PolarHBondContact O-N 3.12Å; M88-F90 PolarHBondContact O-N 2.64Å; M88-F90 VanDerWaalsContact O-N 3.13Å; F90-V461 HydrophobicContact CB-CG1 4.38Å; F90-V461 HydrophobicContact CD2-CB 4.44Å; F90-V461 HydrophobicContact CD2-CG2 3.96Å; F90-V461 HydrophobicContact CE2-CG2 4.4Å
91	H	94.4	Very high	92.6	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.014	12%	0.115	C	C	.	.	S	Bend	trans	-130.6	77.5	178.8	-53.6	-58.5	0	0	0	111.4	M88 S89 Q93 Y94 L95 L381 Y383 S458 H462 L465	M88-H91 CarbonylContact O-C 3.57Å; M88-H91 PolarHBondContact O-N 3.3Å; S89-H91 PolarHBondContact O-N 2.63Å; H91-Q93 VanDerWaalsContact C-N 3.28Å; H91-Q93 PolarHBondContact O-N 2.82Å; H91-Y94 PolarHBondContact O-N 3.24Å; H91-Y94 VanDerWaalsContact O-N 3.08Å; H91-L95 PolarHBondContact O-N 3.42Å; H91-L381 HydrophobicContact CB-CD2 3.9Å; H91-Y383 AromaticContact CE1-CE2 3.67Å; H91-Y383 AromaticContact ND1-CE2 3.27Å; H91-Y383 VanDerWaalsContact ND1-CE2 3.27Å; H91-Y383 WeakPolarHBondContact ND1-CE2 3.34Å; H91-Y383 AromaticContact ND1-CZ 3.47Å; H91-Y383 PolarHBondContact ND1-OH 2.87Å; H91-S458 PolarHBondContact CE1-O 3.49Å; H91-S458 PolarHBondContact NE2-O 3.12Å; H91-H462 WeakPolarHBondContact NE2-CA 3.42Å; H91-H462 WeakPolarHBondContact NE2-CB 3.4Å; H91-H462 PolarHBondContact NE2-N 3.4Å; H91-L465 HydrophobicContact CB-CD1 3.96Å
92	P	91.6	Very high	93.2	Very high	28 Å²	28	21.4 Å²	21.4	18%	0.182	11%	0.105	C	C	.	.	H	α-helix	trans	-58.6	-35.9	-172.2	-25.7	34.4	0	0	0	114.3	T67 I70 S89 Y94 L95 G96	T67-P92 HydrophobicContact CG2-CB 4.35Å; T67-P92 HydrophobicContact CG2-CG 4.13Å; T67-P92 WeakPolarHBondContact OG1-CB 3.49Å; T67-P92 WeakPolarHBondContact OG1-CG 3.23Å; I70-P92 HydrophobicContact CD1-CB 4.15Å; I70-P92 WeakPolarHBondContact CD1-O 3.43Å; S89-P92 VanDerWaalsContact O-CD 3.3Å; S89-P92 WeakPolarHBondContact O-CD 3.33Å; S89-P92 WeakPolarHBondContact O-CG 3.28Å; P92-Y94 PolarHBondContact O-N 2.71Å; P92-L95 PolarHBondContact O-N 2.88Å; P92-G96 PolarHBondContact O-N 2.93Å
93	Q	91.3	Very high	93.4	Very high	129 Å²	129	24 Å²	24	60%	0.603	12%	0.116	S	C	*	.	H	α-helix	trans	-57.2	-51.4	176.7	-64.3	178.8	18.9	0	0	110.5	H91 G96 S97 M377	H91-Q93 VanDerWaalsContact C-N 3.28Å; H91-Q93 PolarHBondContact O-N 2.82Å; Q93-G96 PolarHBondContact O-N 3.27Å; Q93-S97 PolarHBondContact O-N 3.36Å; Q93-M377 HydrophobicContact CB-SD 4.35Å
94	Y	95.9	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-45.6	176.9	-178.7	-90.7	0	0	0	112	M88 H91 P92 G96 S97 F98 K374 M377 A378 L465 M468 E469	M88-Y94 HydrophobicContact CE-CE1 4.33Å; M88-Y94 HydrophobicContact SD-CE1 4.11Å; H91-Y94 PolarHBondContact O-N 3.24Å; H91-Y94 VanDerWaalsContact O-N 3.08Å; P92-Y94 PolarHBondContact O-N 2.71Å; Y94-G96 VanDerWaalsContact C-N 3.28Å; Y94-G96 PolarHBondContact O-N 3.35Å; Y94-S97 PolarHBondContact O-N 3.4Å; Y94-S97 VanDerWaalsContact O-N 3.13Å; Y94-F98 HydrophobicContact CD1-CB 4.36Å; Y94-F98 HydrophobicContact CE1-CB 3.86Å; Y94-F98 HydrophobicContact CE1-CD2 4.42Å; Y94-F98 HydrophobicContact CE1-CG 4.36Å; Y94-F98 WeakPolarHBondContact O-CB 3.49Å; Y94-F98 PolarHBondContact O-N 2.98Å; Y94-K374 HydrophobicContact CE2-CG 3.9Å; Y94-M377 VanDerWaalsContact CA-SD 3.52Å; Y94-A378 HydrophobicContact CD2-CB 4.07Å; Y94-A378 HydrophobicContact CE2-CB 3.85Å; Y94-L465 HydrophobicContact CD1-CD1 3.62Å; Y94-L465 HydrophobicContact CD1-CD2 3.63Å; Y94-L465 HydrophobicContact CD1-CG 4.19Å; Y94-L465 HydrophobicContact CD2-CD1 4.43Å; Y94-L465 HydrophobicContact CE1-CD1 4.27Å; Y94-L465 HydrophobicContact CE1-CD2 3.47Å; Y94-L465 VanDerWaalsContact CE1-CD2 3.47Å; Y94-L465 HydrophobicContact CE1-CG 4.35Å; Y94-L465 HydrophobicContact CG-CD1 3.74Å; Y94-L465 HydrophobicContact CG-CD2 4.45Å; Y94-M468 HydrophobicContact CE1-CE 4.02Å; Y94-M468 WeakPolarHBondContact OH-CE 3.39Å; Y94-E469 HydrophobicContact CE2-CG 4.12Å; Y94-E469 PolarHBondContact OH-OE1 3.13Å
95	L	94.3	Very high	93.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-54.5	-44.2	178.6	174.5	62.8	0	0	0	111.9	I70 F71 M88 H91 P92 S97 F98 L99	I70-L95 HydrophobicContact CG2-CD2 3.97Å; I70-L95 HydrophobicContact CG2-CG 4.01Å; F71-L95 HydrophobicContact CD1-CD2 4.25Å; F71-L95 HydrophobicContact CE1-CD2 3.68Å; M88-L95 HydrophobicContact CB-CB 4.35Å; M88-L95 HydrophobicContact CB-CD1 3.83Å; H91-L95 PolarHBondContact O-N 3.42Å; P92-L95 PolarHBondContact O-N 2.88Å; L95-S97 PolarHBondContact O-N 2.94Å; L95-F98 HydrophobicContact CD1-CD1 4.47Å; L95-F98 PolarHBondContact O-N 3.28Å; L95-L99 HydrophobicContact CD1-CD1 3.63Å; L95-L99 HydrophobicContact CD1-CD2 4.31Å; L95-L99 HydrophobicContact CD1-CG 3.72Å; L95-L99 HydrophobicContact CD2-CD1 4.44Å; L95-L99 HydrophobicContact CG-CD1 3.78Å; L95-L99 HydrophobicContact CG-CG 4.28Å; L95-L99 WeakPolarHBondContact O-CB 3.39Å; L95-L99 VanDerWaalsContact O-CG 3.31Å; L95-L99 WeakPolarHBondContact O-CG 3.31Å; L95-L99 PolarHBondContact O-N 2.79Å
96	G	92.8	Very high	93.5	Very high	19 Å²	19	24.9 Å²	24.9	20%	0.196	12%	0.118	C	C	.	.	H	α-helix	trans	-60.7	-43.2	178	0	0	0	0	0	113.1	P92 Q93 Y94 R100	P92-G96 PolarHBondContact O-N 2.93Å; Q93-G96 PolarHBondContact O-N 3.27Å; Y94-G96 VanDerWaalsContact C-N 3.28Å; Y94-G96 PolarHBondContact O-N 3.35Å; G96-R100 WeakPolarHBondContact O-CB 3.24Å; G96-R100 PolarHBondContact O-N 2.67Å; G96-R100 VanDerWaalsContact O-N 3.14Å
97	S	94.5	Very high	93.5	Very high	7 Å²	7	26.8 Å²	26.8	5%	0.049	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-42.8	175.9	-176.5	0	0	0	0	112	Q93 Y94 L95 R100 T101 M377	Q93-S97 PolarHBondContact O-N 3.36Å; Y94-S97 PolarHBondContact O-N 3.4Å; Y94-S97 VanDerWaalsContact O-N 3.13Å; L95-S97 PolarHBondContact O-N 2.94Å; S97-R100 PolarHBondContact O-N 3.2Å; S97-T101 WeakPolarHBondContact O-CB 3.44Å; S97-T101 PolarHBondContact O-N 2.97Å; S97-T101 PolarHBondContact O-OG1 3.15Å; S97-M377 VanDerWaalsContact CB-SD 3.54Å
98	F	95.8	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-51.9	176.5	171.7	-97.3	0	0	0	112	I84 M88 Y94 L95 R100 T101 Q102 H208 L212	I84-F98 HydrophobicContact CG2-CE1 4.41Å; I84-F98 HydrophobicContact CG2-CZ 4.41Å; M88-F98 HydrophobicContact CE-CD1 4.43Å; M88-F98 HydrophobicContact CE-CD2 4.06Å; M88-F98 HydrophobicContact CE-CE1 4.29Å; M88-F98 HydrophobicContact CE-CE2 3.9Å; M88-F98 HydrophobicContact CE-CG 4.33Å; M88-F98 HydrophobicContact CE-CZ 4.03Å; M88-F98 HydrophobicContact SD-CB 4.38Å; M88-F98 HydrophobicContact SD-CD1 3.57Å; M88-F98 VanDerWaalsContact SD-CD1 3.57Å; M88-F98 HydrophobicContact SD-CD2 4.09Å; M88-F98 HydrophobicContact SD-CE1 3.79Å; M88-F98 HydrophobicContact SD-CE2 4.28Å; M88-F98 HydrophobicContact SD-CG 3.74Å; M88-F98 HydrophobicContact SD-CZ 4.14Å; Y94-F98 HydrophobicContact CD1-CB 4.36Å; Y94-F98 HydrophobicContact CE1-CB 3.86Å; Y94-F98 HydrophobicContact CE1-CD2 4.42Å; Y94-F98 HydrophobicContact CE1-CG 4.36Å; Y94-F98 WeakPolarHBondContact O-CB 3.49Å; Y94-F98 PolarHBondContact O-N 2.98Å; L95-F98 HydrophobicContact CD1-CD1 4.47Å; L95-F98 PolarHBondContact O-N 3.28Å; F98-R100 PolarHBondContact O-N 2.84Å; F98-T101 PolarHBondContact O-N 3.31Å; F98-Q102 VanDerWaalsContact CZ-OE1 3.22Å; F98-Q102 WeakPolarHBondContact O-CB 3.36Å; F98-Q102 PolarHBondContact O-N 3.47Å; F98-H208 AromaticContact CE2-CE1 3.59Å; F98-H208 AromaticContact CE2-NE2 3.79Å; F98-L212 HydrophobicContact CE2-CD1 3.96Å; F98-L212 HydrophobicContact CZ-CD1 3.95Å; F98-L212 HydrophobicContact CZ-CD2 4.18Å
99	L	93.8	Very high	93.3	Very high	14 Å²	14	38.2 Å²	38.2	7%	0.073	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-40.4	-178.3	-71.1	171.4	0	0	0	112.3	I70 A74 L78 L95 T101 Q102 H103	I70-L99 HydrophobicContact CG2-CD1 3.75Å; A74-L99 HydrophobicContact CB-CD1 3.66Å; A74-L99 HydrophobicContact CB-CD2 4.44Å; L78-L99 HydrophobicContact CD1-CD2 3.88Å; L95-L99 HydrophobicContact CD1-CD1 3.63Å; L95-L99 HydrophobicContact CD1-CD2 4.31Å; L95-L99 HydrophobicContact CD1-CG 3.72Å; L95-L99 HydrophobicContact CD2-CD1 4.44Å; L95-L99 HydrophobicContact CG-CD1 3.78Å; L95-L99 HydrophobicContact CG-CG 4.28Å; L95-L99 WeakPolarHBondContact O-CB 3.39Å; L95-L99 VanDerWaalsContact O-CG 3.31Å; L95-L99 WeakPolarHBondContact O-CG 3.31Å; L95-L99 PolarHBondContact O-N 2.79Å; L99-T101 VanDerWaalsContact C-N 3.34Å; L99-Q102 PolarHBondContact O-N 3.33Å; L99-H103 WeakPolarHBondContact O-CB 3.49Å; L99-H103 PolarHBondContact O-N 2.93Å
100	R	92.3	Very high	93.4	Very high	144 Å²	144	39.8 Å²	39.8	54%	0.543	20%	0.202	S	C	.	.	H	α-helix	trans	-59.7	-46.8	174.9	-174.2	-172.8	-59.1	164.8	1.6	111.2	G96 S97 F98 H103 Y104 M370 E373	G96-R100 WeakPolarHBondContact O-CB 3.24Å; G96-R100 PolarHBondContact O-N 2.67Å; G96-R100 VanDerWaalsContact O-N 3.14Å; S97-R100 PolarHBondContact O-N 3.2Å; F98-R100 PolarHBondContact O-N 2.84Å; R100-H103 PolarHBondContact O-N 2.92Å; R100-Y104 PolarHBondContact O-N 2.75Å; R100-M370 HydrophobicContact CG-CE 4.07Å; R100-E373 IonicContact NH1-OE2 3.98Å
101	T	94.4	Very high	93.5	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-47	177.5	-56.5	0	0	0	0	110.8	S97 F98 L99 H103 Y104 L105 M370	S97-T101 WeakPolarHBondContact O-CB 3.44Å; S97-T101 PolarHBondContact O-N 2.97Å; S97-T101 PolarHBondContact O-OG1 3.15Å; F98-T101 PolarHBondContact O-N 3.31Å; L99-T101 VanDerWaalsContact C-N 3.34Å; T101-H103 PolarHBondContact O-N 3.09Å; T101-Y104 PolarHBondContact O-N 3.39Å; T101-L105 HydrophobicContact CG2-CD1 3.92Å; T101-L105 HydrophobicContact CG2-CG 4.35Å; T101-L105 WeakPolarHBondContact O-CB 3.2Å; T101-L105 VanDerWaalsContact O-CG 3.31Å; T101-L105 WeakPolarHBondContact O-CG 3.32Å; T101-L105 PolarHBondContact O-N 2.8Å; T101-M370 HydrophobicContact CG2-CB 4.35Å
102	Q	93.3	Very high	93.7	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-42.8	-179.9	-170.7	171.4	-79.8	0	0	112	F98 L99 Y104 L105 L106	F98-Q102 VanDerWaalsContact CZ-OE1 3.22Å; F98-Q102 WeakPolarHBondContact O-CB 3.36Å; F98-Q102 PolarHBondContact O-N 3.47Å; L99-Q102 PolarHBondContact O-N 3.33Å; Q102-Y104 PolarHBondContact O-N 3.16Å; Q102-L105 PolarHBondContact O-N 3.11Å; Q102-L106 HydrophobicContact CG-CD1 3.92Å; Q102-L106 WeakPolarHBondContact O-CB 3.45Å; Q102-L106 PolarHBondContact O-N 3.45Å
103	H	92.4	Very high	93.9	Very high	58 Å²	58	42 Å²	42	27%	0.269	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-45.5	175.6	-178.8	73.9	0	0	0	111.5	L99 R100 T101 L106 Q107 M108	L99-H103 WeakPolarHBondContact O-CB 3.49Å; L99-H103 PolarHBondContact O-N 2.93Å; R100-H103 PolarHBondContact O-N 2.92Å; T101-H103 PolarHBondContact O-N 3.09Å; H103-L106 PolarHBondContact O-N 3.48Å; H103-Q107 WeakPolarHBondContact O-CA 3.39Å; H103-Q107 VanDerWaalsContact O-CB 3.32Å; H103-Q107 WeakPolarHBondContact O-CB 3.49Å; H103-Q107 PolarHBondContact O-N 3.28Å; H103-M108 PolarHBondContact O-N 3.33Å
104	Y	93.3	Very high	94.2	Very high	34 Å²	34	38.7 Å²	38.7	13%	0.133	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-48.5	176.6	-168.3	-81.4	0	0	0	111.9	R100 T101 Q102 L106 M108 Y364 P365 D366 V367 M370	R100-Y104 PolarHBondContact O-N 2.75Å; T101-Y104 PolarHBondContact O-N 3.39Å; Q102-Y104 PolarHBondContact O-N 3.16Å; Y104-L106 VanDerWaalsContact C-N 3.3Å; Y104-L106 PolarHBondContact O-N 3.2Å; Y104-M108 HydrophobicContact CD2-CB 4.28Å; Y104-M108 HydrophobicContact CD2-CG 4.19Å; Y104-M108 HydrophobicContact CG-CB 4.44Å; Y104-M108 HydrophobicContact CG-CG 4.49Å; Y104-Y364 AromaticContact CE1-CE2 3.91Å; Y104-Y364 HydrophobicContact CE1-CE2 3.91Å; Y104-Y364 AromaticContact CE1-CZ 3.8Å; Y104-P365 PolarHBondContact OH-O 2.89Å; Y104-D366 HydrophobicContact CE2-CB 3.96Å; Y104-D366 WeakPolarHBondContact OH-CB 3.37Å; Y104-D366 PolarHBondContact OH-OD2 2.85Å; Y104-V367 HydrophobicContact CD1-CG2 3.68Å; Y104-V367 HydrophobicContact CE1-CG2 3.4Å; Y104-M370 WeakPolarHBondContact CB-SD 3.26Å; Y104-M370 HydrophobicContact CD1-SD 4.28Å; Y104-M370 HydrophobicContact CD2-CE 3.5Å; Y104-M370 VanDerWaalsContact CD2-CE 3.5Å; Y104-M370 HydrophobicContact CD2-SD 4.04Å; Y104-M370 HydrophobicContact CE2-CE 4.26Å; Y104-M370 HydrophobicContact CG-CE 3.77Å; Y104-M370 HydrophobicContact CG-SD 3.67Å
105	L	94.9	Very high	94.2	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-36.7	-177.5	-72.2	176.2	0	0	0	112.7	T101 Q102 R117 H201 V204 L205 V367	T101-L105 HydrophobicContact CG2-CD1 3.92Å; T101-L105 HydrophobicContact CG2-CG 4.35Å; T101-L105 WeakPolarHBondContact O-CB 3.2Å; T101-L105 VanDerWaalsContact O-CG 3.31Å; T101-L105 WeakPolarHBondContact O-CG 3.32Å; T101-L105 PolarHBondContact O-N 2.8Å; Q102-L105 PolarHBondContact O-N 3.11Å; L105-R117 VanDerWaalsContact O-CD 3.23Å; L105-R117 WeakPolarHBondContact O-CD 3.42Å; L105-R117 PolarHBondContact O-NH1 3.09Å; L105-H201 PolarHBondContact O-NE2 2.89Å; L105-H201 VanDerWaalsContact O-NE2 3.11Å; L105-V204 HydrophobicContact CD1-CG1 3.89Å; L105-V204 HydrophobicContact CD2-CG1 3.71Å; L105-V204 HydrophobicContact CG-CG1 4.48Å; L105-L205 HydrophobicContact CB-CD2 4.07Å; L105-V367 HydrophobicContact CD2-CG1 4.18Å; L105-V367 HydrophobicContact CD2-CG2 4.2Å
106	L	93.8	Very high	94.4	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-107.4	-23.8	-169.5	-67.8	-179.7	0	0	0	115.8	Q102 H103 Y104 L114 R117 L205 Y209	Q102-L106 HydrophobicContact CG-CD1 3.92Å; Q102-L106 WeakPolarHBondContact O-CB 3.45Å; Q102-L106 PolarHBondContact O-N 3.45Å; H103-L106 PolarHBondContact O-N 3.48Å; Y104-L106 VanDerWaalsContact C-N 3.3Å; Y104-L106 PolarHBondContact O-N 3.2Å; L106-L114 WeakPolarHBondContact O-CD2 3.44Å; L106-R117 HydrophobicContact CD2-CB 4.12Å; L106-L205 HydrophobicContact CD2-CD2 3.84Å; L106-Y209 VanDerWaalsContact CD1-OH 3.29Å; L106-Y209 WeakPolarHBondContact CD1-OH 3.48Å
107	Q	90.9	Very high	94.7	Very high	79 Å²	79	42.7 Å²	42.7	37%	0.369	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-34.8	-172.7	-57.1	-59.6	-30	0	0	113	L78 H103	L78-Q107 HydrophobicContact CD2-CG 4.5Å; H103-Q107 WeakPolarHBondContact O-CA 3.39Å; H103-Q107 VanDerWaalsContact O-CB 3.32Å; H103-Q107 WeakPolarHBondContact O-CB 3.49Å; H103-Q107 PolarHBondContact O-N 3.28Å
108	M	92.4	Very high	94.8	Very high	86 Å²	86	42.4 Å²	42.4	42%	0.424	22%	0.215	S	C	.	.	S	Bend	trans	-74.7	159.8	-177.2	-62.7	-59.7	-64.8	0	0	112.5	H103 Y104 G110 R117	H103-M108 PolarHBondContact O-N 3.33Å; Y104-M108 HydrophobicContact CD2-CB 4.28Å; Y104-M108 HydrophobicContact CD2-CG 4.19Å; Y104-M108 HydrophobicContact CG-CB 4.44Å; Y104-M108 HydrophobicContact CG-CG 4.49Å; M108-G110 PolarHBondContact O-N 3.37Å; M108-R117 VanDerWaalsContact O-CZ 3.23Å; M108-R117 PolarHBondContact O-NH1 3.27Å; M108-R117 PolarHBondContact O-NH2 3.38Å
109	D	92.1	Very high	94.9	Very high	154 Å²	154	42.4 Å²	42.4	82%	0.824	22%	0.215	S	C	*	.			trans	-57.4	137.7	173.4	-72	-30.3	0	0	0	110.8
110	G	94.1	Very high	95.1	Very high	33 Å²	33	41.7 Å²	41.7	34%	0.34	21%	0.211	S	C	.	.			trans	-169.8	174.5	-174.6	0	0	0	0	0	112	M108 L112 R117	M108-G110 PolarHBondContact O-N 3.37Å; G110-L112 PolarHBondContact O-N 2.94Å; G110-L112 VanDerWaalsContact O-N 3.14Å; G110-R117 VanDerWaalsContact N-NH2 3.11Å
111	P	95.9	Very high	95.4	Very high	42 Å²	42	34.9 Å²	34.9	27%	0.273	19%	0.185	S	C	.	.	S	Bend	trans	-56.9	-33.1	-172.1	-28.1	34.8	0	0	0	114.7	A197 E198 H201 Y364	P111-A197 HydrophobicContact CB-CB 4.16Å; P111-A197 HydrophobicContact CG-CB 3.93Å; P111-E198 HydrophobicContact CB-CB 4.47Å; P111-E198 HydrophobicContact CB-CG 3.98Å; P111-H201 HydrophobicContact CB-CB 4.42Å; P111-H201 HydrophobicContact CG-CB 4.32Å; P111-Y364 VanDerWaalsContact CD-CZ 3.47Å; P111-Y364 HydrophobicContact CG-CD2 4.1Å; P111-Y364 HydrophobicContact CG-CE2 4.14Å; P111-Y364 HydrophobicContact CG-CG 4.33Å
112	L	97.2	Very high	95.5	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	19%	0.185	C	C	.	.	S	Bend	trans	-101.7	144	-177.1	-68.6	169.5	0	0	0	112.5	G110 R117 I120 W194 E198 H201 A202 L205	G110-L112 PolarHBondContact O-N 2.94Å; G110-L112 VanDerWaalsContact O-N 3.14Å; L112-R117 HydrophobicContact CB-CG 3.84Å; L112-R117 VanDerWaalsContact O-CZ 3.27Å; L112-R117 PolarHBondContact O-NE 3.38Å; L112-R117 PolarHBondContact O-NH2 3.02Å; L112-I120 HydrophobicContact CD1-CD1 3.71Å; L112-W194 HydrophobicContact CD1-CZ3 4.3Å; L112-W194 HydrophobicContact CD2-CH2 4.27Å; L112-W194 HydrophobicContact CD2-CZ3 3.76Å; L112-E198 HydrophobicContact CD2-CB 3.92Å; L112-E198 HydrophobicContact CD2-CG 3.92Å; L112-E198 HydrophobicContact CG-CB 4.35Å; L112-E198 HydrophobicContact CG-CG 4.42Å; L112-H201 HydrophobicContact CD1-CB 3.94Å; L112-H201 HydrophobicContact CG-CB 4.35Å; L112-A202 HydrophobicContact CD1-CB 4.1Å; L112-L205 HydrophobicContact CD1-CD1 4.46Å
113	P	96.9	Very high	95.6	Very high	60 Å²	60	34.6 Å²	34.6	39%	0.39	18%	0.184	S	C	.	.			trans	-64.1	148.1	168.6	-20.8	32.3	0	0	0	112.6	H115 Y116 R117	P113-H115 VanDerWaalsContact C-N 3.33Å; P113-H115 PolarHBondContact O-N 3.03Å; P113-Y116 HydrophobicContact CB-CD2 4.27Å; P113-Y116 HydrophobicContact CG-CD2 4.22Å; P113-Y116 WeakPolarHBondContact O-CA 2.96Å; P113-Y116 WeakPolarHBondContact O-CB 3.43Å; P113-Y116 PolarHBondContact O-N 3.03Å; P113-R117 WeakPolarHBondContact O-CG 3.48Å; P113-R117 PolarHBondContact O-N 2.7Å; P113-R117 VanDerWaalsContact O-N 3.1Å
114	L	97.3	Very high	95.8	Very high	59 Å²	59	31.8 Å²	31.8	31%	0.309	17%	0.171	S	C	.	.	H	α-helix	trans	-51.8	-45.5	-176.4	-62.2	175.5	0	0	0	113.9	L106 Y116 R117 H118 V144	L106-L114 WeakPolarHBondContact O-CD2 3.44Å; L114-Y116 VanDerWaalsContact C-N 3.31Å; L114-Y116 PolarHBondContact O-N 3.47Å; L114-R117 WeakPolarHBondContact O-CB 3.41Å; L114-R117 PolarHBondContact O-N 2.73Å; L114-R117 VanDerWaalsContact O-N 3.13Å; L114-H118 PolarHBondContact O-CD2 3.05Å; L114-H118 PolarHBondContact O-N 3.23Å; L114-V144 HydrophobicContact CB-CB 4.17Å; L114-V144 HydrophobicContact CB-CG1 4.19Å; L114-V144 HydrophobicContact CB-CG2 4.17Å; L114-V144 HydrophobicContact CD1-CG1 4.23Å
115	H	96.9	Very high	96	Very high	56 Å²	56	30.2 Å²	30.2	26%	0.259	17%	0.165	S	C	.	.	H	α-helix	trans	-66.7	-29.6	179	62.1	-83.1	0	0	0	112.8	P113 Y119 F141 V144 W150	P113-H115 VanDerWaalsContact C-N 3.33Å; P113-H115 PolarHBondContact O-N 3.03Å; H115-Y119 WeakPolarHBondContact O-CB 3.27Å; H115-Y119 PolarHBondContact O-N 2.82Å; H115-Y119 VanDerWaalsContact O-N 3.16Å; H115-F141 HydrophobicContact CB-CD2 4.05Å; H115-F141 HydrophobicContact CB-CE2 3.94Å; H115-F141 WeakPolarHBondContact O-CD2 3.48Å; H115-F141 VanDerWaalsContact O-CE2 3.32Å; H115-F141 WeakPolarHBondContact O-CE2 3.43Å; H115-V144 HydrophobicContact CB-CG2 3.9Å; H115-W150 AromaticContact CD2-CH2 3.6Å; H115-W150 AromaticContact CD2-CZ3 3.87Å
116	Y	98.1	Very high	95.9	Very high	42 Å²	42	30.1 Å²	30.1	17%	0.165	16%	0.164	C	C	.	.	H	α-helix	trans	-67.8	-43.8	171.2	-85.2	-124.6	0	0	0	110.2	P113 L114 Y119 I120 W150 L161	P113-Y116 HydrophobicContact CB-CD2 4.27Å; P113-Y116 HydrophobicContact CG-CD2 4.22Å; P113-Y116 WeakPolarHBondContact O-CA 2.96Å; P113-Y116 WeakPolarHBondContact O-CB 3.43Å; P113-Y116 PolarHBondContact O-N 3.03Å; L114-Y116 VanDerWaalsContact C-N 3.31Å; L114-Y116 PolarHBondContact O-N 3.47Å; Y116-Y119 PolarHBondContact O-N 2.83Å; Y116-I120 WeakPolarHBondContact O-CD1 3.31Å; Y116-I120 WeakPolarHBondContact O-CG1 3.36Å; Y116-I120 PolarHBondContact O-N 3.42Å; Y116-W150 HydrophobicContact CD2-CH2 4.03Å; Y116-W150 HydrophobicContact CD2-CZ3 4.27Å; Y116-W150 AromaticContact CE2-CH2 3.58Å; Y116-W150 HydrophobicContact CE2-CH2 3.58Å; Y116-W150 HydrophobicContact CE2-CZ3 4.25Å; Y116-L161 HydrophobicContact CD1-CD1 3.85Å; Y116-L161 HydrophobicContact CD1-CD2 3.57Å; Y116-L161 HydrophobicContact CD1-CG 3.78Å; Y116-L161 HydrophobicContact CE1-CD1 3.96Å; Y116-L161 HydrophobicContact CE1-CD2 4.02Å; Y116-L161 HydrophobicContact CE1-CG 3.76Å; Y116-L161 HydrophobicContact CG-CD1 4.17Å; Y116-L161 HydrophobicContact CG-CD2 4.36Å
117	R	98.3	Very high	95.8	Very high	6 Å²	6	30.8 Å²	30.8	2%	0.023	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-53.3	-179.5	-56.7	179.6	-162.4	-174	9.1	111.1	L105 L106 M108 G110 L112 P113 L114 Y119 I120 C121 H201 L205	L105-R117 VanDerWaalsContact O-CD 3.23Å; L105-R117 WeakPolarHBondContact O-CD 3.42Å; L105-R117 PolarHBondContact O-NH1 3.09Å; L106-R117 HydrophobicContact CD2-CB 4.12Å; M108-R117 VanDerWaalsContact O-CZ 3.23Å; M108-R117 PolarHBondContact O-NH1 3.27Å; M108-R117 PolarHBondContact O-NH2 3.38Å; G110-R117 VanDerWaalsContact N-NH2 3.11Å; L112-R117 HydrophobicContact CB-CG 3.84Å; L112-R117 VanDerWaalsContact O-CZ 3.27Å; L112-R117 PolarHBondContact O-NE 3.38Å; L112-R117 PolarHBondContact O-NH2 3.02Å; P113-R117 WeakPolarHBondContact O-CG 3.48Å; P113-R117 PolarHBondContact O-N 2.7Å; P113-R117 VanDerWaalsContact O-N 3.1Å; L114-R117 WeakPolarHBondContact O-CB 3.41Å; L114-R117 PolarHBondContact O-N 2.73Å; L114-R117 VanDerWaalsContact O-N 3.13Å; R117-Y119 VanDerWaalsContact C-N 3.31Å; R117-Y119 PolarHBondContact O-N 3.13Å; R117-I120 WeakPolarHBondContact O-CB 3.29Å; R117-I120 PolarHBondContact O-N 3.24Å; R117-I120 VanDerWaalsContact O-N 3.15Å; R117-C121 PolarHBondContact O-N 3Å; R117-C121 PolarHBondContact O-SG 3.49Å; R117-H201 PolarHBondContact NE-CE1 3.47Å; R117-H201 VanDerWaalsContact NE-CE1 3.34Å; R117-L205 HydrophobicContact CB-CD1 3.8Å; R117-L205 HydrophobicContact CG-CD1 4.01Å
118	H	97.6	Very high	95.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-37.3	178.6	-67.9	-56.3	0	0	0	112.7	L114 C121 I122 H137 D140 F141	L114-H118 PolarHBondContact O-CD2 3.05Å; L114-H118 PolarHBondContact O-N 3.23Å; H118-C121 WeakPolarHBondContact O-CB 3.15Å; H118-C121 PolarHBondContact O-N 3.41Å; H118-I122 WeakPolarHBondContact O-CG1 3.42Å; H118-I122 PolarHBondContact O-N 2.83Å; H118-H137 AromaticContact ND1-ND1 3.27Å; H118-H137 PolarHBondContact ND1-ND1 3.44Å; H118-D140 IonicContact CE1-OD2 2.71Å; H118-F141 HydrophobicContact CB-CB 3.87Å; H118-F141 HydrophobicContact CB-CD2 4.45Å
119	Y	97.6	Very high	95.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.9	-38.2	175.3	-164.8	-98	0	0	0	112.7	H115 Y116 R117 C121 I122 M123 F141 W150 G153 L154 A157 L161 F325	H115-Y119 WeakPolarHBondContact O-CB 3.27Å; H115-Y119 PolarHBondContact O-N 2.82Å; H115-Y119 VanDerWaalsContact O-N 3.16Å; Y116-Y119 PolarHBondContact O-N 2.83Å; R117-Y119 VanDerWaalsContact C-N 3.31Å; R117-Y119 PolarHBondContact O-N 3.13Å; Y119-C121 VanDerWaalsContact C-N 3.31Å; Y119-C121 PolarHBondContact O-N 2.62Å; Y119-I122 HydrophobicContact CD2-CD1 4.42Å; Y119-I122 WeakPolarHBondContact O-CB 3.39Å; Y119-I122 PolarHBondContact O-N 2.8Å; Y119-M123 HydrophobicContact CD1-CG 4.05Å; Y119-M123 HydrophobicContact CD1-SD 3.7Å; Y119-M123 HydrophobicContact CE1-CG 3.97Å; Y119-M123 HydrophobicContact CE1-SD 3.71Å; Y119-M123 WeakPolarHBondContact O-CG 3.44Å; Y119-M123 PolarHBondContact O-N 2.88Å; Y119-F141 HydrophobicContact CD2-CE2 4.15Å; Y119-F141 HydrophobicContact CD2-CZ 4.27Å; Y119-F141 HydrophobicContact CG-CE2 4.48Å; Y119-W150 HydrophobicContact CD1-CE3 4.35Å; Y119-W150 HydrophobicContact CD2-CB 4.01Å; Y119-W150 AromaticContact CD2-CE3 3.93Å; Y119-W150 HydrophobicContact CD2-CE3 3.93Å; Y119-W150 HydrophobicContact CE2-CB 3.4Å; Y119-W150 HydrophobicContact CE2-CE3 4.32Å; Y119-W150 HydrophobicContact CE2-CG 4.46Å; Y119-W150 VanDerWaalsContact CE2-O 3.27Å; Y119-W150 WeakPolarHBondContact CE2-O 3.42Å; Y119-W150 AromaticContact CG-CE3 3.92Å; Y119-W150 HydrophobicContact CG-CE3 3.92Å; Y119-W150 HydrophobicContact CG-CZ3 4.49Å; Y119-W150 PolarHBondContact OH-O 2.89Å; Y119-G153 PolarHBondContact OH-O 3.48Å; Y119-L154 HydrophobicContact CE1-CD1 4.26Å; Y119-A157 HydrophobicContact CE1-CB 3.59Å; Y119-A157 WeakPolarHBondContact OH-CB 3.49Å; Y119-L161 HydrophobicContact CD1-CD1 3.65Å; Y119-L161 HydrophobicContact CE1-CD1 4.28Å; Y119-L161 HydrophobicContact CG-CD1 4.29Å; Y119-F325 HydrophobicContact CE1-CE1 4.32Å; Y119-F325 AromaticContact CE2-CE1 3.66Å; Y119-F325 HydrophobicContact CE2-CE1 3.66Å; Y119-F325 AromaticContact CE2-CZ 3.85Å; Y119-F325 HydrophobicContact CE2-CZ 3.85Å; Y119-F325 AromaticContact CZ-CE1 3.5Å; Y119-F325 VanDerWaalsContact CZ-CE1 3.5Å; Y119-F325 VanDerWaalsContact OH-CE1 3.22Å; Y119-F325 WeakPolarHBondContact OH-CE1 3.47Å
120	I	98.3	Very high	95.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-40.9	172.7	-67.9	163.3	0	0	0	110.3	L112 Y116 R117 I122 M123 A124 L161 L164 W194 A202 L205 L206	L112-I120 HydrophobicContact CD1-CD1 3.71Å; Y116-I120 WeakPolarHBondContact O-CD1 3.31Å; Y116-I120 WeakPolarHBondContact O-CG1 3.36Å; Y116-I120 PolarHBondContact O-N 3.42Å; R117-I120 WeakPolarHBondContact O-CB 3.29Å; R117-I120 PolarHBondContact O-N 3.24Å; R117-I120 VanDerWaalsContact O-N 3.15Å; I120-I122 PolarHBondContact O-N 3.05Å; I120-M123 WeakPolarHBondContact O-CB 3.46Å; I120-M123 PolarHBondContact O-N 2.87Å; I120-A124 WeakPolarHBondContact O-CB 3.41Å; I120-A124 PolarHBondContact O-N 3.32Å; I120-L161 HydrophobicContact CD1-CD2 4.09Å; I120-L161 HydrophobicContact CG1-CD2 3.86Å; I120-L164 HydrophobicContact CD1-CD2 4.12Å; I120-L164 HydrophobicContact CG1-CD2 3.87Å; I120-L164 HydrophobicContact CG2-CD2 4.23Å; I120-W194 HydrophobicContact CD1-CH2 4.19Å; I120-A202 HydrophobicContact CD1-CB 4.02Å; I120-L205 HydrophobicContact CG2-CB 3.88Å; I120-L205 HydrophobicContact CG2-CD1 4.44Å; I120-L206 HydrophobicContact CG2-CD2 3.67Å; I120-L206 HydrophobicContact CG2-CG 3.85Å
121	C	98	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-40.4	174.9	-53.9	0	0	0	0	112.4	R117 H118 Y119 A124 A125 H137 Y209	R117-C121 PolarHBondContact O-N 3Å; R117-C121 PolarHBondContact O-SG 3.49Å; H118-C121 WeakPolarHBondContact O-CB 3.15Å; H118-C121 PolarHBondContact O-N 3.41Å; Y119-C121 VanDerWaalsContact C-N 3.31Å; Y119-C121 PolarHBondContact O-N 2.62Å; C121-A124 PolarHBondContact O-N 3.15Å; C121-A125 WeakPolarHBondContact O-CB 3.3Å; C121-A125 PolarHBondContact O-N 3.3Å; C121-H137 HydrophobicContact CB-CB 4.22Å; C121-H137 WeakPolarHBondContact CB-CD2 3.14Å; C121-Y209 HydrophobicContact CB-CD1 4.4Å; C121-Y209 HydrophobicContact CB-CD2 3.66Å; C121-Y209 HydrophobicContact CB-CE2 3.84Å; C121-Y209 HydrophobicContact CB-CG 3.98Å; C121-Y209 WeakPolarHBondContact SG-CD2 3.48Å; C121-Y209 WeakPolarHBondContact SG-CE2 3.43Å
122	I	96.2	Very high	95.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59	-49	172.9	-66.6	166.1	0	0	0	110	H118 Y119 I120 A124 A125 A126 V134 H137 V138 F141 L151 F325	H118-I122 WeakPolarHBondContact O-CG1 3.42Å; H118-I122 PolarHBondContact O-N 2.83Å; Y119-I122 HydrophobicContact CD2-CD1 4.42Å; Y119-I122 WeakPolarHBondContact O-CB 3.39Å; Y119-I122 PolarHBondContact O-N 2.8Å; I120-I122 PolarHBondContact O-N 3.05Å; I122-A124 VanDerWaalsContact C-N 3.3Å; I122-A124 PolarHBondContact O-N 3.48Å; I122-A125 PolarHBondContact O-N 3.07Å; I122-A126 VanDerWaalsContact O-CB 3.26Å; I122-A126 WeakPolarHBondContact O-CB 3.23Å; I122-A126 PolarHBondContact O-N 3.12Å; I122-V134 HydrophobicContact CG2-CG1 4.3Å; I122-H137 HydrophobicContact CD1-CB 4.34Å; I122-H137 HydrophobicContact CG1-CB 3.61Å; I122-V138 HydrophobicContact CD1-CB 4.46Å; I122-V138 HydrophobicContact CD1-CG2 3.76Å; I122-V138 HydrophobicContact CG1-CG2 4.24Å; I122-F141 HydrophobicContact CD1-CB 4.31Å; I122-L151 HydrophobicContact CD1-CD2 3.96Å; I122-F325 HydrophobicContact CG2-CD1 4.23Å; I122-F325 HydrophobicContact CG2-CD2 4.26Å; I122-F325 HydrophobicContact CG2-CE1 3.99Å; I122-F325 HydrophobicContact CG2-CE2 4.08Å; I122-F325 HydrophobicContact CG2-CG 4.34Å; I122-F325 HydrophobicContact CG2-CZ 3.93Å
123	M	95.6	Very high	95.1	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.03	10%	0.095	C	C	.	.	H	α-helix	trans	-59.1	-40.8	179.1	-70.6	172.6	60.8	0	0	112.3	Y119 I120 L154 L164 N168 F325	Y119-M123 HydrophobicContact CD1-CG 4.05Å; Y119-M123 HydrophobicContact CD1-SD 3.7Å; Y119-M123 HydrophobicContact CE1-CG 3.97Å; Y119-M123 HydrophobicContact CE1-SD 3.71Å; Y119-M123 WeakPolarHBondContact O-CG 3.44Å; Y119-M123 PolarHBondContact O-N 2.88Å; I120-M123 WeakPolarHBondContact O-CB 3.46Å; I120-M123 PolarHBondContact O-N 2.87Å; M123-L154 HydrophobicContact CE-CD1 3.6Å; M123-L154 HydrophobicContact CE-CD2 4.36Å; M123-L154 HydrophobicContact CG-CD1 4.43Å; M123-L154 HydrophobicContact SD-CD1 3.78Å; M123-L164 HydrophobicContact CE-CB 4.47Å; M123-N168 PolarHBondContact O-ND2 3.48Å; M123-F325 HydrophobicContact CG-CD1 4.46Å
124	A	97.3	Very high	94.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-67	-53.6	178.6	0	0	0	0	0	111.6	I120 C121 I122 A126 R127 L206 H210	I120-A124 WeakPolarHBondContact O-CB 3.41Å; I120-A124 PolarHBondContact O-N 3.32Å; C121-A124 PolarHBondContact O-N 3.15Å; I122-A124 VanDerWaalsContact C-N 3.3Å; I122-A124 PolarHBondContact O-N 3.48Å; A124-A126 VanDerWaalsContact C-N 3.26Å; A124-A126 PolarHBondContact O-N 2.84Å; A124-R127 VanDerWaalsContact O-CB 3.3Å; A124-R127 WeakPolarHBondContact O-CB 3.39Å; A124-R127 PolarHBondContact O-N 3.3Å; A124-L206 HydrophobicContact CB-CD2 3.89Å; A124-H210 PolarHBondContact O-CD2 3.47Å
125	A	95.9	Very high	94.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.2	-34.8	-179.3	0	0	0	0	0	112.8	C121 I122 R127 H128 Q129 C130 L133 V134	C121-A125 WeakPolarHBondContact O-CB 3.3Å; C121-A125 PolarHBondContact O-N 3.3Å; I122-A125 PolarHBondContact O-N 3.07Å; A125-R127 PolarHBondContact O-N 2.9Å; A125-H128 PolarHBondContact O-N 3.48Å; A125-Q129 PolarHBondContact O-N 3.22Å; A125-C130 HydrophobicContact CB-CB 4.33Å; A125-C130 WeakPolarHBondContact O-CB 3.45Å; A125-C130 PolarHBondContact O-N 3.35Å; A125-C130 VanDerWaalsContact O-N 3.13Å; A125-L133 HydrophobicContact CB-CB 3.61Å; A125-L133 HydrophobicContact CB-CD1 4.48Å; A125-V134 HydrophobicContact CB-CG2 3.86Å
126	A	93.4	Very high	94.2	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.008	6%	0.055	C	C	.	.	H	α-helix	trans	-63.9	-23.6	176.8	0	0	0	0	0	113.4	I122 A124 H128 Q129 V134 F325	I122-A126 VanDerWaalsContact O-CB 3.26Å; I122-A126 WeakPolarHBondContact O-CB 3.23Å; I122-A126 PolarHBondContact O-N 3.12Å; A124-A126 VanDerWaalsContact C-N 3.26Å; A124-A126 PolarHBondContact O-N 2.84Å; A126-H128 PolarHBondContact O-N 3.47Å; A126-H128 VanDerWaalsContact O-N 3.15Å; A126-Q129 PolarHBondContact O-N 3.39Å; A126-Q129 VanDerWaalsContact O-N 3.12Å; A126-V134 HydrophobicContact CB-CG2 4.24Å; A126-F325 HydrophobicContact CB-CB 3.45Å; A126-F325 VanDerWaalsContact CB-CB 3.45Å; A126-F325 HydrophobicContact CB-CG 4.4Å
127	R	92.8	Very high	94	Very high	19 Å²	19	9.3 Å²	9.3	7%	0.072	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.2	175.9	-65.6	-52.4	-55.3	150.8	5.3	113.5	A124 A125 N168 A172 H173 D327 Y330	A124-R127 VanDerWaalsContact O-CB 3.3Å; A124-R127 WeakPolarHBondContact O-CB 3.39Å; A124-R127 PolarHBondContact O-N 3.3Å; A125-R127 PolarHBondContact O-N 2.9Å; R127-N168 WeakPolarHBondContact CG-OD1 3.27Å; R127-A172 HydrophobicContact CB-CB 3.74Å; R127-A172 HydrophobicContact CG-CB 3.87Å; R127-H173 PolarHBondContact NE-NE2 3.34Å; R127-H173 PolarHBondContact NH2-CD2 3.37Å; R127-H173 PolarHBondContact NH2-NE2 3.07Å; R127-H173 VanDerWaalsContact NH2-NE2 3.16Å; R127-H173 PolarHBondContact O-CE1 3.12Å; R127-H173 PolarHBondContact O-NE2 2.73Å; R127-D327 PolarHBondContact NH1-O 3.47Å; R127-D327 PolarHBondContact NH2-O 2.83Å; R127-Y330 PolarHBondContact NH2-O 2.99Å
128	H	91.1	Very high	93.7	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	17	178.2	-65.5	-58.9	0	0	0	112.6	A125 A126 C130 H173 F217 P440 E441 R471	A125-H128 PolarHBondContact O-N 3.48Å; A126-H128 PolarHBondContact O-N 3.47Å; A126-H128 VanDerWaalsContact O-N 3.15Å; H128-C130 PolarHBondContact O-N 3.04Å; H128-H173 AromaticContact CE1-CE1 3.66Å; H128-F217 VanDerWaalsContact O-CE2 3.29Å; H128-F217 WeakPolarHBondContact O-CE2 3.32Å; H128-P440 HydrophobicContact CB-CG 3.9Å; H128-E441 IonicContact ND1-OE2 3.14Å; H128-R471 PolarHBondContact CE1-NH2 2.92Å; H128-R471 VanDerWaalsContact CE1-NH2 3.33Å; H128-R471 PolarHBondContact NE2-NH1 2.89Å; H128-R471 PolarHBondContact NE2-NH2 3.48Å
129	Q	90.5	Very high	93.3	Very high	83 Å²	83	12.2 Å²	12.2	39%	0.388	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	31.9	-179.7	-50.5	176.6	37.6	0	0	112.4	A125 A126 S131 E326	A125-Q129 PolarHBondContact O-N 3.22Å; A126-Q129 PolarHBondContact O-N 3.39Å; A126-Q129 VanDerWaalsContact O-N 3.12Å; Q129-S131 VanDerWaalsContact C-N 3.32Å; Q129-S131 PolarHBondContact O-N 3.49Å; Q129-E326 HydrophobicContact CG-CG 4.17Å
130	C	92.4	Very high	93	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.007	7%	0.067	C	C	.	.			trans	-80.7	80.6	-175.3	-165.6	0	0	0	0	110.2	A125 H128 Y132 L133 V134 F217	A125-C130 HydrophobicContact CB-CB 4.33Å; A125-C130 WeakPolarHBondContact O-CB 3.45Å; A125-C130 PolarHBondContact O-N 3.35Å; A125-C130 VanDerWaalsContact O-N 3.13Å; H128-C130 PolarHBondContact O-N 3.04Å; C130-Y132 PolarHBondContact O-N 3.04Å; C130-L133 HydrophobicContact CB-CB 4.43Å; C130-L133 HydrophobicContact CB-CD1 4.45Å; C130-L133 PolarHBondContact O-N 3.13Å; C130-L133 VanDerWaalsContact O-N 3.16Å; C130-V134 WeakPolarHBondContact O-CG2 3.17Å; C130-V134 PolarHBondContact O-N 3.22Å; C130-F217 HydrophobicContact CB-CE2 3.78Å; C130-F217 HydrophobicContact CB-CZ 4.38Å
131	S	89	Confident	92.9	Very high	42 Å²	42	12.8 Å²	12.8	29%	0.294	7%	0.067	S	C	.	.	H	α-helix	trans	-56.9	-33.9	-176.7	60.8	0	0	0	0	113.1	Q129 N135	Q129-S131 VanDerWaalsContact C-N 3.32Å; Q129-S131 PolarHBondContact O-N 3.49Å; S131-N135 VanDerWaalsContact O-CB 3.25Å; S131-N135 WeakPolarHBondContact O-CB 3.24Å; S131-N135 PolarHBondContact O-N 3.06Å; S131-N135 PolarHBondContact O-ND2 3.34Å
132	Y	91	Very high	92.7	Very high	15 Å²	15	16.2 Å²	16.2	6%	0.059	9%	0.085	C	C	.	.	H	α-helix	trans	-54.5	-57.3	173.9	-179.9	-86.6	0	0	0	111.6	N83 I84 C130 N135 L136 T216 I221 M222 E224	N83-Y132 HydrophobicContact CB-CE2 4.45Å; N83-Y132 PolarHBondContact N-OH 3.26Å; I84-Y132 HydrophobicContact CD1-CD1 4.04Å; I84-Y132 HydrophobicContact CD1-CE1 3.44Å; I84-Y132 VanDerWaalsContact CD1-CE1 3.44Å; I84-Y132 HydrophobicContact CG1-CD1 4.49Å; I84-Y132 HydrophobicContact CG1-CE1 3.66Å; C130-Y132 PolarHBondContact O-N 3.04Å; Y132-N135 PolarHBondContact O-N 3.06Å; Y132-L136 WeakPolarHBondContact O-CB 3.45Å; Y132-L136 PolarHBondContact O-N 2.88Å; Y132-T216 HydrophobicContact CD1-CG2 3.96Å; Y132-T216 HydrophobicContact CG-CG2 4Å; Y132-I221 HydrophobicContact CD2-CG2 3.97Å; Y132-I221 HydrophobicContact CE1-CG2 4.3Å; Y132-I221 HydrophobicContact CE2-CG2 3.67Å; Y132-I221 HydrophobicContact CG-CG2 4.45Å; Y132-M222 WeakPolarHBondContact CD2-O 3.31Å; Y132-M222 WeakPolarHBondContact CE2-O 3.4Å; Y132-E224 HydrophobicContact CE2-CG 4.1Å; Y132-E224 WeakPolarHBondContact CE2-OE1 3.22Å; Y132-E224 PolarHBondContact OH-OE1 2.97Å
133	L	93.7	Very high	92.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.3	-34.9	-177	-68.4	174.5	0	0	0	112.2	I84 A125 C130 L136 H137 Y209 L212	I84-L133 HydrophobicContact CD1-CD2 3.74Å; A125-L133 HydrophobicContact CB-CB 3.61Å; A125-L133 HydrophobicContact CB-CD1 4.48Å; C130-L133 HydrophobicContact CB-CB 4.43Å; C130-L133 HydrophobicContact CB-CD1 4.45Å; C130-L133 PolarHBondContact O-N 3.13Å; C130-L133 VanDerWaalsContact O-N 3.16Å; L133-L136 HydrophobicContact CD2-CD2 4.28Å; L133-L136 WeakPolarHBondContact O-CB 3.28Å; L133-L136 PolarHBondContact O-N 3.47Å; L133-H137 PolarHBondContact O-CD2 2.83Å; L133-H137 VanDerWaalsContact O-CD2 3.32Å; L133-H137 PolarHBondContact O-N 3.14Å; L133-H137 VanDerWaalsContact O-N 3.08Å; L133-Y209 HydrophobicContact CD1-CD1 4.24Å; L133-Y209 HydrophobicContact CD2-CD1 4.33Å; L133-Y209 HydrophobicContact CD2-CE1 4.23Å; L133-L212 HydrophobicContact CD1-CB 4.12Å; L133-L212 HydrophobicContact CD1-CD2 4.29Å; L133-L212 HydrophobicContact CD1-CG 4.03Å; L133-L212 HydrophobicContact CD2-CD2 3.7Å; L133-L212 HydrophobicContact CD2-CG 4.13Å
134	V	92.6	Very high	92.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-52.4	172.8	168.1	0	0	0	0	110	I122 A125 A126 C130 L136 H137 V138 I321	I122-V134 HydrophobicContact CG2-CG1 4.3Å; A125-V134 HydrophobicContact CB-CG2 3.86Å; A126-V134 HydrophobicContact CB-CG2 4.24Å; C130-V134 WeakPolarHBondContact O-CG2 3.17Å; C130-V134 PolarHBondContact O-N 3.22Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.25Å; V134-H137 PolarHBondContact O-N 2.99Å; V134-V138 HydrophobicContact CG1-CG2 4.19Å; V134-V138 WeakPolarHBondContact O-CB 3.34Å; V134-V138 VanDerWaalsContact O-CG2 3.24Å; V134-V138 WeakPolarHBondContact O-CG2 3.39Å; V134-V138 PolarHBondContact O-N 3.11Å; V134-I321 HydrophobicContact CG1-CG2 4.3Å
135	N	88.9	Confident	92.5	Very high	17 Å²	17	28.7 Å²	28.7	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-37.8	-178.5	-71	-23.7	0	0	0	112	S131 Y132 H137 V138 N139	S131-N135 VanDerWaalsContact O-CB 3.25Å; S131-N135 WeakPolarHBondContact O-CB 3.24Å; S131-N135 PolarHBondContact O-N 3.06Å; S131-N135 PolarHBondContact O-ND2 3.34Å; Y132-N135 PolarHBondContact O-N 3.06Å; N135-H137 VanDerWaalsContact C-N 3.33Å; N135-H137 PolarHBondContact O-N 3.48Å; N135-V138 PolarHBondContact O-N 3.34Å; N135-N139 PolarHBondContact O-N 3.48Å; N135-N139 VanDerWaalsContact O-N 3.11Å; N135-N139 PolarHBondContact O-ND2 3.05Å; N135-N139 VanDerWaalsContact O-ND2 3.11Å
136	L	89.8	Confident	92.5	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-53.5	-51.6	173.8	-166	77.4	0	0	0	110.9	R80 Y132 L133 V134 N139 D140	R80-L136 VanDerWaalsContact NH2-CD1 3.28Å; Y132-L136 WeakPolarHBondContact O-CB 3.45Å; Y132-L136 PolarHBondContact O-N 2.88Å; L133-L136 HydrophobicContact CD2-CD2 4.28Å; L133-L136 WeakPolarHBondContact O-CB 3.28Å; L133-L136 PolarHBondContact O-N 3.47Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.25Å; L136-N139 PolarHBondContact O-N 3.02Å; L136-D140 VanDerWaalsContact O-CG 3.28Å; L136-D140 PolarHBondContact O-N 3.16Å
137	H	93.3	Very high	92.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-82	-22.9	-177.9	-71.5	-53	0	0	0	115	H118 C121 I122 L133 V134 N135 N139 D140 F141 Y209	H118-H137 AromaticContact ND1-ND1 3.27Å; H118-H137 PolarHBondContact ND1-ND1 3.44Å; C121-H137 HydrophobicContact CB-CB 4.22Å; C121-H137 WeakPolarHBondContact CB-CD2 3.14Å; I122-H137 HydrophobicContact CD1-CB 4.34Å; I122-H137 HydrophobicContact CG1-CB 3.61Å; L133-H137 PolarHBondContact O-CD2 2.83Å; L133-H137 VanDerWaalsContact O-CD2 3.32Å; L133-H137 PolarHBondContact O-N 3.14Å; L133-H137 VanDerWaalsContact O-N 3.08Å; V134-H137 PolarHBondContact O-N 2.99Å; N135-H137 VanDerWaalsContact C-N 3.33Å; N135-H137 PolarHBondContact O-N 3.48Å; H137-N139 VanDerWaalsContact C-N 3.3Å; H137-D140 IonicContact ND1-OD2 3.82Å; H137-D140 PolarHBondContact O-N 3.48Å; H137-F141 WeakPolarHBondContact O-CA 3.26Å; H137-F141 WeakPolarHBondContact O-CB 3.48Å; H137-F141 PolarHBondContact O-N 3.34Å; H137-Y209 AromaticContact CD2-CE1 3.8Å; H137-Y209 AromaticContact CE1-CE1 3.86Å; H137-Y209 AromaticContact CE1-CZ 3.54Å; H137-Y209 PolarHBondContact CE1-OH 2.92Å; H137-Y209 VanDerWaalsContact CE1-OH 3.27Å; H137-Y209 AromaticContact NE2-CD1 3.63Å; H137-Y209 AromaticContact NE2-CE1 2.88Å; H137-Y209 WeakPolarHBondContact NE2-CE1 3.16Å; H137-Y209 AromaticContact NE2-CE2 3.78Å; H137-Y209 AromaticContact NE2-CZ 2.98Å; H137-Y209 PolarHBondContact NE2-OH 3.31Å; H137-Y209 VanDerWaalsContact NE2-OH 3.16Å
138	V	92.2	Very high	92.8	Very high	9 Å²	9	36 Å²	36	6%	0.055	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-46.4	167.6	165.4	0	0	0	0	109.6	I122 V134 N135 F141 L142 L151 I321	I122-V138 HydrophobicContact CD1-CB 4.46Å; I122-V138 HydrophobicContact CD1-CG2 3.76Å; I122-V138 HydrophobicContact CG1-CG2 4.24Å; V134-V138 HydrophobicContact CG1-CG2 4.19Å; V134-V138 WeakPolarHBondContact O-CB 3.34Å; V134-V138 VanDerWaalsContact O-CG2 3.24Å; V134-V138 WeakPolarHBondContact O-CG2 3.39Å; V134-V138 PolarHBondContact O-N 3.11Å; N135-V138 PolarHBondContact O-N 3.34Å; V138-F141 PolarHBondContact O-N 3.09Å; V138-L142 HydrophobicContact CG1-CD1 4.13Å; V138-L142 VanDerWaalsContact O-CG 3.24Å; V138-L142 WeakPolarHBondContact O-CG 3.38Å; V138-L142 PolarHBondContact O-N 3.49Å; V138-L142 VanDerWaalsContact O-N 3.07Å; V138-L151 HydrophobicContact CG1-CD1 3.91Å; V138-L151 HydrophobicContact CG2-CD2 4.13Å; V138-I321 HydrophobicContact CG1-CD1 4.43Å; V138-I321 HydrophobicContact CG2-CG2 4.21Å
139	N	89.4	Confident	92.9	Very high	57 Å²	57	42 Å²	42	31%	0.305	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-49.2	177.5	-71	-36.6	0	0	0	111.4	N135 L136 H137 F141 L142 Q143	N135-N139 PolarHBondContact O-N 3.48Å; N135-N139 VanDerWaalsContact O-N 3.11Å; N135-N139 PolarHBondContact O-ND2 3.05Å; N135-N139 VanDerWaalsContact O-ND2 3.11Å; L136-N139 PolarHBondContact O-N 3.02Å; H137-N139 VanDerWaalsContact C-N 3.3Å; N139-F141 PolarHBondContact O-N 3.25Å; N139-L142 PolarHBondContact O-N 3.01Å; N139-Q143 WeakPolarHBondContact O-CG 3.45Å; N139-Q143 PolarHBondContact O-N 3.03Å
140	D	91.9	Very high	93.1	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.07	22%	0.221	C	C	.	.	H	α-helix	trans	-66	-40	-178.8	-58.8	-14.9	0	0	0	111.7	R80 H118 L136 H137 L142 Q143 V144	R80-D140 IonicContact CZ-OD1 3.47Å; R80-D140 IonicContact CZ-OD2 3.65Å; R80-D140 IonicContact NH1-OD1 2.78Å; R80-D140 PolarHBondContact NH1-OD1 2.96Å; R80-D140 IonicContact NH1-OD2 3.66Å; R80-D140 IonicContact NH2-OD1 3.38Å; R80-D140 PolarHBondContact NH2-OD1 3.45Å; R80-D140 IonicContact NH2-OD2 2.78Å; R80-D140 PolarHBondContact NH2-OD2 2.76Å; H118-D140 IonicContact CE1-OD2 2.71Å; L136-D140 VanDerWaalsContact O-CG 3.28Å; L136-D140 PolarHBondContact O-N 3.16Å; H137-D140 IonicContact ND1-OD2 3.82Å; H137-D140 PolarHBondContact O-N 3.48Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 3.04Å; D140-Q143 PolarHBondContact O-N 3.3Å; D140-V144 WeakPolarHBondContact O-CG2 3.46Å; D140-V144 PolarHBondContact O-N 2.7Å
141	F	95.4	Very high	93.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.7	-44.9	174.5	173.3	-101.3	0	0	0	111.9	H115 H118 Y119 I122 H137 V138 N139 V144 G146 N147 W150 L151	H115-F141 HydrophobicContact CB-CD2 4.05Å; H115-F141 HydrophobicContact CB-CE2 3.94Å; H115-F141 WeakPolarHBondContact O-CD2 3.48Å; H115-F141 VanDerWaalsContact O-CE2 3.32Å; H115-F141 WeakPolarHBondContact O-CE2 3.43Å; H118-F141 HydrophobicContact CB-CB 3.87Å; H118-F141 HydrophobicContact CB-CD2 4.45Å; Y119-F141 HydrophobicContact CD2-CE2 4.15Å; Y119-F141 HydrophobicContact CD2-CZ 4.27Å; Y119-F141 HydrophobicContact CG-CE2 4.48Å; I122-F141 HydrophobicContact CD1-CB 4.31Å; H137-F141 WeakPolarHBondContact O-CA 3.26Å; H137-F141 WeakPolarHBondContact O-CB 3.48Å; H137-F141 PolarHBondContact O-N 3.34Å; V138-F141 PolarHBondContact O-N 3.09Å; N139-F141 PolarHBondContact O-N 3.25Å; F141-V144 WeakPolarHBondContact O-CG2 3.35Å; F141-G146 VanDerWaalsContact CE1-C 3.44Å; F141-G146 VanDerWaalsContact CZ-C 3.49Å; F141-G146 WeakPolarHBondContact O-CA 3.3Å; F141-G146 PolarHBondContact O-N 2.62Å; F141-N147 WeakPolarHBondContact CE1-O 3.33Å; F141-N147 VanDerWaalsContact CZ-N 3.34Å; F141-W150 HydrophobicContact CE2-CD2 4.5Å; F141-W150 AromaticContact CE2-CE3 3.65Å; F141-W150 HydrophobicContact CE2-CE3 3.65Å; F141-W150 AromaticContact CE2-CZ3 3.97Å; F141-W150 HydrophobicContact CE2-CZ3 3.97Å; F141-W150 HydrophobicContact CZ-CB 4.23Å; F141-W150 HydrophobicContact CZ-CD2 4.01Å; F141-W150 AromaticContact CZ-CE3 3.59Å; F141-W150 HydrophobicContact CZ-CE3 3.59Å; F141-W150 HydrophobicContact CZ-CG 4.33Å; F141-W150 HydrophobicContact CZ-CZ3 4.27Å; F141-L151 HydrophobicContact CD1-CD1 4.37Å; F141-L151 HydrophobicContact CD1-CD2 3.91Å; F141-L151 HydrophobicContact CD1-CG 4.28Å; F141-L151 HydrophobicContact CE1-CD2 4.01Å; F141-L151 HydrophobicContact CE1-CG 4.11Å
142	L	94.6	Very high	93.1	Very high	71 Å²	71	43 Å²	43	37%	0.372	24%	0.238	S	C	.	.	H	α-helix	trans	-68.2	-39.2	177.7	-67.6	173.5	0	0	0	111.8	V138 N139 D140 V144 G145 T148 L151	V138-L142 HydrophobicContact CG1-CD1 4.13Å; V138-L142 VanDerWaalsContact O-CG 3.24Å; V138-L142 WeakPolarHBondContact O-CG 3.38Å; V138-L142 PolarHBondContact O-N 3.49Å; V138-L142 VanDerWaalsContact O-N 3.07Å; N139-L142 PolarHBondContact O-N 3.01Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 3.04Å; L142-V144 VanDerWaalsContact C-N 3.32Å; L142-V144 PolarHBondContact O-N 3.03Å; L142-G145 PolarHBondContact O-N 2.97Å; L142-G145 VanDerWaalsContact O-N 3.1Å; L142-T148 HydrophobicContact CD2-CG2 3.67Å; L142-L151 HydrophobicContact CD1-CD1 4.34Å; L142-L151 HydrophobicContact CD2-CD1 3.95Å; L142-L151 HydrophobicContact CG-CD1 4.23Å
143	Q	92.7	Very high	92.8	Very high	154 Å²	154	42.6 Å²	42.6	72%	0.72	24%	0.238	S	C	*	.	H	α-helix	trans	-61.9	-38.1	177.8	-74.6	178	8.3	0	0	112.5	N139 D140 G145	N139-Q143 WeakPolarHBondContact O-CG 3.45Å; N139-Q143 PolarHBondContact O-N 3.03Å; D140-Q143 PolarHBondContact O-N 3.3Å; Q143-G145 PolarHBondContact O-N 3.01Å
144	V	95.3	Very high	92.7	Very high	52 Å²	52	44.8 Å²	44.8	32%	0.315	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	11.8	176.7	-56.1	0	0	0	0	113.7	L114 H115 D140 F141 L142	L114-V144 HydrophobicContact CB-CB 4.17Å; L114-V144 HydrophobicContact CB-CG1 4.19Å; L114-V144 HydrophobicContact CB-CG2 4.17Å; L114-V144 HydrophobicContact CD1-CG1 4.23Å; H115-V144 HydrophobicContact CB-CG2 3.9Å; D140-V144 WeakPolarHBondContact O-CG2 3.46Å; D140-V144 PolarHBondContact O-N 2.7Å; F141-V144 WeakPolarHBondContact O-CG2 3.35Å; L142-V144 VanDerWaalsContact C-N 3.32Å; L142-V144 PolarHBondContact O-N 3.03Å
145	G	96.2	Very high	92.6	Very high	63 Å²	63	51.2 Å²	51.2	65%	0.649	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	23.5	175.4	0	0	0	0	0	115	L142 Q143	L142-G145 PolarHBondContact O-N 2.97Å; L142-G145 VanDerWaalsContact O-N 3.1Å; Q143-G145 PolarHBondContact O-N 3.01Å
146	G	97.1	Very high	92.9	Very high	9 Å²	9	55.5 Å²	55.5	9%	0.093	30%	0.303	C	S	.	.			trans	-60	145.5	176	0	0	0	0	0	113.3	F141 T148	F141-G146 VanDerWaalsContact CE1-C 3.44Å; F141-G146 VanDerWaalsContact CZ-C 3.49Å; F141-G146 WeakPolarHBondContact O-CA 3.3Å; F141-G146 PolarHBondContact O-N 2.62Å; G146-T148 PolarHBondContact O-N 3.34Å
147	N	96.5	Very high	93.1	Very high	75 Å²	75	55.6 Å²	55.6	40%	0.401	31%	0.305	S	S	.	.			trans	-72.8	116	-179.8	-176.5	-15.8	0	0	0	111.1	F141 K149 W150	F141-N147 WeakPolarHBondContact CE1-O 3.33Å; F141-N147 VanDerWaalsContact CZ-N 3.34Å; N147-K149 PolarHBondContact O-N 3.49Å; N147-K149 WeakPolarHBondContact OD1-CB 3.47Å; N147-K149 WeakPolarHBondContact OD1-CG 3.24Å; N147-K149 PolarHBondContact OD1-N 2.93Å; N147-W150 HydrophobicContact CB-CD2 4.3Å; N147-W150 HydrophobicContact CB-CG 4.2Å; N147-W150 WeakPolarHBondContact O-CB 3.46Å; N147-W150 PolarHBondContact O-N 3.31Å
148	T	94.6	Very high	93.1	Very high	90 Å²	90	57.1 Å²	57.1	55%	0.552	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-56.1	-27.3	-178.9	57	0	0	0	0	113.7	L142 G146 W150 L151	L142-T148 HydrophobicContact CD2-CG2 3.67Å; G146-T148 PolarHBondContact O-N 3.34Å; T148-W150 PolarHBondContact O-N 3.42Å; T148-L151 WeakPolarHBondContact O-CB 3.19Å; T148-L151 PolarHBondContact O-N 3.47Å; T148-L151 VanDerWaalsContact O-N 3.13Å
149	K	94.3	Very high	93.2	Very high	126 Å²	126	61.4 Å²	61.4	55%	0.548	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-61.6	-32.7	177.9	-65.9	-175.8	179.1	-177	0	112.5	N147 L151 N152 E156	N147-K149 PolarHBondContact O-N 3.49Å; N147-K149 WeakPolarHBondContact OD1-CB 3.47Å; N147-K149 WeakPolarHBondContact OD1-CG 3.24Å; N147-K149 PolarHBondContact OD1-N 2.93Å; K149-L151 PolarHBondContact O-N 2.65Å; K149-N152 WeakPolarHBondContact O-CB 3.29Å; K149-N152 PolarHBondContact O-N 3.41Å; K149-N152 VanDerWaalsContact O-N 3.11Å; K149-N152 PolarHBondContact O-ND2 3.29Å; K149-E156 WeakPolarHBondContact O-CB 3.22Å
150	W	94.6	Very high	93.4	Very high	23 Å²	23	60 Å²	60	9%	0.087	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-64.1	-24.3	180	-57.6	1.2	0	0	0	111.8	H115 Y116 Y119 F141 N147 T148 N152 G153 A157 P158 L161	H115-W150 AromaticContact CD2-CH2 3.6Å; H115-W150 AromaticContact CD2-CZ3 3.87Å; Y116-W150 HydrophobicContact CD2-CH2 4.03Å; Y116-W150 HydrophobicContact CD2-CZ3 4.27Å; Y116-W150 AromaticContact CE2-CH2 3.58Å; Y116-W150 HydrophobicContact CE2-CH2 3.58Å; Y116-W150 HydrophobicContact CE2-CZ3 4.25Å; Y119-W150 HydrophobicContact CD1-CE3 4.35Å; Y119-W150 HydrophobicContact CD2-CB 4.01Å; Y119-W150 AromaticContact CD2-CE3 3.93Å; Y119-W150 HydrophobicContact CD2-CE3 3.93Å; Y119-W150 HydrophobicContact CE2-CB 3.4Å; Y119-W150 HydrophobicContact CE2-CE3 4.32Å; Y119-W150 HydrophobicContact CE2-CG 4.46Å; Y119-W150 VanDerWaalsContact CE2-O 3.27Å; Y119-W150 WeakPolarHBondContact CE2-O 3.42Å; Y119-W150 AromaticContact CG-CE3 3.92Å; Y119-W150 HydrophobicContact CG-CE3 3.92Å; Y119-W150 HydrophobicContact CG-CZ3 4.49Å; Y119-W150 PolarHBondContact OH-O 2.89Å; F141-W150 HydrophobicContact CE2-CD2 4.5Å; F141-W150 AromaticContact CE2-CE3 3.65Å; F141-W150 HydrophobicContact CE2-CE3 3.65Å; F141-W150 AromaticContact CE2-CZ3 3.97Å; F141-W150 HydrophobicContact CE2-CZ3 3.97Å; F141-W150 HydrophobicContact CZ-CB 4.23Å; F141-W150 HydrophobicContact CZ-CD2 4.01Å; F141-W150 AromaticContact CZ-CE3 3.59Å; F141-W150 HydrophobicContact CZ-CE3 3.59Å; F141-W150 HydrophobicContact CZ-CG 4.33Å; F141-W150 HydrophobicContact CZ-CZ3 4.27Å; N147-W150 HydrophobicContact CB-CD2 4.3Å; N147-W150 HydrophobicContact CB-CG 4.2Å; N147-W150 WeakPolarHBondContact O-CB 3.46Å; N147-W150 PolarHBondContact O-N 3.31Å; T148-W150 PolarHBondContact O-N 3.42Å; W150-N152 PolarHBondContact O-N 3.04Å; W150-G153 PolarHBondContact O-N 2.98Å; W150-A157 HydrophobicContact CG-CB 4.48Å; W150-P158 VanDerWaalsContact CE2-CD 3.4Å; W150-P158 HydrophobicContact CH2-CG 3.56Å; W150-P158 HydrophobicContact CZ2-CG 3.19Å; W150-P158 HydrophobicContact CZ3-CG 4.37Å; W150-L161 HydrophobicContact CE3-CD1 4.13Å; W150-L161 HydrophobicContact CH2-CD1 4.22Å; W150-L161 HydrophobicContact CZ3-CD1 3.62Å
151	L	91.9	Very high	93.6	Very high	24 Å²	24	59.3 Å²	59.3	13%	0.126	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-72.3	-10	178.9	-57.6	-177.7	0	0	0	113.4	I122 V138 F141 L142 T148 K149 G153	I122-L151 HydrophobicContact CD1-CD2 3.96Å; V138-L151 HydrophobicContact CG1-CD1 3.91Å; V138-L151 HydrophobicContact CG2-CD2 4.13Å; F141-L151 HydrophobicContact CD1-CD1 4.37Å; F141-L151 HydrophobicContact CD1-CD2 3.91Å; F141-L151 HydrophobicContact CD1-CG 4.28Å; F141-L151 HydrophobicContact CE1-CD2 4.01Å; F141-L151 HydrophobicContact CE1-CG 4.11Å; L142-L151 HydrophobicContact CD1-CD1 4.34Å; L142-L151 HydrophobicContact CD2-CD1 3.95Å; L142-L151 HydrophobicContact CG-CD1 4.23Å; T148-L151 WeakPolarHBondContact O-CB 3.19Å; T148-L151 PolarHBondContact O-N 3.47Å; T148-L151 VanDerWaalsContact O-N 3.13Å; K149-L151 PolarHBondContact O-N 2.65Å; L151-G153 PolarHBondContact O-N 2.98Å
152	N	88.3	Confident	93.5	Very high	100 Å²	100	62.6 Å²	62.6	54%	0.535	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-79	-5.6	173.1	-62.3	-39.9	0	0	0	113	K149 W150 E156 H324	K149-N152 WeakPolarHBondContact O-CB 3.29Å; K149-N152 PolarHBondContact O-N 3.41Å; K149-N152 VanDerWaalsContact O-N 3.11Å; K149-N152 PolarHBondContact O-ND2 3.29Å; W150-N152 PolarHBondContact O-N 3.04Å; N152-E156 HydrophobicContact CB-CG 4.05Å; N152-H324 PolarHBondContact O-ND1 3.13Å
153	G	86.6	Confident	93.4	Very high	5 Å²	5	61.4 Å²	61.4	5%	0.052	33%	0.33	C	S	.	.			trans	134.1	170.9	174	0	0	0	0	0	113.2	Y119 W150 L151 N155 E156 H324	Y119-G153 PolarHBondContact OH-O 3.48Å; W150-G153 PolarHBondContact O-N 2.98Å; L151-G153 PolarHBondContact O-N 2.98Å; G153-N155 PolarHBondContact O-N 3.33Å; G153-E156 PolarHBondContact O-N 2.87Å; G153-H324 VanDerWaalsContact CA-O 3.23Å; G153-H324 WeakPolarHBondContact CA-O 3.46Å
154	L	90.2	Very high	93.5	Very high	46 Å²	46	54 Å²	54	24%	0.241	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-57.7	-35.2	-173.6	-173.6	59.1	0	0	0	112.9	Y119 M123 E156 A157 Q162	Y119-L154 HydrophobicContact CE1-CD1 4.26Å; M123-L154 HydrophobicContact CE-CD1 3.6Å; M123-L154 HydrophobicContact CE-CD2 4.36Å; M123-L154 HydrophobicContact CG-CD1 4.43Å; M123-L154 HydrophobicContact SD-CD1 3.78Å; L154-E156 PolarHBondContact O-N 3.31Å; L154-E156 VanDerWaalsContact O-N 3.16Å; L154-A157 HydrophobicContact CD1-CB 4.42Å; L154-A157 VanDerWaalsContact O-CB 3.25Å; L154-A157 WeakPolarHBondContact O-CB 3.45Å; L154-A157 PolarHBondContact O-N 2.77Å; L154-Q162 HydrophobicContact CD1-CG 4.46Å; L154-Q162 HydrophobicContact CG-CG 4.32Å; L154-Q162 VanDerWaalsContact O-CG 3.23Å; L154-Q162 WeakPolarHBondContact O-CG 3.23Å
155	N	91.6	Very high	93.4	Very high	135 Å²	135	52.2 Å²	52.2	72%	0.722	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-62.2	-22.4	-180	-63.1	-25	0	0	0	113.7	G153 Q162	G153-N155 PolarHBondContact O-N 3.33Å; N155-Q162 PolarHBondContact O-NE2 3.27Å
156	E	94.1	Very high	93.3	Very high	107 Å²	107	52.2 Å²	52.2	50%	0.5	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-92.4	-5	179	-62.3	-68	149.1	0	0	112.6	K149 N152 G153 L154	K149-E156 WeakPolarHBondContact O-CB 3.22Å; N152-E156 HydrophobicContact CB-CG 4.05Å; G153-E156 PolarHBondContact O-N 2.87Å; L154-E156 PolarHBondContact O-N 3.31Å; L154-E156 VanDerWaalsContact O-N 3.16Å
157	A	94	Very high	93.3	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	27%	0.266	C	S	.	.	S	Bend	trans	-80.4	165.8	174.7	0	0	0	0	0	111.8	Y119 W150 L154 L161 Q162	Y119-A157 HydrophobicContact CE1-CB 3.59Å; Y119-A157 WeakPolarHBondContact OH-CB 3.49Å; W150-A157 HydrophobicContact CG-CB 4.48Å; L154-A157 HydrophobicContact CD1-CB 4.42Å; L154-A157 VanDerWaalsContact O-CB 3.25Å; L154-A157 WeakPolarHBondContact O-CB 3.45Å; L154-A157 PolarHBondContact O-N 2.77Å; A157-L161 HydrophobicContact CB-CB 4.24Å; A157-Q162 PolarHBondContact O-NE2 2.99Å
158	P	94.7	Very high	93.3	Very high	33 Å²	33	48.7 Å²	48.7	21%	0.214	25%	0.249	C	C	.	.			trans	-59.8	145.9	172.2	-21.3	35	0	0	0	111.1	W150 K160 L161 Q162	W150-P158 VanDerWaalsContact CE2-CD 3.4Å; W150-P158 HydrophobicContact CH2-CG 3.56Å; W150-P158 HydrophobicContact CZ2-CG 3.19Å; W150-P158 HydrophobicContact CZ3-CG 4.37Å; P158-K160 PolarHBondContact O-N 3.37Å; P158-L161 PolarHBondContact O-N 3Å; P158-Q162 PolarHBondContact O-N 3.05Å; P158-Q162 VanDerWaalsContact O-N 3.1Å
159	Q	93.1	Very high	93.4	Very high	100 Å²	100	46.3 Å²	46.3	47%	0.467	23%	0.231	S	C	.	.	H	α-helix	trans	-54.5	-34.1	-177.9	-170.8	173.7	11.1	0	0	112.6	L161 Q162 Q163 H192	Q159-L161 VanDerWaalsContact C-N 3.33Å; Q159-L161 PolarHBondContact O-N 3.23Å; Q159-Q162 WeakPolarHBondContact O-CB 3.32Å; Q159-Q162 PolarHBondContact O-N 3.48Å; Q159-Q163 VanDerWaalsContact O-CG 3.32Å; Q159-Q163 WeakPolarHBondContact O-CG 3.06Å; Q159-Q163 PolarHBondContact O-N 3.06Å; Q159-H192 PolarHBondContact OE1-CD2 2.84Å; Q159-H192 VanDerWaalsContact OE1-CD2 3.25Å
160	K	94.3	Very high	93.4	Very high	26 Å²	26	40.5 Å²	40.5	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-53.5	-45.7	172.8	-171.2	167.2	-176.7	169.3	0	112.8	P158 H192 S193 W194 E198	P158-K160 PolarHBondContact O-N 3.37Å; K160-H192 HydrophobicContact CB-CB 4.16Å; K160-H192 WeakPolarHBondContact CG-O 3.19Å; K160-S193 WeakPolarHBondContact CE-O 3.49Å; K160-S193 PolarHBondContact NZ-O 3.14Å; K160-S193 VanDerWaalsContact NZ-O 3.09Å; K160-W194 HydrophobicContact CG-CD2 4.22Å; K160-W194 HydrophobicContact CG-CG 4.45Å; K160-W194 HydrophobicContact CG-CZ2 3.84Å; K160-W194 WeakPolarHBondContact O-CZ2 3.39Å; K160-W194 PolarHBondContact O-NE1 2.8Å; K160-E198 IonicContact NZ-OE1 3.21Å; K160-E198 PolarHBondContact NZ-OE1 3.18Å; K160-E198 IonicContact NZ-OE2 2.82Å; K160-E198 PolarHBondContact NZ-OE2 3.08Å
161	L	95.1	Very high	93.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-75.6	-34.7	177.6	-69	178.5	0	0	0	112.1	Y116 Y119 I120 W150 A157 P158 Q159 Q163 L164 W194	Y116-L161 HydrophobicContact CD1-CD1 3.85Å; Y116-L161 HydrophobicContact CD1-CD2 3.57Å; Y116-L161 HydrophobicContact CD1-CG 3.78Å; Y116-L161 HydrophobicContact CE1-CD1 3.96Å; Y116-L161 HydrophobicContact CE1-CD2 4.02Å; Y116-L161 HydrophobicContact CE1-CG 3.76Å; Y116-L161 HydrophobicContact CG-CD1 4.17Å; Y116-L161 HydrophobicContact CG-CD2 4.36Å; Y119-L161 HydrophobicContact CD1-CD1 3.65Å; Y119-L161 HydrophobicContact CE1-CD1 4.28Å; Y119-L161 HydrophobicContact CG-CD1 4.29Å; I120-L161 HydrophobicContact CD1-CD2 4.09Å; I120-L161 HydrophobicContact CG1-CD2 3.86Å; W150-L161 HydrophobicContact CE3-CD1 4.13Å; W150-L161 HydrophobicContact CH2-CD1 4.22Å; W150-L161 HydrophobicContact CZ3-CD1 3.62Å; A157-L161 HydrophobicContact CB-CB 4.24Å; P158-L161 PolarHBondContact O-N 3Å; Q159-L161 VanDerWaalsContact C-N 3.33Å; Q159-L161 PolarHBondContact O-N 3.23Å; L161-Q163 VanDerWaalsContact C-N 3.29Å; L161-Q163 PolarHBondContact O-N 3.42Å; L161-L164 WeakPolarHBondContact O-CB 3.17Å; L161-L164 PolarHBondContact O-N 2.81Å; L161-L164 VanDerWaalsContact O-N 3.13Å; L161-W194 HydrophobicContact CD2-CH2 4.1Å; L161-W194 HydrophobicContact CD2-CZ2 4.12Å
162	Q	93.8	Very high	93.8	Very high	68 Å²	68	38.3 Å²	38.3	32%	0.318	20%	0.197	S	C	.	.	H	α-helix	trans	-58	-43.5	175.2	-64.3	-174.7	24.3	0	0	111.9	L154 N155 A157 P158 Q159 L164 G165	L154-Q162 HydrophobicContact CD1-CG 4.46Å; L154-Q162 HydrophobicContact CG-CG 4.32Å; L154-Q162 VanDerWaalsContact O-CG 3.23Å; L154-Q162 WeakPolarHBondContact O-CG 3.23Å; N155-Q162 PolarHBondContact O-NE2 3.27Å; A157-Q162 PolarHBondContact O-NE2 2.99Å; P158-Q162 PolarHBondContact O-N 3.05Å; P158-Q162 VanDerWaalsContact O-N 3.1Å; Q159-Q162 WeakPolarHBondContact O-CB 3.32Å; Q159-Q162 PolarHBondContact O-N 3.48Å; Q162-L164 PolarHBondContact O-N 3.35Å; Q162-G165 PolarHBondContact O-N 2.97Å
163	Q	92.7	Very high	94.1	Very high	46 Å²	46	33.9 Å²	33.9	22%	0.215	17%	0.172	C	C	.	.	H	α-helix	trans	-61.4	-30.2	178.5	-70.4	177.2	-21	0	0	113.1	Q159 L161 G165 L186 T189	Q159-Q163 VanDerWaalsContact O-CG 3.32Å; Q159-Q163 WeakPolarHBondContact O-CG 3.06Å; Q159-Q163 PolarHBondContact O-N 3.06Å; L161-Q163 VanDerWaalsContact C-N 3.29Å; L161-Q163 PolarHBondContact O-N 3.42Å; Q163-G165 PolarHBondContact O-N 2.98Å; Q163-L186 HydrophobicContact CB-CD2 3.61Å; Q163-T189 VanDerWaalsContact NE2-CG2 3.34Å; Q163-T189 PolarHBondContact NE2-OG1 3.18Å
164	L	95.3	Very high	94.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.6	-20.9	177.4	-168.1	69.6	0	0	0	112.4	I120 M123 L161 Q162 E166 I167 N168 L186 W194 L199 A202 L206	I120-L164 HydrophobicContact CD1-CD2 4.12Å; I120-L164 HydrophobicContact CG1-CD2 3.87Å; I120-L164 HydrophobicContact CG2-CD2 4.23Å; M123-L164 HydrophobicContact CE-CB 4.47Å; L161-L164 WeakPolarHBondContact O-CB 3.17Å; L161-L164 PolarHBondContact O-N 2.81Å; L161-L164 VanDerWaalsContact O-N 3.13Å; Q162-L164 PolarHBondContact O-N 3.35Å; L164-E166 PolarHBondContact O-N 2.8Å; L164-I167 PolarHBondContact O-N 2.78Å; L164-N168 WeakPolarHBondContact O-CB 3.26Å; L164-N168 PolarHBondContact O-N 3.34Å; L164-L186 HydrophobicContact CD1-CD1 4.1Å; L164-W194 HydrophobicContact CB-CZ2 4.03Å; L164-W194 HydrophobicContact CD1-CH2 4.5Å; L164-W194 HydrophobicContact CD1-CZ2 4.31Å; L164-W194 HydrophobicContact CD2-CH2 3.95Å; L164-W194 HydrophobicContact CD2-CZ2 4.09Å; L164-W194 HydrophobicContact CG-CZ2 4.38Å; L164-L199 HydrophobicContact CD1-CD1 4.33Å; L164-A202 HydrophobicContact CD1-CB 4.21Å; L164-A202 HydrophobicContact CD2-CB 3.95Å; L164-L206 HydrophobicContact CD1-CD1 4.18Å; L164-L206 HydrophobicContact CD2-CD1 4.17Å; L164-L206 HydrophobicContact CG-CD1 4.08Å
165	G	93.7	Very high	94.8	Very high	13 Å²	13	33.2 Å²	33.2	13%	0.134	17%	0.165	C	C	.	.	H	α-helix	trans	-56.6	-34	-179.2	0	0	0	0	0	114.2	Q162 Q163 K169	Q162-G165 PolarHBondContact O-N 2.97Å; Q163-G165 PolarHBondContact O-N 2.98Å; G165-K169 PolarHBondContact O-N 2.92Å; G165-K169 VanDerWaalsContact O-N 3.16Å
166	E	93.8	Very high	95	Very high	64 Å²	64	27.7 Å²	27.7	30%	0.299	13%	0.134	S	C	.	.	H	α-helix	trans	-66.4	-46.7	177.7	-172.4	62.7	-154.2	0	0	111.8	L164 K169 I170	L164-E166 PolarHBondContact O-N 2.8Å; E166-K169 VanDerWaalsContact O-CG 3.3Å; E166-K169 WeakPolarHBondContact O-CG 3.22Å; E166-K169 WeakPolarHBondContact OE1-CE 3.34Å; E166-K169 IonicContact OE1-NZ 3.27Å; E166-K169 PolarHBondContact OE1-NZ 3.4Å; E166-K169 VanDerWaalsContact OE1-NZ 3.13Å; E166-K169 WeakPolarHBondContact OE2-CE 3.37Å; E166-K169 IonicContact OE2-NZ 3.8Å; E166-K169 PolarHBondContact OE2-NZ 2.92Å; E166-I170 HydrophobicContact CG-CD1 4.16Å; E166-I170 WeakPolarHBondContact O-CD1 3.49Å; E166-I170 VanDerWaalsContact O-CG1 3.28Å; E166-I170 WeakPolarHBondContact O-CG1 3.22Å; E166-I170 PolarHBondContact O-N 3.49Å
167	I	96.5	Very high	95	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-69.2	-38.8	178.2	-65.9	-168.6	0	0	0	110.5	L164 K169 I170 L171 L178 H182 I183 L186	L164-I167 PolarHBondContact O-N 2.78Å; I167-K169 PolarHBondContact O-N 3.02Å; I167-I170 PolarHBondContact O-N 3.43Å; I167-L171 HydrophobicContact CG2-CD1 3.56Å; I167-L171 HydrophobicContact CG2-CG 3.89Å; I167-L171 WeakPolarHBondContact O-CB 3.27Å; I167-L171 WeakPolarHBondContact O-CG 3.43Å; I167-L171 PolarHBondContact O-N 3.33Å; I167-L178 HydrophobicContact CD1-CD1 4.12Å; I167-L178 HydrophobicContact CG1-CD1 3.94Å; I167-L178 HydrophobicContact CG2-CD1 4.19Å; I167-L178 HydrophobicContact CG2-CD2 4.33Å; I167-H182 HydrophobicContact CD1-CB 4.19Å; I167-H182 HydrophobicContact CG1-CB 4.19Å; I167-I183 HydrophobicContact CD1-CD1 3.99Å; I167-L186 HydrophobicContact CD1-CD1 3.34Å; I167-L186 HydrophobicContact CD1-CG 4.09Å; I167-L186 HydrophobicContact CG1-CD1 4.21Å
168	N	97.2	Very high	95.1	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-52.3	-55.1	176	177.7	22.6	0	0	0	111.9	M123 R127 L164 I170 L171 A172 L206 H210	M123-N168 PolarHBondContact O-ND2 3.48Å; R127-N168 WeakPolarHBondContact CG-OD1 3.27Å; L164-N168 WeakPolarHBondContact O-CB 3.26Å; L164-N168 PolarHBondContact O-N 3.34Å; N168-I170 VanDerWaalsContact C-N 3.33Å; N168-I170 PolarHBondContact O-N 2.96Å; N168-L171 PolarHBondContact O-N 2.94Å; N168-A172 WeakPolarHBondContact O-CB 3.39Å; N168-A172 PolarHBondContact O-N 3.38Å; N168-L206 HydrophobicContact CB-CD1 4.18Å; N168-L206 HydrophobicContact CB-CD2 3.94Å; N168-H210 PolarHBondContact OD1-NE2 3.41Å
169	K	94.8	Very high	95.2	Very high	39 Å²	39	26 Å²	26	17%	0.17	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-35.4	-179.8	73	179.7	-175.1	-164.8	0	112.9	G165 E166 I167 H173 Y330	G165-K169 PolarHBondContact O-N 2.92Å; G165-K169 VanDerWaalsContact O-N 3.16Å; E166-K169 VanDerWaalsContact O-CG 3.3Å; E166-K169 WeakPolarHBondContact O-CG 3.22Å; E166-K169 WeakPolarHBondContact OE1-CE 3.34Å; E166-K169 IonicContact OE1-NZ 3.27Å; E166-K169 PolarHBondContact OE1-NZ 3.4Å; E166-K169 VanDerWaalsContact OE1-NZ 3.13Å; E166-K169 WeakPolarHBondContact OE2-CE 3.37Å; E166-K169 IonicContact OE2-NZ 3.8Å; E166-K169 PolarHBondContact OE2-NZ 2.92Å; I167-K169 PolarHBondContact O-N 3.02Å; K169-H173 PolarHBondContact O-CD2 2.88Å; K169-H173 PolarHBondContact O-N 3.33Å; K169-Y330 HydrophobicContact CB-CD1 3.91Å; K169-Y330 HydrophobicContact CB-CE1 4.16Å; K169-Y330 HydrophobicContact CB-CG 4.3Å; K169-Y330 HydrophobicContact CD-CD1 4.27Å; K169-Y330 HydrophobicContact CD-CD2 3.74Å; K169-Y330 HydrophobicContact CD-CE1 4.49Å; K169-Y330 HydrophobicContact CD-CE2 3.97Å; K169-Y330 HydrophobicContact CD-CG 3.89Å; K169-Y330 HydrophobicContact CG-CD1 4.13Å; K169-Y330 HydrophobicContact CG-CD2 4.36Å; K169-Y330 HydrophobicContact CG-CE1 4.08Å; K169-Y330 HydrophobicContact CG-CE2 4.29Å; K169-Y330 HydrophobicContact CG-CG 4.26Å; K169-Y330 WeakPolarHBondContact O-CE1 3.35Å
170	I	96.3	Very high	95.4	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-65.3	-50.3	178	-69.4	168.6	0	0	0	109.5	E166 I167 N168 A172 H173 R174 P175 L177 L178 H182	E166-I170 HydrophobicContact CG-CD1 4.16Å; E166-I170 WeakPolarHBondContact O-CD1 3.49Å; E166-I170 VanDerWaalsContact O-CG1 3.28Å; E166-I170 WeakPolarHBondContact O-CG1 3.22Å; E166-I170 PolarHBondContact O-N 3.49Å; I167-I170 PolarHBondContact O-N 3.43Å; N168-I170 VanDerWaalsContact C-N 3.33Å; N168-I170 PolarHBondContact O-N 2.96Å; I170-A172 PolarHBondContact O-N 3.2Å; I170-H173 PolarHBondContact O-N 3.48Å; I170-R174 WeakPolarHBondContact CG2-O 3.45Å; I170-R174 CarbonylContact O-C 3.6Å; I170-R174 WeakPolarHBondContact O-CA 3.49Å; I170-R174 PolarHBondContact O-N 2.78Å; I170-P175 WeakPolarHBondContact O-CA 3.42Å; I170-L177 HydrophobicContact CG2-CB 4.27Å; I170-L178 HydrophobicContact CG2-CB 3.81Å; I170-L178 HydrophobicContact CG2-CD1 4.39Å; I170-H182 VanDerWaalsContact CD1-CD2 3.42Å; I170-H182 WeakPolarHBondContact CD1-CD2 3.17Å; I170-H182 VanDerWaalsContact CD1-NE2 3.28Å; I170-H182 WeakPolarHBondContact CD1-NE2 3.38Å
171	L	97.7	Very high	95.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-46.9	179.8	-72.3	175.8	0	0	0	112.2	I167 N168 H173 P175 L178 V203 L206 T207 E475 A479	I167-L171 HydrophobicContact CG2-CD1 3.56Å; I167-L171 HydrophobicContact CG2-CG 3.89Å; I167-L171 WeakPolarHBondContact O-CB 3.27Å; I167-L171 WeakPolarHBondContact O-CG 3.43Å; I167-L171 PolarHBondContact O-N 3.33Å; N168-L171 PolarHBondContact O-N 2.94Å; L171-H173 PolarHBondContact O-N 3.48Å; L171-P175 HydrophobicContact CD2-CB 4.37Å; L171-L178 HydrophobicContact CD2-CD2 3.68Å; L171-L178 HydrophobicContact CG-CD2 4.27Å; L171-V203 HydrophobicContact CD1-CG1 4.47Å; L171-V203 HydrophobicContact CD1-CG2 4.45Å; L171-L206 HydrophobicContact CD1-CB 4.46Å; L171-L206 HydrophobicContact CD1-CD1 4.19Å; L171-T207 HydrophobicContact CD1-CG2 4.24Å; L171-E475 VanDerWaalsContact O-CD 3.26Å; L171-E475 WeakPolarHBondContact O-CG 3.45Å; L171-A479 HydrophobicContact CD2-CB 3.96Å
172	A	96.3	Very high	95.6	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-27.2	-176.4	0	0	0	0	0	114.2	R127 N168 I170 R471	R127-A172 HydrophobicContact CB-CB 3.74Å; R127-A172 HydrophobicContact CG-CB 3.87Å; N168-A172 WeakPolarHBondContact O-CB 3.39Å; N168-A172 PolarHBondContact O-N 3.38Å; I170-A172 PolarHBondContact O-N 3.2Å; A172-R471 PolarHBondContact O-NH2 3.5Å
173	H	94.8	Very high	95.7	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.028	13%	0.129	C	C	.	.	H	α-helix	trans	-130.1	-36.2	-165	-66.5	-68.8	0	0	0	114.4	R127 H128 K169 I170 L171 Y330 Y332	R127-H173 PolarHBondContact NE-NE2 3.34Å; R127-H173 PolarHBondContact NH2-CD2 3.37Å; R127-H173 PolarHBondContact NH2-NE2 3.07Å; R127-H173 VanDerWaalsContact NH2-NE2 3.16Å; R127-H173 PolarHBondContact O-CE1 3.12Å; R127-H173 PolarHBondContact O-NE2 2.73Å; H128-H173 AromaticContact CE1-CE1 3.66Å; K169-H173 PolarHBondContact O-CD2 2.88Å; K169-H173 PolarHBondContact O-N 3.33Å; I170-H173 PolarHBondContact O-N 3.48Å; L171-H173 PolarHBondContact O-N 3.48Å; H173-Y330 HydrophobicContact CB-CD1 4.1Å; H173-Y330 HydrophobicContact CB-CE1 3.91Å; H173-Y330 AromaticContact CD2-CD1 3.96Å; H173-Y332 PolarHBondContact ND1-N 3.16Å; H173-Y332 VanDerWaalsContact O-CD2 3.24Å; H173-Y332 WeakPolarHBondContact O-CD2 3.21Å
174	R	94.9	Very high	95.9	Very high	37 Å²	37	26.7 Å²	26.7	14%	0.14	13%	0.13	C	C	.	.			trans	-147.3	59.7	-173.7	-63.5	-174.6	-82.9	175.1	-6.7	110.4	I170 W176 L177 Y330	I170-R174 WeakPolarHBondContact CG2-O 3.45Å; I170-R174 CarbonylContact O-C 3.6Å; I170-R174 WeakPolarHBondContact O-CA 3.49Å; I170-R174 PolarHBondContact O-N 2.78Å; R174-W176 HydrophobicContact CB-CD2 4.46Å; R174-W176 HydrophobicContact CB-CH2 4.32Å; R174-W176 HydrophobicContact CB-CZ2 3.84Å; R174-W176 HydrophobicContact CG-CH2 4.16Å; R174-W176 HydrophobicContact CG-CZ2 3.71Å; R174-W176 PolarHBondContact O-N 2.71Å; R174-L177 HydrophobicContact CB-CD1 3.82Å; R174-L177 HydrophobicContact CB-CG 4.11Å; R174-L177 HydrophobicContact CG-CD1 4.47Å; R174-L177 WeakPolarHBondContact O-CB 3.44Å; R174-L177 PolarHBondContact O-N 3.33Å; R174-Y330 PolarHBondContact NE-OH 3.12Å; R174-Y330 VanDerWaalsContact NH2-CD2 3.32Å
175	P	96.7	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-60	-25.1	-169.4	23.5	-35.4	0	0	0	113.2	I170 L171 L177 L178 F409 E475 Y478	I170-P175 WeakPolarHBondContact O-CA 3.42Å; L171-P175 HydrophobicContact CD2-CB 4.37Å; P175-L177 PolarHBondContact O-N 3.41Å; P175-L178 VanDerWaalsContact O-CB 3.22Å; P175-L178 WeakPolarHBondContact O-CB 3.4Å; P175-L178 PolarHBondContact O-N 3.39Å; P175-L178 VanDerWaalsContact O-N 3.08Å; P175-F409 HydrophobicContact CG-CD1 3.45Å; P175-F409 VanDerWaalsContact CG-CD1 3.45Å; P175-F409 HydrophobicContact CG-CE1 3.74Å; P175-E475 HydrophobicContact CB-CG 4.36Å; P175-E475 HydrophobicContact CG-CG 4.26Å; P175-Y478 HydrophobicContact CB-CD2 3.78Å; P175-Y478 HydrophobicContact CB-CG 4.2Å; P175-Y478 HydrophobicContact CG-CD2 3.94Å; P175-Y478 HydrophobicContact CG-CE2 4.39Å; P175-Y478 WeakPolarHBondContact O-CB 3.36Å
176	W	95.4	Very high	95.9	Very high	19 Å²	19	32.6 Å²	32.6	7%	0.072	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-64.6	-18.6	176	58.1	86.7	0	0	0	115.4	R174 L178 Y332 Q333 F335 V342 F409 Y478	R174-W176 HydrophobicContact CB-CD2 4.46Å; R174-W176 HydrophobicContact CB-CH2 4.32Å; R174-W176 HydrophobicContact CB-CZ2 3.84Å; R174-W176 HydrophobicContact CG-CH2 4.16Å; R174-W176 HydrophobicContact CG-CZ2 3.71Å; R174-W176 PolarHBondContact O-N 2.71Å; W176-L178 VanDerWaalsContact C-N 3.25Å; W176-Y332 HydrophobicContact CH2-CD2 4.25Å; W176-Y332 AromaticContact CH2-CE2 3.76Å; W176-Y332 HydrophobicContact CH2-CE2 3.76Å; W176-Y332 HydrophobicContact CZ3-CE2 4.26Å; W176-Q333 VanDerWaalsContact CH2-O 3.24Å; W176-Q333 WeakPolarHBondContact CH2-O 3.37Å; W176-Q333 WeakPolarHBondContact CZ2-O 3.24Å; W176-F335 HydrophobicContact CB-CD2 3.94Å; W176-F335 HydrophobicContact CB-CE2 3.41Å; W176-F335 VanDerWaalsContact CB-CE2 3.41Å; W176-F335 HydrophobicContact CB-CZ 4.43Å; W176-F335 AromaticContact CD1-CD2 3.98Å; W176-F335 AromaticContact CD2-CD2 3.32Å; W176-F335 HydrophobicContact CD2-CD2 3.32Å; W176-F335 AromaticContact CD2-CE2 3.82Å; W176-F335 HydrophobicContact CD2-CE2 3.82Å; W176-F335 HydrophobicContact CD2-CG 4.33Å; W176-F335 AromaticContact CE2-CD2 3.79Å; W176-F335 AromaticContact CE3-CD2 3.55Å; W176-F335 HydrophobicContact CE3-CD2 3.55Å; W176-F335 HydrophobicContact CE3-CE2 4.2Å; W176-F335 AromaticContact CG-CD2 3.49Å; W176-F335 HydrophobicContact CG-CD2 3.49Å; W176-F335 VanDerWaalsContact CG-CD2 3.49Å; W176-F335 AromaticContact CG-CE2 3.46Å; W176-F335 HydrophobicContact CG-CE2 3.46Å; W176-F335 VanDerWaalsContact CG-CE2 3.46Å; W176-F335 HydrophobicContact CH2-CB 4.33Å; W176-F335 HydrophobicContact CZ2-CB 4.26Å; W176-F335 HydrophobicContact CZ2-CD2 4.4Å; W176-F335 HydrophobicContact CZ3-CD2 4.16Å; W176-V342 HydrophobicContact CG-CG1 4.41Å; W176-F409 HydrophobicContact CE3-CD1 4.03Å; W176-F409 AromaticContact CZ3-CD1 3.63Å; W176-F409 HydrophobicContact CZ3-CD1 3.63Å; W176-F409 HydrophobicContact CZ3-CE1 4.26Å; W176-F409 HydrophobicContact CZ3-CG 4.48Å; W176-Y478 HydrophobicContact CB-CD1 4.21Å; W176-Y478 HydrophobicContact CB-CE1 3.63Å; W176-Y478 HydrophobicContact CB-CE2 4.09Å
177	L	95.1	Very high	95.8	Very high	54 Å²	54	30.7 Å²	30.7	28%	0.283	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-81.2	-5.4	174.7	-61.3	-178.9	0	0	0	112.9	I170 R174 P175 T179	I170-L177 HydrophobicContact CG2-CB 4.27Å; R174-L177 HydrophobicContact CB-CD1 3.82Å; R174-L177 HydrophobicContact CB-CG 4.11Å; R174-L177 HydrophobicContact CG-CD1 4.47Å; R174-L177 WeakPolarHBondContact O-CB 3.44Å; R174-L177 PolarHBondContact O-N 3.33Å; P175-L177 PolarHBondContact O-N 3.41Å; L177-T179 WeakPolarHBondContact O-CG2 3.37Å; L177-T179 PolarHBondContact O-N 3.14Å
178	L	96.2	Very high	95.3	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.037	17%	0.167	C	C	.	.			trans	-71.4	123.6	178.2	-170.8	59	0	0	0	110.5	I167 I170 L171 P175 W176 H182 A479 A482	I167-L178 HydrophobicContact CD1-CD1 4.12Å; I167-L178 HydrophobicContact CG1-CD1 3.94Å; I167-L178 HydrophobicContact CG2-CD1 4.19Å; I167-L178 HydrophobicContact CG2-CD2 4.33Å; I170-L178 HydrophobicContact CG2-CB 3.81Å; I170-L178 HydrophobicContact CG2-CD1 4.39Å; L171-L178 HydrophobicContact CD2-CD2 3.68Å; L171-L178 HydrophobicContact CG-CD2 4.27Å; P175-L178 VanDerWaalsContact O-CB 3.22Å; P175-L178 WeakPolarHBondContact O-CB 3.4Å; P175-L178 PolarHBondContact O-N 3.39Å; P175-L178 VanDerWaalsContact O-N 3.08Å; W176-L178 VanDerWaalsContact C-N 3.25Å; L178-H182 HydrophobicContact CD1-CB 3.6Å; L178-A479 HydrophobicContact CD2-CB 3.88Å; L178-A482 HydrophobicContact CG-CB 4.1Å
179	T	96.1	Very high	94.3	Very high	52 Å²	52	38 Å²	38	32%	0.319	18%	0.175	S	C	.	.			trans	-121	167.3	-176.7	76.4	0	0	0	0	111.9	L177 E181 H182	L177-T179 WeakPolarHBondContact O-CG2 3.37Å; L177-T179 PolarHBondContact O-N 3.14Å; T179-E181 WeakPolarHBondContact CB-OE2 3.24Å; T179-E181 PolarHBondContact O-N 2.84Å; T179-E181 PolarHBondContact OG1-N 3.48Å; T179-E181 PolarHBondContact OG1-OE2 3.03Å; T179-H182 PolarHBondContact N-ND1 3.47Å; T179-H182 VanDerWaalsContact N-ND1 3.18Å; T179-H182 WeakPolarHBondContact O-CB 3.32Å; T179-H182 PolarHBondContact O-N 3.41Å; T179-H182 VanDerWaalsContact O-N 3.12Å; T179-H182 PolarHBondContact OG1-ND1 3.33Å
180	K	96.3	Very high	93.1	Very high	82 Å²	82	45.5 Å²	45.5	36%	0.357	21%	0.21	S	C	.	.	H	α-helix	trans	-61.2	-30.3	176.4	67.4	175.7	-175	172.2	0	112.5	H182 I183 E184 R485	K180-H182 PolarHBondContact O-N 2.89Å; K180-I183 CarbonylContact O-C 3.41Å; K180-I183 WeakPolarHBondContact O-CA 3.5Å; K180-I183 WeakPolarHBondContact O-CB 3.35Å; K180-I183 PolarHBondContact O-N 2.99Å; K180-E184 WeakPolarHBondContact O-CG 3.18Å; K180-E184 PolarHBondContact O-N 3.28Å; K180-R485 HydrophobicContact CB-CB 4.23Å
181	E	96.6	Very high	92	Very high	92 Å²	92	53.1 Å²	53.1	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-28.7	178.1	-61.8	71.4	-153.1	0	0	111.9	T179 R185	T179-E181 WeakPolarHBondContact CB-OE2 3.24Å; T179-E181 PolarHBondContact O-N 2.84Å; T179-E181 PolarHBondContact OG1-N 3.48Å; T179-E181 PolarHBondContact OG1-OE2 3.03Å; E181-R185 WeakPolarHBondContact O-CG 3.5Å; E181-R185 PolarHBondContact O-N 3.13Å
182	H	96.8	Very high	91.2	Very high	29 Å²	29	56.2 Å²	56.2	13%	0.134	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-42.5	170.1	-63.7	86.4	0	0	0	111	I167 I170 L178 T179 K180 R185	I167-H182 HydrophobicContact CD1-CB 4.19Å; I167-H182 HydrophobicContact CG1-CB 4.19Å; I170-H182 VanDerWaalsContact CD1-CD2 3.42Å; I170-H182 WeakPolarHBondContact CD1-CD2 3.17Å; I170-H182 VanDerWaalsContact CD1-NE2 3.28Å; I170-H182 WeakPolarHBondContact CD1-NE2 3.38Å; L178-H182 HydrophobicContact CD1-CB 3.6Å; T179-H182 PolarHBondContact N-ND1 3.47Å; T179-H182 VanDerWaalsContact N-ND1 3.18Å; T179-H182 WeakPolarHBondContact O-CB 3.32Å; T179-H182 PolarHBondContact O-N 3.41Å; T179-H182 VanDerWaalsContact O-N 3.12Å; T179-H182 PolarHBondContact OG1-ND1 3.33Å; K180-H182 PolarHBondContact O-N 2.89Å; H182-R185 PolarHBondContact CD2-NH2 3.37Å; H182-R185 PolarHBondContact NE2-NH2 3.02Å
183	I	97.4	Very high	90.9	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-45.1	177.5	-51.1	-54.4	0	0	0	110.7	I167 K180 R185 L186 L187 L199 A482 I483 Y486	I167-I183 HydrophobicContact CD1-CD1 3.99Å; K180-I183 CarbonylContact O-C 3.41Å; K180-I183 WeakPolarHBondContact O-CA 3.5Å; K180-I183 WeakPolarHBondContact O-CB 3.35Å; K180-I183 PolarHBondContact O-N 2.99Å; I183-R185 VanDerWaalsContact C-N 3.3Å; I183-R185 PolarHBondContact O-N 3.49Å; I183-L186 PolarHBondContact O-N 3.18Å; I183-L186 VanDerWaalsContact O-N 3.13Å; I183-L187 HydrophobicContact CG2-CD1 3.68Å; I183-L187 HydrophobicContact CG2-CG 4.35Å; I183-L187 WeakPolarHBondContact O-CG 3.46Å; I183-L187 PolarHBondContact O-N 3.14Å; I183-L199 HydrophobicContact CD1-CD2 4.34Å; I183-L199 HydrophobicContact CG2-CD2 3.97Å; I183-A482 HydrophobicContact CD1-CB 4.31Å; I183-A482 HydrophobicContact CG1-CB 3.94Å; I183-I483 HydrophobicContact CD1-CG1 3.79Å; I183-I483 HydrophobicContact CG1-CG1 4.11Å; I183-I483 HydrophobicContact CG2-CG1 4.16Å; I183-Y486 HydrophobicContact CB-CG 4.43Å; I183-Y486 HydrophobicContact CG2-CD1 3.98Å; I183-Y486 HydrophobicContact CG2-CG 3.91Å
184	E	95.3	Very high	91	Very high	50 Å²	50	58.6 Å²	58.6	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-54.7	-43.8	177.5	-75.5	-169.3	-156.6	0	0	112.6	K180 L186 L187 K188 Y486	K180-E184 WeakPolarHBondContact O-CG 3.18Å; K180-E184 PolarHBondContact O-N 3.28Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.03Å; E184-L187 PolarHBondContact O-N 3.14Å; E184-K188 HydrophobicContact CB-CD 4.4Å; E184-K188 VanDerWaalsContact O-CB 3.31Å; E184-K188 WeakPolarHBondContact O-CB 3.41Å; E184-K188 WeakPolarHBondContact O-CG 3.48Å; E184-K188 PolarHBondContact O-N 3.27Å; E184-K188 IonicContact OE2-NZ 3.6Å; E184-K188 PolarHBondContact OE2-NZ 3.02Å; E184-Y486 HydrophobicContact CB-CD2 4.37Å; E184-Y486 HydrophobicContact CB-CE2 4.35Å; E184-Y486 HydrophobicContact CG-CD2 3.28Å; E184-Y486 HydrophobicContact CG-CE2 3.49Å; E184-Y486 VanDerWaalsContact CG-CE2 3.49Å; E184-Y486 HydrophobicContact CG-CG 4.45Å
185	R	94.1	Very high	91	Very high	131 Å²	131	59.4 Å²	59.4	49%	0.494	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-36.7	179.8	-76.8	-174.2	-71	155.5	-9	112.7	E181 H182 I183 T189	E181-R185 WeakPolarHBondContact O-CG 3.5Å; E181-R185 PolarHBondContact O-N 3.13Å; H182-R185 PolarHBondContact CD2-NH2 3.37Å; H182-R185 PolarHBondContact NE2-NH2 3.02Å; I183-R185 VanDerWaalsContact C-N 3.3Å; I183-R185 PolarHBondContact O-N 3.49Å; R185-T189 PolarHBondContact O-OG1 3.33Å
186	L	94.9	Very high	91	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-73.9	-34.9	178.5	-65	-170.2	0	0	0	112.9	Q163 L164 I167 I183 E184 W194 L199	Q163-L186 HydrophobicContact CB-CD2 3.61Å; L164-L186 HydrophobicContact CD1-CD1 4.1Å; I167-L186 HydrophobicContact CD1-CD1 3.34Å; I167-L186 HydrophobicContact CD1-CG 4.09Å; I167-L186 HydrophobicContact CG1-CD1 4.21Å; I183-L186 PolarHBondContact O-N 3.18Å; I183-L186 VanDerWaalsContact O-N 3.13Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.03Å; L186-W194 HydrophobicContact CB-CB 4.29Å; L186-W194 HydrophobicContact CB-CG 4.24Å; L186-W194 PolarHBondContact O-N 3.43Å; L186-L199 HydrophobicContact CD1-CD1 3.51Å; L186-L199 HydrophobicContact CD1-CD2 4.46Å
187	L	93.3	Very high	91.1	Very high	25 Å²	25	62 Å²	62	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-90	-23	-173.4	-59.6	176.8	0	0	0	113.4	I183 E184 W194 L196 L199 Y486	I183-L187 HydrophobicContact CG2-CD1 3.68Å; I183-L187 HydrophobicContact CG2-CG 4.35Å; I183-L187 WeakPolarHBondContact O-CG 3.46Å; I183-L187 PolarHBondContact O-N 3.14Å; E184-L187 PolarHBondContact O-N 3.14Å; L187-W194 HydrophobicContact CD2-CB 4.07Å; L187-W194 WeakPolarHBondContact CD2-O 3.39Å; L187-L196 HydrophobicContact CD1-CD2 3.67Å; L187-L196 HydrophobicContact CD1-CG 4.29Å; L187-L196 HydrophobicContact CD2-CD2 4.43Å; L187-L199 HydrophobicContact CD2-CD2 4.25Å; L187-L199 HydrophobicContact CG-CD2 4.5Å; L187-Y486 HydrophobicContact CB-CE1 4.48Å; L187-Y486 HydrophobicContact CD1-CD1 3.54Å; L187-Y486 HydrophobicContact CD1-CE1 3.1Å; L187-Y486 HydrophobicContact CD1-CG 4.42Å; L187-Y486 HydrophobicContact CG-CE1 4.38Å
188	K	86.2	Confident	91.2	Very high	129 Å²	129	61.2 Å²	61.2	56%	0.561	30%	0.302	S	S	*	.	S	Bend	trans	-95	1.8	-177.1	-68.1	179.3	178.2	170	0	115.2	E184 E190	E184-K188 HydrophobicContact CB-CD 4.4Å; E184-K188 VanDerWaalsContact O-CB 3.31Å; E184-K188 WeakPolarHBondContact O-CB 3.41Å; E184-K188 WeakPolarHBondContact O-CG 3.48Å; E184-K188 PolarHBondContact O-N 3.27Å; E184-K188 IonicContact OE2-NZ 3.6Å; E184-K188 PolarHBondContact OE2-NZ 3.02Å; K188-E190 PolarHBondContact O-N 3.07Å
189	T	75.1	Confident	91.3	Very high	35 Å²	35	60.9 Å²	60.9	22%	0.215	30%	0.3	C	S	.	.			trans	-77	105.5	-179.1	-61.5	0	0	0	0	110.6	Q163 R185 E191 H192 S193	Q163-T189 VanDerWaalsContact NE2-CG2 3.34Å; Q163-T189 PolarHBondContact NE2-OG1 3.18Å; R185-T189 PolarHBondContact O-OG1 3.33Å; T189-E191 PolarHBondContact O-N 3.07Å; T189-H192 HydrophobicContact CG2-CB 4.25Å; T189-H192 PolarHBondContact O-N 3.44Å; T189-S193 WeakPolarHBondContact O-CA 3.37Å; T189-S193 WeakPolarHBondContact O-CB 3.47Å; T189-S193 PolarHBondContact O-N 2.85Å
190	E	70.9	Confident	91.4	Very high	196 Å²	196	58.5 Å²	58.5	92%	0.916	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-44.1	-169.3	-64.3	-177.1	178.3	0	0	115.4	K188	K188-E190 PolarHBondContact O-N 3.07Å
191	E	72.8	Confident	91.5	Very high	164 Å²	164	54.6 Å²	54.6	77%	0.766	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-22.2	-173.7	-162.5	171.2	-175.1	0	0	113.8	T189	T189-E191 PolarHBondContact O-N 3.07Å
192	H	80.6	Confident	91.6	Very high	65 Å²	65	50.2 Å²	50.2	30%	0.301	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.4	29.1	-171.5	-65.2	-39.3	0	0	0	113.2	Q159 K160 T189	Q159-H192 PolarHBondContact OE1-CD2 2.84Å; Q159-H192 VanDerWaalsContact OE1-CD2 3.25Å; K160-H192 HydrophobicContact CB-CB 4.16Å; K160-H192 WeakPolarHBondContact CG-O 3.19Å; T189-H192 HydrophobicContact CG2-CB 4.25Å; T189-H192 PolarHBondContact O-N 3.44Å
193	S	89.2	Confident	91.7	Very high	53 Å²	53	48.9 Å²	48.9	37%	0.371	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-60.4	139.6	-176.5	55	0	0	0	0	111.9	K160 T189	K160-S193 WeakPolarHBondContact CE-O 3.49Å; K160-S193 PolarHBondContact NZ-O 3.14Å; K160-S193 VanDerWaalsContact NZ-O 3.09Å; T189-S193 WeakPolarHBondContact O-CA 3.37Å; T189-S193 WeakPolarHBondContact O-CB 3.47Å; T189-S193 PolarHBondContact O-N 2.85Å
194	W	96.5	Very high	91.7	Very high	5 Å²	5	48.9 Å²	48.9	2%	0.019	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-75.9	141.2	162.1	-69.9	79.7	0	0	0	109.7	L112 I120 K160 L161 L164 L186 L187 E198 A202	L112-W194 HydrophobicContact CD1-CZ3 4.3Å; L112-W194 HydrophobicContact CD2-CH2 4.27Å; L112-W194 HydrophobicContact CD2-CZ3 3.76Å; I120-W194 HydrophobicContact CD1-CH2 4.19Å; K160-W194 HydrophobicContact CG-CD2 4.22Å; K160-W194 HydrophobicContact CG-CG 4.45Å; K160-W194 HydrophobicContact CG-CZ2 3.84Å; K160-W194 WeakPolarHBondContact O-CZ2 3.39Å; K160-W194 PolarHBondContact O-NE1 2.8Å; L161-W194 HydrophobicContact CD2-CH2 4.1Å; L161-W194 HydrophobicContact CD2-CZ2 4.12Å; L164-W194 HydrophobicContact CB-CZ2 4.03Å; L164-W194 HydrophobicContact CD1-CH2 4.5Å; L164-W194 HydrophobicContact CD1-CZ2 4.31Å; L164-W194 HydrophobicContact CD2-CH2 3.95Å; L164-W194 HydrophobicContact CD2-CZ2 4.09Å; L164-W194 HydrophobicContact CG-CZ2 4.38Å; L186-W194 HydrophobicContact CB-CB 4.29Å; L186-W194 HydrophobicContact CB-CG 4.24Å; L186-W194 PolarHBondContact O-N 3.43Å; L187-W194 HydrophobicContact CD2-CB 4.07Å; L187-W194 WeakPolarHBondContact CD2-O 3.39Å; W194-E198 HydrophobicContact CE3-CB 3.67Å; W194-E198 HydrophobicContact CZ3-CB 4.06Å; W194-A202 HydrophobicContact CH2-CB 4.01Å; W194-A202 HydrophobicContact CZ3-CB 3.66Å
195	S	96.2	Very high	91.9	Very high	53 Å²	53	46.5 Å²	46.5	37%	0.371	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-82	161.6	158.8	67.5	0	0	0	0	110.1	A197 E198 L199	S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 2.73Å; S195-E198 PolarHBondContact N-OE2 2.89Å; S195-E198 PolarHBondContact O-N 2.99Å; S195-E198 WeakPolarHBondContact OG-CB 3.44Å; S195-E198 WeakPolarHBondContact OG-CG 3.44Å; S195-E198 PolarHBondContact OG-N 3.27Å; S195-E198 VanDerWaalsContact OG-N 3.17Å; S195-E198 PolarHBondContact OG-OE2 2.83Å; S195-L199 WeakPolarHBondContact O-CB 3.49Å; S195-L199 PolarHBondContact O-N 3Å
196	L	96.7	Very high	92.1	Very high	43 Å²	43	40.3 Å²	40.3	23%	0.225	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-37.5	174.7	-75.8	169.6	0	0	0	112.3	L187 L199 I200 L363 I483 M487	L187-L196 HydrophobicContact CD1-CD2 3.67Å; L187-L196 HydrophobicContact CD1-CG 4.29Å; L187-L196 HydrophobicContact CD2-CD2 4.43Å; L196-L199 PolarHBondContact O-N 2.95Å; L196-I200 VanDerWaalsContact O-CG1 3.31Å; L196-I200 WeakPolarHBondContact O-CG1 3.47Å; L196-I200 PolarHBondContact O-N 2.93Å; L196-L363 HydrophobicContact CB-CD1 4.22Å; L196-L363 HydrophobicContact CB-CD2 3.92Å; L196-L363 HydrophobicContact CD1-CD2 4.22Å; L196-I483 HydrophobicContact CD2-CG2 4.02Å; L196-M487 HydrophobicContact CD1-CE 3.76Å; L196-M487 HydrophobicContact CD1-CG 4.36Å; L196-M487 HydrophobicContact CD1-SD 4.08Å; L196-M487 HydrophobicContact CD2-SD 4.49Å
197	A	97.1	Very high	92.3	Very high	31 Å²	31	40 Å²	40	26%	0.256	21%	0.206	S	C	.	.	H	α-helix	trans	-66.3	-46	178.3	0	0	0	0	0	111.8	P111 S195 L199 I200 H201 L363	P111-A197 HydrophobicContact CB-CB 4.16Å; P111-A197 HydrophobicContact CG-CB 3.93Å; S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 2.73Å; A197-L199 VanDerWaalsContact C-N 3.33Å; A197-L199 PolarHBondContact O-N 3.32Å; A197-I200 PolarHBondContact O-N 3.06Å; A197-H201 PolarHBondContact O-N 3.18Å; A197-L363 VanDerWaalsContact CB-O 3.32Å; A197-L363 WeakPolarHBondContact CB-O 3.01Å
198	E	97.8	Very high	92.6	Very high	37 Å²	37	38.9 Å²	38.9	17%	0.173	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-41.1	174.4	-71.3	169.9	130	0	0	111.9	P111 L112 K160 W194 S195 H201 A202	P111-E198 HydrophobicContact CB-CB 4.47Å; P111-E198 HydrophobicContact CB-CG 3.98Å; L112-E198 HydrophobicContact CD2-CB 3.92Å; L112-E198 HydrophobicContact CD2-CG 3.92Å; L112-E198 HydrophobicContact CG-CB 4.35Å; L112-E198 HydrophobicContact CG-CG 4.42Å; K160-E198 IonicContact NZ-OE1 3.21Å; K160-E198 PolarHBondContact NZ-OE1 3.18Å; K160-E198 IonicContact NZ-OE2 2.82Å; K160-E198 PolarHBondContact NZ-OE2 3.08Å; W194-E198 HydrophobicContact CE3-CB 3.67Å; W194-E198 HydrophobicContact CZ3-CB 4.06Å; S195-E198 PolarHBondContact N-OE2 2.89Å; S195-E198 PolarHBondContact O-N 2.99Å; S195-E198 WeakPolarHBondContact OG-CB 3.44Å; S195-E198 WeakPolarHBondContact OG-CG 3.44Å; S195-E198 PolarHBondContact OG-N 3.27Å; S195-E198 VanDerWaalsContact OG-N 3.17Å; S195-E198 PolarHBondContact OG-OE2 2.83Å; E198-H201 PolarHBondContact O-N 2.88Å; E198-A202 WeakPolarHBondContact O-CB 3.4Å; E198-A202 PolarHBondContact O-N 3.38Å
199	L	97.9	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-42.6	179.5	180	57.3	0	0	0	111.6	L164 I183 L186 L187 S195 L196 A197 A202 V203 I483	L164-L199 HydrophobicContact CD1-CD1 4.33Å; I183-L199 HydrophobicContact CD1-CD2 4.34Å; I183-L199 HydrophobicContact CG2-CD2 3.97Å; L186-L199 HydrophobicContact CD1-CD1 3.51Å; L186-L199 HydrophobicContact CD1-CD2 4.46Å; L187-L199 HydrophobicContact CD2-CD2 4.25Å; L187-L199 HydrophobicContact CG-CD2 4.5Å; S195-L199 WeakPolarHBondContact O-CB 3.49Å; S195-L199 PolarHBondContact O-N 3Å; L196-L199 PolarHBondContact O-N 2.95Å; A197-L199 VanDerWaalsContact C-N 3.33Å; A197-L199 PolarHBondContact O-N 3.32Å; L199-A202 PolarHBondContact O-N 2.91Å; L199-V203 HydrophobicContact CD1-CG2 4.06Å; L199-V203 HydrophobicContact CG-CG2 4.41Å; L199-V203 WeakPolarHBondContact O-CB 3.36Å; L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.16Å; L199-I483 HydrophobicContact CD2-CD1 4.4Å; L199-I483 HydrophobicContact CD2-CG1 4.46Å; L199-I483 HydrophobicContact CG-CD1 4.49Å
200	I	98.1	Very high	94.3	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-45.7	175.1	-72.4	-70.7	0	0	0	110.6	L196 A197 A202 V203 V204 V360 L363 L480 I483	L196-I200 VanDerWaalsContact O-CG1 3.31Å; L196-I200 WeakPolarHBondContact O-CG1 3.47Å; L196-I200 PolarHBondContact O-N 2.93Å; A197-I200 PolarHBondContact O-N 3.06Å; I200-A202 VanDerWaalsContact C-N 3.34Å; I200-A202 PolarHBondContact O-N 3.45Å; I200-V203 PolarHBondContact O-N 2.8Å; I200-V204 HydrophobicContact CG2-CG2 4.49Å; I200-V204 VanDerWaalsContact O-CG2 3.32Å; I200-V204 WeakPolarHBondContact O-CG2 3.41Å; I200-V204 PolarHBondContact O-N 3.12Å; I200-V360 HydrophobicContact CG2-CG1 4.26Å; I200-L363 HydrophobicContact CB-CB 4.41Å; I200-L363 HydrophobicContact CD1-CD1 3.99Å; I200-L363 HydrophobicContact CG1-CB 3.82Å; I200-L363 HydrophobicContact CG1-CD1 3.57Å; I200-L363 HydrophobicContact CG1-CG 4.35Å; I200-L480 HydrophobicContact CD1-CD2 3.46Å; I200-L480 VanDerWaalsContact CD1-CD2 3.46Å; I200-I483 HydrophobicContact CD1-CD1 3.61Å; I200-I483 HydrophobicContact CG1-CD1 4.46Å
201	H	98.2	Very high	95.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.3	-45.6	176.4	-168.6	177.6	0	0	0	111.5	L105 P111 L112 R117 A197 E198 V204 L205 Y364	L105-H201 PolarHBondContact O-NE2 2.89Å; L105-H201 VanDerWaalsContact O-NE2 3.11Å; P111-H201 HydrophobicContact CB-CB 4.42Å; P111-H201 HydrophobicContact CG-CB 4.32Å; L112-H201 HydrophobicContact CD1-CB 3.94Å; L112-H201 HydrophobicContact CG-CB 4.35Å; R117-H201 PolarHBondContact NE-CE1 3.47Å; R117-H201 VanDerWaalsContact NE-CE1 3.34Å; A197-H201 PolarHBondContact O-N 3.18Å; E198-H201 PolarHBondContact O-N 2.88Å; H201-V204 PolarHBondContact O-N 3.38Å; H201-L205 WeakPolarHBondContact O-CG 3.32Å; H201-L205 PolarHBondContact O-N 3.3Å; H201-Y364 HydrophobicContact CB-CD1 3.92Å; H201-Y364 HydrophobicContact CB-CE1 3.81Å; H201-Y364 AromaticContact CD2-CE1 3.54Å; H201-Y364 AromaticContact CE1-CE1 3.94Å; H201-Y364 PolarHBondContact CE1-OH 3.05Å; H201-Y364 AromaticContact CG-CE1 3.47Å; H201-Y364 VanDerWaalsContact CG-CE1 3.47Å; H201-Y364 AromaticContact ND1-CE1 3.77Å; H201-Y364 AromaticContact NE2-CE1 3.85Å
202	A	98.6	Very high	96.8	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.8	-45.6	176.8	0	0	0	0	0	112.5	L112 I120 L164 W194 E198 L199 I200 V204 L205 L206	L112-A202 HydrophobicContact CD1-CB 4.1Å; I120-A202 HydrophobicContact CD1-CB 4.02Å; L164-A202 HydrophobicContact CD1-CB 4.21Å; L164-A202 HydrophobicContact CD2-CB 3.95Å; W194-A202 HydrophobicContact CH2-CB 4.01Å; W194-A202 HydrophobicContact CZ3-CB 3.66Å; E198-A202 WeakPolarHBondContact O-CB 3.4Å; E198-A202 PolarHBondContact O-N 3.38Å; L199-A202 PolarHBondContact O-N 2.91Å; I200-A202 VanDerWaalsContact C-N 3.34Å; I200-A202 PolarHBondContact O-N 3.45Å; A202-V204 VanDerWaalsContact C-N 3.34Å; A202-V204 PolarHBondContact O-N 3.44Å; A202-L205 PolarHBondContact O-N 3.45Å; A202-L206 WeakPolarHBondContact O-CB 3.33Å; A202-L206 VanDerWaalsContact O-CG 3.26Å; A202-L206 WeakPolarHBondContact O-CG 3.22Å; A202-L206 PolarHBondContact O-N 3.47Å
203	V	98.6	Very high	97.6	Very high	2 Å²	2	11 Å²	11	1%	0.012	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-41.8	178	163.6	0	0	0	0	111.3	L171 L199 I200 L206 T207 L476 A479	L171-V203 HydrophobicContact CD1-CG1 4.47Å; L171-V203 HydrophobicContact CD1-CG2 4.45Å; L199-V203 HydrophobicContact CD1-CG2 4.06Å; L199-V203 HydrophobicContact CG-CG2 4.41Å; L199-V203 WeakPolarHBondContact O-CB 3.36Å; L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.16Å; I200-V203 PolarHBondContact O-N 2.8Å; V203-L206 PolarHBondContact O-N 2.98Å; V203-T207 HydrophobicContact CG1-CG2 4.49Å; V203-T207 WeakPolarHBondContact O-CG2 3.33Å; V203-T207 PolarHBondContact O-N 3.18Å; V203-T207 PolarHBondContact O-OG1 3.12Å; V203-L476 HydrophobicContact CG1-CD2 3.69Å; V203-A479 HydrophobicContact CG1-CB 3.6Å
204	V	98.6	Very high	98	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-63.2	-43.8	175.3	173	0	0	0	0	111	L105 I200 H201 A202 T207 H208 V367 L371 M472 L476	L105-V204 HydrophobicContact CD1-CG1 3.89Å; L105-V204 HydrophobicContact CD2-CG1 3.71Å; L105-V204 HydrophobicContact CG-CG1 4.48Å; I200-V204 HydrophobicContact CG2-CG2 4.49Å; I200-V204 VanDerWaalsContact O-CG2 3.32Å; I200-V204 WeakPolarHBondContact O-CG2 3.41Å; I200-V204 PolarHBondContact O-N 3.12Å; H201-V204 PolarHBondContact O-N 3.38Å; A202-V204 VanDerWaalsContact C-N 3.34Å; A202-V204 PolarHBondContact O-N 3.44Å; V204-T207 PolarHBondContact O-OG1 2.99Å; V204-H208 WeakPolarHBondContact O-CB 3.39Å; V204-H208 PolarHBondContact O-N 3.44Å; V204-V367 HydrophobicContact CG1-CG1 4.13Å; V204-V367 HydrophobicContact CG2-CG1 4.24Å; V204-L371 HydrophobicContact CG1-CD1 4.12Å; V204-L371 HydrophobicContact CG1-CD2 4.3Å; V204-L371 HydrophobicContact CG2-CD1 3.91Å; V204-M472 HydrophobicContact CG1-CE 4.27Å; V204-L476 HydrophobicContact CG2-CD2 4.23Å
205	L	98.8	Very high	98.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63	-45.5	176	-71.7	170.4	0	0	0	112.2	L105 L106 L112 R117 I120 H201 A202 H208 Y209	L105-L205 HydrophobicContact CB-CD2 4.07Å; L106-L205 HydrophobicContact CD2-CD2 3.84Å; L112-L205 HydrophobicContact CD1-CD1 4.46Å; R117-L205 HydrophobicContact CB-CD1 3.8Å; R117-L205 HydrophobicContact CG-CD1 4.01Å; I120-L205 HydrophobicContact CG2-CB 3.88Å; I120-L205 HydrophobicContact CG2-CD1 4.44Å; H201-L205 WeakPolarHBondContact O-CG 3.32Å; H201-L205 PolarHBondContact O-N 3.3Å; A202-L205 PolarHBondContact O-N 3.45Å; L205-H208 PolarHBondContact O-N 3.07Å; L205-Y209 HydrophobicContact CD2-CE2 4.46Å; L205-Y209 WeakPolarHBondContact O-CD2 3.33Å; L205-Y209 PolarHBondContact O-N 2.94Å
206	L	98.7	Very high	98.2	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.1	-57.4	179.2	-72.2	174.5	0	0	0	110.9	I120 A124 L164 N168 L171 A202 V203 H208 Y209 H210	I120-L206 HydrophobicContact CG2-CD2 3.67Å; I120-L206 HydrophobicContact CG2-CG 3.85Å; A124-L206 HydrophobicContact CB-CD2 3.89Å; L164-L206 HydrophobicContact CD1-CD1 4.18Å; L164-L206 HydrophobicContact CD2-CD1 4.17Å; L164-L206 HydrophobicContact CG-CD1 4.08Å; N168-L206 HydrophobicContact CB-CD1 4.18Å; N168-L206 HydrophobicContact CB-CD2 3.94Å; L171-L206 HydrophobicContact CD1-CB 4.46Å; L171-L206 HydrophobicContact CD1-CD1 4.19Å; A202-L206 WeakPolarHBondContact O-CB 3.33Å; A202-L206 VanDerWaalsContact O-CG 3.26Å; A202-L206 WeakPolarHBondContact O-CG 3.22Å; A202-L206 PolarHBondContact O-N 3.47Å; V203-L206 PolarHBondContact O-N 2.98Å; L206-H208 VanDerWaalsContact C-N 3.32Å; L206-H208 PolarHBondContact O-N 3.41Å; L206-Y209 PolarHBondContact O-N 3.42Å; L206-H210 PolarHBondContact O-CD2 3.11Å; L206-H210 VanDerWaalsContact O-CD2 3.25Å; L206-H210 PolarHBondContact O-N 2.99Å; L206-H210 PolarHBondContact O-ND1 2.93Å
207	T	98.7	Very high	98.2	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-61.7	-39.2	-178.3	54.8	0	0	0	0	112.3	L171 V203 V204 Y209 H210 S211 E475 L476	L171-T207 HydrophobicContact CD1-CG2 4.24Å; V203-T207 HydrophobicContact CG1-CG2 4.49Å; V203-T207 WeakPolarHBondContact O-CG2 3.33Å; V203-T207 PolarHBondContact O-N 3.18Å; V203-T207 PolarHBondContact O-OG1 3.12Å; V204-T207 PolarHBondContact O-OG1 2.99Å; T207-Y209 PolarHBondContact O-N 3.2Å; T207-H210 PolarHBondContact O-N 3.45Å; T207-S211 WeakPolarHBondContact O-CB 3.43Å; T207-S211 PolarHBondContact O-N 3.07Å; T207-S211 PolarHBondContact O-OG 3.24Å; T207-E475 HydrophobicContact CG2-CB 3.52Å; T207-L476 HydrophobicContact CG2-CD2 4.01Å; T207-L476 HydrophobicContact CG2-CG 4.11Å; T207-L476 WeakPolarHBondContact OG1-CD2 3.09Å
208	H	98.6	Very high	98.2	Very high	1 Å²	1	3.8 Å²	3.8	1%	0.005	2%	0.018	C	C	.	.	H	α-helix	trans	-60.3	-43.3	175.2	-175	74.4	0	0	0	112.5	F98 V204 L205 L206 S211 L212 M472	F98-H208 AromaticContact CE2-CE1 3.59Å; F98-H208 AromaticContact CE2-NE2 3.79Å; V204-H208 WeakPolarHBondContact O-CB 3.39Å; V204-H208 PolarHBondContact O-N 3.44Å; L205-H208 PolarHBondContact O-N 3.07Å; L206-H208 VanDerWaalsContact C-N 3.32Å; L206-H208 PolarHBondContact O-N 3.41Å; H208-S211 PolarHBondContact O-OG 3.11Å; H208-L212 WeakPolarHBondContact O-CB 3.43Å; H208-L212 PolarHBondContact O-N 3.26Å; H208-M472 HydrophobicContact CB-CE 3.75Å; H208-M472 HydrophobicContact CB-SD 4.23Å
209	Y	98.4	Very high	98.2	Very high	1 Å²	1	2 Å²	2	0%	0.004	1%	0.01	C	C	.	.	H	α-helix	trans	-84.3	-19.8	-178.5	-79.7	-75.5	0	0	0	113.9	L106 C121 L133 H137 L205 L206 T207 L212 S213	L106-Y209 VanDerWaalsContact CD1-OH 3.29Å; L106-Y209 WeakPolarHBondContact CD1-OH 3.48Å; C121-Y209 HydrophobicContact CB-CD1 4.4Å; C121-Y209 HydrophobicContact CB-CD2 3.66Å; C121-Y209 HydrophobicContact CB-CE2 3.84Å; C121-Y209 HydrophobicContact CB-CG 3.98Å; C121-Y209 WeakPolarHBondContact SG-CD2 3.48Å; C121-Y209 WeakPolarHBondContact SG-CE2 3.43Å; L133-Y209 HydrophobicContact CD1-CD1 4.24Å; L133-Y209 HydrophobicContact CD2-CD1 4.33Å; L133-Y209 HydrophobicContact CD2-CE1 4.23Å; H137-Y209 AromaticContact CD2-CE1 3.8Å; H137-Y209 AromaticContact CE1-CE1 3.86Å; H137-Y209 AromaticContact CE1-CZ 3.54Å; H137-Y209 PolarHBondContact CE1-OH 2.92Å; H137-Y209 VanDerWaalsContact CE1-OH 3.27Å; H137-Y209 AromaticContact NE2-CD1 3.63Å; H137-Y209 AromaticContact NE2-CE1 2.88Å; H137-Y209 WeakPolarHBondContact NE2-CE1 3.16Å; H137-Y209 AromaticContact NE2-CE2 3.78Å; H137-Y209 AromaticContact NE2-CZ 2.98Å; H137-Y209 PolarHBondContact NE2-OH 3.31Å; H137-Y209 VanDerWaalsContact NE2-OH 3.16Å; L205-Y209 HydrophobicContact CD2-CE2 4.46Å; L205-Y209 WeakPolarHBondContact O-CD2 3.33Å; L205-Y209 PolarHBondContact O-N 2.94Å; L206-Y209 PolarHBondContact O-N 3.42Å; T207-Y209 PolarHBondContact O-N 3.2Å; Y209-L212 HydrophobicContact CD1-CB 4.48Å; Y209-L212 HydrophobicContact CD1-CD2 3.96Å; Y209-L212 HydrophobicContact CE1-CD2 3.59Å; Y209-S213 WeakPolarHBondContact O-CB 3.3Å; Y209-S213 PolarHBondContact O-N 3.13Å; Y209-S213 VanDerWaalsContact O-N 3.09Å; Y209-S213 PolarHBondContact O-OG 3.03Å
210	H	98.4	Very high	98.1	Very high	0 Å²	0	2 Å²	2	0%	0	1%	0.01	C	C	.	.	H	α-helix	trans	-65.5	-49.2	163.8	-58.9	158.1	0	0	0	111.1	A124 N168 L206 T207 S213 S214 E475	A124-H210 PolarHBondContact O-CD2 3.47Å; N168-H210 PolarHBondContact OD1-NE2 3.41Å; L206-H210 PolarHBondContact O-CD2 3.11Å; L206-H210 VanDerWaalsContact O-CD2 3.25Å; L206-H210 PolarHBondContact O-N 2.99Å; L206-H210 PolarHBondContact O-ND1 2.93Å; T207-H210 PolarHBondContact O-N 3.45Å; H210-S213 WeakPolarHBondContact O-CB 3.17Å; H210-S213 PolarHBondContact O-N 3.23Å; H210-S214 PolarHBondContact O-N 3.19Å; H210-S214 PolarHBondContact O-OG 3.37Å; H210-E475 IonicContact CE1-OE2 3.9Å; H210-E475 IonicContact CG-OE2 3.96Å; H210-E475 IonicContact ND1-OE2 3.53Å; H210-E475 PolarHBondContact ND1-OE2 3.43Å
211	S	98.3	Very high	97.9	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-68	-41.7	179.8	67.9	0	0	0	0	111.5	T207 H208 S213 S214 F215 M468	T207-S211 WeakPolarHBondContact O-CB 3.43Å; T207-S211 PolarHBondContact O-N 3.07Å; T207-S211 PolarHBondContact O-OG 3.24Å; H208-S211 PolarHBondContact O-OG 3.11Å; S211-S213 VanDerWaalsContact C-N 3.28Å; S211-S213 PolarHBondContact O-N 2.99Å; S211-S214 WeakPolarHBondContact O-CA 3.26Å; S211-S214 WeakPolarHBondContact O-CB 3.14Å; S211-S214 PolarHBondContact O-N 3.33Å; S211-S214 PolarHBondContact O-OG 3.37Å; S211-F215 PolarHBondContact O-N 3.1Å; S211-F215 VanDerWaalsContact O-N 3.13Å; S211-M468 WeakPolarHBondContact CB-O 3.5Å; S211-M468 WeakPolarHBondContact O-CG 3.13Å
212	L	98.5	Very high	97.5	Very high	1 Å²	1	4.1 Å²	4.1	1%	0.005	2%	0.02	C	C	.	.	H	α-helix	trans	-63.4	-34.5	176.6	-169	62.3	0	0	0	111.8	I84 M88 F98 L133 H208 Y209 S214 F215 T216 M468	I84-L212 HydrophobicContact CD1-CD1 4.1Å; I84-L212 HydrophobicContact CD1-CD2 4.12Å; I84-L212 HydrophobicContact CD1-CG 4.08Å; I84-L212 HydrophobicContact CG2-CD1 4.14Å; M88-L212 HydrophobicContact CE-CD1 3.85Å; F98-L212 HydrophobicContact CE2-CD1 3.96Å; F98-L212 HydrophobicContact CZ-CD1 3.95Å; F98-L212 HydrophobicContact CZ-CD2 4.18Å; L133-L212 HydrophobicContact CD1-CB 4.12Å; L133-L212 HydrophobicContact CD1-CD2 4.29Å; L133-L212 HydrophobicContact CD1-CG 4.03Å; L133-L212 HydrophobicContact CD2-CD2 3.7Å; L133-L212 HydrophobicContact CD2-CG 4.13Å; H208-L212 WeakPolarHBondContact O-CB 3.43Å; H208-L212 PolarHBondContact O-N 3.26Å; Y209-L212 HydrophobicContact CD1-CB 4.48Å; Y209-L212 HydrophobicContact CD1-CD2 3.96Å; Y209-L212 HydrophobicContact CE1-CD2 3.59Å; L212-S214 PolarHBondContact O-N 3.38Å; L212-F215 HydrophobicContact CD1-CB 4.37Å; L212-F215 HydrophobicContact CD1-CD1 4.43Å; L212-F215 PolarHBondContact O-N 2.77Å; L212-F215 VanDerWaalsContact O-N 3.15Å; L212-T216 PolarHBondContact O-N 3.07Å; L212-T216 PolarHBondContact O-OG1 2.9Å; L212-M468 HydrophobicContact CB-SD 4.5Å; L212-M468 HydrophobicContact CD1-SD 3.86Å
213	S	97.9	Very high	96.9	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-56.8	-40.4	170.3	-60	0	0	0	0	111.2	Y209 H210 S211 F215 T216 F217	Y209-S213 WeakPolarHBondContact O-CB 3.3Å; Y209-S213 PolarHBondContact O-N 3.13Å; Y209-S213 VanDerWaalsContact O-N 3.09Å; Y209-S213 PolarHBondContact O-OG 3.03Å; H210-S213 WeakPolarHBondContact O-CB 3.17Å; H210-S213 PolarHBondContact O-N 3.23Å; S211-S213 VanDerWaalsContact C-N 3.28Å; S211-S213 PolarHBondContact O-N 2.99Å; S213-F215 PolarHBondContact O-N 3.27Å; S213-T216 PolarHBondContact O-N 3.38Å; S213-F217 WeakPolarHBondContact O-CD2 3.21Å; S213-F217 PolarHBondContact O-N 3.46Å
214	S	97.7	Very high	96.2	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-61.1	-45.6	176.8	-45.5	0	0	0	0	111.4	H210 S211 L212 G218 M436 R471	H210-S214 PolarHBondContact O-N 3.19Å; H210-S214 PolarHBondContact O-OG 3.37Å; S211-S214 WeakPolarHBondContact O-CA 3.26Å; S211-S214 WeakPolarHBondContact O-CB 3.14Å; S211-S214 PolarHBondContact O-N 3.33Å; S211-S214 PolarHBondContact O-OG 3.37Å; L212-S214 PolarHBondContact O-N 3.38Å; S214-G218 PolarHBondContact O-N 2.86Å; S214-M436 VanDerWaalsContact CB-O 3.31Å; S214-M436 WeakPolarHBondContact CB-O 3.49Å; S214-M436 VanDerWaalsContact O-CG 3.27Å; S214-M436 WeakPolarHBondContact O-CG 3.27Å; S214-M436 PolarHBondContact OG-O 2.57Å; S214-R471 WeakPolarHBondContact OG-CD 3.39Å; S214-R471 PolarHBondContact OG-NH1 2.79Å
215	F	98.6	Very high	95.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.4	-44.2	175.1	-176.1	-92	0	0	0	112.3	I84 V87 M88 S211 L212 S213 F217 G218 C219 V461 N464 L465 M468	I84-F215 HydrophobicContact CG2-CD1 4.33Å; I84-F215 HydrophobicContact CG2-CE1 4.16Å; V87-F215 HydrophobicContact CG1-CZ 4.21Å; M88-F215 HydrophobicContact CE-CD1 3.74Å; M88-F215 HydrophobicContact CE-CD2 4.32Å; M88-F215 HydrophobicContact CE-CE1 3.69Å; M88-F215 HydrophobicContact CE-CE2 4.29Å; M88-F215 HydrophobicContact CE-CG 4.06Å; M88-F215 HydrophobicContact CE-CZ 3.97Å; M88-F215 HydrophobicContact CG-CE1 3.72Å; M88-F215 HydrophobicContact CG-CE2 4.31Å; M88-F215 HydrophobicContact CG-CZ 3.49Å; M88-F215 VanDerWaalsContact CG-CZ 3.49Å; S211-F215 PolarHBondContact O-N 3.1Å; S211-F215 VanDerWaalsContact O-N 3.13Å; L212-F215 HydrophobicContact CD1-CB 4.37Å; L212-F215 HydrophobicContact CD1-CD1 4.43Å; L212-F215 PolarHBondContact O-N 2.77Å; L212-F215 VanDerWaalsContact O-N 3.15Å; S213-F215 PolarHBondContact O-N 3.27Å; F215-F217 VanDerWaalsContact C-N 3.34Å; F215-F217 PolarHBondContact O-N 3.12Å; F215-G218 PolarHBondContact O-N 2.83Å; F215-C219 HydrophobicContact CE1-CB 4.33Å; F215-C219 WeakPolarHBondContact CE2-SG 3.38Å; F215-C219 HydrophobicContact CZ-CB 4.41Å; F215-C219 WeakPolarHBondContact CZ-SG 3.34Å; F215-C219 WeakPolarHBondContact O-CB 3.28Å; F215-C219 PolarHBondContact O-N 3.43Å; F215-V461 HydrophobicContact CE2-CG1 4.19Å; F215-V461 HydrophobicContact CZ-CG1 4.2Å; F215-N464 HydrophobicContact CD2-CB 3.84Å; F215-N464 HydrophobicContact CE2-CB 4.04Å; F215-L465 HydrophobicContact CD2-CD2 3.93Å; F215-L465 HydrophobicContact CE2-CD2 3.43Å; F215-L465 VanDerWaalsContact CE2-CD2 3.43Å; F215-L465 HydrophobicContact CE2-CG 4.22Å; F215-L465 HydrophobicContact CZ-CD2 4.16Å; F215-M468 HydrophobicContact CB-CB 4.43Å; F215-M468 HydrophobicContact CB-CG 4.45Å; F215-M468 HydrophobicContact CB-SD 3.69Å; F215-M468 HydrophobicContact CG-SD 4.22Å
216	T	97.8	Very high	93.8	Very high	6 Å²	6	16.5 Å²	16.5	4%	0.037	9%	0.086	C	C	.	.	H	α-helix	trans	-56.6	-47.1	178.9	-56.5	0	0	0	0	111.4	Y132 L212 S213 G220 I221	Y132-T216 HydrophobicContact CD1-CG2 3.96Å; Y132-T216 HydrophobicContact CG-CG2 4Å; L212-T216 PolarHBondContact O-N 3.07Å; L212-T216 PolarHBondContact O-OG1 2.9Å; S213-T216 PolarHBondContact O-N 3.38Å; T216-G220 PolarHBondContact O-N 2.9Å; T216-I221 HydrophobicContact CG2-CB 3.85Å; T216-I221 HydrophobicContact CG2-CG1 4.25Å; T216-I221 HydrophobicContact CG2-CG2 4.44Å; T216-I221 WeakPolarHBondContact O-CG1 3.36Å; T216-I221 PolarHBondContact O-N 3.25Å
217	F	97.5	Very high	92.5	Very high	29 Å²	29	17 Å²	17	13%	0.127	9%	0.089	C	C	.	.	H	α-helix	trans	-73.4	-42.6	177.4	-76.6	-72.9	0	0	0	112.7	F51 H128 C130 S213 F215 C219 G220 P440 E441	F51-F217 WeakPolarHBondContact CE2-O 3.49Å; H128-F217 VanDerWaalsContact O-CE2 3.29Å; H128-F217 WeakPolarHBondContact O-CE2 3.32Å; C130-F217 HydrophobicContact CB-CE2 3.78Å; C130-F217 HydrophobicContact CB-CZ 4.38Å; S213-F217 WeakPolarHBondContact O-CD2 3.21Å; S213-F217 PolarHBondContact O-N 3.46Å; F215-F217 VanDerWaalsContact C-N 3.34Å; F215-F217 PolarHBondContact O-N 3.12Å; F217-C219 PolarHBondContact O-N 2.99Å; F217-G220 PolarHBondContact O-N 3.09Å; F217-P440 HydrophobicContact CB-CB 3.96Å; F217-P440 WeakPolarHBondContact CB-O 3.25Å; F217-P440 HydrophobicContact CD2-CB 3.78Å; F217-P440 HydrophobicContact CD2-CG 4.36Å; F217-P440 HydrophobicContact CG-CB 4.17Å; F217-P440 VanDerWaalsContact CG-O 3.27Å; F217-P440 WeakPolarHBondContact CG-O 3.46Å; F217-E441 HydrophobicContact CE1-CB 4.42Å; F217-E441 HydrophobicContact CE2-CB 4.33Å; F217-E441 HydrophobicContact CZ-CB 4.05Å
218	G	96.9	Very high	90.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-37.9	-179.8	0	0	0	0	0	114	F51 S214 F215 G220 Y432 N464	F51-G218 VanDerWaalsContact CD2-O 3.29Å; F51-G218 WeakPolarHBondContact CD2-O 3.47Å; F51-G218 WeakPolarHBondContact CE2-O 3.2Å; S214-G218 PolarHBondContact O-N 2.86Å; F215-G218 PolarHBondContact O-N 2.83Å; G218-G220 VanDerWaalsContact C-N 3.35Å; G218-Y432 WeakPolarHBondContact CA-OH 3.25Å; G218-Y432 PolarHBondContact O-OH 2.75Å; G218-N464 VanDerWaalsContact C-ND2 3.32Å; G218-N464 PolarHBondContact O-ND2 3.07Å
219	C	97.4	Very high	89.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2	174.6	-69.8	0	0	0	0	113	S49 V87 F215 F217 I221 N464	S49-C219 WeakPolarHBondContact CB-O 3.3Å; S49-C219 PolarHBondContact OG-O 3.38Å; V87-C219 HydrophobicContact CG1-CB 4.03Å; F215-C219 HydrophobicContact CE1-CB 4.33Å; F215-C219 WeakPolarHBondContact CE2-SG 3.38Å; F215-C219 HydrophobicContact CZ-CB 4.41Å; F215-C219 WeakPolarHBondContact CZ-SG 3.34Å; F215-C219 WeakPolarHBondContact O-CB 3.28Å; F215-C219 PolarHBondContact O-N 3.43Å; F217-C219 PolarHBondContact O-N 2.99Å; C219-I221 VanDerWaalsContact C-N 3.31Å; C219-I221 HydrophobicContact CB-CD1 3.74Å; C219-I221 HydrophobicContact CB-CG1 4.07Å; C219-I221 PolarHBondContact O-N 3.42Å; C219-N464 PolarHBondContact SG-ND2 2.88Å
220	G	95.3	Very high	88	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	41.5	180	0	0	0	0	0	113.1	S49 R50 T216 F217 G218 M222	S49-G220 CarbonylContact C-O 3.45Å; S49-G220 WeakPolarHBondContact CA-O 3.45Å; R50-G220 WeakPolarHBondContact CG-O 3.34Å; R50-G220 PolarHBondContact N-O 3Å; T216-G220 PolarHBondContact O-N 2.9Å; F217-G220 PolarHBondContact O-N 3.09Å; G218-G220 VanDerWaalsContact C-N 3.35Å; G220-M222 PolarHBondContact O-N 3.04Å
221	I	94.5	Very high	86.8	Confident	9 Å²	9	27 Å²	27	5%	0.046	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-58.9	135.2	-176	-57.8	-59.3	0	0	0	110.7	P48 N83 I84 V87 Y132 T216 C219	P48-I221 WeakPolarHBondContact O-CA 3.27Å; N83-I221 HydrophobicContact CB-CG2 3.77Å; I84-I221 HydrophobicContact CG1-CG1 4.24Å; I84-I221 HydrophobicContact CG1-CG2 4.11Å; V87-I221 HydrophobicContact CB-CD1 3.79Å; V87-I221 HydrophobicContact CG1-CD1 4.23Å; V87-I221 HydrophobicContact CG2-CD1 3.51Å; Y132-I221 HydrophobicContact CD2-CG2 3.97Å; Y132-I221 HydrophobicContact CE1-CG2 4.3Å; Y132-I221 HydrophobicContact CE2-CG2 3.67Å; Y132-I221 HydrophobicContact CG-CG2 4.45Å; T216-I221 HydrophobicContact CG2-CB 3.85Å; T216-I221 HydrophobicContact CG2-CG1 4.25Å; T216-I221 HydrophobicContact CG2-CG2 4.44Å; T216-I221 WeakPolarHBondContact O-CG1 3.36Å; T216-I221 PolarHBondContact O-N 3.25Å; C219-I221 VanDerWaalsContact C-N 3.31Å; C219-I221 HydrophobicContact CB-CD1 3.74Å; C219-I221 HydrophobicContact CB-CG1 4.07Å; C219-I221 PolarHBondContact O-N 3.42Å
222	M	90.1	Very high	85.7	Confident	37 Å²	37	28.7 Å²	28.7	18%	0.182	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-87.6	145.4	178	-72.7	-61.3	-68.1	0	0	111.5	P48 R50 N83 Y132 G220	P48-M222 PolarHBondContact O-N 3.48Å; R50-M222 HydrophobicContact CB-CG 4.39Å; R50-M222 HydrophobicContact CB-SD 3.79Å; N83-M222 PolarHBondContact ND2-O 2.86Å; Y132-M222 WeakPolarHBondContact CD2-O 3.31Å; Y132-M222 WeakPolarHBondContact CE2-O 3.4Å; G220-M222 PolarHBondContact O-N 3.04Å
223	P	86.1	Confident	84.6	Confident	36 Å²	36	33.1 Å²	33.1	23%	0.234	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-53.9	142.5	170.5	-24.6	34.5	0	0	0	112.9
224	E	83.6	Confident	83.2	Confident	26 Å²	26	42.7 Å²	42.7	12%	0.121	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-61.1	149.1	173.8	-59.6	-55.4	144.3	0	0	111.2	N83 Y132 N226 C227 G230	N83-E224 VanDerWaalsContact CB-OE1 3.3Å; N83-E224 WeakPolarHBondContact CB-OE1 3.28Å; N83-E224 PolarHBondContact N-OE1 2.63Å; N83-E224 PolarHBondContact ND2-OE1 3.23Å; Y132-E224 HydrophobicContact CE2-CG 4.1Å; Y132-E224 WeakPolarHBondContact CE2-OE1 3.22Å; Y132-E224 PolarHBondContact OH-OE1 2.97Å; E224-N226 WeakPolarHBondContact CB-OD1 3.03Å; E224-N226 PolarHBondContact O-N 3.42Å; E224-N226 VanDerWaalsContact O-N 3.09Å; E224-C227 HydrophobicContact CB-CB 4.32Å; E224-C227 WeakPolarHBondContact O-CB 3.47Å; E224-C227 PolarHBondContact O-N 3.27Å; E224-G230 WeakPolarHBondContact O-CA 3.42Å
225	I	76.9	Confident	81.3	Confident	87 Å²	87	47.7 Å²	47.7	45%	0.446	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.5	-177.7	-164.1	176.8	0	0	0	112.9	P43 C227 H231	P43-I225 HydrophobicContact CG-CD1 3.86Å; P43-I225 HydrophobicContact CG-CG1 4.45Å; I225-C227 VanDerWaalsContact C-N 3.31Å; I225-H231 HydrophobicContact CG1-CB 4.1Å; I225-H231 WeakPolarHBondContact O-CB 3.42Å; I225-H231 VanDerWaalsContact O-CG 3.3Å; I225-H231 PolarHBondContact O-ND1 2.94Å
226	N	69.9	Low	79.3	Confident	113 Å²	113	51.3 Å²	51.3	60%	0.604	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6	179	64.5	-17.6	0	0	0	113.4	E224	E224-N226 WeakPolarHBondContact CB-OD1 3.03Å; E224-N226 PolarHBondContact O-N 3.42Å; E224-N226 VanDerWaalsContact O-N 3.09Å
227	C	70.8	Confident	77	Confident	10 Å²	10	55.6 Å²	55.6	7%	0.068	31%	0.306	C	S	.	.	S	Bend	trans	-94.9	157.7	177.6	-66.6	0	0	0	0	111.6	E224 I225 G229 G230 H231	E224-C227 HydrophobicContact CB-CB 4.32Å; E224-C227 WeakPolarHBondContact O-CB 3.47Å; E224-C227 PolarHBondContact O-N 3.27Å; I225-C227 VanDerWaalsContact C-N 3.31Å; C227-G229 PolarHBondContact O-N 3.48Å; C227-G230 PolarHBondContact O-N 3.42Å; C227-H231 PolarHBondContact O-ND1 3.09Å
228	D	64.9	Low	74.4	Confident	119 Å²	119	61.2 Å²	61.2	64%	0.636	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	133.9	171.3	-72.7	-24.2	0	0	0	110.1	G230	D228-G230 PolarHBondContact O-N 3.45Å
229	G	68.4	Low	71.8	Confident	46 Å²	46	65 Å²	65	47%	0.474	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-4.4	-174.3	0	0	0	0	0	115.2	L44 C227	L44-G229 WeakPolarHBondContact CD1-O 3.28Å; C227-G229 PolarHBondContact O-N 3.48Å
230	G	67.9	Low	69	Low	5 Å²	5	74 Å²	74	5%	0.052	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-20	173.5	0	0	0	0	0	114.3	P43 L44 E224 C227 D228	P43-G230 WeakPolarHBondContact CA-O 3.45Å; L44-G230 PolarHBondContact N-O 2.66Å; E224-G230 WeakPolarHBondContact O-CA 3.42Å; C227-G230 PolarHBondContact O-N 3.42Å; D228-G230 PolarHBondContact O-N 3.45Å
231	H	73.8	Confident	66.4	Low	43 Å²	43	81 Å²	81	20%	0.199	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158.6	-178.8	67.9	-78.7	0	0	0	114.7	P41 R42 L44 I225 C227 F233	P41-H231 HydrophobicContact CB-CB 3.99Å; R42-H231 CarbonylContact O-C 3.42Å; R42-H231 WeakPolarHBondContact O-CA 3.46Å; R42-H231 WeakPolarHBondContact O-CB 3.24Å; L44-H231 VanDerWaalsContact CD1-O 3.29Å; L44-H231 WeakPolarHBondContact CD1-O 3.11Å; I225-H231 HydrophobicContact CG1-CB 4.1Å; I225-H231 WeakPolarHBondContact O-CB 3.42Å; I225-H231 VanDerWaalsContact O-CG 3.3Å; I225-H231 PolarHBondContact O-ND1 2.94Å; C227-H231 PolarHBondContact O-ND1 3.09Å; H231-F233 AromaticContact CD2-CE2 3.41Å; H231-F233 VanDerWaalsContact CD2-CE2 3.41Å; H231-F233 WeakPolarHBondContact CD2-CE2 3.33Å; H231-F233 AromaticContact CD2-CZ 3.56Å; H231-F233 AromaticContact NE2-CE2 3.23Å; H231-F233 WeakPolarHBondContact NE2-CE2 3.43Å; H231-F233 AromaticContact NE2-CZ 3.5Å; H231-F233 WeakPolarHBondContact NE2-CZ 3.46Å
232	T	75.6	Confident	63.8	Low	36 Å²	36	82.6 Å²	82.6	22%	0.221	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.3	170.3	-175.9	0	0	0	0	110.7	R42 L44 R234	R42-T232 HydrophobicContact CB-CG2 4.22Å; R42-T232 WeakPolarHBondContact CB-O 3.4Å; R42-T232 PolarHBondContact N-O 3.29Å; R42-T232 PolarHBondContact O-N 3.48Å; L44-T232 HydrophobicContact CD2-CG2 3.8Å; L44-T232 HydrophobicContact CG-CG2 4.26Å; T232-R234 WeakPolarHBondContact OG1-CB 3.4Å; T232-R234 PolarHBondContact OG1-N 3.16Å
233	F	76	Confident	61.5	Low	94 Å²	94	85 Å²	85	41%	0.412	47%	0.466	S	S	.	.			trans	-94.7	2.4	168.7	-61.2	-75.4	0	0	0	112.2	R39 P41 H231	R39-F233 HydrophobicContact CB-CB 4.27Å; R39-F233 HydrophobicContact CB-CD1 3.58Å; R39-F233 HydrophobicContact CB-CE1 4.25Å; R39-F233 HydrophobicContact CB-CG 4.19Å; P41-F233 HydrophobicContact CB-CD1 4.29Å; P41-F233 HydrophobicContact CB-CE1 3.66Å; P41-F233 HydrophobicContact CB-CZ 4.06Å; P41-F233 HydrophobicContact CG-CE1 4.21Å; H231-F233 AromaticContact CD2-CE2 3.41Å; H231-F233 VanDerWaalsContact CD2-CE2 3.41Å; H231-F233 WeakPolarHBondContact CD2-CE2 3.33Å; H231-F233 AromaticContact CD2-CZ 3.56Å; H231-F233 AromaticContact NE2-CE2 3.23Å; H231-F233 WeakPolarHBondContact NE2-CE2 3.43Å; H231-F233 AromaticContact NE2-CZ 3.5Å; H231-F233 WeakPolarHBondContact NE2-CZ 3.46Å
234	R	68	Low	59.5	Low	200 Å²	200	85.8 Å²	85.8	76%	0.755	47%	0.472	S	S	*	.	S	Bend	trans	-69.4	138.8	177.9	-66.2	-174.7	179.1	176.9	0.9	109.5	T232	T232-R234 WeakPolarHBondContact OG1-CB 3.4Å; T232-R234 PolarHBondContact OG1-N 3.16Å
235	P	58.2	Low	57.5	Low	105 Å²	105	87.4 Å²	87.4	68%	0.682	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-56.5	151.6	168.6	-16.7	28.2	0	0	0	109.7	S237	P235-S237 PolarHBondContact O-N 3.28Å
236	P	56.4	Low	56.1	Low	77 Å²	77	90.1 Å²	90.1	50%	0.5	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-62	126.3	174	27.6	-24.5	0	0	0	106.7	R42	R42-P236 VanDerWaalsContact NH1-CG 3.3Å
237	S	49.2	Very low	54.7	Low	96 Å²	96	89 Å²	89	67%	0.671	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-54.5	142	162.1	41.9	0	0	0	0	107.5	P235 S239	P235-S237 PolarHBondContact O-N 3.28Å; S237-S239 PolarHBondContact O-N 3.44Å; S237-S239 PolarHBondContact O-OG 3.4Å
238	V	42.3	Very low	53	Low	146 Å²	146	95 Å²	95	89%	0.885	53%	0.534	S	S	*	.	S	Bend	trans	-66.6	78.2	-179.1	-167.3	0	0	0	0	109
239	S	42.6	Very low	51.8	Low	79 Å²	79	92.3 Å²	92.3	55%	0.552	53%	0.534	S	S	*	.			trans	-119.5	91.9	172.9	60.9	0	0	0	0	107	S237 Y241	S237-S239 PolarHBondContact O-N 3.44Å; S237-S239 PolarHBondContact O-OG 3.4Å; S239-Y241 PolarHBondContact O-N 3.24Å
240	Q	38.7	Very low	50.3	Low	190 Å²	190	95.9 Å²	95.9	89%	0.888	54%	0.542	S	S	*	.	S	Bend	trans	34.6	12	156.8	-118.2	160.5	-2.4	0	0	122.6
241	Y	41	Very low	48.7	Very low	148 Å²	148	97.3 Å²	97.3	58%	0.58	56%	0.556	S	S	*	*			trans	-131.9	126.2	179.9	-79	-78.6	0	0	0	110.6	S239	S239-Y241 PolarHBondContact O-N 3.24Å
242	C	39.9	Very low	46.8	Very low	41 Å²	41	103 Å²	103	28%	0.277	58%	0.583	S	S	.	*			trans	-83.9	143.8	177.4	178.3	0	0	0	0	109.5	C244 D245	C242-C244 HydrophobicContact CB-CB 4.36Å; C242-C244 WeakPolarHBondContact CB-SG 3.48Å; C242-C244 PolarHBondContact O-N 3.43Å; C242-C244 WeakPolarHBondContact SG-CB 3.42Å; C242-C244 PolarHBondContact SG-N 2.84Å; C242-C244 CovalentContact SG-SG 2.06Å; C242-C244 PolarHBondContact SG-SG 3.22Å; C242-D245 PolarHBondContact N-OD2 3.33Å; C242-D245 WeakPolarHBondContact O-CB 3.45Å; C242-D245 PolarHBondContact O-N 2.82Å
243	V	42.3	Very low	44.9	Very low	88 Å²	88	104.4 Å²	104.4	53%	0.533	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.1	-20.5	169.8	175.2	0	0	0	0	112.2	D245 I246	V243-D245 VanDerWaalsContact C-N 3.33Å; V243-I246 PolarHBondContact O-N 3.43Å
244	C	42.4	Very low	42.7	Very low	53 Å²	53	107 Å²	107	36%	0.358	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	-17.2	174.7	57.3	0	0	0	0	114.7	C242 I246	C242-C244 HydrophobicContact CB-CB 4.36Å; C242-C244 WeakPolarHBondContact CB-SG 3.48Å; C242-C244 PolarHBondContact O-N 3.43Å; C242-C244 WeakPolarHBondContact SG-CB 3.42Å; C242-C244 PolarHBondContact SG-N 2.84Å; C242-C244 CovalentContact SG-SG 2.06Å; C242-C244 PolarHBondContact SG-SG 3.22Å; C244-I246 VanDerWaalsContact C-N 3.28Å; C244-I246 PolarHBondContact O-N 2.78Å
245	D	42.1	Very low	41.1	Very low	60 Å²	60	105.9 Å²	105.9	32%	0.321	62%	0.619	S	S	.	*	H	α-helix	trans	-74.9	-21.4	175.5	-60.8	-39.3	0	0	0	112.1	C242 V243 G249	C242-D245 PolarHBondContact N-OD2 3.33Å; C242-D245 WeakPolarHBondContact O-CB 3.45Å; C242-D245 PolarHBondContact O-N 2.82Å; V243-D245 VanDerWaalsContact C-N 3.33Å; D245-G249 PolarHBondContact O-N 3.31Å
246	I	48.3	Very low	39.9	Very low	143 Å²	143	109.1 Å²	109.1	73%	0.733	63%	0.625	S	S	*	*	H	α-helix	trans	-72.9	-31.6	-179.3	-56.9	172.3	0	0	0	111.3	V243 C244	V243-I246 PolarHBondContact O-N 3.43Å; C244-I246 VanDerWaalsContact C-N 3.28Å; C244-I246 PolarHBondContact O-N 2.78Å
247	A	39.2	Very low	38.9	Very low	89 Å²	89	111 Å²	111	74%	0.736	63%	0.631	S	S	*	*	H	α-helix	trans	-87.3	-16.9	-178.1	0	0	0	0	0	114.1
248	N	36.7	Very low	38.1	Very low	138 Å²	138	112.9 Å²	112.9	74%	0.738	63%	0.634	S	S	*	*	H	α-helix	trans	-121.3	9.3	-171	-106.9	15.2	0	0	0	115.2	N250	N248-N250 PolarHBondContact O-N 3.23Å
249	G	38.9	Very low	38	Very low	62 Å²	62	112.6 Å²	112.6	64%	0.639	63%	0.626	S	S	*	*	S	Bend	trans	63	8.8	166.8	0	0	0	0	0	116.8	D245	D245-G249 PolarHBondContact O-N 3.31Å
250	N	37.8	Very low	37.9	Very low	120 Å²	120	116.5 Å²	116.5	64%	0.642	64%	0.64	S	S	*	*			trans	-118.3	60.3	-175.3	-99.7	10.2	0	0	0	111.6	N248 H252	N248-N250 PolarHBondContact O-N 3.23Å; N250-H252 PolarHBondContact O-N 2.85Å
251	G	33.5	Very low	37.8	Very low	35 Å²	35	111 Å²	111	36%	0.361	64%	0.635	S	S	.	*			trans	-75.7	103	158.9	0	0	0	0	0	109	A253	G251-A253 VanDerWaalsContact C-N 3.34Å; G251-A253 PolarHBondContact O-N 2.67Å
252	H	34.6	Very low	37.7	Very low	162 Å²	162	112.1 Å²	112.1	75%	0.75	65%	0.651	S	S	*	*			trans	-63.5	97.3	165.6	-89.2	57.5	0	0	0	108.1	N250 N254	N250-H252 PolarHBondContact O-N 2.85Å; H252-N254 PolarHBondContact O-N 3.21Å
253	A	33.8	Very low	37.9	Very low	67 Å²	67	118.9 Å²	118.9	55%	0.554	68%	0.678	S	S	*	*			trans	-65.3	119.1	162.8	0	0	0	0	0	107.1	G251 H255	G251-A253 VanDerWaalsContact C-N 3.34Å; G251-A253 PolarHBondContact O-N 2.67Å; A253-H255 VanDerWaalsContact C-N 3.29Å; A253-H255 PolarHBondContact O-N 3.17Å
254	N	30.8	Very low	38	Very low	149 Å²	149	124 Å²	124	80%	0.797	70%	0.697	S	S	*	*			trans	-57.3	99.8	162.5	-85.5	-18.4	0	0	0	107.4	H252 H256	H252-N254 PolarHBondContact O-N 3.21Å; N254-H256 VanDerWaalsContact C-N 3.28Å; N254-H256 PolarHBondContact O-N 3.29Å
255	H	34.2	Very low	38.4	Very low	175 Å²	175	126.8 Å²	126.8	81%	0.81	71%	0.706	S	S	*	*			trans	-63.5	93.5	162.6	-93	-86.4	0	0	0	107.4	A253 D257	A253-H255 VanDerWaalsContact C-N 3.29Å; A253-H255 PolarHBondContact O-N 3.17Å; H255-D257 VanDerWaalsContact C-N 3.29Å; H255-D257 PolarHBondContact O-N 3.4Å
256	H	34.2	Very low	39	Very low	173 Å²	173	129.1 Å²	129.1	80%	0.801	73%	0.726	S	S	*	*			trans	-76.3	97	148.7	-107	-81.4	0	0	0	105.9	N254 D258	N254-H256 VanDerWaalsContact C-N 3.28Å; N254-H256 PolarHBondContact O-N 3.29Å; H256-D258 VanDerWaalsContact C-N 3.26Å; H256-D258 PolarHBondContact O-N 3.04Å
257	D	34.7	Very low	40.5	Very low	118 Å²	118	123.9 Å²	123.9	63%	0.631	71%	0.706	S	S	*	*			trans	-68.6	84.5	171.3	-162.4	19.8	0	0	0	107.9	H255 L259	H255-D257 VanDerWaalsContact C-N 3.29Å; H255-D257 PolarHBondContact O-N 3.4Å; D257-L259 PolarHBondContact O-N 3.21Å; D257-L259 WeakPolarHBondContact OD2-CD1 3.44Å
258	D	33.1	Very low	42.9	Very low	135 Å²	135	122 Å²	122	72%	0.722	68%	0.683	S	S	*	*			trans	-77	82.9	168.5	-101.4	-14.5	0	0	0	108.4	H256 L260	H256-D258 VanDerWaalsContact C-N 3.26Å; H256-D258 PolarHBondContact O-N 3.04Å; D258-L260 PolarHBondContact O-N 2.89Å
259	L	39.7	Very low	45.5	Very low	139 Å²	139	115.5 Å²	115.5	73%	0.728	65%	0.648	S	S	*	*			trans	-79	54.5	177.6	-136.7	147.4	0	0	0	110.5	D257	D257-L259 PolarHBondContact O-N 3.21Å; D257-L259 WeakPolarHBondContact OD2-CD1 3.44Å
260	L	39.3	Very low	48.1	Very low	161 Å²	161	116.1 Å²	116.1	84%	0.843	63%	0.634	S	S	*	*			trans	-128.6	101.1	177.4	-71.6	174.9	0	0	0	110.8	D258	D258-L260 PolarHBondContact O-N 2.89Å
261	G	36.6	Very low	50.8	Low	76 Å²	76	115.5 Å²	115.5	78%	0.784	63%	0.627	S	S	*	*			trans	123.4	29.4	160.4	0	0	0	0	0	117	Q263	G261-Q263 PolarHBondContact O-N 3.16Å; G261-Q263 VanDerWaalsContact O-N 3.09Å
262	N	39.8	Very low	53.7	Low	171 Å²	171	114.3 Å²	114.3	91%	0.914	61%	0.612	S	S	*	*			trans	-86.2	51.3	179.5	-145.6	18.1	0	0	0	113.2
263	Q	43.1	Very low	56.5	Low	182 Å²	182	108.5 Å²	108.5	85%	0.85	59%	0.586	S	S	*	*	S	Bend	trans	-153.2	67.8	-173.4	-141.2	151	4.1	0	0	112.1	G261	G261-Q263 PolarHBondContact O-N 3.16Å; G261-Q263 VanDerWaalsContact O-N 3.09Å
264	E	45.9	Very low	59.4	Low	196 Å²	196	109.7 Å²	109.7	92%	0.916	58%	0.58	S	S	*	*	S	Bend	trans	178.5	2.9	150.8	-104.3	170.1	-171	0	0	117.1
265	M	51	Low	62.4	Low	111 Å²	111	106.2 Å²	106.2	55%	0.547	56%	0.556	S	S	.	*			trans	-114.6	53	-170.7	-74.2	-72.8	-51.6	0	0	114.5	Q454	M265-Q454 PolarHBondContact O-NE2 3.46Å
266	C	54.7	Low	65.3	Low	110 Å²	110	98.6 Å²	98.6	74%	0.743	52%	0.521	S	S	*	.	S	Bend	trans	-116.2	31.6	-177.9	-161.3	0	0	0	0	113.9
267	G	78.4	Confident	68.1	Low	32 Å²	32	95.9 Å²	95.9	33%	0.33	51%	0.507	S	S	.	.			trans	-143.9	-1	-175.1	0	0	0	0	0	117.6	E270 E271	G267-E270 VanDerWaalsContact CA-OE2 3.24Å; G267-E270 WeakPolarHBondContact CA-OE2 3.16Å; G267-E271 WeakPolarHBondContact O-CB 3.07Å; G267-E271 PolarHBondContact O-N 2.56Å
268	E	89.1	Confident	70.8	Confident	50 Å²	50	94.5 Å²	94.5	23%	0.234	50%	0.497	C	S	.	.	H	α-helix	trans	-62.5	-46.2	-177.3	-177.2	-173.2	-176.2	0	0	111.3	L272	E268-L272 WeakPolarHBondContact O-CB 3.31Å; E268-L272 PolarHBondContact O-N 3.03Å; E268-L272 VanDerWaalsContact O-N 3.09Å
269	V	92.1	Very high	73.5	Confident	1 Å²	1	88.8 Å²	88.8	1%	0.006	47%	0.466	C	S	.	.	H	α-helix	trans	-70.9	-43.3	-179.6	174	0	0	0	0	110.7	L272 M273 M386 A387 Q454 F455	V269-L272 PolarHBondContact O-N 3.39Å; V269-M273 HydrophobicContact CG1-CE 4.03Å; V269-M273 HydrophobicContact CG1-CG 4.49Å; V269-M273 HydrophobicContact CG1-SD 4.35Å; V269-M273 WeakPolarHBondContact O-CG 2.79Å; V269-M273 PolarHBondContact O-N 3.05Å; V269-M386 HydrophobicContact CG1-CG 3.99Å; V269-M386 HydrophobicContact CG1-SD 4.21Å; V269-A387 HydrophobicContact CG1-CB 4.29Å; V269-A387 HydrophobicContact CG2-CB 3.82Å; V269-Q454 HydrophobicContact CG2-CB 3.93Å; V269-F455 HydrophobicContact CG2-CD2 4.05Å; V269-F455 HydrophobicContact CG2-CE2 3.54Å; V269-F455 HydrophobicContact CG2-CZ 4.11Å
270	E	94	Very high	75.8	Confident	76 Å²	76	86.6 Å²	86.6	36%	0.355	45%	0.452	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178.2	-66.1	80.7	179.2	0	0	112.1	G267 M273 E274 H389	G267-E270 VanDerWaalsContact CA-OE2 3.24Å; G267-E270 WeakPolarHBondContact CA-OE2 3.16Å; E270-M273 HydrophobicContact CG-CE 4.32Å; E270-M273 PolarHBondContact O-N 3.34Å; E270-E274 WeakPolarHBondContact O-CB 3.27Å; E270-E274 PolarHBondContact O-N 3.36Å; E270-H389 IonicContact OE1-NE2 3.29Å
271	E	93.4	Very high	78.1	Confident	106 Å²	106	83.8 Å²	83.8	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-65.7	-40.4	176.7	-171.1	179.6	-168.8	0	0	111.4	G267 E274 R275	G267-E271 WeakPolarHBondContact O-CB 3.07Å; G267-E271 PolarHBondContact O-N 2.56Å; E271-E274 PolarHBondContact O-N 2.7Å; E271-R275 WeakPolarHBondContact O-CG 3.41Å; E271-R275 PolarHBondContact O-N 3.08Å; E271-R275 IonicContact OE1-CZ 3.93Å; E271-R275 IonicContact OE1-NE 2.75Å; E271-R275 IonicContact OE1-NH2 2.8Å; E271-R275 PolarHBondContact OE1-NH2 2.92Å; E271-R275 IonicContact OE2-NH2 3.16Å; E271-R275 PolarHBondContact OE2-NH2 3.03Å
272	L	94.6	Very high	80.2	Confident	10 Å²	10	84 Å²	84	5%	0.052	42%	0.423	C	S	.	.	H	α-helix	trans	-63.3	-45.7	175.1	179.2	60.4	0	0	0	111.7	E268 V269 E274 R275 M276 M386 L397 L424 F455	E268-L272 WeakPolarHBondContact O-CB 3.31Å; E268-L272 PolarHBondContact O-N 3.03Å; E268-L272 VanDerWaalsContact O-N 3.09Å; V269-L272 PolarHBondContact O-N 3.39Å; L272-E274 VanDerWaalsContact C-N 3.33Å; L272-E274 PolarHBondContact O-N 3.08Å; L272-R275 PolarHBondContact O-N 2.91Å; L272-M276 HydrophobicContact CD1-CG 4.47Å; L272-M276 HydrophobicContact CG-SD 4.28Å; L272-M276 WeakPolarHBondContact O-CB 3.36Å; L272-M276 VanDerWaalsContact O-CG 3.31Å; L272-M276 WeakPolarHBondContact O-CG 3.27Å; L272-M276 PolarHBondContact O-N 2.96Å; L272-M386 HydrophobicContact CD2-CE 4.33Å; L272-M386 HydrophobicContact CD2-SD 4.07Å; L272-M386 HydrophobicContact CG-SD 4.41Å; L272-L397 HydrophobicContact CD2-CD2 4.07Å; L272-L424 HydrophobicContact CD1-CB 4.49Å; L272-L424 HydrophobicContact CD1-CD2 3.92Å; L272-L424 WeakPolarHBondContact CD1-O 3.49Å; L272-F455 HydrophobicContact CD2-CZ 4.12Å
273	M	94.2	Very high	82	Confident	41 Å²	41	80.2 Å²	80.2	20%	0.202	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-40.4	177.2	-72.3	-173	-58.2	0	0	112	V269 E270 M276 K277 M386 H389 V392	V269-M273 HydrophobicContact CG1-CE 4.03Å; V269-M273 HydrophobicContact CG1-CG 4.49Å; V269-M273 HydrophobicContact CG1-SD 4.35Å; V269-M273 WeakPolarHBondContact O-CG 2.79Å; V269-M273 PolarHBondContact O-N 3.05Å; E270-M273 HydrophobicContact CG-CE 4.32Å; E270-M273 PolarHBondContact O-N 3.34Å; M273-M276 WeakPolarHBondContact O-CB 3.29Å; M273-M276 PolarHBondContact O-N 3.27Å; M273-K277 PolarHBondContact O-N 2.96Å; M273-M386 HydrophobicContact CG-SD 3.6Å; M273-M386 HydrophobicContact SD-SD 4.47Å; M273-H389 HydrophobicContact SD-CB 4.09Å; M273-V392 HydrophobicContact SD-CG2 4.16Å
274	E	94.5	Very high	83.2	Confident	92 Å²	92	77.7 Å²	77.7	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-44.4	177	-177.8	57.9	-153.4	0	0	111.3	E270 E271 L272 M276 K277 Q278	E270-E274 WeakPolarHBondContact O-CB 3.27Å; E270-E274 PolarHBondContact O-N 3.36Å; E271-E274 PolarHBondContact O-N 2.7Å; L272-E274 VanDerWaalsContact C-N 3.33Å; L272-E274 PolarHBondContact O-N 3.08Å; E274-M276 VanDerWaalsContact C-N 3.3Å; E274-M276 PolarHBondContact O-N 3.3Å; E274-K277 WeakPolarHBondContact O-CB 3.17Å; E274-K277 PolarHBondContact O-N 3.23Å; E274-Q278 WeakPolarHBondContact O-CG 3.22Å; E274-Q278 PolarHBondContact O-N 2.96Å; E274-Q278 PolarHBondContact OE1-NE2 3.29Å
275	R	94.5	Very high	84.1	Confident	76 Å²	76	75 Å²	75	29%	0.287	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-39.7	172.6	-71.4	-179.7	-161.6	148.9	3.4	111.9	E271 L272 K277 Q278 L279 Q423	E271-R275 WeakPolarHBondContact O-CG 3.41Å; E271-R275 PolarHBondContact O-N 3.08Å; E271-R275 IonicContact OE1-CZ 3.93Å; E271-R275 IonicContact OE1-NE 2.75Å; E271-R275 IonicContact OE1-NH2 2.8Å; E271-R275 PolarHBondContact OE1-NH2 2.92Å; E271-R275 IonicContact OE2-NH2 3.16Å; E271-R275 PolarHBondContact OE2-NH2 3.03Å; L272-R275 PolarHBondContact O-N 2.91Å; R275-K277 VanDerWaalsContact C-N 3.3Å; R275-K277 PolarHBondContact O-N 2.78Å; R275-Q278 PolarHBondContact O-N 3.15Å; R275-L279 WeakPolarHBondContact O-CB 3.47Å; R275-L279 WeakPolarHBondContact O-CG 3.21Å; R275-L279 PolarHBondContact O-N 3.12Å; R275-Q423 WeakPolarHBondContact CD-O 3.23Å; R275-Q423 PolarHBondContact NH1-O 3.25Å
276	M	94.6	Very high	84.9	Confident	15 Å²	15	78 Å²	78	7%	0.074	39%	0.393	C	S	.	.	H	α-helix	trans	-62.3	-41.2	177.4	-77.4	176.5	61.8	0	0	111.7	L272 M273 E274 Q280 M386 D393 M396 L397 L424	L272-M276 HydrophobicContact CD1-CG 4.47Å; L272-M276 HydrophobicContact CG-SD 4.28Å; L272-M276 WeakPolarHBondContact O-CB 3.36Å; L272-M276 VanDerWaalsContact O-CG 3.31Å; L272-M276 WeakPolarHBondContact O-CG 3.27Å; L272-M276 PolarHBondContact O-N 2.96Å; M273-M276 WeakPolarHBondContact O-CB 3.29Å; M273-M276 PolarHBondContact O-N 3.27Å; E274-M276 VanDerWaalsContact C-N 3.3Å; E274-M276 PolarHBondContact O-N 3.3Å; M276-Q280 PolarHBondContact O-N 2.88Å; M276-Q280 VanDerWaalsContact O-N 3.14Å; M276-M386 HydrophobicContact CE-CE 4.23Å; M276-M386 HydrophobicContact SD-CE 3.6Å; M276-M386 VanDerWaalsContact SD-CE 3.6Å; M276-D393 WeakPolarHBondContact CE-O 3.16Å; M276-M396 HydrophobicContact CB-CE 3.72Å; M276-M396 HydrophobicContact CG-CE 3.72Å; M276-M396 VanDerWaalsContact O-CE 3.29Å; M276-M396 WeakPolarHBondContact O-CE 3.33Å; M276-L397 HydrophobicContact CE-CB 4.25Å; M276-L397 HydrophobicContact SD-CB 4.14Å; M276-L424 HydrophobicContact CG-CD2 3.4Å; M276-L424 VanDerWaalsContact CG-CD2 3.4Å
277	K	92.5	Very high	85.8	Confident	116 Å²	116	82 Å²	82	50%	0.504	40%	0.4	S	S	.	.	H	α-helix	trans	-65.4	-45.9	176.4	-171	-175	174.3	-155.2	0	112	M273 E274 R275 L279 Q280 E281	M273-K277 PolarHBondContact O-N 2.96Å; E274-K277 WeakPolarHBondContact O-CB 3.17Å; E274-K277 PolarHBondContact O-N 3.23Å; R275-K277 VanDerWaalsContact C-N 3.3Å; R275-K277 PolarHBondContact O-N 2.78Å; K277-L279 PolarHBondContact O-N 3.47Å; K277-Q280 WeakPolarHBondContact O-CB 3.41Å; K277-Q280 PolarHBondContact O-N 3.26Å; K277-E281 WeakPolarHBondContact CE-OE1 3.29Å; K277-E281 IonicContact NZ-OE1 2.71Å; K277-E281 WeakPolarHBondContact O-CG 3.35Å; K277-E281 PolarHBondContact O-N 3.02Å
278	Q	91.8	Very high	85.9	Confident	89 Å²	89	81.7 Å²	81.7	42%	0.416	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-43.4	178.4	-71.6	171.2	9.7	0	0	112.3	E274 R275 Q280 E281 C282	E274-Q278 WeakPolarHBondContact O-CG 3.22Å; E274-Q278 PolarHBondContact O-N 2.96Å; E274-Q278 PolarHBondContact OE1-NE2 3.29Å; R275-Q278 PolarHBondContact O-N 3.15Å; Q278-Q280 VanDerWaalsContact C-N 3.3Å; Q278-Q280 PolarHBondContact O-N 3.36Å; Q278-E281 PolarHBondContact O-N 3.34Å; Q278-C282 WeakPolarHBondContact O-CB 3.49Å; Q278-C282 PolarHBondContact O-N 3.03Å; Q278-C282 PolarHBondContact O-SG 3.25Å
279	L	90.6	Very high	85.8	Confident	15 Å²	15	82.4 Å²	82.4	8%	0.079	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-36.7	176.1	-79.8	172.9	0	0	0	112.6	R275 K277 R283 M396 E420 Q423 L424	R275-L279 WeakPolarHBondContact O-CB 3.47Å; R275-L279 WeakPolarHBondContact O-CG 3.21Å; R275-L279 PolarHBondContact O-N 3.12Å; K277-L279 PolarHBondContact O-N 3.47Å; L279-R283 PolarHBondContact O-N 2.89Å; L279-R283 VanDerWaalsContact O-N 3.15Å; L279-M396 HydrophobicContact CB-CE 3.69Å; L279-M396 HydrophobicContact CB-SD 3.88Å; L279-M396 HydrophobicContact CD1-CE 3.84Å; L279-M396 HydrophobicContact CD1-SD 4.41Å; L279-M396 HydrophobicContact CG-CE 4.44Å; L279-E420 HydrophobicContact CD1-CB 4.44Å; L279-E420 HydrophobicContact CD1-CG 4.37Å; L279-E420 HydrophobicContact CD2-CG 4.2Å; L279-Q423 HydrophobicContact CD1-CB 4.11Å; L279-L424 HydrophobicContact CD1-CD1 4.17Å; L279-L424 HydrophobicContact CD1-CD2 3.93Å; L279-L424 HydrophobicContact CD1-CG 3.92Å
280	Q	87.8	Confident	85.4	Confident	92 Å²	92	87.5 Å²	87.5	43%	0.43	43%	0.43	S	S	.	.	H	α-helix	trans	-66.6	-42	176	-172.9	61.2	44.7	0	0	111.5	M276 K277 Q278	M276-Q280 PolarHBondContact O-N 2.88Å; M276-Q280 VanDerWaalsContact O-N 3.14Å; K277-Q280 WeakPolarHBondContact O-CB 3.41Å; K277-Q280 PolarHBondContact O-N 3.26Å; Q278-Q280 VanDerWaalsContact C-N 3.3Å; Q278-Q280 PolarHBondContact O-N 3.36Å
281	E	87	Confident	85.1	Confident	102 Å²	102	91.5 Å²	91.5	48%	0.477	45%	0.448	S	S	.	.	H	α-helix	trans	-66.4	-44.6	176.3	-69.3	172.9	-179.6	0	0	111.7	K277 Q278 R283 D284	K277-E281 WeakPolarHBondContact CE-OE1 3.29Å; K277-E281 IonicContact NZ-OE1 2.71Å; K277-E281 WeakPolarHBondContact O-CG 3.35Å; K277-E281 PolarHBondContact O-N 3.02Å; Q278-E281 PolarHBondContact O-N 3.34Å; E281-R283 VanDerWaalsContact C-N 3.32Å; E281-R283 PolarHBondContact O-N 3.25Å; E281-D284 PolarHBondContact O-N 2.95Å
282	C	81.8	Confident	84.9	Confident	80 Å²	80	90 Å²	90	54%	0.541	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-33.2	178.9	-71.7	0	0	0	0	113.7	Q278 D284 D285 E286	Q278-C282 WeakPolarHBondContact O-CB 3.49Å; Q278-C282 PolarHBondContact O-N 3.03Å; Q278-C282 PolarHBondContact O-SG 3.25Å; C282-D284 PolarHBondContact O-N 3.27Å; C282-D285 PolarHBondContact O-N 3.36Å; C282-E286 PolarHBondContact O-N 3.19Å; C282-E286 VanDerWaalsContact O-N 3.16Å
283	R	77.4	Confident	84.5	Confident	93 Å²	93	90.2 Å²	90.2	35%	0.351	44%	0.442	S	S	.	.	H	α-helix	trans	-61.4	-29.7	177	-99.4	177.8	171.6	-117.9	-11.1	112.9	L279 E281 D285 E420	L279-R283 PolarHBondContact O-N 2.89Å; L279-R283 VanDerWaalsContact O-N 3.15Å; E281-R283 VanDerWaalsContact C-N 3.32Å; E281-R283 PolarHBondContact O-N 3.25Å; R283-D285 VanDerWaalsContact C-N 3.31Å; R283-E420 IonicContact CZ-OE1 3.69Å; R283-E420 IonicContact NE-OE1 2.79Å; R283-E420 PolarHBondContact NE-OE1 3.28Å; R283-E420 IonicContact NH2-OE1 2.93Å; R283-E420 PolarHBondContact NH2-OE1 2.9Å; R283-E420 IonicContact NH2-OE2 2.62Å
284	D	67.6	Low	84.3	Confident	128 Å²	128	89.4 Å²	89.4	68%	0.684	44%	0.442	S	S	*	.	H	α-helix	trans	-79.2	-18.2	-179.6	-66.7	-21	0	0	0	112	E281 C282	E281-D284 PolarHBondContact O-N 2.95Å; C282-D284 PolarHBondContact O-N 3.27Å
285	D	64.9	Low	84.1	Confident	140 Å²	140	89 Å²	89	75%	0.749	45%	0.446	S	S	*	.	H	α-helix	trans	-104.8	-39.3	-172.1	-74.8	-23.5	0	0	0	114.6	C282 R283	C282-D285 PolarHBondContact O-N 3.36Å; R283-D285 VanDerWaalsContact C-N 3.31Å
286	E	66.9	Low	84	Confident	175 Å²	175	88 Å²	88	82%	0.818	44%	0.442	S	S	*	.			trans	-142.6	116.4	-177.8	-71.5	-172.5	166.8	0	0	113.2	C282	C282-E286 PolarHBondContact O-N 3.19Å; C282-E286 VanDerWaalsContact O-N 3.16Å
287	E	74.4	Confident	83.8	Confident	192 Å²	192	87.3 Å²	87.3	90%	0.897	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-94.5	122.3	176.4	-157.8	172	-159.8	0	0	111
288	A	80.6	Confident	83.7	Confident	26 Å²	26	85.2 Å²	85.2	22%	0.215	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-64.5	147.1	179.1	0	0	0	0	0	111.5	M293	A288-M293 HydrophobicContact CB-CG 4.08Å
289	S	86.3	Confident	83.6	Confident	66 Å²	66	86.9 Å²	86.9	46%	0.462	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-67.8	153.6	176.5	73	0	0	0	0	112	E291 E292 M293	S289-E291 VanDerWaalsContact C-N 3.25Å; S289-E291 PolarHBondContact O-N 3.03Å; S289-E292 WeakPolarHBondContact O-CB 2.82Å; S289-E292 PolarHBondContact O-N 3.13Å; S289-E292 WeakPolarHBondContact OG-CB 3.25Å; S289-E292 PolarHBondContact OG-N 2.9Å; S289-M293 WeakPolarHBondContact O-CG 3.45Å; S289-M293 PolarHBondContact O-N 3.31Å
290	Q	84.7	Confident	83.6	Confident	108 Å²	108	86.2 Å²	86.2	51%	0.505	43%	0.43	S	S	.	.	H	α-helix	trans	-57.1	-35.8	176.7	-75.2	-68.6	-41.1	0	0	113.5	A294 D414	Q290-A294 PolarHBondContact O-N 3.27Å; Q290-A294 VanDerWaalsContact O-N 3.08Å; Q290-D414 PolarHBondContact NE2-O 3.34Å; Q290-D414 PolarHBondContact OE1-O 2.92Å
291	E	87.4	Confident	83.6	Confident	159 Å²	159	82.4 Å²	82.4	74%	0.743	41%	0.412	S	S	*	.	H	α-helix	trans	-66.8	-43	175.3	-175	173.3	-175.9	0	0	111	S289 A294 T295	S289-E291 VanDerWaalsContact C-N 3.25Å; S289-E291 PolarHBondContact O-N 3.03Å; E291-A294 WeakPolarHBondContact O-CB 3.36Å; E291-A294 PolarHBondContact O-N 3.47Å; E291-T295 WeakPolarHBondContact O-CG2 3.42Å; E291-T295 PolarHBondContact O-N 3.17Å
292	E	88.1	Confident	83.5	Confident	74 Å²	74	81 Å²	81	35%	0.346	41%	0.41	S	S	.	.	H	α-helix	trans	-63.7	-44.8	176.1	-173.1	179.8	177.2	0	0	111.7	S289 A294 T295 R296	S289-E292 WeakPolarHBondContact O-CB 2.82Å; S289-E292 PolarHBondContact O-N 3.13Å; S289-E292 WeakPolarHBondContact OG-CB 3.25Å; S289-E292 PolarHBondContact OG-N 2.9Å; E292-A294 VanDerWaalsContact C-N 3.27Å; E292-A294 PolarHBondContact O-N 3.08Å; E292-T295 PolarHBondContact O-N 2.58Å; E292-T295 PolarHBondContact O-OG1 2.97Å; E292-R296 HydrophobicContact CG-CG 4.47Å; E292-R296 WeakPolarHBondContact O-CG 3.5Å; E292-R296 PolarHBondContact O-N 3.48Å; E292-R296 IonicContact OE1-CZ 3.52Å; E292-R296 VanDerWaalsContact OE1-CZ 3.27Å; E292-R296 IonicContact OE1-NE 3.75Å; E292-R296 PolarHBondContact OE1-NE 3.37Å; E292-R296 VanDerWaalsContact OE1-NE 3.16Å; E292-R296 IonicContact OE1-NH2 2.67Å; E292-R296 PolarHBondContact OE1-NH2 2.85Å
293	M	88.1	Confident	83.7	Confident	16 Å²	16	80.4 Å²	80.4	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-58.2	-40.7	176.2	-65.7	172.1	81.5	0	0	111.6	A288 S289 R296 F297 D414 D415 Y416	A288-M293 HydrophobicContact CB-CG 4.08Å; S289-M293 WeakPolarHBondContact O-CG 3.45Å; S289-M293 PolarHBondContact O-N 3.31Å; M293-R296 PolarHBondContact O-N 3.19Å; M293-F297 PolarHBondContact O-N 3.01Å; M293-D414 WeakPolarHBondContact CE-O 3.49Å; M293-D415 VanDerWaalsContact CE-C 3.45Å; M293-Y416 VanDerWaalsContact CE-C 3.4Å; M293-Y416 VanDerWaalsContact CE-N 3.35Å; M293-Y416 WeakPolarHBondContact CE-O 3.47Å
294	A	88.9	Confident	83.9	Confident	24 Å²	24	76.1 Å²	76.1	20%	0.198	38%	0.384	C	S	.	.	H	α-helix	trans	-63.2	-40.6	174.1	0	0	0	0	0	112.5	Q290 E291 E292 F297 E298	Q290-A294 PolarHBondContact O-N 3.27Å; Q290-A294 VanDerWaalsContact O-N 3.08Å; E291-A294 WeakPolarHBondContact O-CB 3.36Å; E291-A294 PolarHBondContact O-N 3.47Å; E292-A294 VanDerWaalsContact C-N 3.27Å; E292-A294 PolarHBondContact O-N 3.08Å; A294-F297 WeakPolarHBondContact O-CB 3.39Å; A294-F297 PolarHBondContact O-N 3.42Å; A294-E298 WeakPolarHBondContact O-CG 3.05Å; A294-E298 PolarHBondContact O-N 3.32Å; A294-E298 VanDerWaalsContact O-N 3.09Å
295	T	89.9	Confident	84.6	Confident	83 Å²	83	72 Å²	72	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-67.1	-38.5	175.8	64.4	0	0	0	0	112.5	E291 E292 F297 E298 R299	E291-T295 WeakPolarHBondContact O-CG2 3.42Å; E291-T295 PolarHBondContact O-N 3.17Å; E292-T295 PolarHBondContact O-N 2.58Å; E292-T295 PolarHBondContact O-OG1 2.97Å; T295-F297 VanDerWaalsContact C-N 3.34Å; T295-E298 PolarHBondContact O-N 2.64Å; T295-R299 PolarHBondContact O-N 2.82Å
296	R	91.9	Very high	85.3	Confident	56 Å²	56	71.5 Å²	71.5	21%	0.211	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-39.5	175.6	-67.7	179.5	-176.9	-163.1	5.7	111.5	E292 M293 R299 E300 D417	E292-R296 HydrophobicContact CG-CG 4.47Å; E292-R296 WeakPolarHBondContact O-CG 3.5Å; E292-R296 PolarHBondContact O-N 3.48Å; E292-R296 IonicContact OE1-CZ 3.52Å; E292-R296 VanDerWaalsContact OE1-CZ 3.27Å; E292-R296 IonicContact OE1-NE 3.75Å; E292-R296 PolarHBondContact OE1-NE 3.37Å; E292-R296 VanDerWaalsContact OE1-NE 3.16Å; E292-R296 IonicContact OE1-NH2 2.67Å; E292-R296 PolarHBondContact OE1-NH2 2.85Å; M293-R296 PolarHBondContact O-N 3.19Å; R296-R299 PolarHBondContact O-N 2.89Å; R296-E300 PolarHBondContact O-N 2.94Å; R296-D417 WeakPolarHBondContact CD-OD1 3.39Å; R296-D417 IonicContact CZ-OD1 3.27Å; R296-D417 IonicContact CZ-OD2 2.93Å; R296-D417 IonicContact NE-OD1 3.16Å; R296-D417 IonicContact NH1-OD1 2.65Å; R296-D417 PolarHBondContact NH1-OD1 3.46Å; R296-D417 IonicContact NH1-OD2 3.86Å; R296-D417 PolarHBondContact NH1-OD2 2.53Å
297	F	92	Very high	85.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.2	-50.5	171.3	172	-96.4	0	0	0	112.1	M293 A294 T295 R299 E300 K301 T344 C407 R412 Y418	M293-F297 PolarHBondContact O-N 3.01Å; A294-F297 WeakPolarHBondContact O-CB 3.39Å; A294-F297 PolarHBondContact O-N 3.42Å; T295-F297 VanDerWaalsContact C-N 3.34Å; F297-R299 VanDerWaalsContact C-N 3.25Å; F297-R299 PolarHBondContact O-N 3.17Å; F297-E300 PolarHBondContact O-N 3.21Å; F297-K301 HydrophobicContact CE1-CD 4.02Å; F297-K301 HydrophobicContact CZ-CD 4.26Å; F297-K301 VanDerWaalsContact O-CB 3.29Å; F297-K301 WeakPolarHBondContact O-CB 3.48Å; F297-K301 PolarHBondContact O-N 2.93Å; F297-T344 HydrophobicContact CD1-CG2 4.04Å; F297-T344 HydrophobicContact CE1-CG2 3.29Å; F297-T344 HydrophobicContact CZ-CG2 3.75Å; F297-C407 HydrophobicContact CE2-CB 4.18Å; F297-R412 HydrophobicContact CB-CG 4.04Å; F297-R412 HydrophobicContact CD1-CB 4.23Å; F297-R412 HydrophobicContact CD1-CG 4.09Å; F297-R412 HydrophobicContact CD2-CB 3.84Å; F297-R412 HydrophobicContact CD2-CG 3.62Å; F297-R412 HydrophobicContact CE1-CB 4.14Å; F297-R412 HydrophobicContact CE1-CG 4.5Å; F297-R412 HydrophobicContact CE2-CB 3.69Å; F297-R412 HydrophobicContact CE2-CG 4.03Å; F297-R412 HydrophobicContact CG-CB 4.09Å; F297-R412 HydrophobicContact CG-CG 3.62Å; F297-R412 HydrophobicContact CZ-CB 3.86Å; F297-R412 HydrophobicContact CZ-CG 4.46Å; F297-Y418 HydrophobicContact CB-CD2 3.83Å; F297-Y418 HydrophobicContact CB-CE2 4.18Å; F297-Y418 HydrophobicContact CB-CG 4.09Å; F297-Y418 AromaticContact CD2-CD1 3.89Å; F297-Y418 HydrophobicContact CD2-CD1 3.89Å; F297-Y418 HydrophobicContact CD2-CD2 4.03Å; F297-Y418 AromaticContact CD2-CE1 3.61Å; F297-Y418 HydrophobicContact CD2-CE1 3.61Å; F297-Y418 AromaticContact CD2-CE2 3.72Å; F297-Y418 HydrophobicContact CD2-CE2 3.72Å; F297-Y418 HydrophobicContact CD2-CG 4.11Å; F297-Y418 AromaticContact CD2-CZ 3.51Å; F297-Y418 HydrophobicContact CE2-CE1 4.1Å; F297-Y418 HydrophobicContact CG-CD2 4.44Å; F297-Y418 HydrophobicContact CG-CE2 4.39Å
298	E	89.9	Confident	85.8	Confident	72 Å²	72	59.7 Å²	59.7	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-34.7	-179.6	-70.7	-63	138.7	0	0	112.2	A294 T295 K301 T302 T344	A294-E298 WeakPolarHBondContact O-CG 3.05Å; A294-E298 PolarHBondContact O-N 3.32Å; A294-E298 VanDerWaalsContact O-N 3.09Å; T295-E298 PolarHBondContact O-N 2.64Å; E298-K301 IonicContact OE1-NZ 3.86Å; E298-K301 PolarHBondContact OE1-NZ 3.17Å; E298-K301 WeakPolarHBondContact OE2-CE 3.41Å; E298-K301 IonicContact OE2-NZ 3.83Å; E298-K301 PolarHBondContact OE2-NZ 2.85Å; E298-T302 WeakPolarHBondContact O-CB 3.38Å; E298-T302 PolarHBondContact O-N 2.94Å; E298-T302 PolarHBondContact O-OG1 3.34Å; E298-T344 PolarHBondContact OE1-OG1 3.25Å
299	R	89.6	Confident	85.1	Confident	123 Å²	123	59.9 Å²	59.9	46%	0.464	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-53.6	172.1	-177.6	177.7	64.7	-160.5	-0.4	111.8	T295 R296 F297 K301 T302 E303	T295-R299 PolarHBondContact O-N 2.82Å; R296-R299 PolarHBondContact O-N 2.89Å; F297-R299 VanDerWaalsContact C-N 3.25Å; F297-R299 PolarHBondContact O-N 3.17Å; R299-K301 VanDerWaalsContact C-N 3.31Å; R299-K301 PolarHBondContact O-N 3.17Å; R299-T302 WeakPolarHBondContact O-CB 3.36Å; R299-T302 PolarHBondContact O-N 3.36Å; R299-T302 VanDerWaalsContact O-N 3.08Å; R299-E303 HydrophobicContact CG-CG 4.4Å; R299-E303 WeakPolarHBondContact CG-OE1 3.46Å; R299-E303 WeakPolarHBondContact O-CG 3.31Å; R299-E303 PolarHBondContact O-N 3.44Å
300	E	90.9	Very high	83.4	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-41.2	-180	-177.6	62.7	-134.5	0	0	111.3	R296 F297 T302 E303 S304 Y404 I421 N422 K430	R296-E300 PolarHBondContact O-N 2.94Å; F297-E300 PolarHBondContact O-N 3.21Å; E300-T302 VanDerWaalsContact C-N 3.29Å; E300-T302 PolarHBondContact O-N 3.42Å; E300-E303 PolarHBondContact O-N 3.45Å; E300-S304 WeakPolarHBondContact O-CB 3.46Å; E300-S304 PolarHBondContact O-N 2.91Å; E300-Y404 HydrophobicContact CG-CD2 4.42Å; E300-Y404 WeakPolarHBondContact OE1-CD2 3.34Å; E300-Y404 WeakPolarHBondContact OE1-CE2 3.5Å; E300-I421 HydrophobicContact CG-CB 4.49Å; E300-I421 HydrophobicContact CG-CD1 4.03Å; E300-I421 HydrophobicContact CG-CG2 4.36Å; E300-N422 PolarHBondContact OE2-ND2 3.28Å; E300-K430 VanDerWaalsContact CD-NZ 3.31Å; E300-K430 IonicContact OE1-NZ 3.17Å; E300-K430 PolarHBondContact OE1-NZ 3.27Å; E300-K430 IonicContact OE2-NZ 2.73Å; E300-K430 PolarHBondContact OE2-NZ 3.47Å
301	K	87.4	Confident	81.5	Confident	11 Å²	11	63.3 Å²	63.3	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-56.3	-44.9	173.6	-173.3	-177.3	68.8	-175	0	111.1	F297 E298 R299 M305 F335 T344	F297-K301 HydrophobicContact CE1-CD 4.02Å; F297-K301 HydrophobicContact CZ-CD 4.26Å; F297-K301 VanDerWaalsContact O-CB 3.29Å; F297-K301 WeakPolarHBondContact O-CB 3.48Å; F297-K301 PolarHBondContact O-N 2.93Å; E298-K301 IonicContact OE1-NZ 3.86Å; E298-K301 PolarHBondContact OE1-NZ 3.17Å; E298-K301 WeakPolarHBondContact OE2-CE 3.41Å; E298-K301 IonicContact OE2-NZ 3.83Å; E298-K301 PolarHBondContact OE2-NZ 2.85Å; R299-K301 VanDerWaalsContact C-N 3.31Å; R299-K301 PolarHBondContact O-N 3.17Å; K301-M305 HydrophobicContact CD-CE 4.47Å; K301-M305 HydrophobicContact CG-CE 3.94Å; K301-M305 VanDerWaalsContact O-CG 3.24Å; K301-M305 WeakPolarHBondContact O-CG 3.38Å; K301-M305 PolarHBondContact O-N 3.02Å; K301-F335 HydrophobicContact CD-CD1 4.05Å; K301-T344 PolarHBondContact NZ-OG1 2.92Å
302	T	85.8	Confident	79.1	Confident	73 Å²	73	61.8 Å²	61.8	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-69.4	-43.3	178.7	-57.3	0	0	0	0	112.1	E298 R299 E300 S304 M305 L306	E298-T302 WeakPolarHBondContact O-CB 3.38Å; E298-T302 PolarHBondContact O-N 2.94Å; E298-T302 PolarHBondContact O-OG1 3.34Å; R299-T302 WeakPolarHBondContact O-CB 3.36Å; R299-T302 PolarHBondContact O-N 3.36Å; R299-T302 VanDerWaalsContact O-N 3.08Å; E300-T302 VanDerWaalsContact C-N 3.29Å; E300-T302 PolarHBondContact O-N 3.42Å; T302-S304 VanDerWaalsContact C-N 3.33Å; T302-S304 PolarHBondContact O-N 3.13Å; T302-M305 VanDerWaalsContact O-CB 3.31Å; T302-M305 WeakPolarHBondContact O-CB 3.35Å; T302-M305 PolarHBondContact O-N 2.91Å; T302-M305 VanDerWaalsContact O-N 3.12Å; T302-L306 PolarHBondContact O-N 3.06Å
303	E	84.8	Confident	76.6	Confident	68 Å²	68	67.3 Å²	67.3	32%	0.318	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-39.3	177.9	-76	175.6	-173.2	0	0	111.8	R299 E300 M305 L306 V307 N422	R299-E303 HydrophobicContact CG-CG 4.4Å; R299-E303 WeakPolarHBondContact CG-OE1 3.46Å; R299-E303 WeakPolarHBondContact O-CG 3.31Å; R299-E303 PolarHBondContact O-N 3.44Å; E300-E303 PolarHBondContact O-N 3.45Å; E303-M305 PolarHBondContact O-N 3.12Å; E303-L306 WeakPolarHBondContact O-CA 2.99Å; E303-L306 WeakPolarHBondContact O-CB 3.3Å; E303-L306 PolarHBondContact O-N 3.16Å; E303-V307 PolarHBondContact O-N 2.94Å; E303-N422 PolarHBondContact OE2-ND2 3.29Å; E303-N422 PolarHBondContact OE2-OD1 3.06Å
304	S	82.8	Confident	74.1	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-58.2	-33.8	173.7	-171.5	0	0	0	0	112.1	E300 T302 L306 V307 Y404 M408 K434	E300-S304 WeakPolarHBondContact O-CB 3.46Å; E300-S304 PolarHBondContact O-N 2.91Å; T302-S304 VanDerWaalsContact C-N 3.33Å; T302-S304 PolarHBondContact O-N 3.13Å; S304-L306 VanDerWaalsContact C-N 3.28Å; S304-L306 PolarHBondContact O-N 2.7Å; S304-V307 VanDerWaalsContact O-CB 3.32Å; S304-V307 WeakPolarHBondContact O-CB 3.43Å; S304-V307 PolarHBondContact O-N 3.31Å; S304-Y404 PolarHBondContact OG-OH 3.46Å; S304-M408 VanDerWaalsContact OG-CG 3.28Å; S304-M408 WeakPolarHBondContact OG-CG 3.4Å; S304-K434 PolarHBondContact O-NZ 2.96Å
305	M	80.9	Confident	71.7	Confident	42 Å²	42	79.8 Å²	79.8	21%	0.207	41%	0.413	C	S	.	.	H	α-helix	trans	-64.9	-33	174.3	-48.2	-170.1	-173.8	0	0	112.4	K301 T302 E303 V307 D334 K434	K301-M305 HydrophobicContact CD-CE 4.47Å; K301-M305 HydrophobicContact CG-CE 3.94Å; K301-M305 VanDerWaalsContact O-CG 3.24Å; K301-M305 WeakPolarHBondContact O-CG 3.38Å; K301-M305 PolarHBondContact O-N 3.02Å; T302-M305 VanDerWaalsContact O-CB 3.31Å; T302-M305 WeakPolarHBondContact O-CB 3.35Å; T302-M305 PolarHBondContact O-N 2.91Å; T302-M305 VanDerWaalsContact O-N 3.12Å; E303-M305 PolarHBondContact O-N 3.12Å; M305-V307 PolarHBondContact O-N 3.32Å; M305-D334 HydrophobicContact CB-CB 4.17Å; M305-D334 HydrophobicContact CE-CB 4.49Å; M305-D334 HydrophobicContact CG-CB 3.75Å; M305-D334 HydrophobicContact SD-CB 3.9Å; M305-K434 PolarHBondContact O-NZ 3.32Å
306	L	80.3	Confident	69	Low	128 Å²	128	81.8 Å²	81.8	67%	0.67	43%	0.425	S	S	*	.	H	α-helix	trans	-76.4	-10	179.2	-58.8	175.4	0	0	0	112.9	T302 E303 S304 V308	T302-L306 PolarHBondContact O-N 3.06Å; E303-L306 WeakPolarHBondContact O-CA 2.99Å; E303-L306 WeakPolarHBondContact O-CB 3.3Å; E303-L306 PolarHBondContact O-N 3.16Å; S304-L306 VanDerWaalsContact C-N 3.28Å; S304-L306 PolarHBondContact O-N 2.7Å; L306-V308 PolarHBondContact O-N 3.05Å
307	V	77.8	Confident	66.4	Low	21 Å²	21	83.6 Å²	83.6	13%	0.127	44%	0.444	C	S	.	.			trans	-69.3	101.7	172.2	-178.6	0	0	0	0	108.5	E303 S304 M305 I431 K434	E303-V307 PolarHBondContact O-N 2.94Å; S304-V307 VanDerWaalsContact O-CB 3.32Å; S304-V307 WeakPolarHBondContact O-CB 3.43Å; S304-V307 PolarHBondContact O-N 3.31Å; M305-V307 PolarHBondContact O-N 3.32Å; V307-I431 HydrophobicContact CG1-CB 4.18Å; V307-I431 HydrophobicContact CG1-CG1 3.52Å; V307-K434 HydrophobicContact CB-CD 3.83Å; V307-K434 HydrophobicContact CG1-CB 4.34Å; V307-K434 HydrophobicContact CG1-CD 4.01Å; V307-K434 PolarHBondContact O-NZ 3.08Å
308	V	73.8	Confident	64	Low	98 Å²	98	86 Å²	86	59%	0.594	46%	0.461	S	S	*	.			trans	-79.2	119.5	177.9	-178.2	0	0	0	0	109.6	L306	L306-V308 PolarHBondContact O-N 3.05Å
309	T	65.4	Low	61.9	Low	31 Å²	31	94.7 Å²	94.7	19%	0.19	49%	0.491	C	S	.	.			trans	-80.4	139.5	163.8	59.6	0	0	0	0	108.1	E311 K434 T435	T309-E311 PolarHBondContact O-N 3.3Å; T309-K434 HydrophobicContact CG2-CG 4.37Å; T309-T435 WeakPolarHBondContact CG2-OG1 3.48Å
310	S	51.4	Low	60.4	Low	70 Å²	70	91 Å²	91	49%	0.49	48%	0.48	S	S	.	.			trans	-45.8	127.6	-177.5	45.2	0	0	0	0	112.3
311	E	44.6	Very low	58.8	Low	175 Å²	175	93.6 Å²	93.6	82%	0.818	49%	0.493	S	S	*	.			trans	-61.1	152.5	-179.5	-67.7	-178.1	161.3	0	0	111.7	T309 E313	T309-E311 PolarHBondContact O-N 3.3Å; E311-E313 PolarHBondContact O-N 3.49Å
312	D	37.2	Very low	57.5	Low	128 Å²	128	93.3 Å²	93.3	68%	0.684	49%	0.493	S	S	*	.			trans	-50.9	101.9	-170.1	-59.7	-43.9	0	0	0	113.6	K442	D312-K442 IonicContact OD1-NZ 2.64Å; D312-K442 PolarHBondContact OD1-NZ 3.2Å
313	E	35.7	Very low	56.3	Low	190 Å²	190	95.6 Å²	95.6	89%	0.888	49%	0.493	S	S	*	.			trans	-78.4	117	146.3	-75.8	-163.5	165.5	0	0	107.1	E311 C315	E311-E313 PolarHBondContact O-N 3.49Å; E313-C315 PolarHBondContact O-N 3.09Å
314	E	35.8	Very low	55.4	Low	189 Å²	189	97.5 Å²	97.5	88%	0.883	50%	0.502	S	S	*	.			trans	-52.1	110.2	173.9	-75.5	-173.5	154.7	0	0	109.6	V316	E314-V316 PolarHBondContact O-N 3.34Å
315	C	37.6	Very low	54.6	Low	112 Å²	112	98.4 Å²	98.4	76%	0.757	51%	0.506	S	S	*	.			trans	-63.9	123	175.6	-151	0	0	0	0	108.7	E313	E313-C315 PolarHBondContact O-N 3.09Å
316	V	34.4	Very low	53.8	Low	125 Å²	125	98.3 Å²	98.3	76%	0.758	51%	0.505	S	S	*	.			trans	-54.3	135.7	-178.1	-178.3	0	0	0	0	109.8	E314 S318	E314-V316 PolarHBondContact O-N 3.34Å; V316-S318 PolarHBondContact O-N 2.84Å
317	P	36.4	Very low	53.2	Low	95 Å²	95	95 Å²	95	62%	0.617	49%	0.487	S	S	*	.			trans	-69.5	106.1	-169.2	19.9	-27.3	0	0	0	113.2	R323	P317-R323 VanDerWaalsContact CB-NH1 3.35Å
318	S	41.9	Very low	52.9	Low	51 Å²	51	99.3 Å²	99.3	36%	0.357	51%	0.514	S	S	.	.			trans	-73.8	146.5	165.7	-177.9	0	0	0	0	111.1	V316 D320 R323	V316-S318 PolarHBondContact O-N 2.84Å; S318-D320 VanDerWaalsContact CB-OD2 3.27Å; S318-D320 WeakPolarHBondContact CB-OD2 3.13Å; S318-D320 PolarHBondContact O-N 3.39Å; S318-D320 PolarHBondContact OG-OD1 3.32Å; S318-D320 PolarHBondContact OG-OD2 2.88Å; S318-R323 WeakPolarHBondContact O-CD 3.37Å; S318-R323 PolarHBondContact O-NE 3.28Å; S318-R323 PolarHBondContact O-NH1 3.12Å
319	R	44.8	Very low	52.8	Low	254 Å²	254	99.6 Å²	99.6	96%	0.958	52%	0.52	S	S	*	.			trans	-86	43.9	171.7	-77.3	-179.5	151.3	-173.5	-6	110.8
320	D	58.6	Low	53.5	Low	46 Å²	46	99.4 Å²	99.4	25%	0.246	52%	0.517	C	S	.	.			trans	-83	144.4	-174.2	-81.6	-37.3	0	0	0	112.8	S318 S322 R323	S318-D320 VanDerWaalsContact CB-OD2 3.27Å; S318-D320 WeakPolarHBondContact CB-OD2 3.13Å; S318-D320 PolarHBondContact O-N 3.39Å; S318-D320 PolarHBondContact OG-OD1 3.32Å; S318-D320 PolarHBondContact OG-OD2 2.88Å; D320-S322 PolarHBondContact O-N 3.15Å; D320-S322 VanDerWaalsContact O-N 3.08Å; D320-R323 PolarHBondContact O-N 2.93Å; D320-R323 VanDerWaalsContact O-N 3.11Å
321	I	57.4	Low	54.8	Low	55 Å²	55	97.5 Å²	97.5	28%	0.282	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-53	-28.6	174.8	-65.2	169.1	0	0	0	111.2	V134 V138 R323 H324 F325	V134-I321 HydrophobicContact CG1-CG2 4.3Å; V138-I321 HydrophobicContact CG1-CD1 4.43Å; V138-I321 HydrophobicContact CG2-CG2 4.21Å; I321-R323 PolarHBondContact O-N 3.44Å; I321-R323 VanDerWaalsContact O-N 3.16Å; I321-H324 PolarHBondContact O-N 3.15Å; I321-F325 HydrophobicContact CG2-CE2 4.1Å; I321-F325 WeakPolarHBondContact O-CD2 3.2Å
322	S	59.4	Low	56.6	Low	6 Å²	6	90.9 Å²	90.9	4%	0.042	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-54	-34.3	178.2	66.7	0	0	0	0	113.1	D320 H324 F325 E326	D320-S322 PolarHBondContact O-N 3.15Å; D320-S322 VanDerWaalsContact O-N 3.08Å; S322-H324 PolarHBondContact O-N 3.04Å; S322-H324 VanDerWaalsContact O-N 3.16Å; S322-F325 PolarHBondContact O-N 3.45Å; S322-E326 WeakPolarHBondContact CB-OE1 3.44Å; S322-E326 VanDerWaalsContact O-CG 3.27Å; S322-E326 WeakPolarHBondContact O-CG 3.47Å; S322-E326 PolarHBondContact O-N 2.94Å; S322-E326 VanDerWaalsContact O-N 3.16Å; S322-E326 PolarHBondContact OG-OE1 3.22Å
323	R	61.1	Low	58.6	Low	121 Å²	121	88.1 Å²	88.1	46%	0.457	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-61.9	-27.8	-177.9	-69.1	-172	164.1	-165.3	-11.8	114.4	P317 S318 D320 I321 F325 E326	P317-R323 VanDerWaalsContact CB-NH1 3.35Å; S318-R323 WeakPolarHBondContact O-CD 3.37Å; S318-R323 PolarHBondContact O-NE 3.28Å; S318-R323 PolarHBondContact O-NH1 3.12Å; D320-R323 PolarHBondContact O-N 2.93Å; D320-R323 VanDerWaalsContact O-N 3.11Å; I321-R323 PolarHBondContact O-N 3.44Å; I321-R323 VanDerWaalsContact O-N 3.16Å; R323-F325 PolarHBondContact O-N 3.22Å; R323-E326 PolarHBondContact N-OE1 3.45Å
324	H	66.6	Low	60.6	Low	108 Å²	108	80.9 Å²	80.9	50%	0.5	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-70.2	-14.4	177.5	-66.7	-68.8	0	0	0	112.9	N152 G153 I321 S322	N152-H324 PolarHBondContact O-ND1 3.13Å; G153-H324 VanDerWaalsContact CA-O 3.23Å; G153-H324 WeakPolarHBondContact CA-O 3.46Å; I321-H324 PolarHBondContact O-N 3.15Å; S322-H324 PolarHBondContact O-N 3.04Å; S322-H324 VanDerWaalsContact O-N 3.16Å
325	F	65.9	Low	62.2	Low	22 Å²	22	72.1 Å²	72.1	10%	0.096	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-8.5	-175.9	-63.3	-91.4	0	0	0	112.9	Y119 I122 M123 A126 I321 S322 R323 D327	Y119-F325 HydrophobicContact CE1-CE1 4.32Å; Y119-F325 AromaticContact CE2-CE1 3.66Å; Y119-F325 HydrophobicContact CE2-CE1 3.66Å; Y119-F325 AromaticContact CE2-CZ 3.85Å; Y119-F325 HydrophobicContact CE2-CZ 3.85Å; Y119-F325 AromaticContact CZ-CE1 3.5Å; Y119-F325 VanDerWaalsContact CZ-CE1 3.5Å; Y119-F325 VanDerWaalsContact OH-CE1 3.22Å; Y119-F325 WeakPolarHBondContact OH-CE1 3.47Å; I122-F325 HydrophobicContact CG2-CD1 4.23Å; I122-F325 HydrophobicContact CG2-CD2 4.26Å; I122-F325 HydrophobicContact CG2-CE1 3.99Å; I122-F325 HydrophobicContact CG2-CE2 4.08Å; I122-F325 HydrophobicContact CG2-CG 4.34Å; I122-F325 HydrophobicContact CG2-CZ 3.93Å; M123-F325 HydrophobicContact CG-CD1 4.46Å; A126-F325 HydrophobicContact CB-CB 3.45Å; A126-F325 VanDerWaalsContact CB-CB 3.45Å; A126-F325 HydrophobicContact CB-CG 4.4Å; I321-F325 HydrophobicContact CG2-CE2 4.1Å; I321-F325 WeakPolarHBondContact O-CD2 3.2Å; S322-F325 PolarHBondContact O-N 3.45Å; R323-F325 PolarHBondContact O-N 3.22Å; F325-D327 PolarHBondContact O-N 3.37Å
326	E	63.3	Low	63.5	Low	39 Å²	39	68.4 Å²	68.4	18%	0.182	36%	0.36	C	S	.	.			trans	-81.3	113.8	-176.9	-78	162.4	-152.8	0	0	111.1	Q129 S322 R323 T328	Q129-E326 HydrophobicContact CG-CG 4.17Å; S322-E326 WeakPolarHBondContact CB-OE1 3.44Å; S322-E326 VanDerWaalsContact O-CG 3.27Å; S322-E326 WeakPolarHBondContact O-CG 3.47Å; S322-E326 PolarHBondContact O-N 2.94Å; S322-E326 VanDerWaalsContact O-N 3.16Å; S322-E326 PolarHBondContact OG-OE1 3.22Å; R323-E326 PolarHBondContact N-OE1 3.45Å; E326-T328 HydrophobicContact CB-CG2 4.03Å
327	D	68.9	Low	64.8	Low	58 Å²	58	70.1 Å²	70.1	31%	0.31	35%	0.353	S	S	.	.			trans	-92.4	93.3	152.1	173.6	14.6	0	0	0	107.7	R127 F325 S329	R127-D327 PolarHBondContact NH1-O 3.47Å; R127-D327 PolarHBondContact NH2-O 2.83Å; F325-D327 PolarHBondContact O-N 3.37Å; D327-S329 PolarHBondContact O-N 2.62Å; D327-S329 WeakPolarHBondContact OD1-CB 3.24Å; D327-S329 PolarHBondContact OD1-N 3.44Å; D327-S329 PolarHBondContact OD1-OG 3.09Å
328	T	71	Confident	65.4	Low	113 Å²	113	77.9 Å²	77.9	69%	0.693	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.9	179.4	57.1	0	0	0	0	113	E326 Y330	E326-T328 HydrophobicContact CB-CG2 4.03Å; T328-Y330 VanDerWaalsContact C-N 3.3Å
329	S	72.1	Confident	65.8	Low	103 Å²	103	79.5 Å²	79.5	72%	0.72	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-15.9	178.5	78.3	0	0	0	0	113.2	D327	D327-S329 PolarHBondContact O-N 2.62Å; D327-S329 WeakPolarHBondContact OD1-CB 3.24Å; D327-S329 PolarHBondContact OD1-N 3.44Å; D327-S329 PolarHBondContact OD1-OG 3.09Å
330	Y	79.5	Confident	66.4	Low	28 Å²	28	73.3 Å²	73.3	11%	0.11	38%	0.377	C	S	.	.			trans	-112.6	110.1	-178.6	-161.9	-75.6	0	0	0	110.2	R127 K169 H173 R174 T328	R127-Y330 PolarHBondContact NH2-O 2.99Å; K169-Y330 HydrophobicContact CB-CD1 3.91Å; K169-Y330 HydrophobicContact CB-CE1 4.16Å; K169-Y330 HydrophobicContact CB-CG 4.3Å; K169-Y330 HydrophobicContact CD-CD1 4.27Å; K169-Y330 HydrophobicContact CD-CD2 3.74Å; K169-Y330 HydrophobicContact CD-CE1 4.49Å; K169-Y330 HydrophobicContact CD-CE2 3.97Å; K169-Y330 HydrophobicContact CD-CG 3.89Å; K169-Y330 HydrophobicContact CG-CD1 4.13Å; K169-Y330 HydrophobicContact CG-CD2 4.36Å; K169-Y330 HydrophobicContact CG-CE1 4.08Å; K169-Y330 HydrophobicContact CG-CE2 4.29Å; K169-Y330 HydrophobicContact CG-CG 4.26Å; K169-Y330 WeakPolarHBondContact O-CE1 3.35Å; H173-Y330 HydrophobicContact CB-CD1 4.1Å; H173-Y330 HydrophobicContact CB-CE1 3.91Å; H173-Y330 AromaticContact CD2-CD1 3.96Å; R174-Y330 PolarHBondContact NE-OH 3.12Å; R174-Y330 VanDerWaalsContact NH2-CD2 3.32Å; T328-Y330 VanDerWaalsContact C-N 3.3Å
331	G	79.3	Confident	66.6	Low	29 Å²	29	80.3 Å²	80.3	30%	0.299	41%	0.408	S	S	.	.			trans	-132.4	178.8	176.8	0	0	0	0	0	112.2
332	Y	81.9	Confident	67.5	Low	37 Å²	37	79 Å²	79	15%	0.145	40%	0.402	C	S	.	.			trans	-57.5	139.1	173	174.5	-91	0	0	0	110.8	H173 W176 D334 C438	H173-Y332 PolarHBondContact ND1-N 3.16Å; H173-Y332 VanDerWaalsContact O-CD2 3.24Å; H173-Y332 WeakPolarHBondContact O-CD2 3.21Å; W176-Y332 HydrophobicContact CH2-CD2 4.25Å; W176-Y332 AromaticContact CH2-CE2 3.76Å; W176-Y332 HydrophobicContact CH2-CE2 3.76Å; W176-Y332 HydrophobicContact CZ3-CE2 4.26Å; Y332-D334 WeakPolarHBondContact CE1-OD1 3.22Å; Y332-D334 PolarHBondContact OH-OD1 2.97Å; Y332-C438 WeakPolarHBondContact CB-O 3.47Å; Y332-C438 HydrophobicContact CD1-CB 3.63Å; Y332-C438 HydrophobicContact CD2-CB 3.78Å; Y332-C438 HydrophobicContact CE1-CB 3.96Å; Y332-C438 HydrophobicContact CE2-CB 4.11Å; Y332-C438 WeakPolarHBondContact CE2-SG 3.3Å; Y332-C438 HydrophobicContact CG-CB 3.54Å; Y332-C438 VanDerWaalsContact CZ-SG 3.51Å
333	Q	78.3	Confident	68.6	Low	70 Å²	70	83.9 Å²	83.9	33%	0.327	43%	0.434	S	S	.	.			trans	-135.9	144.7	168.1	-55.5	-176.3	10.8	0	0	107.2	W176 F335	W176-Q333 VanDerWaalsContact CH2-O 3.24Å; W176-Q333 WeakPolarHBondContact CH2-O 3.37Å; W176-Q333 WeakPolarHBondContact CZ2-O 3.24Å; Q333-F335 PolarHBondContact O-N 2.85Å
334	D	77.4	Confident	70	Confident	38 Å²	38	79.8 Å²	79.8	20%	0.203	42%	0.422	C	S	.	.			trans	-57.7	140	-178.5	-65.4	-49.3	0	0	0	111.9	M305 Y332 S336 R337 K434	M305-D334 HydrophobicContact CB-CB 4.17Å; M305-D334 HydrophobicContact CE-CB 4.49Å; M305-D334 HydrophobicContact CG-CB 3.75Å; M305-D334 HydrophobicContact SD-CB 3.9Å; Y332-D334 WeakPolarHBondContact CE1-OD1 3.22Å; Y332-D334 PolarHBondContact OH-OD1 2.97Å; D334-S336 PolarHBondContact O-N 3.28Å; D334-R337 PolarHBondContact O-N 3.06Å; D334-K434 WeakPolarHBondContact OD1-CE 3.39Å; D334-K434 IonicContact OD1-NZ 3.77Å; D334-K434 PolarHBondContact OD1-NZ 3.43Å; D334-K434 IonicContact OD2-NZ 3.53Å
335	F	70	Confident	71.3	Confident	5 Å²	5	74.8 Å²	74.8	2%	0.022	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-33.7	-171.7	-178	-91.2	0	0	0	115.2	W176 K301 Q333 V342 P343 F409 Y478	W176-F335 HydrophobicContact CB-CD2 3.94Å; W176-F335 HydrophobicContact CB-CE2 3.41Å; W176-F335 VanDerWaalsContact CB-CE2 3.41Å; W176-F335 HydrophobicContact CB-CZ 4.43Å; W176-F335 AromaticContact CD1-CD2 3.98Å; W176-F335 AromaticContact CD2-CD2 3.32Å; W176-F335 HydrophobicContact CD2-CD2 3.32Å; W176-F335 AromaticContact CD2-CE2 3.82Å; W176-F335 HydrophobicContact CD2-CE2 3.82Å; W176-F335 HydrophobicContact CD2-CG 4.33Å; W176-F335 AromaticContact CE2-CD2 3.79Å; W176-F335 AromaticContact CE3-CD2 3.55Å; W176-F335 HydrophobicContact CE3-CD2 3.55Å; W176-F335 HydrophobicContact CE3-CE2 4.2Å; W176-F335 AromaticContact CG-CD2 3.49Å; W176-F335 HydrophobicContact CG-CD2 3.49Å; W176-F335 VanDerWaalsContact CG-CD2 3.49Å; W176-F335 AromaticContact CG-CE2 3.46Å; W176-F335 HydrophobicContact CG-CE2 3.46Å; W176-F335 VanDerWaalsContact CG-CE2 3.46Å; W176-F335 HydrophobicContact CH2-CB 4.33Å; W176-F335 HydrophobicContact CZ2-CB 4.26Å; W176-F335 HydrophobicContact CZ2-CD2 4.4Å; W176-F335 HydrophobicContact CZ3-CD2 4.16Å; K301-F335 HydrophobicContact CD-CD1 4.05Å; Q333-F335 PolarHBondContact O-N 2.85Å; F335-V342 HydrophobicContact CD1-CB 4.43Å; F335-V342 HydrophobicContact CE1-CB 3.96Å; F335-V342 HydrophobicContact CE1-CG1 3.94Å; F335-V342 WeakPolarHBondContact CE1-O 3.29Å; F335-V342 HydrophobicContact CE2-CG1 3.93Å; F335-V342 HydrophobicContact CZ-CB 4.07Å; F335-V342 HydrophobicContact CZ-CG1 3.51Å; F335-V342 WeakPolarHBondContact O-CG2 3.45Å; F335-P343 WeakPolarHBondContact CZ-O 3.5Å; F335-F409 VanDerWaalsContact CD2-O 3.32Å; F335-F409 WeakPolarHBondContact CD2-O 3.44Å; F335-F409 VanDerWaalsContact CE2-O 3.3Å; F335-F409 WeakPolarHBondContact CE2-O 3.35Å; F335-Y478 WeakPolarHBondContact CE2-OH 3.07Å
336	S	65.8	Low	72.6	Confident	33 Å²	33	78.4 Å²	78.4	23%	0.231	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.5	68.9	177.2	-166.7	0	0	0	0	111.2	D334 E340	D334-S336 PolarHBondContact O-N 3.28Å; S336-E340 PolarHBondContact OG-O 2.88Å
337	R	60.7	Low	74.1	Confident	162 Å²	162	76.8 Å²	76.8	61%	0.611	41%	0.406	S	S	*	.			trans	-62.6	144.6	171.6	-161.2	176.4	-174.8	-176.5	2.6	110.2	D334 G339 E340	D334-R337 PolarHBondContact O-N 3.06Å; R337-G339 PolarHBondContact O-N 3.2Å; R337-E340 PolarHBondContact O-N 3.45Å; R337-E340 VanDerWaalsContact O-N 3.15Å
338	R	49.8	Very low	75.1	Confident	258 Å²	258	77.8 Å²	77.8	97%	0.974	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	109.9	-177.8	-68	-173.7	-172.4	-141.3	1.6	111.8
339	G	50.8	Low	76.2	Confident	85 Å²	85	77 Å²	77	88%	0.876	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.4	-25.2	175.5	0	0	0	0	0	115.2	R337	R337-G339 PolarHBondContact O-N 3.2Å
340	E	57.6	Low	77.4	Confident	124 Å²	124	72.6 Å²	72.6	58%	0.579	37%	0.368	S	S	*	.			trans	-111.7	108.9	178.3	-71.6	-179.9	177.4	0	0	110.6	S336 R337 V342	S336-E340 PolarHBondContact OG-O 2.88Å; R337-E340 PolarHBondContact O-N 3.45Å; R337-E340 VanDerWaalsContact O-N 3.15Å; E340-V342 PolarHBondContact O-N 3.39Å
341	Q	61.7	Low	78.3	Confident	192 Å²	192	72.2 Å²	72.2	90%	0.897	37%	0.369	S	S	*	.			trans	-83.7	85	171.3	-74	-174.2	-18.8	0	0	109.4
342	V	76.8	Confident	79.1	Confident	27 Å²	27	71.2 Å²	71.2	16%	0.164	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-74.4	127	167.4	-176.8	0	0	0	0	108.4	W176 F335 E340 T344	W176-V342 HydrophobicContact CG-CG1 4.41Å; F335-V342 HydrophobicContact CD1-CB 4.43Å; F335-V342 HydrophobicContact CE1-CB 3.96Å; F335-V342 HydrophobicContact CE1-CG1 3.94Å; F335-V342 WeakPolarHBondContact CE1-O 3.29Å; F335-V342 HydrophobicContact CE2-CG1 3.93Å; F335-V342 HydrophobicContact CZ-CB 4.07Å; F335-V342 HydrophobicContact CZ-CG1 3.51Å; F335-V342 WeakPolarHBondContact O-CG2 3.45Å; E340-V342 PolarHBondContact O-N 3.39Å; V342-T344 PolarHBondContact O-N 3.42Å
343	P	82.3	Confident	79.8	Confident	109 Å²	109	76 Å²	76	71%	0.708	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-63	130.8	179.7	-21.2	31.9	0	0	0	111.9	F335 F345	F335-P343 WeakPolarHBondContact CZ-O 3.5Å; P343-F345 PolarHBondContact O-N 2.95Å
344	T	90.3	Very high	80.6	Confident	35 Å²	35	78 Å²	78	22%	0.215	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-54.4	132.4	169.9	-64.2	0	0	0	0	110.3	F297 E298 K301 V342 R412	F297-T344 HydrophobicContact CD1-CG2 4.04Å; F297-T344 HydrophobicContact CE1-CG2 3.29Å; F297-T344 HydrophobicContact CZ-CG2 3.75Å; E298-T344 PolarHBondContact OE1-OG1 3.25Å; K301-T344 PolarHBondContact NZ-OG1 2.92Å; V342-T344 PolarHBondContact O-N 3.42Å; T344-R412 HydrophobicContact CG2-CB 3.75Å
345	F	93.6	Very high	81.6	Confident	4 Å²	4	79.6 Å²	79.6	2%	0.018	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	110.9	177.5	175.2	-165	0	0	0	109.4	P343 Y350 G410 I411 R412 L477 Y478	P343-F345 PolarHBondContact O-N 2.95Å; F345-Y350 HydrophobicContact CZ-CD1 4.45Å; F345-Y350 VanDerWaalsContact CZ-O 3.23Å; F345-Y350 WeakPolarHBondContact CZ-O 3.49Å; F345-G410 PolarHBondContact N-O 2.77Å; F345-I411 HydrophobicContact CD1-CD1 4.11Å; F345-I411 HydrophobicContact CD1-CG1 3.72Å; F345-I411 HydrophobicContact CD1-CG2 4.47Å; F345-I411 HydrophobicContact CE1-CD1 4.19Å; F345-I411 HydrophobicContact CE1-CG1 4.28Å; F345-I411 HydrophobicContact CG-CG1 4.45Å; F345-I411 CarbonylContact O-C 3.6Å; F345-I411 VanDerWaalsContact O-CA 3.29Å; F345-I411 WeakPolarHBondContact O-CA 3.03Å; F345-R412 PolarHBondContact O-N 3.17Å; F345-L477 HydrophobicContact CE1-CB 4.03Å; F345-L477 HydrophobicContact CZ-CB 4.41Å; F345-Y478 HydrophobicContact CB-CE1 4.17Å; F345-Y478 HydrophobicContact CD1-CD1 4.08Å; F345-Y478 AromaticContact CD1-CE1 3.48Å; F345-Y478 HydrophobicContact CD1-CE1 3.48Å; F345-Y478 VanDerWaalsContact CD1-CE1 3.48Å; F345-Y478 HydrophobicContact CD1-CE2 4.17Å; F345-Y478 AromaticContact CD1-CZ 3.54Å; F345-Y478 HydrophobicContact CE1-CD1 4.41Å; F345-Y478 HydrophobicContact CE1-CE1 4.23Å; F345-Y478 HydrophobicContact CG-CE1 4.16Å
346	R	94.5	Very high	82.9	Confident	97 Å²	97	79.3 Å²	79.3	37%	0.366	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.1	172.1	-61.5	171.8	68.3	-159.6	8.1	110	Q348 D349 D414	R346-Q348 PolarHBondContact O-N 3.33Å; R346-D349 HydrophobicContact CB-CB 4.5Å; R346-D349 IonicContact NH1-OD1 3.13Å; R346-D349 WeakPolarHBondContact O-CB 3.47Å; R346-D349 PolarHBondContact O-N 2.98Å; R346-D414 IonicContact CZ-OD2 2.77Å; R346-D414 IonicContact NE-OD1 3.45Å; R346-D414 IonicContact NE-OD2 3.87Å; R346-D414 PolarHBondContact NE-OD2 3.3Å; R346-D414 IonicContact NH2-OD2 3.56Å; R346-D414 PolarHBondContact NH2-OD2 3.49Å
347	A	93.3	Very high	84.4	Confident	6 Å²	6	80.5 Å²	80.5	5%	0.05	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-59.1	-32	179.7	0	0	0	0	0	112	D349 Y350 S351 I411 R412 Y413	A347-D349 VanDerWaalsContact C-N 3.27Å; A347-D349 PolarHBondContact O-N 3.41Å; A347-Y350 CarbonylContact O-C 3.14Å; A347-Y350 PolarHBondContact O-N 3.17Å; A347-S351 WeakPolarHBondContact O-CA 3.33Å; A347-S351 WeakPolarHBondContact O-CB 3.39Å; A347-S351 PolarHBondContact O-N 3.42Å; A347-I411 HydrophobicContact CB-CG2 4.18Å; A347-R412 WeakPolarHBondContact CB-O 3.5Å; A347-R412 PolarHBondContact N-O 2.93Å; A347-Y413 HydrophobicContact CB-CD1 3.54Å; A347-Y413 HydrophobicContact CB-CE1 3.55Å; A347-Y413 HydrophobicContact CB-CG 4.16Å
348	Q	91.1	Very high	86.1	Confident	79 Å²	79	76 Å²	76	37%	0.369	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-65.7	-26.6	176.6	-66.8	73.2	16.8	0	0	113.1	R346 Y350 D414	R346-Q348 PolarHBondContact O-N 3.33Å; Q348-Y350 VanDerWaalsContact C-N 3.33Å; Q348-D414 PolarHBondContact OE1-OD2 3.03Å
349	D	94.4	Very high	88.3	Confident	96 Å²	96	64 Å²	64	51%	0.513	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-75.1	-26.5	178.6	-63.7	-17.5	0	0	0	111.5	R346 A347	R346-D349 HydrophobicContact CB-CB 4.5Å; R346-D349 IonicContact NH1-OD1 3.13Å; R346-D349 WeakPolarHBondContact O-CB 3.47Å; R346-D349 PolarHBondContact O-N 2.98Å; A347-D349 VanDerWaalsContact C-N 3.27Å; A347-D349 PolarHBondContact O-N 3.41Å
350	Y	97.1	Very high	90.5	Very high	11 Å²	11	60 Å²	60	4%	0.043	31%	0.305	C	S	.	.	S	Bend	trans	-161.7	88.3	177.7	-164.2	-83.6	0	0	0	110.9	F345 A347 Q348 H355 L477 L480 R481 T484	F345-Y350 HydrophobicContact CZ-CD1 4.45Å; F345-Y350 VanDerWaalsContact CZ-O 3.23Å; F345-Y350 WeakPolarHBondContact CZ-O 3.49Å; A347-Y350 CarbonylContact O-C 3.14Å; A347-Y350 PolarHBondContact O-N 3.17Å; Q348-Y350 VanDerWaalsContact C-N 3.33Å; Y350-H355 HydrophobicContact CD1-CB 4.22Å; Y350-H355 HydrophobicContact CD2-CB 3.79Å; Y350-H355 AromaticContact CD2-CG 3.89Å; Y350-H355 HydrophobicContact CE1-CB 3.97Å; Y350-H355 HydrophobicContact CE2-CB 3.55Å; Y350-H355 HydrophobicContact CG-CB 4.12Å; Y350-L477 HydrophobicContact CD1-CD2 4.21Å; Y350-L477 HydrophobicContact CE1-CD2 4.4Å; Y350-L480 HydrophobicContact CE1-CB 3.86Å; Y350-L480 VanDerWaalsContact OH-C 3.28Å; Y350-L480 WeakPolarHBondContact OH-CB 3.32Å; Y350-L480 PolarHBondContact OH-O 3.3Å; Y350-R481 HydrophobicContact CD1-CB 3.9Å; Y350-R481 HydrophobicContact CD1-CG 4.41Å; Y350-R481 HydrophobicContact CD2-CB 4.18Å; Y350-R481 HydrophobicContact CD2-CG 4.03Å; Y350-R481 HydrophobicContact CE1-CB 4.11Å; Y350-R481 HydrophobicContact CE2-CB 4.34Å; Y350-R481 HydrophobicContact CG-CB 3.96Å; Y350-R481 HydrophobicContact CG-CG 3.96Å; Y350-T484 HydrophobicContact CE2-CG2 4.22Å; Y350-T484 PolarHBondContact OH-OG1 3.15Å; Y350-T484 VanDerWaalsContact OH-OG1 3.07Å
351	S	97	Very high	92.3	Very high	19 Å²	19	57 Å²	57	13%	0.133	29%	0.293	C	S	.	.			trans	-91.3	163.7	179	68.2	0	0	0	0	112.7	A347 D354 H355 G356	A347-S351 WeakPolarHBondContact O-CA 3.33Å; A347-S351 WeakPolarHBondContact O-CB 3.39Å; A347-S351 PolarHBondContact O-N 3.42Å; S351-D354 VanDerWaalsContact OG-CB 3.22Å; S351-D354 WeakPolarHBondContact OG-CB 3.35Å; S351-D354 VanDerWaalsContact OG-CG 3.24Å; S351-D354 PolarHBondContact OG-N 3.24Å; S351-D354 PolarHBondContact OG-OD2 2.96Å; S351-H355 PolarHBondContact N-ND1 3.03Å; S351-H355 WeakPolarHBondContact O-CB 3.27Å; S351-H355 PolarHBondContact O-N 2.93Å; S351-G356 PolarHBondContact O-N 3.37Å
352	W	97.4	Very high	93.9	Very high	9 Å²	9	55 Å²	55	3%	0.034	28%	0.278	C	S	.	.	I	π-helix	trans	-64	-48.1	170.9	172.4	-103.4	0	0	0	110.8	G356 F357 V360 L371 D372 F375 L477 L480	W352-G356 PolarHBondContact O-N 3.31Å; W352-G356 VanDerWaalsContact O-N 3.14Å; W352-F357 HydrophobicContact CD2-CB 4.42Å; W352-F357 HydrophobicContact CZ2-CB 4.14Å; W352-F357 HydrophobicContact CZ2-CD2 4.13Å; W352-F357 WeakPolarHBondContact O-CB 3.46Å; W352-F357 PolarHBondContact O-N 3.43Å; W352-V360 HydrophobicContact CH2-CG2 4.25Å; W352-V360 HydrophobicContact CZ3-CG2 4.13Å; W352-L371 HydrophobicContact CH2-CB 3.82Å; W352-L371 HydrophobicContact CH2-CD1 4.07Å; W352-L371 HydrophobicContact CZ2-CB 3.9Å; W352-D372 HydrophobicContact CZ2-CB 4.18Å; W352-D372 PolarHBondContact NE1-OD1 2.88Å; W352-F375 HydrophobicContact CD2-CD2 4.16Å; W352-F375 HydrophobicContact CD2-CE2 4.12Å; W352-F375 AromaticContact CE2-CD2 3.85Å; W352-F375 HydrophobicContact CE3-CE2 4.2Å; W352-F375 HydrophobicContact CH2-CE2 4.13Å; W352-F375 HydrophobicContact CZ2-CD2 4.13Å; W352-F375 HydrophobicContact CZ2-CE2 4.04Å; W352-F375 HydrophobicContact CZ3-CE2 4.21Å; W352-L477 HydrophobicContact CB-CD2 4.13Å; W352-L480 HydrophobicContact CE3-CD1 4.37Å; W352-L480 HydrophobicContact CZ3-CD1 3.99Å
353	E	95.8	Very high	94.8	Very high	138 Å²	138	54.9 Å²	54.9	65%	0.645	28%	0.276	S	S	*	.	I	π-helix	trans	-62.6	-46.2	-174.7	-62	179.3	176.6	0	0	112.4
354	D	95.7	Very high	95.4	Very high	111 Å²	111	50.1 Å²	50.1	59%	0.594	24%	0.244	S	C	*	.	I	π-helix	trans	-85.5	-31.4	-174.7	-55.7	-55.2	0	0	0	112.7	S351	S351-D354 VanDerWaalsContact OG-CB 3.22Å; S351-D354 WeakPolarHBondContact OG-CB 3.35Å; S351-D354 VanDerWaalsContact OG-CG 3.24Å; S351-D354 PolarHBondContact OG-N 3.24Å; S351-D354 PolarHBondContact OG-OD2 2.96Å
355	H	97.6	Very high	95.3	Very high	71 Å²	71	51.8 Å²	51.8	33%	0.329	26%	0.255	S	S	.	.	I	π-helix	trans	-125	-55.9	-169	-51.7	85.9	0	0	0	113.2	Y350 S351 F357 S358 L359	Y350-H355 HydrophobicContact CD1-CB 4.22Å; Y350-H355 HydrophobicContact CD2-CB 3.79Å; Y350-H355 AromaticContact CD2-CG 3.89Å; Y350-H355 HydrophobicContact CE1-CB 3.97Å; Y350-H355 HydrophobicContact CE2-CB 3.55Å; Y350-H355 HydrophobicContact CG-CB 4.12Å; S351-H355 PolarHBondContact N-ND1 3.03Å; S351-H355 WeakPolarHBondContact O-CB 3.27Å; S351-H355 PolarHBondContact O-N 2.93Å; H355-F357 PolarHBondContact O-N 3.47Å; H355-S358 PolarHBondContact O-N 3.39Å; H355-L359 PolarHBondContact O-N 3.39Å
356	G	97.2	Very high	95.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-58.8	-51.9	-170.6	0	0	0	0	0	113.1	S351 W352 S358 L359 V360	S351-G356 PolarHBondContact O-N 3.37Å; W352-G356 PolarHBondContact O-N 3.31Å; W352-G356 VanDerWaalsContact O-N 3.14Å; G356-S358 PolarHBondContact O-N 2.85Å; G356-L359 PolarHBondContact O-N 2.85Å; G356-V360 WeakPolarHBondContact O-CG2 3.47Å; G356-V360 PolarHBondContact O-N 3.13Å
357	F	97.1	Very high	95.1	Very high	58 Å²	58	50.9 Å²	50.9	25%	0.254	26%	0.258	S	S	.	.	H	α-helix	trans	-54.8	-53.3	178.4	172.6	-97.3	0	0	0	111.7	W352 H355 L359 V360 N361 G368 D372	W352-F357 HydrophobicContact CD2-CB 4.42Å; W352-F357 HydrophobicContact CZ2-CB 4.14Å; W352-F357 HydrophobicContact CZ2-CD2 4.13Å; W352-F357 WeakPolarHBondContact O-CB 3.46Å; W352-F357 PolarHBondContact O-N 3.43Å; H355-F357 PolarHBondContact O-N 3.47Å; F357-L359 VanDerWaalsContact C-N 3.31Å; F357-L359 PolarHBondContact O-N 3.02Å; F357-V360 PolarHBondContact O-N 2.93Å; F357-N361 WeakPolarHBondContact O-CB 3.43Å; F357-N361 PolarHBondContact O-N 3.43Å; F357-G368 WeakPolarHBondContact CD2-O 3.31Å; F357-G368 WeakPolarHBondContact CE2-O 3.32Å; F357-D372 HydrophobicContact CD2-CB 3.86Å; F357-D372 HydrophobicContact CE2-CB 3.99Å
358	S	96.6	Very high	95.1	Very high	66 Å²	66	50.6 Å²	50.6	46%	0.462	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-39.2	-178.4	-67.5	0	0	0	0	112.3	H355 G356 R362	H355-S358 PolarHBondContact O-N 3.39Å; G356-S358 PolarHBondContact O-N 2.85Å; S358-R362 VanDerWaalsContact O-CB 3.25Å; S358-R362 WeakPolarHBondContact O-CB 3.28Å; S358-R362 PolarHBondContact O-N 3.33Å; S358-R362 VanDerWaalsContact O-N 3.12Å
359	L	97.4	Very high	95.3	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-48.8	176.8	-179.5	63.4	0	0	0	111.8	H355 G356 F357 R362 L363 L480 I483 T484 M487	H355-L359 PolarHBondContact O-N 3.39Å; G356-L359 PolarHBondContact O-N 2.85Å; F357-L359 VanDerWaalsContact C-N 3.31Å; F357-L359 PolarHBondContact O-N 3.02Å; L359-R362 PolarHBondContact O-N 3.48Å; L359-L363 HydrophobicContact CD1-CD1 3.6Å; L359-L363 HydrophobicContact CD1-CG 4.16Å; L359-L363 HydrophobicContact CG-CD1 4.05Å; L359-L363 WeakPolarHBondContact O-CG 3.41Å; L359-L363 PolarHBondContact O-N 3.47Å; L359-L363 VanDerWaalsContact O-N 3.15Å; L359-L480 HydrophobicContact CD2-CB 3.98Å; L359-L480 HydrophobicContact CD2-CD2 3.82Å; L359-L480 HydrophobicContact CD2-CG 4.49Å; L359-L480 WeakPolarHBondContact CD2-O 3.13Å; L359-L480 HydrophobicContact CG-CD2 4.34Å; L359-I483 HydrophobicContact CD2-CB 4.31Å; L359-I483 HydrophobicContact CD2-CG2 4.1Å; L359-T484 WeakPolarHBondContact CD2-OG1 3.49Å; L359-M487 HydrophobicContact CD1-SD 3.99Å
360	V	97.1	Very high	95.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-50.2	179.6	175.4	0	0	0	0	109.7	I200 W352 G356 F357 R362 L363 Y364 V367 L371 L480	I200-V360 HydrophobicContact CG2-CG1 4.26Å; W352-V360 HydrophobicContact CH2-CG2 4.25Å; W352-V360 HydrophobicContact CZ3-CG2 4.13Å; G356-V360 WeakPolarHBondContact O-CG2 3.47Å; G356-V360 PolarHBondContact O-N 3.13Å; F357-V360 PolarHBondContact O-N 2.93Å; V360-R362 PolarHBondContact O-N 3.43Å; V360-L363 PolarHBondContact O-N 3.19Å; V360-Y364 CarbonylContact O-C 3.44Å; V360-Y364 PolarHBondContact O-N 2.96Å; V360-V367 HydrophobicContact CG1-CB 4.37Å; V360-V367 HydrophobicContact CG1-CG1 4.19Å; V360-L371 HydrophobicContact CG1-CD1 4.44Å; V360-L480 HydrophobicContact CG2-CD1 3.73Å; V360-L480 HydrophobicContact CG2-CD2 3.65Å; V360-L480 HydrophobicContact CG2-CG 4.36Å
361	N	94.6	Very high	95.3	Very high	62 Å²	62	48 Å²	48	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-28.9	-177.1	-162	42.4	0	0	0	112.9	F357 P365 D366	F357-N361 WeakPolarHBondContact O-CB 3.43Å; F357-N361 PolarHBondContact O-N 3.43Å; N361-P365 WeakPolarHBondContact O-CA 3.4Å; N361-D366 PolarHBondContact OD1-N 3.41Å
362	R	96	Very high	95.3	Very high	150 Å²	150	49.3 Å²	49.3	57%	0.566	25%	0.246	S	C	*	.	H	α-helix	trans	-73.5	-35.1	174.6	-178.2	171.2	62.1	101.2	-0.8	113.3	S358 L359 V360 M487	S358-R362 VanDerWaalsContact O-CB 3.25Å; S358-R362 WeakPolarHBondContact O-CB 3.28Å; S358-R362 PolarHBondContact O-N 3.33Å; S358-R362 VanDerWaalsContact O-N 3.12Å; L359-R362 PolarHBondContact O-N 3.48Å; V360-R362 PolarHBondContact O-N 3.43Å; R362-M487 VanDerWaalsContact NH1-CE 3.3Å; R362-M487 VanDerWaalsContact NH2-CE 3.29Å
363	L	95.5	Very high	95.3	Very high	25 Å²	25	51.8 Å²	51.8	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-96.9	-27.8	-173.7	-66.4	179.6	0	0	0	113.4	L196 A197 I200 L359 V360 I483 M487	L196-L363 HydrophobicContact CB-CD1 4.22Å; L196-L363 HydrophobicContact CB-CD2 3.92Å; L196-L363 HydrophobicContact CD1-CD2 4.22Å; A197-L363 VanDerWaalsContact CB-O 3.32Å; A197-L363 WeakPolarHBondContact CB-O 3.01Å; I200-L363 HydrophobicContact CB-CB 4.41Å; I200-L363 HydrophobicContact CD1-CD1 3.99Å; I200-L363 HydrophobicContact CG1-CB 3.82Å; I200-L363 HydrophobicContact CG1-CD1 3.57Å; I200-L363 HydrophobicContact CG1-CG 4.35Å; L359-L363 HydrophobicContact CD1-CD1 3.6Å; L359-L363 HydrophobicContact CD1-CG 4.16Å; L359-L363 HydrophobicContact CG-CD1 4.05Å; L359-L363 WeakPolarHBondContact O-CG 3.41Å; L359-L363 PolarHBondContact O-N 3.47Å; L359-L363 VanDerWaalsContact O-N 3.15Å; V360-L363 PolarHBondContact O-N 3.19Å; L363-I483 HydrophobicContact CD1-CG2 4.43Å; L363-M487 HydrophobicContact CD1-SD 4.43Å
364	Y	93.7	Very high	95.3	Very high	9 Å²	9	45.2 Å²	45.2	4%	0.035	23%	0.228	C	C	.	.	S	Bend	trans	-145.8	89.5	173.9	-168.8	-169.1	0	0	0	108.9	Y104 P111 H201 V360 V367	Y104-Y364 AromaticContact CE1-CE2 3.91Å; Y104-Y364 HydrophobicContact CE1-CE2 3.91Å; Y104-Y364 AromaticContact CE1-CZ 3.8Å; P111-Y364 VanDerWaalsContact CD-CZ 3.47Å; P111-Y364 HydrophobicContact CG-CD2 4.1Å; P111-Y364 HydrophobicContact CG-CE2 4.14Å; P111-Y364 HydrophobicContact CG-CG 4.33Å; H201-Y364 HydrophobicContact CB-CD1 3.92Å; H201-Y364 HydrophobicContact CB-CE1 3.81Å; H201-Y364 AromaticContact CD2-CE1 3.54Å; H201-Y364 AromaticContact CE1-CE1 3.94Å; H201-Y364 PolarHBondContact CE1-OH 3.05Å; H201-Y364 AromaticContact CG-CE1 3.47Å; H201-Y364 VanDerWaalsContact CG-CE1 3.47Å; H201-Y364 AromaticContact ND1-CE1 3.77Å; H201-Y364 AromaticContact NE2-CE1 3.85Å; V360-Y364 CarbonylContact O-C 3.44Å; V360-Y364 PolarHBondContact O-N 2.96Å; Y364-V367 HydrophobicContact CD1-CB 3.97Å; Y364-V367 HydrophobicContact CD1-CG1 4.37Å; Y364-V367 HydrophobicContact CD1-CG2 3.43Å; Y364-V367 VanDerWaalsContact CD1-CG2 3.43Å; Y364-V367 HydrophobicContact CD2-CG2 4.11Å; Y364-V367 HydrophobicContact CE1-CB 4.33Å; Y364-V367 HydrophobicContact CE1-CG2 3.33Å; Y364-V367 HydrophobicContact CE2-CG2 4.03Å; Y364-V367 HydrophobicContact CG-CB 4.25Å; Y364-V367 HydrophobicContact CG-CG2 3.84Å
365	P	88.6	Confident	95.4	Very high	70 Å²	70	40 Å²	40	46%	0.455	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	156.1	-178.7	-26.3	35.3	0	0	0	112.9	Y104 N361 V367	Y104-P365 PolarHBondContact OH-O 2.89Å; N361-P365 WeakPolarHBondContact O-CA 3.4Å; P365-V367 PolarHBondContact O-N 3.23Å
366	D	89.4	Confident	95.4	Very high	81 Å²	81	39.9 Å²	39.9	43%	0.433	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-35.9	-176.9	-44.3	-42.5	0	0	0	115.4	Y104 N361 G368 Q369 M370	Y104-D366 HydrophobicContact CE2-CB 3.96Å; Y104-D366 WeakPolarHBondContact OH-CB 3.37Å; Y104-D366 PolarHBondContact OH-OD2 2.85Å; N361-D366 PolarHBondContact OD1-N 3.41Å; D366-G368 VanDerWaalsContact C-N 3.28Å; D366-G368 PolarHBondContact O-N 3.45Å; D366-Q369 PolarHBondContact O-N 3Å; D366-Q369 VanDerWaalsContact O-N 3.17Å; D366-M370 WeakPolarHBondContact O-CG 3.32Å; D366-M370 PolarHBondContact O-N 2.89Å
367	V	93.5	Very high	95.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-36.6	176.6	176.7	0	0	0	0	111.6	Y104 L105 V204 V360 Y364 P365 Q369 M370 L371	Y104-V367 HydrophobicContact CD1-CG2 3.68Å; Y104-V367 HydrophobicContact CE1-CG2 3.4Å; L105-V367 HydrophobicContact CD2-CG1 4.18Å; L105-V367 HydrophobicContact CD2-CG2 4.2Å; V204-V367 HydrophobicContact CG1-CG1 4.13Å; V204-V367 HydrophobicContact CG2-CG1 4.24Å; V360-V367 HydrophobicContact CG1-CB 4.37Å; V360-V367 HydrophobicContact CG1-CG1 4.19Å; Y364-V367 HydrophobicContact CD1-CB 3.97Å; Y364-V367 HydrophobicContact CD1-CG1 4.37Å; Y364-V367 HydrophobicContact CD1-CG2 3.43Å; Y364-V367 VanDerWaalsContact CD1-CG2 3.43Å; Y364-V367 HydrophobicContact CD2-CG2 4.11Å; Y364-V367 HydrophobicContact CE1-CB 4.33Å; Y364-V367 HydrophobicContact CE1-CG2 3.33Å; Y364-V367 HydrophobicContact CE2-CG2 4.03Å; Y364-V367 HydrophobicContact CG-CB 4.25Å; Y364-V367 HydrophobicContact CG-CG2 3.84Å; P365-V367 PolarHBondContact O-N 3.23Å; V367-Q369 VanDerWaalsContact C-N 3.3Å; V367-Q369 PolarHBondContact O-N 3.38Å; V367-M370 PolarHBondContact O-N 3.32Å; V367-L371 HydrophobicContact CG1-CD1 3.83Å; V367-L371 HydrophobicContact CG1-CG 4.04Å; V367-L371 WeakPolarHBondContact O-CB 3.29Å; V367-L371 VanDerWaalsContact O-CG 3.28Å; V367-L371 WeakPolarHBondContact O-CG 3.38Å; V367-L371 PolarHBondContact O-N 2.88Å
368	G	93.9	Very high	95.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-45.8	174.5	0	0	0	0	0	111.8	F357 D366 D372	F357-G368 WeakPolarHBondContact CD2-O 3.31Å; F357-G368 WeakPolarHBondContact CE2-O 3.32Å; D366-G368 VanDerWaalsContact C-N 3.28Å; D366-G368 PolarHBondContact O-N 3.45Å; G368-D372 WeakPolarHBondContact O-CB 3.46Å; G368-D372 PolarHBondContact O-N 2.97Å
369	Q	95	Very high	95.5	Very high	103 Å²	103	40 Å²	40	48%	0.481	19%	0.192	S	C	.	.	H	α-helix	trans	-66.3	-45.6	177.5	-176.9	177.3	-10.5	0	0	112.2	D366 V367 L371 D372 E373	D366-Q369 PolarHBondContact O-N 3Å; D366-Q369 VanDerWaalsContact O-N 3.17Å; V367-Q369 VanDerWaalsContact C-N 3.3Å; V367-Q369 PolarHBondContact O-N 3.38Å; Q369-L371 VanDerWaalsContact C-N 3.33Å; Q369-L371 PolarHBondContact O-N 3.3Å; Q369-D372 PolarHBondContact O-N 2.9Å; Q369-E373 HydrophobicContact CG-CG 4.41Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.47Å; Q369-E373 PolarHBondContact NE2-OE1 3.13Å; Q369-E373 WeakPolarHBondContact O-CB 3.49Å; Q369-E373 WeakPolarHBondContact O-CG 3.1Å; Q369-E373 PolarHBondContact O-N 3.03Å
370	M	95.4	Very high	95.5	Very high	29 Å²	29	43.8 Å²	43.8	14%	0.143	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-40.6	179.3	-68.6	-170.5	174.4	0	0	112.5	R100 T101 Y104 D366 V367 K374	R100-M370 HydrophobicContact CG-CE 4.07Å; T101-M370 HydrophobicContact CG2-CB 4.35Å; Y104-M370 WeakPolarHBondContact CB-SD 3.26Å; Y104-M370 HydrophobicContact CD1-SD 4.28Å; Y104-M370 HydrophobicContact CD2-CE 3.5Å; Y104-M370 VanDerWaalsContact CD2-CE 3.5Å; Y104-M370 HydrophobicContact CD2-SD 4.04Å; Y104-M370 HydrophobicContact CE2-CE 4.26Å; Y104-M370 HydrophobicContact CG-CE 3.77Å; Y104-M370 HydrophobicContact CG-SD 3.67Å; D366-M370 WeakPolarHBondContact O-CG 3.32Å; D366-M370 PolarHBondContact O-N 2.89Å; V367-M370 PolarHBondContact O-N 3.32Å; M370-K374 WeakPolarHBondContact O-CB 3.45Å; M370-K374 PolarHBondContact O-N 3.34Å
371	L	97.4	Very high	95.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-42.3	175.7	-70.1	177.8	0	0	0	111.7	V204 W352 V360 V367 Q369 K374 F375 M472 L476	V204-L371 HydrophobicContact CG1-CD1 4.12Å; V204-L371 HydrophobicContact CG1-CD2 4.3Å; V204-L371 HydrophobicContact CG2-CD1 3.91Å; W352-L371 HydrophobicContact CH2-CB 3.82Å; W352-L371 HydrophobicContact CH2-CD1 4.07Å; W352-L371 HydrophobicContact CZ2-CB 3.9Å; V360-L371 HydrophobicContact CG1-CD1 4.44Å; V367-L371 HydrophobicContact CG1-CD1 3.83Å; V367-L371 HydrophobicContact CG1-CG 4.04Å; V367-L371 WeakPolarHBondContact O-CB 3.29Å; V367-L371 VanDerWaalsContact O-CG 3.28Å; V367-L371 WeakPolarHBondContact O-CG 3.38Å; V367-L371 PolarHBondContact O-N 2.88Å; Q369-L371 VanDerWaalsContact C-N 3.33Å; Q369-L371 PolarHBondContact O-N 3.3Å; L371-K374 PolarHBondContact O-N 3.03Å; L371-F375 HydrophobicContact CB-CE2 4.07Å; L371-F375 WeakPolarHBondContact O-CD2 3.41Å; L371-F375 VanDerWaalsContact O-CG 3.3Å; L371-F375 WeakPolarHBondContact O-CG 3.31Å; L371-F375 PolarHBondContact O-N 3.38Å; L371-M472 HydrophobicContact CD2-CE 3.52Å; L371-L476 HydrophobicContact CD1-CD1 4.16Å
372	D	97.4	Very high	95.6	Very high	45 Å²	45	43.2 Å²	43.2	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-49.1	177.1	-169.6	63.5	0	0	0	111.9	W352 F357 G368 Q369 K374 F375 Q376	W352-D372 HydrophobicContact CZ2-CB 4.18Å; W352-D372 PolarHBondContact NE1-OD1 2.88Å; F357-D372 HydrophobicContact CD2-CB 3.86Å; F357-D372 HydrophobicContact CE2-CB 3.99Å; G368-D372 WeakPolarHBondContact O-CB 3.46Å; G368-D372 PolarHBondContact O-N 2.97Å; Q369-D372 PolarHBondContact O-N 2.9Å; D372-K374 VanDerWaalsContact C-N 3.25Å; D372-K374 PolarHBondContact O-N 3.31Å; D372-F375 PolarHBondContact O-N 2.98Å; D372-Q376 WeakPolarHBondContact O-CB 3.19Å; D372-Q376 WeakPolarHBondContact O-CG 3.43Å; D372-Q376 PolarHBondContact O-N 3.48Å
373	E	96.2	Very high	95.6	Very high	61 Å²	61	40.8 Å²	40.8	29%	0.285	20%	0.202	S	C	.	.	H	α-helix	trans	-55.9	-41.4	174.8	-74.6	177	-166	0	0	111.3	R100 Q369 M377	R100-E373 IonicContact NH1-OE2 3.98Å; Q369-E373 HydrophobicContact CG-CG 4.41Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.47Å; Q369-E373 PolarHBondContact NE2-OE1 3.13Å; Q369-E373 WeakPolarHBondContact O-CB 3.49Å; Q369-E373 WeakPolarHBondContact O-CG 3.1Å; Q369-E373 PolarHBondContact O-N 3.03Å; E373-M377 WeakPolarHBondContact O-CB 3.39Å; E373-M377 PolarHBondContact O-N 3.26Å
374	K	96.1	Very high	95.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.8	-46	178.8	-170.4	171.6	60.7	73.9	0	112.5	Y94 M370 L371 D372 M377 A378 E469 M472	Y94-K374 HydrophobicContact CE2-CG 3.9Å; M370-K374 WeakPolarHBondContact O-CB 3.45Å; M370-K374 PolarHBondContact O-N 3.34Å; L371-K374 PolarHBondContact O-N 3.03Å; D372-K374 VanDerWaalsContact C-N 3.25Å; D372-K374 PolarHBondContact O-N 3.31Å; K374-M377 PolarHBondContact O-N 3.13Å; K374-A378 PolarHBondContact O-N 3.05Å; K374-E469 IonicContact NZ-OE1 3.72Å; K374-E469 PolarHBondContact NZ-OE1 3.3Å; K374-E469 IonicContact NZ-OE2 2.77Å; K374-E469 PolarHBondContact NZ-OE2 3.27Å; K374-M472 PolarHBondContact NZ-SD 3.23Å
375	F	97.9	Very high	95.7	Very high	3 Å²	3	45 Å²	45	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-48.2	177.2	-66.5	-40	0	0	0	111.4	W352 L371 D372 M377 A378 Y379 W402 E469 M472 Q473 L476	W352-F375 HydrophobicContact CD2-CD2 4.16Å; W352-F375 HydrophobicContact CD2-CE2 4.12Å; W352-F375 AromaticContact CE2-CD2 3.85Å; W352-F375 HydrophobicContact CE3-CE2 4.2Å; W352-F375 HydrophobicContact CH2-CE2 4.13Å; W352-F375 HydrophobicContact CZ2-CD2 4.13Å; W352-F375 HydrophobicContact CZ2-CE2 4.04Å; W352-F375 HydrophobicContact CZ3-CE2 4.21Å; L371-F375 HydrophobicContact CB-CE2 4.07Å; L371-F375 WeakPolarHBondContact O-CD2 3.41Å; L371-F375 VanDerWaalsContact O-CG 3.3Å; L371-F375 WeakPolarHBondContact O-CG 3.31Å; L371-F375 PolarHBondContact O-N 3.38Å; D372-F375 PolarHBondContact O-N 2.98Å; F375-M377 VanDerWaalsContact C-N 3.33Å; F375-M377 PolarHBondContact O-N 3.04Å; F375-A378 PolarHBondContact O-N 2.93Å; F375-Y379 VanDerWaalsContact O-CB 3.22Å; F375-Y379 WeakPolarHBondContact O-CB 3.33Å; F375-Y379 PolarHBondContact O-N 3.24Å; F375-W402 HydrophobicContact CD1-CH2 4.36Å; F375-E469 HydrophobicContact CD1-CB 4.34Å; F375-E469 WeakPolarHBondContact CD1-OE2 3.45Å; F375-E469 VanDerWaalsContact CE1-OE2 3.26Å; F375-E469 WeakPolarHBondContact CE1-OE2 3.3Å; F375-M472 HydrophobicContact CE1-CB 4.32Å; F375-M472 HydrophobicContact CE1-CG 4.36Å; F375-M472 HydrophobicContact CE1-SD 4.43Å; F375-M472 HydrophobicContact CZ-CG 4.37Å; F375-Q473 HydrophobicContact CD1-CB 4.28Å; F375-Q473 HydrophobicContact CE1-CB 3.89Å; F375-Q473 HydrophobicContact CE2-CB 4.44Å; F375-Q473 HydrophobicContact CE2-CG 4.36Å; F375-Q473 HydrophobicContact CZ-CB 3.99Å; F375-Q473 HydrophobicContact CZ-CG 4.39Å; F375-L476 HydrophobicContact CE2-CD1 4.37Å; F375-L476 HydrophobicContact CZ-CD1 3.91Å
376	Q	97.4	Very high	96.1	Very high	68 Å²	68	41.7 Å²	41.7	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-41	178.4	-69.9	-62.4	-23.5	0	0	111.6	D372 N380	D372-Q376 WeakPolarHBondContact O-CB 3.19Å; D372-Q376 WeakPolarHBondContact O-CG 3.43Å; D372-Q376 PolarHBondContact O-N 3.48Å; Q376-N380 VanDerWaalsContact O-CB 3.22Å; Q376-N380 WeakPolarHBondContact O-CB 3.46Å; Q376-N380 PolarHBondContact O-N 3.05Å; Q376-N380 PolarHBondContact O-ND2 2.83Å; Q376-N380 PolarHBondContact OE1-ND2 3.14Å
377	M	96.9	Very high	96.3	Very high	61 Å²	61	38 Å²	38	30%	0.3	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-47.8	178.7	-173.8	170.8	-67.8	0	0	111.8	Q93 Y94 S97 E373 K374 F375 L381	Q93-M377 HydrophobicContact CB-SD 4.35Å; Y94-M377 VanDerWaalsContact CA-SD 3.52Å; S97-M377 VanDerWaalsContact CB-SD 3.54Å; E373-M377 WeakPolarHBondContact O-CB 3.39Å; E373-M377 PolarHBondContact O-N 3.26Å; K374-M377 PolarHBondContact O-N 3.13Å; F375-M377 VanDerWaalsContact C-N 3.33Å; F375-M377 PolarHBondContact O-N 3.04Å; M377-L381 WeakPolarHBondContact O-CB 3.4Å; M377-L381 PolarHBondContact O-N 2.6Å
378	A	97.5	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-44.6	177.3	0	0	0	0	0	112.3	Y94 K374 F375 N380 L466 E469	Y94-A378 HydrophobicContact CD2-CB 4.07Å; Y94-A378 HydrophobicContact CE2-CB 3.85Å; K374-A378 PolarHBondContact O-N 3.05Å; F375-A378 PolarHBondContact O-N 2.93Å; A378-N380 PolarHBondContact O-N 3.43Å; A378-L466 WeakPolarHBondContact O-CD2 3.32Å; A378-E469 HydrophobicContact CB-CB 3.91Å; A378-E469 HydrophobicContact CB-CG 3.56Å
379	Y	97.5	Very high	96.2	Very high	66 Å²	66	46.6 Å²	46.6	26%	0.259	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-42.3	-178.8	-173.5	-98.5	0	0	0	111.8	F375 R398 R399 W402	F375-Y379 VanDerWaalsContact O-CB 3.22Å; F375-Y379 WeakPolarHBondContact O-CB 3.33Å; F375-Y379 PolarHBondContact O-N 3.24Å; Y379-R398 PolarHBondContact O-NH1 3.46Å; Y379-R399 WeakPolarHBondContact OH-CG 3.19Å; Y379-W402 HydrophobicContact CD2-CB 4.31Å; Y379-W402 AromaticContact CD2-CD2 3.68Å; Y379-W402 HydrophobicContact CD2-CD2 3.68Å; Y379-W402 AromaticContact CD2-CE3 3.68Å; Y379-W402 HydrophobicContact CD2-CE3 3.68Å; Y379-W402 AromaticContact CD2-CG 3.97Å; Y379-W402 HydrophobicContact CD2-CG 3.97Å; Y379-W402 HydrophobicContact CD2-CZ3 4.25Å; Y379-W402 HydrophobicContact CE2-CB 4.01Å; Y379-W402 HydrophobicContact CE2-CD2 4.11Å; Y379-W402 HydrophobicContact CE2-CE3 4.48Å; Y379-W402 AromaticContact CE2-CG 3.89Å; Y379-W402 HydrophobicContact CE2-CG 3.89Å
380	N	97.7	Very high	96.2	Very high	85 Å²	85	49.5 Å²	49.5	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-91.9	-9.3	-175.5	-63.5	-50.1	0	0	0	114.6	Q376 A378 T382	Q376-N380 VanDerWaalsContact O-CB 3.22Å; Q376-N380 WeakPolarHBondContact O-CB 3.46Å; Q376-N380 PolarHBondContact O-N 3.05Å; Q376-N380 PolarHBondContact O-ND2 2.83Å; Q376-N380 PolarHBondContact OE1-ND2 3.14Å; A378-N380 PolarHBondContact O-N 3.43Å; N380-T382 PolarHBondContact O-N 3.35Å
381	L	97.4	Very high	96.2	Very high	8 Å²	8	55.4 Å²	55.4	4%	0.042	28%	0.278	C	S	.	.			trans	-55.6	124.7	-179.8	-176.6	64.1	0	0	0	109.8	H91 M377 Y383 R398 H462 L465	H91-L381 HydrophobicContact CB-CD2 3.9Å; M377-L381 WeakPolarHBondContact O-CB 3.4Å; M377-L381 PolarHBondContact O-N 2.6Å; L381-Y383 HydrophobicContact CD1-CE2 4.29Å; L381-Y383 HydrophobicContact CD2-CE2 4.46Å; L381-Y383 HydrophobicContact CG-CE2 4.26Å; L381-R398 VanDerWaalsContact O-CD 3.28Å; L381-R398 WeakPolarHBondContact O-CD 3.47Å; L381-R398 PolarHBondContact O-NE 3.28Å; L381-H462 PolarHBondContact O-CE1 3.15Å; L381-H462 PolarHBondContact O-NE2 3.38Å; L381-L465 HydrophobicContact CD2-CD1 4.47Å
382	T	97.1	Very high	96.2	Very high	43 Å²	43	56.7 Å²	56.7	26%	0.264	29%	0.286	S	S	.	.			trans	-153.9	142.9	175.8	-178.3	0	0	0	0	109.2	N380 N384 T394	N380-T382 PolarHBondContact O-N 3.35Å; T382-N384 WeakPolarHBondContact CG2-OD1 3.37Å; T382-N384 PolarHBondContact OG1-N 2.96Å; T382-N384 PolarHBondContact OG1-OD1 2.97Å; T382-T394 PolarHBondContact OG1-OG1 2.95Å
383	Y	96.1	Very high	96.1	Very high	99 Å²	99	59.1 Å²	59.1	39%	0.388	30%	0.299	S	S	.	.			trans	-104.3	4.9	168.4	-58.5	-79	0	0	0	111.3	H91 L381 T385	H91-Y383 AromaticContact CE1-CE2 3.67Å; H91-Y383 AromaticContact ND1-CE2 3.27Å; H91-Y383 VanDerWaalsContact ND1-CE2 3.27Å; H91-Y383 WeakPolarHBondContact ND1-CE2 3.34Å; H91-Y383 AromaticContact ND1-CZ 3.47Å; H91-Y383 PolarHBondContact ND1-OH 2.87Å; L381-Y383 HydrophobicContact CD1-CE2 4.29Å; L381-Y383 HydrophobicContact CD2-CE2 4.46Å; L381-Y383 HydrophobicContact CG-CE2 4.26Å; Y383-T385 PolarHBondContact O-N 3.45Å
384	N	96.6	Very high	96.1	Very high	73 Å²	73	56.8 Å²	56.8	39%	0.39	29%	0.289	S	S	.	.	S	Bend	trans	51.3	41.4	-171.4	-57	-32	0	0	0	111.8	T382 K390 D391 V392	T382-N384 WeakPolarHBondContact CG2-OD1 3.37Å; T382-N384 PolarHBondContact OG1-N 2.96Å; T382-N384 PolarHBondContact OG1-OD1 2.97Å; N384-K390 CarbonylContact O-C 2.89Å; N384-D391 WeakPolarHBondContact O-CA 3.42Å; N384-D391 PolarHBondContact O-N 3.06Å; N384-V392 CarbonylContact C-O 3.51Å; N384-V392 VanDerWaalsContact CA-O 3.23Å; N384-V392 WeakPolarHBondContact CA-O 3.36Å; N384-V392 PolarHBondContact O-N 3.48Å
385	T	95.8	Very high	96.1	Very high	48 Å²	48	58.9 Å²	58.9	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151	179.5	55.5	0	0	0	0	110.2	Y383 H389 K390	Y383-T385 PolarHBondContact O-N 3.45Å; T385-H389 CarbonylContact C-O 3.57Å; T385-H389 WeakPolarHBondContact CA-O 3.42Å; T385-H389 WeakPolarHBondContact CB-O 3.44Å; T385-K390 HydrophobicContact CG2-CG 4.35Å
386	M	95.6	Very high	96	Very high	1 Å²	1	59 Å²	59	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	109.9	170.3	-176.6	173.5	-69.2	0	0	108.7	V269 L272 M273 M276 T388 H389 V392 T394 L397 F455 E459	V269-M386 HydrophobicContact CG1-CG 3.99Å; V269-M386 HydrophobicContact CG1-SD 4.21Å; L272-M386 HydrophobicContact CD2-CE 4.33Å; L272-M386 HydrophobicContact CD2-SD 4.07Å; L272-M386 HydrophobicContact CG-SD 4.41Å; M273-M386 HydrophobicContact CG-SD 3.6Å; M273-M386 HydrophobicContact SD-SD 4.47Å; M276-M386 HydrophobicContact CE-CE 4.23Å; M276-M386 HydrophobicContact SD-CE 3.6Å; M276-M386 VanDerWaalsContact SD-CE 3.6Å; M386-T388 PolarHBondContact O-N 3.39Å; M386-H389 PolarHBondContact N-O 3.47Å; M386-H389 WeakPolarHBondContact O-CB 2.88Å; M386-H389 PolarHBondContact O-N 3.26Å; M386-V392 HydrophobicContact CB-CB 4.37Å; M386-V392 HydrophobicContact CB-CG1 4.24Å; M386-V392 HydrophobicContact CB-CG2 4.43Å; M386-V392 HydrophobicContact CE-CG1 4.36Å; M386-T394 HydrophobicContact CE-CG2 4.1Å; M386-L397 HydrophobicContact CE-CD2 3.72Å; M386-F455 HydrophobicContact CG-CE1 3.63Å; M386-F455 HydrophobicContact CG-CZ 3.77Å; M386-F455 HydrophobicContact SD-CZ 4.22Å; M386-E459 WeakPolarHBondContact CA-OE1 3.2Å
387	A	93.4	Very high	96	Very high	5 Å²	5	56.1 Å²	56.1	4%	0.041	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	-104.3	-170.9	0	0	0	0	0	112.5	V269 F455 Q456 E459	V269-A387 HydrophobicContact CG1-CB 4.29Å; V269-A387 HydrophobicContact CG2-CB 3.82Å; A387-F455 HydrophobicContact CB-CG 4.37Å; A387-Q456 PolarHBondContact O-NE2 3.18Å; A387-E459 WeakPolarHBondContact CA-OE2 3.05Å; A387-E459 PolarHBondContact N-OE1 2.86Å; A387-E459 PolarHBondContact N-OE2 2.91Å
388	T	92.6	Very high	96	Very high	121 Å²	121	54.2 Å²	54.2	74%	0.742	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-10.8	178.2	54.3	0	0	0	0	113.1	M386	M386-T388 PolarHBondContact O-N 3.39Å
389	H	94.4	Very high	96	Very high	60 Å²	60	57 Å²	57	28%	0.278	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	144.6	-178.4	-61.6	-92.3	0	0	0	111.5	E270 M273 T385 M386 V392	E270-H389 IonicContact OE1-NE2 3.29Å; M273-H389 HydrophobicContact SD-CB 4.09Å; T385-H389 CarbonylContact C-O 3.57Å; T385-H389 WeakPolarHBondContact CA-O 3.42Å; T385-H389 WeakPolarHBondContact CB-O 3.44Å; M386-H389 PolarHBondContact N-O 3.47Å; M386-H389 WeakPolarHBondContact O-CB 2.88Å; M386-H389 PolarHBondContact O-N 3.26Å; H389-V392 HydrophobicContact CB-CG2 3.87Å
390	K	94.9	Very high	96	Very high	163 Å²	163	53.9 Å²	53.9	71%	0.709	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	162.9	177.4	-61.6	-177.4	179.4	-178.5	0	109.8	N384 T385 V392	N384-K390 CarbonylContact O-C 2.89Å; T385-K390 HydrophobicContact CG2-CG 4.35Å; K390-V392 VanDerWaalsContact C-N 3.27Å; K390-V392 PolarHBondContact O-N 2.86Å
391	D	95.4	Very high	96.1	Very high	154 Å²	154	50 Å²	50	82%	0.824	26%	0.258	S	S	*	.	S	Bend	trans	59.4	36.2	179.4	-51.8	-52.7	0	0	0	113.1	N384	N384-D391 WeakPolarHBondContact O-CA 3.42Å; N384-D391 PolarHBondContact O-N 3.06Å
392	V	95.8	Very high	96.1	Very high	26 Å²	26	50 Å²	50	16%	0.158	26%	0.257	C	S	.	.			trans	-102.2	123.4	178.4	-177.4	0	0	0	0	109.7	M273 N384 M386 H389 K390 T394	M273-V392 HydrophobicContact SD-CG2 4.16Å; N384-V392 CarbonylContact C-O 3.51Å; N384-V392 VanDerWaalsContact CA-O 3.23Å; N384-V392 WeakPolarHBondContact CA-O 3.36Å; N384-V392 PolarHBondContact O-N 3.48Å; M386-V392 HydrophobicContact CB-CB 4.37Å; M386-V392 HydrophobicContact CB-CG1 4.24Å; M386-V392 HydrophobicContact CB-CG2 4.43Å; M386-V392 HydrophobicContact CE-CG1 4.36Å; H389-V392 HydrophobicContact CB-CG2 3.87Å; K390-V392 VanDerWaalsContact C-N 3.27Å; K390-V392 PolarHBondContact O-N 2.86Å; V392-T394 HydrophobicContact CG1-CG2 4.41Å; V392-T394 PolarHBondContact O-N 3.2Å
393	D	95.5	Very high	96.1	Very high	97 Å²	97	48.2 Å²	48.2	52%	0.519	25%	0.246	S	C	.	.			trans	-74.2	114.8	168.9	-177	12.9	0	0	0	110.3	M276 S395	M276-D393 WeakPolarHBondContact CE-O 3.16Å; D393-S395 VanDerWaalsContact CG-OG 3.24Å; D393-S395 WeakPolarHBondContact OD1-CB 3.34Å; D393-S395 PolarHBondContact OD1-N 3.41Å; D393-S395 PolarHBondContact OD1-OG 3.46Å; D393-S395 VanDerWaalsContact OD1-OG 3.05Å; D393-S395 PolarHBondContact OD2-OG 3.16Å
394	T	96.4	Very high	96.2	Very high	12 Å²	12	43.5 Å²	43.5	7%	0.074	23%	0.228	C	C	.	.			trans	-98.1	3.8	-179.5	59.6	0	0	0	0	113.4	T382 M386 V392 M396 L397 R398	T382-T394 PolarHBondContact OG1-OG1 2.95Å; M386-T394 HydrophobicContact CE-CG2 4.1Å; V392-T394 HydrophobicContact CG1-CG2 4.41Å; V392-T394 PolarHBondContact O-N 3.2Å; T394-M396 VanDerWaalsContact C-N 3.28Å; T394-M396 PolarHBondContact O-N 3.28Å; T394-L397 PolarHBondContact O-N 2.99Å; T394-L397 VanDerWaalsContact O-N 3.13Å; T394-R398 PolarHBondContact O-N 3.16Å; T394-R398 PolarHBondContact OG1-NE 2.95Å
395	S	96.3	Very high	96.3	Very high	44 Å²	44	40 Å²	40	31%	0.308	21%	0.209	S	C	.	.	H	α-helix	trans	-51.7	-45	-175.5	63.7	0	0	0	0	112.9	D393 R398 R399	D393-S395 VanDerWaalsContact CG-OG 3.24Å; D393-S395 WeakPolarHBondContact OD1-CB 3.34Å; D393-S395 PolarHBondContact OD1-N 3.41Å; D393-S395 PolarHBondContact OD1-OG 3.46Å; D393-S395 VanDerWaalsContact OD1-OG 3.05Å; D393-S395 PolarHBondContact OD2-OG 3.16Å; S395-R398 VanDerWaalsContact CA-NH2 3.33Å; S395-R398 PolarHBondContact O-N 3.24Å; S395-R399 VanDerWaalsContact O-CB 3.31Å; S395-R399 WeakPolarHBondContact O-CB 3.46Å; S395-R399 PolarHBondContact O-N 3.16Å
396	M	95.4	Very high	96.4	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-40.9	-178.8	-162	173.8	64.3	0	0	112.6	M276 L279 T394 A400 L424	M276-M396 HydrophobicContact CB-CE 3.72Å; M276-M396 HydrophobicContact CG-CE 3.72Å; M276-M396 VanDerWaalsContact O-CE 3.29Å; M276-M396 WeakPolarHBondContact O-CE 3.33Å; L279-M396 HydrophobicContact CB-CE 3.69Å; L279-M396 HydrophobicContact CB-SD 3.88Å; L279-M396 HydrophobicContact CD1-CE 3.84Å; L279-M396 HydrophobicContact CD1-SD 4.41Å; L279-M396 HydrophobicContact CG-CE 4.44Å; T394-M396 VanDerWaalsContact C-N 3.28Å; T394-M396 PolarHBondContact O-N 3.28Å; M396-A400 WeakPolarHBondContact O-CB 3.33Å; M396-A400 PolarHBondContact O-N 3.23Å; M396-L424 HydrophobicContact CE-CD1 4.11Å; M396-L424 HydrophobicContact CE-CD2 4.05Å; M396-L424 HydrophobicContact CG-CD1 4.08Å
397	L	97	Very high	96.4	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-45.6	176.2	-179.4	61.1	0	0	0	111.3	L272 M276 M386 T394 R399 A400 I401 L424 L425 W452	L272-L397 HydrophobicContact CD2-CD2 4.07Å; M276-L397 HydrophobicContact CE-CB 4.25Å; M276-L397 HydrophobicContact SD-CB 4.14Å; M386-L397 HydrophobicContact CE-CD2 3.72Å; T394-L397 PolarHBondContact O-N 2.99Å; T394-L397 VanDerWaalsContact O-N 3.13Å; L397-R399 PolarHBondContact O-N 3.2Å; L397-A400 PolarHBondContact O-N 2.97Å; L397-I401 HydrophobicContact CG-CD1 4.33Å; L397-I401 WeakPolarHBondContact O-CG1 3.38Å; L397-I401 PolarHBondContact O-N 2.94Å; L397-L424 HydrophobicContact CD1-CB 4.16Å; L397-L425 HydrophobicContact CD1-CD2 3.89Å; L397-W452 HydrophobicContact CD1-CZ2 4.24Å; L397-W452 HydrophobicContact CD2-CH2 3.92Å; L397-W452 HydrophobicContact CD2-CZ2 3.79Å; L397-W452 HydrophobicContact CG-CH2 4.48Å; L397-W452 HydrophobicContact CG-CZ2 4.31Å
398	R	98	Very high	96.3	Very high	21 Å²	21	37.7 Å²	37.7	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-43.5	177.1	-69.9	-175.7	-78.2	111	-4	111.7	Y379 L381 T394 S395 I401 W402 L466	Y379-R398 PolarHBondContact O-NH1 3.46Å; L381-R398 VanDerWaalsContact O-CD 3.28Å; L381-R398 WeakPolarHBondContact O-CD 3.47Å; L381-R398 PolarHBondContact O-NE 3.28Å; T394-R398 PolarHBondContact O-N 3.16Å; T394-R398 PolarHBondContact OG1-NE 2.95Å; S395-R398 VanDerWaalsContact CA-NH2 3.33Å; S395-R398 PolarHBondContact O-N 3.24Å; R398-I401 PolarHBondContact O-N 3.32Å; R398-W402 PolarHBondContact O-N 3.16Å; R398-L466 HydrophobicContact CB-CD1 4.15Å; R398-L466 HydrophobicContact CG-CD1 3.83Å
399	R	97.5	Very high	96.4	Very high	60 Å²	60	32 Å²	32	23%	0.226	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-40.9	175.3	-174.4	174.7	68	-163.2	-4.7	112.1	Y379 S395 L397 I401 W402 N403 Y416 E420	Y379-R399 WeakPolarHBondContact OH-CG 3.19Å; S395-R399 VanDerWaalsContact O-CB 3.31Å; S395-R399 WeakPolarHBondContact O-CB 3.46Å; S395-R399 PolarHBondContact O-N 3.16Å; L397-R399 PolarHBondContact O-N 3.2Å; R399-I401 PolarHBondContact O-N 2.92Å; R399-W402 PolarHBondContact O-N 3.19Å; R399-N403 VanDerWaalsContact O-CB 3.31Å; R399-N403 WeakPolarHBondContact O-CB 3.46Å; R399-N403 PolarHBondContact O-N 3.42Å; R399-Y416 HydrophobicContact CG-CD2 4.27Å; R399-Y416 HydrophobicContact CG-CE2 4.04Å; R399-E420 IonicContact NH2-OE2 2.66Å
400	A	98.1	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-41.4	176.3	0	0	0	0	0	112.3	M396 L397 Y404 Y416 I421 L424	M396-A400 WeakPolarHBondContact O-CB 3.33Å; M396-A400 PolarHBondContact O-N 3.23Å; L397-A400 PolarHBondContact O-N 2.97Å; A400-Y404 WeakPolarHBondContact O-CB 3.39Å; A400-Y404 PolarHBondContact O-N 3.08Å; A400-Y416 WeakPolarHBondContact CA-OH 3.2Å; A400-Y416 WeakPolarHBondContact CB-OH 3.39Å; A400-I421 HydrophobicContact CB-CG1 4.46Å; A400-L424 HydrophobicContact CB-CB 4.35Å; A400-L424 HydrophobicContact CB-CD1 3.71Å
401	I	98.3	Very high	96.5	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-50.5	174.6	-66.2	165.2	0	0	0	110.6	L397 R398 R399 N403 Y404 I405 L425 F429 W452 V463 L466 L467	L397-I401 HydrophobicContact CG-CD1 4.33Å; L397-I401 WeakPolarHBondContact O-CG1 3.38Å; L397-I401 PolarHBondContact O-N 2.94Å; R398-I401 PolarHBondContact O-N 3.32Å; R399-I401 PolarHBondContact O-N 2.92Å; I401-N403 PolarHBondContact O-N 2.6Å; I401-Y404 PolarHBondContact O-N 3.25Å; I401-I405 HydrophobicContact CG2-CD1 4.3Å; I401-I405 WeakPolarHBondContact O-CG1 3.26Å; I401-I405 PolarHBondContact O-N 3.26Å; I401-L425 HydrophobicContact CG1-CD1 4.48Å; I401-L425 HydrophobicContact CG1-CD2 3.79Å; I401-F429 HydrophobicContact CD1-CE1 3.83Å; I401-F429 HydrophobicContact CD1-CZ 3.81Å; I401-F429 HydrophobicContact CG1-CE1 3.88Å; I401-F429 HydrophobicContact CG1-CZ 4.06Å; I401-W452 HydrophobicContact CD1-CH2 4.11Å; I401-W452 HydrophobicContact CD1-CZ2 4.47Å; I401-V463 HydrophobicContact CD1-CG2 4.22Å; I401-L466 HydrophobicContact CG2-CB 4.48Å; I401-L467 HydrophobicContact CG2-CD1 3.31Å
402	W	98.5	Very high	96.5	Very high	8 Å²	8	16 Å²	16	3%	0.03	8%	0.08	C	C	.	.	H	α-helix	trans	-58.7	-49	179.6	-168.8	-80.7	0	0	0	111.9	F375 Y379 R398 R399 Y404 I405 H406 L466 E469 A470 Q473	F375-W402 HydrophobicContact CD1-CH2 4.36Å; Y379-W402 HydrophobicContact CD2-CB 4.31Å; Y379-W402 AromaticContact CD2-CD2 3.68Å; Y379-W402 HydrophobicContact CD2-CD2 3.68Å; Y379-W402 AromaticContact CD2-CE3 3.68Å; Y379-W402 HydrophobicContact CD2-CE3 3.68Å; Y379-W402 AromaticContact CD2-CG 3.97Å; Y379-W402 HydrophobicContact CD2-CG 3.97Å; Y379-W402 HydrophobicContact CD2-CZ3 4.25Å; Y379-W402 HydrophobicContact CE2-CB 4.01Å; Y379-W402 HydrophobicContact CE2-CD2 4.11Å; Y379-W402 HydrophobicContact CE2-CE3 4.48Å; Y379-W402 AromaticContact CE2-CG 3.89Å; Y379-W402 HydrophobicContact CE2-CG 3.89Å; R398-W402 PolarHBondContact O-N 3.16Å; R399-W402 PolarHBondContact O-N 3.19Å; W402-Y404 PolarHBondContact O-N 3.02Å; W402-I405 PolarHBondContact O-N 3.16Å; W402-H406 AromaticContact NE1-CD2 3.97Å; W402-H406 AromaticContact NE1-CE1 3.42Å; W402-H406 PolarHBondContact NE1-CE1 2.96Å; W402-H406 AromaticContact NE1-ND1 3.89Å; W402-H406 AromaticContact NE1-NE2 3.47Å; W402-H406 PolarHBondContact NE1-NE2 3.11Å; W402-H406 PolarHBondContact O-N 2.58Å; W402-L466 HydrophobicContact CE3-CD2 4.21Å; W402-E469 HydrophobicContact CH2-CB 3.97Å; W402-E469 HydrophobicContact CZ3-CB 3.85Å; W402-A470 HydrophobicContact CD2-CB 3.61Å; W402-A470 HydrophobicContact CE3-CB 3.67Å; W402-A470 HydrophobicContact CG-CB 4.11Å; W402-A470 HydrophobicContact CH2-CB 4.28Å; W402-A470 HydrophobicContact CZ2-CB 4.21Å; W402-A470 HydrophobicContact CZ3-CB 4.02Å; W402-Q473 HydrophobicContact CZ2-CB 4.13Å
403	N	97.8	Very high	96.5	Very high	7 Å²	7	16.8 Å²	16.8	4%	0.037	8%	0.081	C	C	.	.	H	α-helix	trans	-71.9	-29.4	-176.7	-71	-2.8	0	0	0	112.6	R399 I401 C407 Y413 Y416 Y418	R399-N403 VanDerWaalsContact O-CB 3.31Å; R399-N403 WeakPolarHBondContact O-CB 3.46Å; R399-N403 PolarHBondContact O-N 3.42Å; I401-N403 PolarHBondContact O-N 2.6Å; N403-C407 VanDerWaalsContact O-CB 3.23Å; N403-C407 WeakPolarHBondContact O-CB 3.43Å; N403-C407 PolarHBondContact O-N 3.29Å; N403-Y413 WeakPolarHBondContact OD1-CE2 3.27Å; N403-Y416 HydrophobicContact CB-CD1 3.84Å; N403-Y416 HydrophobicContact CB-CE1 3.7Å; N403-Y416 HydrophobicContact CB-CG 4.43Å; N403-Y416 VanDerWaalsContact ND2-CD1 3.29Å; N403-Y416 WeakPolarHBondContact ND2-CD1 3.13Å; N403-Y416 WeakPolarHBondContact ND2-CD2 3.21Å; N403-Y418 HydrophobicContact CB-CE1 4.47Å
404	Y	97.9	Very high	96.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.7	-41.1	171.2	179.6	-119.1	0	0	0	111.6	E300 S304 A400 I401 W402 C407 M408 I421 L425 K430 I433	E300-Y404 HydrophobicContact CG-CD2 4.42Å; E300-Y404 WeakPolarHBondContact OE1-CD2 3.34Å; E300-Y404 WeakPolarHBondContact OE1-CE2 3.5Å; S304-Y404 PolarHBondContact OG-OH 3.46Å; A400-Y404 WeakPolarHBondContact O-CB 3.39Å; A400-Y404 PolarHBondContact O-N 3.08Å; I401-Y404 PolarHBondContact O-N 3.25Å; W402-Y404 PolarHBondContact O-N 3.02Å; Y404-C407 VanDerWaalsContact O-CB 3.28Å; Y404-C407 WeakPolarHBondContact O-CB 3.38Å; Y404-C407 PolarHBondContact O-N 2.98Å; Y404-M408 HydrophobicContact CD1-CE 4.39Å; Y404-M408 HydrophobicContact CE1-CE 4.22Å; Y404-M408 HydrophobicContact CE1-SD 4.08Å; Y404-M408 WeakPolarHBondContact O-CG 3.47Å; Y404-M408 PolarHBondContact O-N 3.33Å; Y404-I421 HydrophobicContact CD2-CD1 4.46Å; Y404-I421 HydrophobicContact CD2-CG2 3.65Å; Y404-I421 HydrophobicContact CE2-CG2 4.44Å; Y404-I421 HydrophobicContact CG-CG2 4Å; Y404-L425 HydrophobicContact CD1-CD1 4Å; Y404-L425 HydrophobicContact CG-CD1 3.99Å; Y404-K430 HydrophobicContact CE1-CB 4.22Å; Y404-K430 HydrophobicContact CE1-CG 4.05Å; Y404-K430 HydrophobicContact CE2-CD 4.24Å; Y404-K430 HydrophobicContact CE2-CG 4.45Å; Y404-I433 HydrophobicContact CD1-CB 4.31Å; Y404-I433 HydrophobicContact CD1-CD1 3.99Å; Y404-I433 HydrophobicContact CD1-CG2 3.85Å; Y404-I433 HydrophobicContact CE1-CB 4.13Å; Y404-I433 HydrophobicContact CE1-CD1 4.34Å; Y404-I433 HydrophobicContact CE1-CG2 3.97Å
405	I	97.4	Very high	96	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-49.8	176.6	-65.1	165.7	0	0	0	110.8	I401 W402 C407 M408 F409 I433 V437 L467 A470	I401-I405 HydrophobicContact CG2-CD1 4.3Å; I401-I405 WeakPolarHBondContact O-CG1 3.26Å; I401-I405 PolarHBondContact O-N 3.26Å; W402-I405 PolarHBondContact O-N 3.16Å; I405-C407 PolarHBondContact O-N 3.24Å; I405-M408 HydrophobicContact CB-CE 4.31Å; I405-M408 HydrophobicContact CG1-CE 4.02Å; I405-M408 WeakPolarHBondContact O-CB 3.23Å; I405-M408 PolarHBondContact O-N 3.21Å; I405-F409 HydrophobicContact CG2-CD2 4.1Å; I405-F409 HydrophobicContact CG2-CE2 3.98Å; I405-F409 VanDerWaalsContact O-CD2 3.26Å; I405-F409 WeakPolarHBondContact O-CD2 3.16Å; I405-F409 PolarHBondContact O-N 2.83Å; I405-I433 HydrophobicContact CD1-CG2 4.24Å; I405-I433 HydrophobicContact CG1-CG2 3.72Å; I405-V437 HydrophobicContact CD1-CG2 4.24Å; I405-V437 HydrophobicContact CG1-CG2 4.2Å; I405-V437 HydrophobicContact CG2-CG1 4.06Å; I405-V437 HydrophobicContact CG2-CG2 4.35Å; I405-L467 HydrophobicContact CD1-CB 4.1Å; I405-L467 HydrophobicContact CD1-CD1 3.73Å; I405-L467 HydrophobicContact CD1-CG 3.65Å; I405-A470 HydrophobicContact CB-CB 4.05Å; I405-A470 HydrophobicContact CD1-CB 3.76Å; I405-A470 HydrophobicContact CG2-CB 3.9Å
406	H	97.6	Very high	95.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.6	-36.7	175.8	-85	-145.5	0	0	0	112	W402 M408 F409 G410 I411 Y413 A470 Q473	W402-H406 AromaticContact NE1-CD2 3.97Å; W402-H406 AromaticContact NE1-CE1 3.42Å; W402-H406 PolarHBondContact NE1-CE1 2.96Å; W402-H406 AromaticContact NE1-ND1 3.89Å; W402-H406 AromaticContact NE1-NE2 3.47Å; W402-H406 PolarHBondContact NE1-NE2 3.11Å; W402-H406 PolarHBondContact O-N 2.58Å; H406-M408 PolarHBondContact O-N 3.21Å; H406-F409 CarbonylContact O-C 2.97Å; H406-F409 PolarHBondContact O-N 2.97Å; H406-F409 VanDerWaalsContact O-N 3.15Å; H406-G410 PolarHBondContact O-N 3.09Å; H406-G410 VanDerWaalsContact O-N 3.12Å; H406-I411 CarbonylContact C-O 3.39Å; H406-I411 HydrophobicContact CB-CB 3.98Å; H406-I411 HydrophobicContact CB-CG2 4.44Å; H406-I411 WeakPolarHBondContact O-CB 3.47Å; H406-I411 PolarHBondContact O-N 2.77Å; H406-Y413 HydrophobicContact CB-CE2 3.93Å; H406-Y413 PolarHBondContact CE1-OH 3.11Å; H406-Y413 AromaticContact ND1-CE2 3.46Å; H406-Y413 WeakPolarHBondContact ND1-CE2 3.46Å; H406-Y413 AromaticContact ND1-CZ 3.52Å; H406-Y413 PolarHBondContact ND1-OH 3.43Å; H406-A470 PolarHBondContact NE2-O 3.11Å; H406-Q473 PolarHBondContact CE1-OE1 3.1Å; H406-Q473 VanDerWaalsContact CE1-OE1 3.29Å
407	C	95.6	Very high	95.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.1	-44.2	172.5	-169.9	0	0	0	0	112.6	F297 N403 Y404 I405 F409 G410 Y418	F297-C407 HydrophobicContact CE2-CB 4.18Å; N403-C407 VanDerWaalsContact O-CB 3.23Å; N403-C407 WeakPolarHBondContact O-CB 3.43Å; N403-C407 PolarHBondContact O-N 3.29Å; Y404-C407 VanDerWaalsContact O-CB 3.28Å; Y404-C407 WeakPolarHBondContact O-CB 3.38Å; Y404-C407 PolarHBondContact O-N 2.98Å; I405-C407 PolarHBondContact O-N 3.24Å; C407-F409 PolarHBondContact O-N 2.84Å; C407-G410 WeakPolarHBondContact O-CA 3.4Å; C407-G410 PolarHBondContact O-N 2.72Å; C407-Y418 HydrophobicContact CB-CD1 4.31Å; C407-Y418 HydrophobicContact CB-CE1 3.87Å
408	M	92.8	Very high	95.5	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.02	8%	0.077	C	C	.	.	H	α-helix	trans	-59.6	-33.9	176.1	-67.2	-169.5	-70.1	0	0	112.3	S304 Y404 I405 H406 G410 I433 K434 V437	S304-M408 VanDerWaalsContact OG-CG 3.28Å; S304-M408 WeakPolarHBondContact OG-CG 3.4Å; Y404-M408 HydrophobicContact CD1-CE 4.39Å; Y404-M408 HydrophobicContact CE1-CE 4.22Å; Y404-M408 HydrophobicContact CE1-SD 4.08Å; Y404-M408 WeakPolarHBondContact O-CG 3.47Å; Y404-M408 PolarHBondContact O-N 3.33Å; I405-M408 HydrophobicContact CB-CE 4.31Å; I405-M408 HydrophobicContact CG1-CE 4.02Å; I405-M408 WeakPolarHBondContact O-CB 3.23Å; I405-M408 PolarHBondContact O-N 3.21Å; H406-M408 PolarHBondContact O-N 3.21Å; M408-G410 VanDerWaalsContact C-N 3.29Å; M408-I433 HydrophobicContact CE-CG2 3.78Å; M408-K434 HydrophobicContact SD-CB 3.91Å; M408-K434 HydrophobicContact SD-CG 3.91Å; M408-V437 HydrophobicContact CE-CB 4.14Å; M408-V437 HydrophobicContact CE-CG1 4.14Å; M408-V437 HydrophobicContact CE-CG2 4.45Å
409	F	94.2	Very high	95.2	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.009	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7.6	174.1	-69.3	-77.7	0	0	0	113.8	P175 W176 F335 I405 H406 C407 I411 V437 R471 A474 Y478	P175-F409 HydrophobicContact CG-CD1 3.45Å; P175-F409 VanDerWaalsContact CG-CD1 3.45Å; P175-F409 HydrophobicContact CG-CE1 3.74Å; W176-F409 HydrophobicContact CE3-CD1 4.03Å; W176-F409 AromaticContact CZ3-CD1 3.63Å; W176-F409 HydrophobicContact CZ3-CD1 3.63Å; W176-F409 HydrophobicContact CZ3-CE1 4.26Å; W176-F409 HydrophobicContact CZ3-CG 4.48Å; F335-F409 VanDerWaalsContact CD2-O 3.32Å; F335-F409 WeakPolarHBondContact CD2-O 3.44Å; F335-F409 VanDerWaalsContact CE2-O 3.3Å; F335-F409 WeakPolarHBondContact CE2-O 3.35Å; I405-F409 HydrophobicContact CG2-CD2 4.1Å; I405-F409 HydrophobicContact CG2-CE2 3.98Å; I405-F409 VanDerWaalsContact O-CD2 3.26Å; I405-F409 WeakPolarHBondContact O-CD2 3.16Å; I405-F409 PolarHBondContact O-N 2.83Å; H406-F409 CarbonylContact O-C 2.97Å; H406-F409 PolarHBondContact O-N 2.97Å; H406-F409 VanDerWaalsContact O-N 3.15Å; C407-F409 PolarHBondContact O-N 2.84Å; F409-I411 VanDerWaalsContact C-N 3.34Å; F409-I411 HydrophobicContact CB-CG1 4.47Å; F409-I411 PolarHBondContact O-N 2.99Å; F409-V437 HydrophobicContact CE2-CG1 3.35Å; F409-V437 HydrophobicContact CZ-CG1 3.66Å; F409-R471 HydrophobicContact CE2-CG 4.23Å; F409-R471 HydrophobicContact CZ-CG 4.13Å; F409-A474 HydrophobicContact CB-CB 4.17Å; F409-A474 HydrophobicContact CD2-CB 3.91Å; F409-A474 HydrophobicContact CG-CB 4.06Å; F409-Y478 HydrophobicContact CB-CE2 4.33Å; F409-Y478 WeakPolarHBondContact O-CE2 3.32Å; F409-Y478 PolarHBondContact O-OH 3.2Å
410	G	94.9	Very high	94.9	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	20	177.3	0	0	0	0	0	115.3	F345 H406 C407 M408	F345-G410 PolarHBondContact N-O 2.77Å; H406-G410 PolarHBondContact O-N 3.09Å; H406-G410 VanDerWaalsContact O-N 3.12Å; C407-G410 WeakPolarHBondContact O-CA 3.4Å; C407-G410 PolarHBondContact O-N 2.72Å; M408-G410 VanDerWaalsContact C-N 3.29Å
411	I	96.8	Very high	94.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.7	176.2	-51.6	-177.7	0	0	0	109.3	F345 A347 H406 F409 Y413 Y418 A474 L477 Y478	F345-I411 HydrophobicContact CD1-CD1 4.11Å; F345-I411 HydrophobicContact CD1-CG1 3.72Å; F345-I411 HydrophobicContact CD1-CG2 4.47Å; F345-I411 HydrophobicContact CE1-CD1 4.19Å; F345-I411 HydrophobicContact CE1-CG1 4.28Å; F345-I411 HydrophobicContact CG-CG1 4.45Å; F345-I411 CarbonylContact O-C 3.6Å; F345-I411 VanDerWaalsContact O-CA 3.29Å; F345-I411 WeakPolarHBondContact O-CA 3.03Å; A347-I411 HydrophobicContact CB-CG2 4.18Å; H406-I411 CarbonylContact C-O 3.39Å; H406-I411 HydrophobicContact CB-CB 3.98Å; H406-I411 HydrophobicContact CB-CG2 4.44Å; H406-I411 WeakPolarHBondContact O-CB 3.47Å; H406-I411 PolarHBondContact O-N 2.77Å; F409-I411 VanDerWaalsContact C-N 3.34Å; F409-I411 HydrophobicContact CB-CG1 4.47Å; F409-I411 PolarHBondContact O-N 2.99Å; I411-Y413 HydrophobicContact CG2-CE2 4.48Å; I411-Y418 PolarHBondContact O-OH 2.7Å; I411-A474 HydrophobicContact CD1-CB 3.75Å; I411-L477 HydrophobicContact CD1-CD1 4.33Å; I411-Y478 HydrophobicContact CD1-CE2 4.04Å; I411-Y478 HydrophobicContact CG1-CE2 3.99Å
412	R	95.8	Very high	94.4	Very high	41 Å²	41	16.6 Å²	16.6	16%	0.155	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.6	-179.4	-170.6	-177	75.9	-165.5	7.5	111.7	F297 T344 F345 A347 D414 Y418	F297-R412 HydrophobicContact CB-CG 4.04Å; F297-R412 HydrophobicContact CD1-CB 4.23Å; F297-R412 HydrophobicContact CD1-CG 4.09Å; F297-R412 HydrophobicContact CD2-CB 3.84Å; F297-R412 HydrophobicContact CD2-CG 3.62Å; F297-R412 HydrophobicContact CE1-CB 4.14Å; F297-R412 HydrophobicContact CE1-CG 4.5Å; F297-R412 HydrophobicContact CE2-CB 3.69Å; F297-R412 HydrophobicContact CE2-CG 4.03Å; F297-R412 HydrophobicContact CG-CB 4.09Å; F297-R412 HydrophobicContact CG-CG 3.62Å; F297-R412 HydrophobicContact CZ-CB 3.86Å; F297-R412 HydrophobicContact CZ-CG 4.46Å; T344-R412 HydrophobicContact CG2-CB 3.75Å; F345-R412 PolarHBondContact O-N 3.17Å; A347-R412 WeakPolarHBondContact CB-O 3.5Å; A347-R412 PolarHBondContact N-O 2.93Å; R412-D414 IonicContact CZ-OD1 3.12Å; R412-D414 IonicContact NE-OD1 2.83Å; R412-D414 PolarHBondContact NE-OD1 3.38Å; R412-D414 IonicContact NH2-OD1 2.68Å; R412-D414 PolarHBondContact NH2-OD1 2.89Å; R412-D414 IonicContact NH2-OD2 3.93Å; R412-Y418 WeakPolarHBondContact CA-OH 3.41Å; R412-Y418 HydrophobicContact CG-CE2 3.95Å
413	Y	94.9	Very high	94	Very high	43 Å²	43	20 Å²	20	17%	0.169	10%	0.099	C	C	.	.			trans	-98.6	115.1	167.8	-66.1	-85.7	0	0	0	109.6	A347 N403 H406 I411 D415 Y416 Y418	A347-Y413 HydrophobicContact CB-CD1 3.54Å; A347-Y413 HydrophobicContact CB-CE1 3.55Å; A347-Y413 HydrophobicContact CB-CG 4.16Å; N403-Y413 WeakPolarHBondContact OD1-CE2 3.27Å; H406-Y413 HydrophobicContact CB-CE2 3.93Å; H406-Y413 PolarHBondContact CE1-OH 3.11Å; H406-Y413 AromaticContact ND1-CE2 3.46Å; H406-Y413 WeakPolarHBondContact ND1-CE2 3.46Å; H406-Y413 AromaticContact ND1-CZ 3.52Å; H406-Y413 PolarHBondContact ND1-OH 3.43Å; I411-Y413 HydrophobicContact CG2-CE2 4.48Å; Y413-D415 PolarHBondContact O-N 3.49Å; Y413-Y416 PolarHBondContact O-N 3.25Å; Y413-Y418 PolarHBondContact N-OH 3.21Å
414	D	91.2	Very high	93.9	Very high	12 Å²	12	19.9 Å²	19.9	6%	0.064	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-15.2	-177.3	-67.7	-18	0	0	0	114.5	Q290 M293 R346 Q348 R412	Q290-D414 PolarHBondContact NE2-O 3.34Å; Q290-D414 PolarHBondContact OE1-O 2.92Å; M293-D414 WeakPolarHBondContact CE-O 3.49Å; R346-D414 IonicContact CZ-OD2 2.77Å; R346-D414 IonicContact NE-OD1 3.45Å; R346-D414 IonicContact NE-OD2 3.87Å; R346-D414 PolarHBondContact NE-OD2 3.3Å; R346-D414 IonicContact NH2-OD2 3.56Å; R346-D414 PolarHBondContact NH2-OD2 3.49Å; Q348-D414 PolarHBondContact OE1-OD2 3.03Å; R412-D414 IonicContact CZ-OD1 3.12Å; R412-D414 IonicContact NE-OD1 2.83Å; R412-D414 PolarHBondContact NE-OD1 3.38Å; R412-D414 IonicContact NH2-OD1 2.68Å; R412-D414 PolarHBondContact NH2-OD1 2.89Å; R412-D414 IonicContact NH2-OD2 3.93Å
415	D	90.2	Very high	93.8	Very high	119 Å²	119	20 Å²	20	64%	0.636	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	7	177.7	64.8	-35.8	0	0	0	113.2	M293 Y413	M293-D415 VanDerWaalsContact CE-C 3.45Å; Y413-D415 PolarHBondContact O-N 3.49Å
416	Y	93.1	Very high	93.6	Very high	3 Å²	3	23 Å²	23	1%	0.012	12%	0.115	C	C	.	.			trans	-113.7	129.7	-178.8	-172.5	-108.4	0	0	0	113.2	M293 R399 A400 N403 Y413 Y418 E420 I421	M293-Y416 VanDerWaalsContact CE-C 3.4Å; M293-Y416 VanDerWaalsContact CE-N 3.35Å; M293-Y416 WeakPolarHBondContact CE-O 3.47Å; R399-Y416 HydrophobicContact CG-CD2 4.27Å; R399-Y416 HydrophobicContact CG-CE2 4.04Å; A400-Y416 WeakPolarHBondContact CA-OH 3.2Å; A400-Y416 WeakPolarHBondContact CB-OH 3.39Å; N403-Y416 HydrophobicContact CB-CD1 3.84Å; N403-Y416 HydrophobicContact CB-CE1 3.7Å; N403-Y416 HydrophobicContact CB-CG 4.43Å; N403-Y416 VanDerWaalsContact ND2-CD1 3.29Å; N403-Y416 WeakPolarHBondContact ND2-CD1 3.13Å; N403-Y416 WeakPolarHBondContact ND2-CD2 3.21Å; Y413-Y416 PolarHBondContact O-N 3.25Å; Y416-Y418 HydrophobicContact CD1-CD1 4.15Å; Y416-Y418 AromaticContact CD1-CD2 3.9Å; Y416-Y418 HydrophobicContact CD1-CD2 3.9Å; Y416-Y418 HydrophobicContact CD1-CE1 4.09Å; Y416-Y418 AromaticContact CD1-CE2 3.89Å; Y416-Y418 HydrophobicContact CD1-CE2 3.89Å; Y416-Y418 HydrophobicContact CD1-CG 4.03Å; Y416-Y418 AromaticContact CD1-CZ 3.98Å; Y416-Y418 HydrophobicContact CE1-CD1 4.33Å; Y416-Y418 HydrophobicContact CE1-CG 4.4Å; Y416-Y418 WeakPolarHBondContact O-CD2 3.38Å; Y416-Y418 PolarHBondContact O-N 3.3Å; Y416-E420 WeakPolarHBondContact CE2-OE2 3.45Å; Y416-E420 WeakPolarHBondContact OH-CB 3.39Å; Y416-E420 PolarHBondContact OH-OE2 3.18Å; Y416-I421 HydrophobicContact CE1-CD1 3.93Å; Y416-I421 HydrophobicContact CE1-CG1 3.89Å
417	D	92.3	Very high	93.3	Very high	30 Å²	30	32.5 Å²	32.5	16%	0.16	15%	0.151	C	C	.	.			trans	-82.6	100.5	172.1	-179.2	12.7	0	0	0	111	R296 G419 E420	R296-D417 WeakPolarHBondContact CD-OD1 3.39Å; R296-D417 IonicContact CZ-OD1 3.27Å; R296-D417 IonicContact CZ-OD2 2.93Å; R296-D417 IonicContact NE-OD1 3.16Å; R296-D417 IonicContact NH1-OD1 2.65Å; R296-D417 PolarHBondContact NH1-OD1 3.46Å; R296-D417 IonicContact NH1-OD2 3.86Å; R296-D417 PolarHBondContact NH1-OD2 2.53Å; D417-G419 PolarHBondContact O-N 3.45Å; D417-G419 WeakPolarHBondContact OD1-CA 3.47Å; D417-G419 PolarHBondContact OD1-N 3.14Å; D417-E420 HydrophobicContact CB-CG 4.22Å; D417-E420 VanDerWaalsContact O-CB 3.3Å; D417-E420 WeakPolarHBondContact O-CB 3.39Å; D417-E420 WeakPolarHBondContact O-CG 3.31Å; D417-E420 PolarHBondContact O-N 3.46Å
418	Y	93.4	Very high	93.3	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.008	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.1	176.8	-73	-93.5	0	0	0	113.7	F297 N403 C407 I411 R412 Y413 Y416 E420 I421	F297-Y418 HydrophobicContact CB-CD2 3.83Å; F297-Y418 HydrophobicContact CB-CE2 4.18Å; F297-Y418 HydrophobicContact CB-CG 4.09Å; F297-Y418 AromaticContact CD2-CD1 3.89Å; F297-Y418 HydrophobicContact CD2-CD1 3.89Å; F297-Y418 HydrophobicContact CD2-CD2 4.03Å; F297-Y418 AromaticContact CD2-CE1 3.61Å; F297-Y418 HydrophobicContact CD2-CE1 3.61Å; F297-Y418 AromaticContact CD2-CE2 3.72Å; F297-Y418 HydrophobicContact CD2-CE2 3.72Å; F297-Y418 HydrophobicContact CD2-CG 4.11Å; F297-Y418 AromaticContact CD2-CZ 3.51Å; F297-Y418 HydrophobicContact CE2-CE1 4.1Å; F297-Y418 HydrophobicContact CG-CD2 4.44Å; F297-Y418 HydrophobicContact CG-CE2 4.39Å; N403-Y418 HydrophobicContact CB-CE1 4.47Å; C407-Y418 HydrophobicContact CB-CD1 4.31Å; C407-Y418 HydrophobicContact CB-CE1 3.87Å; I411-Y418 PolarHBondContact O-OH 2.7Å; R412-Y418 WeakPolarHBondContact CA-OH 3.41Å; R412-Y418 HydrophobicContact CG-CE2 3.95Å; Y413-Y418 PolarHBondContact N-OH 3.21Å; Y416-Y418 HydrophobicContact CD1-CD1 4.15Å; Y416-Y418 AromaticContact CD1-CD2 3.9Å; Y416-Y418 HydrophobicContact CD1-CD2 3.9Å; Y416-Y418 HydrophobicContact CD1-CE1 4.09Å; Y416-Y418 AromaticContact CD1-CE2 3.89Å; Y416-Y418 HydrophobicContact CD1-CE2 3.89Å; Y416-Y418 HydrophobicContact CD1-CG 4.03Å; Y416-Y418 AromaticContact CD1-CZ 3.98Å; Y416-Y418 HydrophobicContact CE1-CD1 4.33Å; Y416-Y418 HydrophobicContact CE1-CG 4.4Å; Y416-Y418 WeakPolarHBondContact O-CD2 3.38Å; Y416-Y418 PolarHBondContact O-N 3.3Å; Y418-E420 PolarHBondContact O-N 3.08Å; Y418-I421 HydrophobicContact CD1-CD1 3.56Å; Y418-I421 HydrophobicContact CE1-CD1 4.15Å; Y418-I421 HydrophobicContact CG-CD1 4.43Å; Y418-I421 PolarHBondContact O-N 3.5Å
419	G	90.4	Very high	93.4	Very high	7 Å²	7	33.6 Å²	33.6	7%	0.072	16%	0.159	C	C	.	.	H	α-helix	trans	-64.7	-24	168.3	0	0	0	0	0	113.9	D417 I421 Q423	D417-G419 PolarHBondContact O-N 3.45Å; D417-G419 WeakPolarHBondContact OD1-CA 3.47Å; D417-G419 PolarHBondContact OD1-N 3.14Å; G419-I421 VanDerWaalsContact C-N 3.3Å; G419-I421 PolarHBondContact O-N 3.13Å; G419-Q423 PolarHBondContact O-NE2 3.2Å
420	E	92.3	Very high	93.5	Very high	2 Å²	2	34 Å²	34	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-64.4	-34	176.6	-67.5	174.4	-158	0	0	111.7	L279 R283 R399 Y416 D417 Y418 N422 Q423 L424	L279-E420 HydrophobicContact CD1-CB 4.44Å; L279-E420 HydrophobicContact CD1-CG 4.37Å; L279-E420 HydrophobicContact CD2-CG 4.2Å; R283-E420 IonicContact CZ-OE1 3.69Å; R283-E420 IonicContact NE-OE1 2.79Å; R283-E420 PolarHBondContact NE-OE1 3.28Å; R283-E420 IonicContact NH2-OE1 2.93Å; R283-E420 PolarHBondContact NH2-OE1 2.9Å; R283-E420 IonicContact NH2-OE2 2.62Å; R399-E420 IonicContact NH2-OE2 2.66Å; Y416-E420 WeakPolarHBondContact CE2-OE2 3.45Å; Y416-E420 WeakPolarHBondContact OH-CB 3.39Å; Y416-E420 PolarHBondContact OH-OE2 3.18Å; D417-E420 HydrophobicContact CB-CG 4.22Å; D417-E420 VanDerWaalsContact O-CB 3.3Å; D417-E420 WeakPolarHBondContact O-CB 3.39Å; D417-E420 WeakPolarHBondContact O-CG 3.31Å; D417-E420 PolarHBondContact O-N 3.46Å; Y418-E420 PolarHBondContact O-N 3.08Å; E420-N422 PolarHBondContact O-N 3Å; E420-Q423 PolarHBondContact O-N 2.86Å; E420-Q423 VanDerWaalsContact O-N 3.07Å; E420-L424 HydrophobicContact CB-CD1 4.26Å; E420-L424 WeakPolarHBondContact O-CG 3.2Å; E420-L424 PolarHBondContact O-N 3.35Å
421	I	94.6	Very high	93.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-45.5	-174	-67.3	171.7	0	0	0	111.4	E300 A400 Y404 Y416 Y418 G419 Q423 L424 L425	E300-I421 HydrophobicContact CG-CB 4.49Å; E300-I421 HydrophobicContact CG-CD1 4.03Å; E300-I421 HydrophobicContact CG-CG2 4.36Å; A400-I421 HydrophobicContact CB-CG1 4.46Å; Y404-I421 HydrophobicContact CD2-CD1 4.46Å; Y404-I421 HydrophobicContact CD2-CG2 3.65Å; Y404-I421 HydrophobicContact CE2-CG2 4.44Å; Y404-I421 HydrophobicContact CG-CG2 4Å; Y416-I421 HydrophobicContact CE1-CD1 3.93Å; Y416-I421 HydrophobicContact CE1-CG1 3.89Å; Y418-I421 HydrophobicContact CD1-CD1 3.56Å; Y418-I421 HydrophobicContact CE1-CD1 4.15Å; Y418-I421 HydrophobicContact CG-CD1 4.43Å; Y418-I421 PolarHBondContact O-N 3.5Å; G419-I421 VanDerWaalsContact C-N 3.3Å; G419-I421 PolarHBondContact O-N 3.13Å; I421-Q423 PolarHBondContact O-N 3.3Å; I421-L424 PolarHBondContact O-N 3.1Å; I421-L425 HydrophobicContact CG2-CD1 3.92Å; I421-L425 HydrophobicContact CG2-CG 4.23Å; I421-L425 WeakPolarHBondContact O-CB 3.36Å; I421-L425 PolarHBondContact O-N 3.37Å
422	N	90.1	Very high	93.5	Very high	68 Å²	68	36 Å²	36	36%	0.364	17%	0.172	S	C	.	.	H	α-helix	trans	-67.7	-21.9	178.7	-88	-42.2	0	0	0	113.8	E300 E303 E420 K430	E300-N422 PolarHBondContact OE2-ND2 3.28Å; E303-N422 PolarHBondContact OE2-ND2 3.29Å; E303-N422 PolarHBondContact OE2-OD1 3.06Å; E420-N422 PolarHBondContact O-N 3Å; N422-K430 PolarHBondContact OD1-NZ 2.96Å
423	Q	92	Very high	93.6	Very high	80 Å²	80	34.1 Å²	34.1	37%	0.374	16%	0.164	S	C	.	.	H	α-helix	trans	-85.2	-31.4	178.7	-64.1	-177.2	63.7	0	0	111.7	R275 L279 G419 E420 I421	R275-Q423 WeakPolarHBondContact CD-O 3.23Å; R275-Q423 PolarHBondContact NH1-O 3.25Å; L279-Q423 HydrophobicContact CD1-CB 4.11Å; G419-Q423 PolarHBondContact O-NE2 3.2Å; E420-Q423 PolarHBondContact O-N 2.86Å; E420-Q423 VanDerWaalsContact O-N 3.07Å; I421-Q423 PolarHBondContact O-N 3.3Å
424	L	95.2	Very high	93.6	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-97.5	-34.7	-174.7	-63.3	173	0	0	0	113.7	L272 M276 L279 M396 L397 A400 E420 I421	L272-L424 HydrophobicContact CD1-CB 4.49Å; L272-L424 HydrophobicContact CD1-CD2 3.92Å; L272-L424 WeakPolarHBondContact CD1-O 3.49Å; M276-L424 HydrophobicContact CG-CD2 3.4Å; M276-L424 VanDerWaalsContact CG-CD2 3.4Å; L279-L424 HydrophobicContact CD1-CD1 4.17Å; L279-L424 HydrophobicContact CD1-CD2 3.93Å; L279-L424 HydrophobicContact CD1-CG 3.92Å; M396-L424 HydrophobicContact CE-CD1 4.11Å; M396-L424 HydrophobicContact CE-CD2 4.05Å; M396-L424 HydrophobicContact CG-CD1 4.08Å; L397-L424 HydrophobicContact CD1-CB 4.16Å; A400-L424 HydrophobicContact CB-CB 4.35Å; A400-L424 HydrophobicContact CB-CD1 3.71Å; E420-L424 HydrophobicContact CB-CD1 4.26Å; E420-L424 WeakPolarHBondContact O-CG 3.2Å; E420-L424 PolarHBondContact O-N 3.35Å; I421-L424 PolarHBondContact O-N 3.1Å
425	L	95.6	Very high	93.8	Very high	4 Å²	4	32 Å²	32	2%	0.021	16%	0.155	C	C	.	.	S	Bend	trans	-106.7	109.7	-176.3	-48.6	-169.9	0	0	0	110.1	L397 I401 Y404 I421 F429 K430 I433	L397-L425 HydrophobicContact CD1-CD2 3.89Å; I401-L425 HydrophobicContact CG1-CD1 4.48Å; I401-L425 HydrophobicContact CG1-CD2 3.79Å; Y404-L425 HydrophobicContact CD1-CD1 4Å; Y404-L425 HydrophobicContact CG-CD1 3.99Å; I421-L425 HydrophobicContact CG2-CD1 3.92Å; I421-L425 HydrophobicContact CG2-CG 4.23Å; I421-L425 WeakPolarHBondContact O-CB 3.36Å; I421-L425 PolarHBondContact O-N 3.37Å; L425-F429 HydrophobicContact CB-CD1 4.41Å; L425-F429 HydrophobicContact CD2-CD1 3.82Å; L425-F429 HydrophobicContact CD2-CE1 3.75Å; L425-K430 HydrophobicContact CB-CG 3.94Å; L425-K430 WeakPolarHBondContact O-CE 3.47Å; L425-I433 HydrophobicContact CD1-CD1 3.95Å
426	D	92.8	Very high	94	Very high	61 Å²	61	26.3 Å²	26.3	33%	0.326	13%	0.125	S	C	.	.			trans	-68.4	167.7	176.5	91.2	-34.5	0	0	0	111.7	S428 F429 K430	D426-S428 VanDerWaalsContact C-N 3.33Å; D426-S428 VanDerWaalsContact CG-OG 3.31Å; D426-S428 PolarHBondContact O-N 2.88Å; D426-S428 PolarHBondContact OD1-N 3.15Å; D426-S428 PolarHBondContact OD1-OG 3.26Å; D426-S428 VanDerWaalsContact OD1-OG 3.11Å; D426-S428 PolarHBondContact OD2-N 3.09Å; D426-S428 PolarHBondContact OD2-OG 2.98Å; D426-F429 PolarHBondContact O-N 3.07Å; D426-F429 WeakPolarHBondContact OD1-CA 3.46Å; D426-F429 WeakPolarHBondContact OD1-CB 3.23Å; D426-F429 PolarHBondContact OD1-N 3.16Å; D426-K430 WeakPolarHBondContact O-CG 3.45Å; D426-K430 PolarHBondContact O-N 2.88Å
427	R	92.3	Very high	94.2	Very high	200 Å²	200	26.1 Å²	26.1	76%	0.755	12%	0.124	S	C	*	.	H	α-helix	trans	-61.6	-40.3	-177.3	-176.4	176.7	178.5	-179.7	0.9	112.5	F429 K430 I431	R427-F429 VanDerWaalsContact C-N 3.3Å; R427-F429 PolarHBondContact O-N 3.22Å; R427-K430 PolarHBondContact O-N 3.27Å; R427-I431 HydrophobicContact CG-CD1 4.01Å; R427-I431 VanDerWaalsContact O-CG1 3.27Å; R427-I431 WeakPolarHBondContact O-CG1 3.45Å; R427-I431 PolarHBondContact O-N 3.36Å
428	S	93.7	Very high	94.2	Very high	27 Å²	27	24.9 Å²	24.9	19%	0.189	12%	0.118	C	C	.	.	H	α-helix	trans	-65.4	-39.3	-177.4	72.8	0	0	0	0	111.1	D426 I431 Y432 F451	D426-S428 VanDerWaalsContact C-N 3.33Å; D426-S428 VanDerWaalsContact CG-OG 3.31Å; D426-S428 PolarHBondContact O-N 2.88Å; D426-S428 PolarHBondContact OD1-N 3.15Å; D426-S428 PolarHBondContact OD1-OG 3.26Å; D426-S428 VanDerWaalsContact OD1-OG 3.11Å; D426-S428 PolarHBondContact OD2-N 3.09Å; D426-S428 PolarHBondContact OD2-OG 2.98Å; S428-I431 PolarHBondContact O-N 2.62Å; S428-Y432 PolarHBondContact O-N 3.26Å; S428-F451 WeakPolarHBondContact OG-CA 3.4Å; S428-F451 WeakPolarHBondContact OG-CB 3.33Å
429	F	95.6	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71.6	-42	177.3	-169.6	-153.9	0	0	0	112.1	I401 L425 D426 R427 I431 Y432 I433 F451 W452 V463	I401-F429 HydrophobicContact CD1-CE1 3.83Å; I401-F429 HydrophobicContact CD1-CZ 3.81Å; I401-F429 HydrophobicContact CG1-CE1 3.88Å; I401-F429 HydrophobicContact CG1-CZ 4.06Å; L425-F429 HydrophobicContact CB-CD1 4.41Å; L425-F429 HydrophobicContact CD2-CD1 3.82Å; L425-F429 HydrophobicContact CD2-CE1 3.75Å; D426-F429 PolarHBondContact O-N 3.07Å; D426-F429 WeakPolarHBondContact OD1-CA 3.46Å; D426-F429 WeakPolarHBondContact OD1-CB 3.23Å; D426-F429 PolarHBondContact OD1-N 3.16Å; R427-F429 VanDerWaalsContact C-N 3.3Å; R427-F429 PolarHBondContact O-N 3.22Å; F429-I431 VanDerWaalsContact C-N 3.29Å; F429-I431 PolarHBondContact O-N 3.49Å; F429-Y432 HydrophobicContact CD2-CD1 4.3Å; F429-Y432 HydrophobicContact CE2-CD1 4.3Å; F429-Y432 PolarHBondContact O-N 3.16Å; F429-Y432 VanDerWaalsContact O-N 3.11Å; F429-I433 HydrophobicContact CD1-CD1 4.08Å; F429-I433 HydrophobicContact CD2-CD1 3.91Å; F429-I433 HydrophobicContact CD2-CG1 3.83Å; F429-I433 HydrophobicContact CE1-CD1 3.96Å; F429-I433 HydrophobicContact CE2-CD1 3.76Å; F429-I433 HydrophobicContact CE2-CG1 3.63Å; F429-I433 HydrophobicContact CG-CD1 4.05Å; F429-I433 HydrophobicContact CG-CG1 4.43Å; F429-I433 HydrophobicContact CZ-CD1 3.8Å; F429-I433 HydrophobicContact CZ-CG1 4.12Å; F429-I433 VanDerWaalsContact O-CG1 3.3Å; F429-I433 WeakPolarHBondContact O-CG1 3.29Å; F429-I433 PolarHBondContact O-N 3.05Å; F429-F451 HydrophobicContact CB-CB 4.06Å; F429-F451 HydrophobicContact CD2-CB 4.41Å; F429-F451 AromaticContact CD2-CD2 3.52Å; F429-F451 HydrophobicContact CD2-CD2 3.52Å; F429-F451 AromaticContact CD2-CE2 3.89Å; F429-F451 HydrophobicContact CD2-CE2 3.89Å; F429-F451 AromaticContact CD2-CG 3.96Å; F429-F451 HydrophobicContact CD2-CG 3.96Å; F429-F451 AromaticContact CE2-CD2 3.94Å; F429-F451 HydrophobicContact CE2-CD2 3.94Å; F429-F451 AromaticContact CE2-CE2 3.83Å; F429-F451 HydrophobicContact CE2-CE2 3.83Å; F429-F451 HydrophobicContact CE2-CZ 4.49Å; F429-F451 HydrophobicContact CG-CD2 4.15Å; F429-W452 AromaticContact CD1-CE2 3.93Å; F429-W452 AromaticContact CD1-CZ2 3.94Å; F429-W452 HydrophobicContact CD1-CZ2 3.94Å; F429-W452 AromaticContact CD1-NE1 3.87Å; F429-W452 AromaticContact CE1-CE2 3.72Å; F429-W452 AromaticContact CE1-CH2 3.92Å; F429-W452 HydrophobicContact CE1-CH2 3.92Å; F429-W452 AromaticContact CE1-CZ2 3.3Å; F429-W452 HydrophobicContact CE1-CZ2 3.3Å; F429-W452 HydrophobicContact CZ-CH2 4.01Å; F429-W452 AromaticContact CZ-CZ2 3.83Å; F429-W452 HydrophobicContact CZ-CZ2 3.83Å; F429-V463 HydrophobicContact CE2-CG1 3.61Å; F429-V463 HydrophobicContact CZ-CG1 3.58Å; F429-V463 HydrophobicContact CZ-CG2 4.1Å
430	K	96	Very high	94.4	Very high	12 Å²	12	25.3 Å²	25.3	5%	0.052	12%	0.12	C	C	.	.	H	α-helix	trans	-57.7	-40.1	172.7	-74.3	-170.3	176.5	-160.8	0	112.7	E300 Y404 N422 L425 D426 R427 K434	E300-K430 VanDerWaalsContact CD-NZ 3.31Å; E300-K430 IonicContact OE1-NZ 3.17Å; E300-K430 PolarHBondContact OE1-NZ 3.27Å; E300-K430 IonicContact OE2-NZ 2.73Å; E300-K430 PolarHBondContact OE2-NZ 3.47Å; Y404-K430 HydrophobicContact CE1-CB 4.22Å; Y404-K430 HydrophobicContact CE1-CG 4.05Å; Y404-K430 HydrophobicContact CE2-CD 4.24Å; Y404-K430 HydrophobicContact CE2-CG 4.45Å; N422-K430 PolarHBondContact OD1-NZ 2.96Å; L425-K430 HydrophobicContact CB-CG 3.94Å; L425-K430 WeakPolarHBondContact O-CE 3.47Å; D426-K430 WeakPolarHBondContact O-CG 3.45Å; D426-K430 PolarHBondContact O-N 2.88Å; R427-K430 PolarHBondContact O-N 3.27Å; K430-K434 WeakPolarHBondContact O-CB 3.24Å; K430-K434 PolarHBondContact O-N 3.16Å
431	I	94.6	Very high	94.2	Very high	42 Å²	42	27.9 Å²	27.9	22%	0.215	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-47	174.1	-69.4	164.1	0	0	0	110.4	V307 R427 S428 F429 K434 T435 M447	V307-I431 HydrophobicContact CG1-CB 4.18Å; V307-I431 HydrophobicContact CG1-CG1 3.52Å; R427-I431 HydrophobicContact CG-CD1 4.01Å; R427-I431 VanDerWaalsContact O-CG1 3.27Å; R427-I431 WeakPolarHBondContact O-CG1 3.45Å; R427-I431 PolarHBondContact O-N 3.36Å; S428-I431 PolarHBondContact O-N 2.62Å; F429-I431 VanDerWaalsContact C-N 3.29Å; F429-I431 PolarHBondContact O-N 3.49Å; I431-K434 PolarHBondContact O-N 2.78Å; I431-T435 WeakPolarHBondContact O-CB 3.21Å; I431-T435 PolarHBondContact O-N 2.82Å; I431-T435 PolarHBondContact O-OG1 3.07Å; I431-M447 HydrophobicContact CG2-CE 3.73Å
432	Y	96.9	Very high	94.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.6	-49	177.8	177.4	-97.5	0	0	0	112.5	G218 S428 F429 K434 T435 M436 T443 M447 Y448 F451 N464 L467	G218-Y432 WeakPolarHBondContact CA-OH 3.25Å; G218-Y432 PolarHBondContact O-OH 2.75Å; S428-Y432 PolarHBondContact O-N 3.26Å; F429-Y432 HydrophobicContact CD2-CD1 4.3Å; F429-Y432 HydrophobicContact CE2-CD1 4.3Å; F429-Y432 PolarHBondContact O-N 3.16Å; F429-Y432 VanDerWaalsContact O-N 3.11Å; Y432-K434 PolarHBondContact O-N 3.27Å; Y432-T435 PolarHBondContact O-N 3.17Å; Y432-M436 HydrophobicContact CE1-CE 4.11Å; Y432-M436 WeakPolarHBondContact O-CB 3.25Å; Y432-M436 PolarHBondContact O-N 3.26Å; Y432-T443 HydrophobicContact CE2-CG2 4Å; Y432-M447 HydrophobicContact CD2-CB 4.17Å; Y432-Y448 HydrophobicContact CE2-CD2 4.48Å; Y432-F451 AromaticContact CD1-CD1 3.96Å; Y432-F451 HydrophobicContact CD1-CD1 3.96Å; Y432-F451 AromaticContact CD1-CE1 3.39Å; Y432-F451 HydrophobicContact CD1-CE1 3.39Å; Y432-F451 HydrophobicContact CD1-CE2 4.44Å; Y432-F451 AromaticContact CD1-CZ 3.69Å; Y432-F451 HydrophobicContact CD1-CZ 3.69Å; Y432-F451 AromaticContact CD2-CD1 3.96Å; Y432-F451 HydrophobicContact CD2-CD1 3.96Å; Y432-F451 AromaticContact CD2-CE1 3.54Å; Y432-F451 HydrophobicContact CD2-CE1 3.54Å; Y432-F451 AromaticContact CE1-CE1 3.57Å; Y432-F451 HydrophobicContact CE1-CE1 3.57Å; Y432-F451 AromaticContact CE1-CZ 3.6Å; Y432-F451 HydrophobicContact CE1-CZ 3.6Å; Y432-F451 AromaticContact CE2-CE1 3.71Å; Y432-F451 HydrophobicContact CE2-CE1 3.71Å; Y432-F451 HydrophobicContact CE2-CZ 4.46Å; Y432-F451 AromaticContact CG-CD1 3.63Å; Y432-F451 HydrophobicContact CG-CD1 3.63Å; Y432-F451 AromaticContact CG-CE1 3.37Å; Y432-F451 HydrophobicContact CG-CE1 3.37Å; Y432-F451 HydrophobicContact CG-CZ 4.16Å; Y432-F451 AromaticContact CZ-CE1 3.72Å; Y432-N464 WeakPolarHBondContact CE1-OD1 3.44Å; Y432-N464 PolarHBondContact OH-ND2 2.79Å; Y432-N464 PolarHBondContact OH-OD1 3.49Å; Y432-L467 HydrophobicContact CE1-CD2 4.26Å
433	I	97.8	Very high	94.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.2	-50	178.2	-64	164.8	0	0	0	110.3	Y404 I405 M408 L425 F429 T435 M436 V437 L467	Y404-I433 HydrophobicContact CD1-CB 4.31Å; Y404-I433 HydrophobicContact CD1-CD1 3.99Å; Y404-I433 HydrophobicContact CD1-CG2 3.85Å; Y404-I433 HydrophobicContact CE1-CB 4.13Å; Y404-I433 HydrophobicContact CE1-CD1 4.34Å; Y404-I433 HydrophobicContact CE1-CG2 3.97Å; I405-I433 HydrophobicContact CD1-CG2 4.24Å; I405-I433 HydrophobicContact CG1-CG2 3.72Å; M408-I433 HydrophobicContact CE-CG2 3.78Å; L425-I433 HydrophobicContact CD1-CD1 3.95Å; F429-I433 HydrophobicContact CD1-CD1 4.08Å; F429-I433 HydrophobicContact CD2-CD1 3.91Å; F429-I433 HydrophobicContact CD2-CG1 3.83Å; F429-I433 HydrophobicContact CE1-CD1 3.96Å; F429-I433 HydrophobicContact CE2-CD1 3.76Å; F429-I433 HydrophobicContact CE2-CG1 3.63Å; F429-I433 HydrophobicContact CG-CD1 4.05Å; F429-I433 HydrophobicContact CG-CG1 4.43Å; F429-I433 HydrophobicContact CZ-CD1 3.8Å; F429-I433 HydrophobicContact CZ-CG1 4.12Å; F429-I433 VanDerWaalsContact O-CG1 3.3Å; F429-I433 WeakPolarHBondContact O-CG1 3.29Å; F429-I433 PolarHBondContact O-N 3.05Å; I433-T435 PolarHBondContact O-N 3.02Å; I433-M436 PolarHBondContact O-N 3.46Å; I433-V437 HydrophobicContact CG2-CG2 4.32Å; I433-V437 WeakPolarHBondContact O-CB 3.36Å; I433-V437 WeakPolarHBondContact O-CG2 3.46Å; I433-V437 PolarHBondContact O-N 3.42Å; I433-L467 HydrophobicContact CB-CD2 4.27Å; I433-L467 HydrophobicContact CG1-CD1 4.3Å; I433-L467 HydrophobicContact CG1-CD2 4.02Å; I433-L467 HydrophobicContact CG1-CG 4.5Å; I433-L467 HydrophobicContact CG2-CD2 4.22Å; I433-L467 HydrophobicContact CG2-CG 4.2Å
434	K	95.8	Very high	94.3	Very high	10 Å²	10	27.1 Å²	27.1	4%	0.043	13%	0.13	C	C	.	.	H	α-helix	trans	-61.3	-46.6	-179.2	-173.9	172.4	-175.3	178.6	0	111.6	S304 M305 V307 T309 D334 M408 K430 I431 Y432 M436 V437 C438	S304-K434 PolarHBondContact O-NZ 2.96Å; M305-K434 PolarHBondContact O-NZ 3.32Å; V307-K434 HydrophobicContact CB-CD 3.83Å; V307-K434 HydrophobicContact CG1-CB 4.34Å; V307-K434 HydrophobicContact CG1-CD 4.01Å; V307-K434 PolarHBondContact O-NZ 3.08Å; T309-K434 HydrophobicContact CG2-CG 4.37Å; D334-K434 WeakPolarHBondContact OD1-CE 3.39Å; D334-K434 IonicContact OD1-NZ 3.77Å; D334-K434 PolarHBondContact OD1-NZ 3.43Å; D334-K434 IonicContact OD2-NZ 3.53Å; M408-K434 HydrophobicContact SD-CB 3.91Å; M408-K434 HydrophobicContact SD-CG 3.91Å; K430-K434 WeakPolarHBondContact O-CB 3.24Å; K430-K434 PolarHBondContact O-N 3.16Å; I431-K434 PolarHBondContact O-N 2.78Å; Y432-K434 PolarHBondContact O-N 3.27Å; K434-M436 PolarHBondContact O-N 3.25Å; K434-V437 PolarHBondContact O-N 2.76Å; K434-C438 WeakPolarHBondContact O-CB 3.36Å; K434-C438 PolarHBondContact O-N 3.27Å; K434-C438 PolarHBondContact O-SG 3.04Å
435	T	95.3	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-48.1	177.2	-65.9	0	0	0	0	111.3	T309 I431 Y432 I433 V437 S439 P440 K442 M447	T309-T435 WeakPolarHBondContact CG2-OG1 3.48Å; I431-T435 WeakPolarHBondContact O-CB 3.21Å; I431-T435 PolarHBondContact O-N 2.82Å; I431-T435 PolarHBondContact O-OG1 3.07Å; Y432-T435 PolarHBondContact O-N 3.17Å; I433-T435 PolarHBondContact O-N 3.02Å; T435-V437 PolarHBondContact O-N 3.03Å; T435-S439 CarbonylContact O-C 3.48Å; T435-S439 WeakPolarHBondContact O-CA 3.4Å; T435-S439 PolarHBondContact O-N 3.17Å; T435-S439 VanDerWaalsContact O-O 3.08Å; T435-P440 WeakPolarHBondContact O-CA 3.42Å; T435-P440 VanDerWaalsContact O-N 3.1Å; T435-K442 HydrophobicContact CG2-CB 4.02Å; T435-M447 VanDerWaalsContact CB-CE 3.42Å; T435-M447 HydrophobicContact CG2-CE 3.8Å; T435-M447 HydrophobicContact CG2-SD 4.13Å; T435-M447 WeakPolarHBondContact OG1-CE 3.23Å
436	M	95.1	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.5	-36.5	-176	-170.6	-117.1	-89.2	0	0	112.8	S214 Y432 I433 K434 P440 N464 L467	S214-M436 VanDerWaalsContact CB-O 3.31Å; S214-M436 WeakPolarHBondContact CB-O 3.49Å; S214-M436 VanDerWaalsContact O-CG 3.27Å; S214-M436 WeakPolarHBondContact O-CG 3.27Å; S214-M436 PolarHBondContact OG-O 2.57Å; Y432-M436 HydrophobicContact CE1-CE 4.11Å; Y432-M436 WeakPolarHBondContact O-CB 3.25Å; Y432-M436 PolarHBondContact O-N 3.26Å; I433-M436 PolarHBondContact O-N 3.46Å; K434-M436 PolarHBondContact O-N 3.25Å; M436-P440 VanDerWaalsContact O-CB 3.29Å; M436-P440 WeakPolarHBondContact O-CB 3.22Å; M436-N464 HydrophobicContact CE-CB 3.77Å; M436-N464 VanDerWaalsContact CE-CG 3.41Å; M436-N464 WeakPolarHBondContact CE-OD1 3.44Å; M436-L467 HydrophobicContact CB-CD2 4.46Å; M436-L467 HydrophobicContact CE-CB 3.74Å; M436-L467 HydrophobicContact CE-CD2 3.2Å; M436-L467 HydrophobicContact CE-CG 4.1Å; M436-L467 HydrophobicContact SD-CB 3.72Å; M436-L467 HydrophobicContact SD-CD2 3.73Å; M436-L467 HydrophobicContact SD-CG 4.3Å
437	V	95.9	Very high	94.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-81.1	-35.1	-178.4	170.9	0	0	0	0	112.5	I405 M408 F409 I433 K434 T435 L467 R471	I405-V437 HydrophobicContact CD1-CG2 4.24Å; I405-V437 HydrophobicContact CG1-CG2 4.2Å; I405-V437 HydrophobicContact CG2-CG1 4.06Å; I405-V437 HydrophobicContact CG2-CG2 4.35Å; M408-V437 HydrophobicContact CE-CB 4.14Å; M408-V437 HydrophobicContact CE-CG1 4.14Å; M408-V437 HydrophobicContact CE-CG2 4.45Å; F409-V437 HydrophobicContact CE2-CG1 3.35Å; F409-V437 HydrophobicContact CZ-CG1 3.66Å; I433-V437 HydrophobicContact CG2-CG2 4.32Å; I433-V437 WeakPolarHBondContact O-CB 3.36Å; I433-V437 WeakPolarHBondContact O-CG2 3.46Å; I433-V437 PolarHBondContact O-N 3.42Å; K434-V437 PolarHBondContact O-N 2.76Å; T435-V437 PolarHBondContact O-N 3.03Å; V437-L467 HydrophobicContact CG2-CB 4.33Å; V437-L467 HydrophobicContact CG2-CG 4.21Å; V437-R471 HydrophobicContact CG1-CB 4.28Å; V437-R471 HydrophobicContact CG1-CG 4.17Å; V437-R471 PolarHBondContact O-NE 2.81Å; V437-R471 PolarHBondContact O-NH1 2.65Å
438	C	93.1	Very high	94.3	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.027	14%	0.139	C	C	.	.	H	α-helix	trans	-103.3	-30.3	-171.2	-59.6	0	0	0	0	113.9	Y332 K434	Y332-C438 WeakPolarHBondContact CB-O 3.47Å; Y332-C438 HydrophobicContact CD1-CB 3.63Å; Y332-C438 HydrophobicContact CD2-CB 3.78Å; Y332-C438 HydrophobicContact CE1-CB 3.96Å; Y332-C438 HydrophobicContact CE2-CB 4.11Å; Y332-C438 WeakPolarHBondContact CE2-SG 3.3Å; Y332-C438 HydrophobicContact CG-CB 3.54Å; Y332-C438 VanDerWaalsContact CZ-SG 3.51Å; K434-C438 WeakPolarHBondContact O-CB 3.36Å; K434-C438 PolarHBondContact O-N 3.27Å; K434-C438 PolarHBondContact O-SG 3.04Å
439	S	92.5	Very high	94.3	Very high	18 Å²	18	33.3 Å²	33.3	13%	0.126	15%	0.152	C	C	.	.			trans	-149.9	59.5	-176.6	-55.4	0	0	0	0	110.5	T435 E441 K442	T435-S439 CarbonylContact O-C 3.48Å; T435-S439 WeakPolarHBondContact O-CA 3.4Å; T435-S439 PolarHBondContact O-N 3.17Å; T435-S439 VanDerWaalsContact O-O 3.08Å; S439-E441 VanDerWaalsContact C-OE2 3.23Å; S439-E441 WeakPolarHBondContact CB-OE1 3.24Å; S439-E441 PolarHBondContact O-N 3.45Å; S439-E441 VanDerWaalsContact O-N 3.08Å; S439-K442 WeakPolarHBondContact O-CB 3.48Å; S439-K442 PolarHBondContact O-N 3.24Å
440	P	94.6	Very high	94.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-56.4	-29.7	-170.5	20	-32.6	0	0	0	113.9	H128 F217 T435 M436 K442 T443	H128-P440 HydrophobicContact CB-CG 3.9Å; F217-P440 HydrophobicContact CB-CB 3.96Å; F217-P440 WeakPolarHBondContact CB-O 3.25Å; F217-P440 HydrophobicContact CD2-CB 3.78Å; F217-P440 HydrophobicContact CD2-CG 4.36Å; F217-P440 HydrophobicContact CG-CB 4.17Å; F217-P440 VanDerWaalsContact CG-O 3.27Å; F217-P440 WeakPolarHBondContact CG-O 3.46Å; T435-P440 WeakPolarHBondContact O-CA 3.42Å; T435-P440 VanDerWaalsContact O-N 3.1Å; M436-P440 VanDerWaalsContact O-CB 3.29Å; M436-P440 WeakPolarHBondContact O-CB 3.22Å; P440-K442 PolarHBondContact O-N 3.46Å; P440-K442 VanDerWaalsContact O-N 3.08Å; P440-T443 VanDerWaalsContact O-CB 3.22Å; P440-T443 WeakPolarHBondContact O-CB 3.2Å; P440-T443 PolarHBondContact O-N 3.43Å; P440-T443 PolarHBondContact O-OG1 2.98Å
441	E	90	Very high	94	Very high	55 Å²	55	34.5 Å²	34.5	26%	0.257	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-56.4	-22.7	174.6	66.3	-75.1	173.8	0	0	114	H128 F217 S439	H128-E441 IonicContact ND1-OE2 3.14Å; F217-E441 HydrophobicContact CE1-CB 4.42Å; F217-E441 HydrophobicContact CE2-CB 4.33Å; F217-E441 HydrophobicContact CZ-CB 4.05Å; S439-E441 VanDerWaalsContact C-OE2 3.23Å; S439-E441 WeakPolarHBondContact CB-OE1 3.24Å; S439-E441 PolarHBondContact O-N 3.45Å; S439-E441 VanDerWaalsContact O-N 3.08Å
442	K	91.3	Very high	93.9	Very high	65 Å²	65	33.1 Å²	33.1	28%	0.283	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-89	1.3	176.5	-54.2	-168.9	-175.4	-166	0	113.5	D312 T435 S439 P440 T444	D312-K442 IonicContact OD1-NZ 2.64Å; D312-K442 PolarHBondContact OD1-NZ 3.2Å; T435-K442 HydrophobicContact CG2-CB 4.02Å; S439-K442 WeakPolarHBondContact O-CB 3.48Å; S439-K442 PolarHBondContact O-N 3.24Å; P440-K442 PolarHBondContact O-N 3.46Å; P440-K442 VanDerWaalsContact O-N 3.08Å; K442-T444 PolarHBondContact O-N 2.89Å
443	T	93.8	Very high	93.6	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.049	18%	0.183	C	C	.	.			trans	-68.1	127.9	179.9	-53.3	0	0	0	0	111.1	F51 Y432 P440	F51-T443 HydrophobicContact CE2-CG2 4.28Å; F51-T443 HydrophobicContact CZ-CG2 4.5Å; Y432-T443 HydrophobicContact CE2-CG2 4Å; P440-T443 VanDerWaalsContact O-CB 3.22Å; P440-T443 WeakPolarHBondContact O-CB 3.2Å; P440-T443 PolarHBondContact O-N 3.43Å; P440-T443 PolarHBondContact O-OG1 2.98Å
444	T	93.4	Very high	93.4	Very high	60 Å²	60	43.6 Å²	43.6	37%	0.368	20%	0.196	S	C	.	.			trans	-119.1	158	179.7	67.2	0	0	0	0	112.6	K442 R446 M447 Y448	K442-T444 PolarHBondContact O-N 2.89Å; T444-R446 PolarHBondContact O-N 3.34Å; T444-M447 WeakPolarHBondContact O-CB 3.3Å; T444-M447 PolarHBondContact O-N 2.99Å; T444-M447 VanDerWaalsContact O-N 3.14Å; T444-M447 WeakPolarHBondContact OG1-CG 3.4Å; T444-M447 PolarHBondContact OG1-N 3.42Å; T444-Y448 PolarHBondContact O-N 3.04Å; T444-Y448 VanDerWaalsContact O-N 3.12Å
445	K	92.8	Very high	93.3	Very high	94 Å²	94	43.9 Å²	43.9	41%	0.409	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-39.1	173.8	-175.9	167.3	178.5	163.5	0	112.2	R50 F51 M447 Y448 E449	R50-K445 PolarHBondContact O-NZ 3.36Å; F51-K445 HydrophobicContact CD1-CB 3.67Å; F51-K445 HydrophobicContact CD1-CD 4.28Å; F51-K445 HydrophobicContact CD1-CG 3.87Å; F51-K445 VanDerWaalsContact CE1-CA 3.5Å; F51-K445 HydrophobicContact CE1-CB 3.61Å; F51-K445 HydrophobicContact CE1-CG 4.34Å; K445-M447 VanDerWaalsContact C-N 3.31Å; K445-M447 PolarHBondContact O-N 3.36Å; K445-Y448 WeakPolarHBondContact O-CB 3.43Å; K445-Y448 PolarHBondContact O-N 3.19Å; K445-Y448 VanDerWaalsContact O-N 3.16Å; K445-E449 WeakPolarHBondContact CE-OE1 3.29Å; K445-E449 HydrophobicContact CG-CG 4.3Å; K445-E449 IonicContact NZ-OE1 2.72Å; K445-E449 WeakPolarHBondContact O-CG 3.49Å; K445-E449 PolarHBondContact O-N 2.83Å
446	R	93.5	Very high	93.3	Very high	209 Å²	209	48.7 Å²	48.7	79%	0.789	22%	0.22	S	C	*	.	H	α-helix	trans	-59.6	-42.3	177	-177.4	-179	177.6	-174	0	111.8	T444 E449 S450	T444-R446 PolarHBondContact O-N 3.34Å; R446-E449 PolarHBondContact O-N 3.03Å; R446-S450 VanDerWaalsContact O-CB 3.24Å; R446-S450 WeakPolarHBondContact O-CB 3.4Å; R446-S450 PolarHBondContact O-N 2.65Å; R446-S450 PolarHBondContact O-OG 3.14Å
447	M	94.1	Very high	93.3	Very high	21 Å²	21	50.7 Å²	50.7	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-47.2	175.3	-70.3	176.8	64.7	0	0	110.7	I431 Y432 T435 T444 K445 E449 S450 F451	I431-M447 HydrophobicContact CG2-CE 3.73Å; Y432-M447 HydrophobicContact CD2-CB 4.17Å; T435-M447 VanDerWaalsContact CB-CE 3.42Å; T435-M447 HydrophobicContact CG2-CE 3.8Å; T435-M447 HydrophobicContact CG2-SD 4.13Å; T435-M447 WeakPolarHBondContact OG1-CE 3.23Å; T444-M447 WeakPolarHBondContact O-CB 3.3Å; T444-M447 PolarHBondContact O-N 2.99Å; T444-M447 VanDerWaalsContact O-N 3.14Å; T444-M447 WeakPolarHBondContact OG1-CG 3.4Å; T444-M447 PolarHBondContact OG1-N 3.42Å; K445-M447 VanDerWaalsContact C-N 3.31Å; K445-M447 PolarHBondContact O-N 3.36Å; M447-E449 VanDerWaalsContact C-N 3.3Å; M447-E449 PolarHBondContact O-N 2.92Å; M447-S450 PolarHBondContact O-N 3.44Å; M447-S450 VanDerWaalsContact O-N 3.07Å; M447-S450 PolarHBondContact O-OG 3.47Å; M447-F451 WeakPolarHBondContact O-CD1 3.47Å
448	Y	95.1	Very high	93.3	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-56.6	-40.8	177.3	177.1	-91.7	0	0	0	113.1	F51 I52 Y432 T444 K445 F451 H457 K460	F51-Y448 HydrophobicContact CB-CD1 3.82Å; F51-Y448 HydrophobicContact CB-CD2 4.48Å; F51-Y448 HydrophobicContact CB-CE1 3.87Å; F51-Y448 HydrophobicContact CB-CG 4.13Å; F51-Y448 HydrophobicContact CD2-CD1 4.35Å; F51-Y448 AromaticContact CD2-CD2 3.85Å; F51-Y448 HydrophobicContact CD2-CD2 3.85Å; F51-Y448 HydrophobicContact CD2-CE2 4.45Å; F51-Y448 AromaticContact CD2-CG 3.79Å; F51-Y448 HydrophobicContact CD2-CG 3.79Å; F51-Y448 HydrophobicContact CG-CD1 4.25Å; F51-Y448 HydrophobicContact CG-CG 4.13Å; I52-Y448 WeakPolarHBondContact CG1-OH 3.17Å; Y432-Y448 HydrophobicContact CE2-CD2 4.48Å; T444-Y448 PolarHBondContact O-N 3.04Å; T444-Y448 VanDerWaalsContact O-N 3.12Å; K445-Y448 WeakPolarHBondContact O-CB 3.43Å; K445-Y448 PolarHBondContact O-N 3.19Å; K445-Y448 VanDerWaalsContact O-N 3.16Å; Y448-F451 WeakPolarHBondContact O-CE1 3.43Å; Y448-H457 AromaticContact CE1-CE1 3.78Å; Y448-H457 AromaticContact CE1-ND1 3.65Å; Y448-H457 AromaticContact CZ-ND1 3.72Å; Y448-H457 PolarHBondContact OH-ND1 3.45Å; Y448-K460 HydrophobicContact CD2-CD 4.36Å; Y448-K460 HydrophobicContact CE1-CD 4.02Å; Y448-K460 HydrophobicContact CE2-CB 3.71Å; Y448-K460 HydrophobicContact CE2-CD 3.8Å; Y448-K460 HydrophobicContact CE2-CG 4.37Å; Y448-K460 PolarHBondContact O-NZ 3.26Å
449	E	93.4	Very high	93.5	Very high	100 Å²	100	52.7 Å²	52.7	47%	0.467	24%	0.241	S	C	.	.	H	α-helix	trans	-77.8	-21.1	178.2	-69.8	172.3	164.8	0	0	113.1	K445 R446 M447	K445-E449 WeakPolarHBondContact CE-OE1 3.29Å; K445-E449 HydrophobicContact CG-CG 4.3Å; K445-E449 IonicContact NZ-OE1 2.72Å; K445-E449 WeakPolarHBondContact O-CG 3.49Å; K445-E449 PolarHBondContact O-N 2.83Å; R446-E449 PolarHBondContact O-N 3.03Å; M447-E449 VanDerWaalsContact C-N 3.3Å; M447-E449 PolarHBondContact O-N 2.92Å
450	S	91.8	Very high	93.8	Very high	38 Å²	38	52.1 Å²	52.1	27%	0.266	24%	0.236	S	C	.	.	H	α-helix	trans	-76.4	-35.3	-171.6	69.1	0	0	0	0	114.9	R446 M447 R453	R446-S450 VanDerWaalsContact O-CB 3.24Å; R446-S450 WeakPolarHBondContact O-CB 3.4Å; R446-S450 PolarHBondContact O-N 2.65Å; R446-S450 PolarHBondContact O-OG 3.14Å; M447-S450 PolarHBondContact O-N 3.44Å; M447-S450 VanDerWaalsContact O-N 3.07Å; M447-S450 PolarHBondContact O-OG 3.47Å; S450-R453 PolarHBondContact O-NE 2.68Å; S450-R453 VanDerWaalsContact O-NE 3.09Å
451	F	92.6	Very high	94	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-92.4	149.8	178.9	79.1	-88.7	0	0	0	110.8	S428 F429 Y432 M447 Y448 R453 K460	S428-F451 WeakPolarHBondContact OG-CA 3.4Å; S428-F451 WeakPolarHBondContact OG-CB 3.33Å; F429-F451 HydrophobicContact CB-CB 4.06Å; F429-F451 HydrophobicContact CD2-CB 4.41Å; F429-F451 AromaticContact CD2-CD2 3.52Å; F429-F451 HydrophobicContact CD2-CD2 3.52Å; F429-F451 AromaticContact CD2-CE2 3.89Å; F429-F451 HydrophobicContact CD2-CE2 3.89Å; F429-F451 AromaticContact CD2-CG 3.96Å; F429-F451 HydrophobicContact CD2-CG 3.96Å; F429-F451 AromaticContact CE2-CD2 3.94Å; F429-F451 HydrophobicContact CE2-CD2 3.94Å; F429-F451 AromaticContact CE2-CE2 3.83Å; F429-F451 HydrophobicContact CE2-CE2 3.83Å; F429-F451 HydrophobicContact CE2-CZ 4.49Å; F429-F451 HydrophobicContact CG-CD2 4.15Å; Y432-F451 AromaticContact CD1-CD1 3.96Å; Y432-F451 HydrophobicContact CD1-CD1 3.96Å; Y432-F451 AromaticContact CD1-CE1 3.39Å; Y432-F451 HydrophobicContact CD1-CE1 3.39Å; Y432-F451 HydrophobicContact CD1-CE2 4.44Å; Y432-F451 AromaticContact CD1-CZ 3.69Å; Y432-F451 HydrophobicContact CD1-CZ 3.69Å; Y432-F451 AromaticContact CD2-CD1 3.96Å; Y432-F451 HydrophobicContact CD2-CD1 3.96Å; Y432-F451 AromaticContact CD2-CE1 3.54Å; Y432-F451 HydrophobicContact CD2-CE1 3.54Å; Y432-F451 AromaticContact CE1-CE1 3.57Å; Y432-F451 HydrophobicContact CE1-CE1 3.57Å; Y432-F451 AromaticContact CE1-CZ 3.6Å; Y432-F451 HydrophobicContact CE1-CZ 3.6Å; Y432-F451 AromaticContact CE2-CE1 3.71Å; Y432-F451 HydrophobicContact CE2-CE1 3.71Å; Y432-F451 HydrophobicContact CE2-CZ 4.46Å; Y432-F451 AromaticContact CG-CD1 3.63Å; Y432-F451 HydrophobicContact CG-CD1 3.63Å; Y432-F451 AromaticContact CG-CE1 3.37Å; Y432-F451 HydrophobicContact CG-CE1 3.37Å; Y432-F451 HydrophobicContact CG-CZ 4.16Å; Y432-F451 AromaticContact CZ-CE1 3.72Å; M447-F451 WeakPolarHBondContact O-CD1 3.47Å; Y448-F451 WeakPolarHBondContact O-CE1 3.43Å; F451-R453 PolarHBondContact O-N 2.9Å; F451-K460 HydrophobicContact CE2-CD 4.25Å; F451-K460 HydrophobicContact CE2-CG 4.03Å; F451-K460 HydrophobicContact CZ-CB 4.4Å; F451-K460 HydrophobicContact CZ-CD 3.99Å; F451-K460 HydrophobicContact CZ-CG 4.01Å; F451-K460 VanDerWaalsContact O-CE 3.29Å; F451-K460 WeakPolarHBondContact O-CE 3.32Å; F451-K460 PolarHBondContact O-NZ 2.96Å
452	W	92.4	Very high	94.3	Very high	13 Å²	13	50.5 Å²	50.5	5%	0.049	23%	0.229	C	C	.	.			trans	47.5	59.5	172.8	-74.3	4.4	0	0	0	112.4	L397 I401 F429 Q454 F455 K460 V463	L397-W452 HydrophobicContact CD1-CZ2 4.24Å; L397-W452 HydrophobicContact CD2-CH2 3.92Å; L397-W452 HydrophobicContact CD2-CZ2 3.79Å; L397-W452 HydrophobicContact CG-CH2 4.48Å; L397-W452 HydrophobicContact CG-CZ2 4.31Å; I401-W452 HydrophobicContact CD1-CH2 4.11Å; I401-W452 HydrophobicContact CD1-CZ2 4.47Å; F429-W452 AromaticContact CD1-CE2 3.93Å; F429-W452 AromaticContact CD1-CZ2 3.94Å; F429-W452 HydrophobicContact CD1-CZ2 3.94Å; F429-W452 AromaticContact CD1-NE1 3.87Å; F429-W452 AromaticContact CE1-CE2 3.72Å; F429-W452 AromaticContact CE1-CH2 3.92Å; F429-W452 HydrophobicContact CE1-CH2 3.92Å; F429-W452 AromaticContact CE1-CZ2 3.3Å; F429-W452 HydrophobicContact CE1-CZ2 3.3Å; F429-W452 HydrophobicContact CZ-CH2 4.01Å; F429-W452 AromaticContact CZ-CZ2 3.83Å; F429-W452 HydrophobicContact CZ-CZ2 3.83Å; W452-Q454 PolarHBondContact O-N 2.71Å; W452-F455 HydrophobicContact CB-CB 3.89Å; W452-F455 HydrophobicContact CB-CD2 3.39Å; W452-F455 HydrophobicContact CB-CE2 4.03Å; W452-F455 HydrophobicContact CB-CG 3.73Å; W452-F455 AromaticContact CD1-CE2 3.88Å; W452-F455 HydrophobicContact CD2-CD1 4.01Å; W452-F455 AromaticContact CD2-CD2 4Å; W452-F455 HydrophobicContact CD2-CD2 4Å; W452-F455 HydrophobicContact CD2-CE1 4.04Å; W452-F455 HydrophobicContact CD2-CE2 4.02Å; W452-F455 AromaticContact CD2-CG 3.99Å; W452-F455 HydrophobicContact CD2-CG 3.99Å; W452-F455 HydrophobicContact CD2-CZ 4.04Å; W452-F455 HydrophobicContact CE3-CB 4.27Å; W452-F455 AromaticContact CE3-CD1 3.59Å; W452-F455 HydrophobicContact CE3-CD1 3.59Å; W452-F455 HydrophobicContact CE3-CD2 4.31Å; W452-F455 AromaticContact CE3-CE1 3.89Å; W452-F455 HydrophobicContact CE3-CE1 3.89Å; W452-F455 AromaticContact CE3-CG 3.82Å; W452-F455 HydrophobicContact CE3-CG 3.82Å; W452-F455 HydrophobicContact CE3-CZ 4.38Å; W452-F455 HydrophobicContact CG-CD1 4.46Å; W452-F455 AromaticContact CG-CD2 3.6Å; W452-F455 HydrophobicContact CG-CD2 3.6Å; W452-F455 AromaticContact CG-CE2 3.74Å; W452-F455 HydrophobicContact CG-CE2 3.74Å; W452-F455 AromaticContact CG-CG 3.98Å; W452-F455 HydrophobicContact CG-CG 3.98Å; W452-F455 HydrophobicContact CG-CZ 4.25Å; W452-F455 HydrophobicContact CH2-CE1 4.45Å; W452-F455 HydrophobicContact CZ3-CD1 4.01Å; W452-F455 HydrophobicContact CZ3-CE1 4.07Å; W452-F455 PolarHBondContact O-N 3.36Å; W452-K460 WeakPolarHBondContact O-CE 3.47Å; W452-K460 PolarHBondContact O-NZ 2.94Å; W452-V463 HydrophobicContact CE3-CG2 4.13Å; W452-V463 HydrophobicContact CH2-CG2 3.5Å; W452-V463 HydrophobicContact CZ3-CG2 3.2Å
453	R	91.6	Very high	94.7	Very high	158 Å²	158	47.7 Å²	47.7	60%	0.596	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-28.4	-170	-64.4	-179.9	-169.7	162.5	4	112.5	S450 F451	S450-R453 PolarHBondContact O-NE 2.68Å; S450-R453 VanDerWaalsContact O-NE 3.09Å; F451-R453 PolarHBondContact O-N 2.9Å
454	Q	92.8	Very high	94.9	Very high	61 Å²	61	47.3 Å²	47.3	29%	0.285	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.1	178.7	-61.6	178.3	-10.7	0	0	113.3	M265 V269 W452	M265-Q454 PolarHBondContact O-NE2 3.46Å; V269-Q454 HydrophobicContact CG2-CB 3.93Å; W452-Q454 PolarHBondContact O-N 2.71Å
455	F	94.9	Very high	95.1	Very high	16 Å²	16	44.4 Å²	44.4	7%	0.07	20%	0.197	C	C	.	.	S	Bend	trans	-82.5	152.6	-178.4	-70.6	-113.8	0	0	0	111.4	V269 L272 M386 A387 W452 E459	V269-F455 HydrophobicContact CG2-CD2 4.05Å; V269-F455 HydrophobicContact CG2-CE2 3.54Å; V269-F455 HydrophobicContact CG2-CZ 4.11Å; L272-F455 HydrophobicContact CD2-CZ 4.12Å; M386-F455 HydrophobicContact CG-CE1 3.63Å; M386-F455 HydrophobicContact CG-CZ 3.77Å; M386-F455 HydrophobicContact SD-CZ 4.22Å; A387-F455 HydrophobicContact CB-CG 4.37Å; W452-F455 HydrophobicContact CB-CB 3.89Å; W452-F455 HydrophobicContact CB-CD2 3.39Å; W452-F455 HydrophobicContact CB-CE2 4.03Å; W452-F455 HydrophobicContact CB-CG 3.73Å; W452-F455 AromaticContact CD1-CE2 3.88Å; W452-F455 HydrophobicContact CD2-CD1 4.01Å; W452-F455 AromaticContact CD2-CD2 4Å; W452-F455 HydrophobicContact CD2-CD2 4Å; W452-F455 HydrophobicContact CD2-CE1 4.04Å; W452-F455 HydrophobicContact CD2-CE2 4.02Å; W452-F455 AromaticContact CD2-CG 3.99Å; W452-F455 HydrophobicContact CD2-CG 3.99Å; W452-F455 HydrophobicContact CD2-CZ 4.04Å; W452-F455 HydrophobicContact CE3-CB 4.27Å; W452-F455 AromaticContact CE3-CD1 3.59Å; W452-F455 HydrophobicContact CE3-CD1 3.59Å; W452-F455 HydrophobicContact CE3-CD2 4.31Å; W452-F455 AromaticContact CE3-CE1 3.89Å; W452-F455 HydrophobicContact CE3-CE1 3.89Å; W452-F455 AromaticContact CE3-CG 3.82Å; W452-F455 HydrophobicContact CE3-CG 3.82Å; W452-F455 HydrophobicContact CE3-CZ 4.38Å; W452-F455 HydrophobicContact CG-CD1 4.46Å; W452-F455 AromaticContact CG-CD2 3.6Å; W452-F455 HydrophobicContact CG-CD2 3.6Å; W452-F455 AromaticContact CG-CE2 3.74Å; W452-F455 HydrophobicContact CG-CE2 3.74Å; W452-F455 AromaticContact CG-CG 3.98Å; W452-F455 HydrophobicContact CG-CG 3.98Å; W452-F455 HydrophobicContact CG-CZ 4.25Å; W452-F455 HydrophobicContact CH2-CE1 4.45Å; W452-F455 HydrophobicContact CZ3-CD1 4.01Å; W452-F455 HydrophobicContact CZ3-CE1 4.07Å; W452-F455 PolarHBondContact O-N 3.36Å; F455-E459 HydrophobicContact CB-CB 4.38Å; F455-E459 HydrophobicContact CD1-CB 4.24Å
456	Q	94.6	Very high	95.4	Very high	102 Å²	102	40.1 Å²	40.1	48%	0.477	18%	0.178	S	C	.	.			trans	-72.6	156	179.2	-57.2	-179	26.8	0	0	111.5	A387 S458 E459 K460	A387-Q456 PolarHBondContact O-NE2 3.18Å; Q456-S458 WeakPolarHBondContact CB-OG 3.48Å; Q456-S458 PolarHBondContact O-N 2.85Å; Q456-S458 PolarHBondContact OE1-OG 3.21Å; Q456-E459 HydrophobicContact CB-CG 4.3Å; Q456-E459 WeakPolarHBondContact CB-OE2 3.28Å; Q456-E459 PolarHBondContact N-OE2 3.28Å; Q456-E459 WeakPolarHBondContact O-CB 3.44Å; Q456-E459 PolarHBondContact O-N 2.75Å; Q456-E459 VanDerWaalsContact O-N 3.09Å; Q456-K460 PolarHBondContact O-N 3.45Å; Q456-K460 VanDerWaalsContact O-N 3.16Å
457	H	95.8	Very high	95.6	Very high	42 Å²	42	30.1 Å²	30.1	19%	0.194	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-33.2	173.7	-69.9	-37.4	0	0	0	112.7	I52 E56 Y448 E459 K460 V461	I52-H457 HydrophobicContact CG1-CB 4.21Å; I52-H457 HydrophobicContact CG2-CB 4.02Å; E56-H457 IonicContact OE1-CD2 2.87Å; E56-H457 IonicContact OE2-CD2 2.63Å; E56-H457 PolarHBondContact OE2-CD2 3.33Å; E56-H457 VanDerWaalsContact OE2-CD2 3.27Å; E56-H457 IonicContact OE2-CG 3.64Å; Y448-H457 AromaticContact CE1-CE1 3.78Å; Y448-H457 AromaticContact CE1-ND1 3.65Å; Y448-H457 AromaticContact CZ-ND1 3.72Å; Y448-H457 PolarHBondContact OH-ND1 3.45Å; H457-E459 VanDerWaalsContact C-N 3.31Å; H457-E459 PolarHBondContact O-N 3.36Å; H457-K460 PolarHBondContact O-N 2.89Å; H457-V461 WeakPolarHBondContact O-CG2 3.35Å; H457-V461 PolarHBondContact O-N 2.93Å
458	S	95.7	Very high	95.8	Very high	24 Å²	24	29.1 Å²	29.1	17%	0.168	14%	0.136	C	C	.	.	H	α-helix	trans	-57.1	-43.1	171.5	56	0	0	0	0	111.7	H91 Q456 K460 V461 H462	H91-S458 PolarHBondContact CE1-O 3.49Å; H91-S458 PolarHBondContact NE2-O 3.12Å; Q456-S458 WeakPolarHBondContact CB-OG 3.48Å; Q456-S458 PolarHBondContact O-N 2.85Å; Q456-S458 PolarHBondContact OE1-OG 3.21Å; S458-K460 PolarHBondContact O-N 3.1Å; S458-V461 PolarHBondContact O-N 2.93Å; S458-H462 WeakPolarHBondContact O-CB 3.32Å; S458-H462 PolarHBondContact O-N 3.14Å
459	E	97.5	Very high	96	Very high	21 Å²	21	29.1 Å²	29.1	10%	0.098	14%	0.135	C	C	.	.	H	α-helix	trans	-68.6	-34.5	178.1	-62.4	173.1	107.2	0	0	112	M386 A387 F455 Q456 H457 H462 V463	M386-E459 WeakPolarHBondContact CA-OE1 3.2Å; A387-E459 WeakPolarHBondContact CA-OE2 3.05Å; A387-E459 PolarHBondContact N-OE1 2.86Å; A387-E459 PolarHBondContact N-OE2 2.91Å; F455-E459 HydrophobicContact CB-CB 4.38Å; F455-E459 HydrophobicContact CD1-CB 4.24Å; Q456-E459 HydrophobicContact CB-CG 4.3Å; Q456-E459 WeakPolarHBondContact CB-OE2 3.28Å; Q456-E459 PolarHBondContact N-OE2 3.28Å; Q456-E459 WeakPolarHBondContact O-CB 3.44Å; Q456-E459 PolarHBondContact O-N 2.75Å; Q456-E459 VanDerWaalsContact O-N 3.09Å; H457-E459 VanDerWaalsContact C-N 3.31Å; H457-E459 PolarHBondContact O-N 3.36Å; E459-H462 WeakPolarHBondContact O-CB 3.42Å; E459-H462 PolarHBondContact O-N 2.81Å; E459-V463 WeakPolarHBondContact O-CG2 3.2Å; E459-V463 PolarHBondContact O-N 3.43Å
460	K	97.9	Very high	96.3	Very high	7 Å²	7	24.3 Å²	24.3	3%	0.03	11%	0.113	C	C	.	.	H	α-helix	trans	-68.6	-37.2	172.7	-65.4	-172.4	174.1	-172	0	112.3	Y448 F451 W452 Q456 H457 S458 V463 N464	Y448-K460 HydrophobicContact CD2-CD 4.36Å; Y448-K460 HydrophobicContact CE1-CD 4.02Å; Y448-K460 HydrophobicContact CE2-CB 3.71Å; Y448-K460 HydrophobicContact CE2-CD 3.8Å; Y448-K460 HydrophobicContact CE2-CG 4.37Å; Y448-K460 PolarHBondContact O-NZ 3.26Å; F451-K460 HydrophobicContact CE2-CD 4.25Å; F451-K460 HydrophobicContact CE2-CG 4.03Å; F451-K460 HydrophobicContact CZ-CB 4.4Å; F451-K460 HydrophobicContact CZ-CD 3.99Å; F451-K460 HydrophobicContact CZ-CG 4.01Å; F451-K460 VanDerWaalsContact O-CE 3.29Å; F451-K460 WeakPolarHBondContact O-CE 3.32Å; F451-K460 PolarHBondContact O-NZ 2.96Å; W452-K460 WeakPolarHBondContact O-CE 3.47Å; W452-K460 PolarHBondContact O-NZ 2.94Å; Q456-K460 PolarHBondContact O-N 3.45Å; Q456-K460 VanDerWaalsContact O-N 3.16Å; H457-K460 PolarHBondContact O-N 2.89Å; S458-K460 PolarHBondContact O-N 3.1Å; K460-V463 PolarHBondContact O-N 3.4Å; K460-N464 VanDerWaalsContact O-CG 3.24Å; K460-N464 PolarHBondContact O-N 3.13Å; K460-N464 PolarHBondContact O-ND2 3.48Å
461	V	98.1	Very high	96.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.3	-43.4	171.4	175	0	0	0	0	110.2	I52 V87 F90 F215 H457 S458 V463 N464 L465	I52-V461 HydrophobicContact CD1-CG2 3.59Å; V87-V461 HydrophobicContact CG1-CG1 4.19Å; V87-V461 HydrophobicContact CG1-CG2 3.82Å; F90-V461 HydrophobicContact CB-CG1 4.38Å; F90-V461 HydrophobicContact CD2-CB 4.44Å; F90-V461 HydrophobicContact CD2-CG2 3.96Å; F90-V461 HydrophobicContact CE2-CG2 4.4Å; F215-V461 HydrophobicContact CE2-CG1 4.19Å; F215-V461 HydrophobicContact CZ-CG1 4.2Å; H457-V461 WeakPolarHBondContact O-CG2 3.35Å; H457-V461 PolarHBondContact O-N 2.93Å; S458-V461 PolarHBondContact O-N 2.93Å; V461-V463 VanDerWaalsContact C-N 3.35Å; V461-V463 PolarHBondContact O-N 2.83Å; V461-N464 CarbonylContact O-C 3.49Å; V461-N464 WeakPolarHBondContact O-CA 3.36Å; V461-N464 WeakPolarHBondContact O-CB 3.29Å; V461-N464 PolarHBondContact O-N 3.38Å; V461-L465 WeakPolarHBondContact O-CG 3.22Å; V461-L465 PolarHBondContact O-N 2.83Å
462	H	98.2	Very high	96.9	Very high	21 Å²	21	22.6 Å²	22.6	10%	0.097	10%	0.101	C	C	.	.	H	α-helix	trans	-56.4	-47.4	175.8	-171.4	-174.1	0	0	0	111.9	H91 L381 S458 E459 N464 L465 L466	H91-H462 WeakPolarHBondContact NE2-CA 3.42Å; H91-H462 WeakPolarHBondContact NE2-CB 3.4Å; H91-H462 PolarHBondContact NE2-N 3.4Å; L381-H462 PolarHBondContact O-CE1 3.15Å; L381-H462 PolarHBondContact O-NE2 3.38Å; S458-H462 WeakPolarHBondContact O-CB 3.32Å; S458-H462 PolarHBondContact O-N 3.14Å; E459-H462 WeakPolarHBondContact O-CB 3.42Å; E459-H462 PolarHBondContact O-N 2.81Å; H462-N464 VanDerWaalsContact C-N 3.29Å; H462-N464 PolarHBondContact O-N 3.32Å; H462-L465 WeakPolarHBondContact O-CB 3.28Å; H462-L465 PolarHBondContact O-N 3.41Å; H462-L465 VanDerWaalsContact O-N 3.09Å; H462-L466 PolarHBondContact O-N 2.78Å; H462-L466 VanDerWaalsContact O-N 3.11Å
463	V	97.9	Very high	97.1	Very high	5 Å²	5	22.8 Å²	22.8	3%	0.03	10%	0.102	C	C	.	.	H	α-helix	trans	-57.2	-44.2	172.6	165.7	0	0	0	0	111	I401 F429 W452 E459 K460 V461 L465 L466 L467	I401-V463 HydrophobicContact CD1-CG2 4.22Å; F429-V463 HydrophobicContact CE2-CG1 3.61Å; F429-V463 HydrophobicContact CZ-CG1 3.58Å; F429-V463 HydrophobicContact CZ-CG2 4.1Å; W452-V463 HydrophobicContact CE3-CG2 4.13Å; W452-V463 HydrophobicContact CH2-CG2 3.5Å; W452-V463 HydrophobicContact CZ3-CG2 3.2Å; E459-V463 WeakPolarHBondContact O-CG2 3.2Å; E459-V463 PolarHBondContact O-N 3.43Å; K460-V463 PolarHBondContact O-N 3.4Å; V461-V463 VanDerWaalsContact C-N 3.35Å; V461-V463 PolarHBondContact O-N 2.83Å; V463-L465 PolarHBondContact O-N 3.47Å; V463-L466 WeakPolarHBondContact O-CB 3.42Å; V463-L466 PolarHBondContact O-N 3.22Å; V463-L466 VanDerWaalsContact O-N 3.1Å; V463-L467 HydrophobicContact CG1-CD1 3.7Å; V463-L467 HydrophobicContact CG1-CD2 4.26Å; V463-L467 VanDerWaalsContact O-CD1 3.24Å; V463-L467 WeakPolarHBondContact O-CD1 3.37Å; V463-L467 PolarHBondContact O-N 3.47Å
464	N	98.5	Very high	97.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.6	-29.4	178.7	-66.6	-22	0	0	0	113.1	F215 G218 C219 Y432 M436 K460 V461 H462 M468	F215-N464 HydrophobicContact CD2-CB 3.84Å; F215-N464 HydrophobicContact CE2-CB 4.04Å; G218-N464 VanDerWaalsContact C-ND2 3.32Å; G218-N464 PolarHBondContact O-ND2 3.07Å; C219-N464 PolarHBondContact SG-ND2 2.88Å; Y432-N464 WeakPolarHBondContact CE1-OD1 3.44Å; Y432-N464 PolarHBondContact OH-ND2 2.79Å; Y432-N464 PolarHBondContact OH-OD1 3.49Å; M436-N464 HydrophobicContact CE-CB 3.77Å; M436-N464 VanDerWaalsContact CE-CG 3.41Å; M436-N464 WeakPolarHBondContact CE-OD1 3.44Å; K460-N464 VanDerWaalsContact O-CG 3.24Å; K460-N464 PolarHBondContact O-N 3.13Å; K460-N464 PolarHBondContact O-ND2 3.48Å; V461-N464 CarbonylContact O-C 3.49Å; V461-N464 WeakPolarHBondContact O-CA 3.36Å; V461-N464 WeakPolarHBondContact O-CB 3.29Å; V461-N464 PolarHBondContact O-N 3.38Å; H462-N464 VanDerWaalsContact C-N 3.29Å; H462-N464 PolarHBondContact O-N 3.32Å; N464-M468 WeakPolarHBondContact O-CB 3.03Å; N464-M468 PolarHBondContact O-N 3.3Å; N464-M468 VanDerWaalsContact O-N 3.07Å
465	L	98.6	Very high	97.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.7	-48.1	170.7	-59.1	179.9	0	0	0	111.6	M88 H91 Y94 F215 L381 V461 H462 V463 L467 M468 E469	M88-L465 HydrophobicContact CE-CD2 4.3Å; M88-L465 HydrophobicContact CG-CD2 4.3Å; H91-L465 HydrophobicContact CB-CD1 3.96Å; Y94-L465 HydrophobicContact CD1-CD1 3.62Å; Y94-L465 HydrophobicContact CD1-CD2 3.63Å; Y94-L465 HydrophobicContact CD1-CG 4.19Å; Y94-L465 HydrophobicContact CD2-CD1 4.43Å; Y94-L465 HydrophobicContact CE1-CD1 4.27Å; Y94-L465 HydrophobicContact CE1-CD2 3.47Å; Y94-L465 VanDerWaalsContact CE1-CD2 3.47Å; Y94-L465 HydrophobicContact CE1-CG 4.35Å; Y94-L465 HydrophobicContact CG-CD1 3.74Å; Y94-L465 HydrophobicContact CG-CD2 4.45Å; F215-L465 HydrophobicContact CD2-CD2 3.93Å; F215-L465 HydrophobicContact CE2-CD2 3.43Å; F215-L465 VanDerWaalsContact CE2-CD2 3.43Å; F215-L465 HydrophobicContact CE2-CG 4.22Å; F215-L465 HydrophobicContact CZ-CD2 4.16Å; L381-L465 HydrophobicContact CD2-CD1 4.47Å; V461-L465 WeakPolarHBondContact O-CG 3.22Å; V461-L465 PolarHBondContact O-N 2.83Å; H462-L465 WeakPolarHBondContact O-CB 3.28Å; H462-L465 PolarHBondContact O-N 3.41Å; H462-L465 VanDerWaalsContact O-N 3.09Å; V463-L465 PolarHBondContact O-N 3.47Å; L465-L467 VanDerWaalsContact C-N 3.29Å; L465-L467 PolarHBondContact O-N 2.78Å; L465-M468 HydrophobicContact CD2-CE 4.07Å; L465-M468 PolarHBondContact O-N 3.38Å; L465-E469 WeakPolarHBondContact O-CB 3.19Å; L465-E469 VanDerWaalsContact O-CG 3.3Å; L465-E469 WeakPolarHBondContact O-CG 3.36Å; L465-E469 PolarHBondContact O-N 3.11Å
466	L	98.4	Very high	97.9	Very high	3 Å²	3	11.7 Å²	11.7	2%	0.016	6%	0.057	C	C	.	.	H	α-helix	trans	-57.4	-43.2	175.6	-73.9	167.2	0	0	0	111.7	A378 R398 I401 W402 H462 V463 E469 A470	A378-L466 WeakPolarHBondContact O-CD2 3.32Å; R398-L466 HydrophobicContact CB-CD1 4.15Å; R398-L466 HydrophobicContact CG-CD1 3.83Å; I401-L466 HydrophobicContact CG2-CB 4.48Å; W402-L466 HydrophobicContact CE3-CD2 4.21Å; H462-L466 PolarHBondContact O-N 2.78Å; H462-L466 VanDerWaalsContact O-N 3.11Å; V463-L466 WeakPolarHBondContact O-CB 3.42Å; V463-L466 PolarHBondContact O-N 3.22Å; V463-L466 VanDerWaalsContact O-N 3.1Å; L466-E469 PolarHBondContact O-N 3.2Å; L466-A470 VanDerWaalsContact O-CB 3.27Å; L466-A470 WeakPolarHBondContact O-CB 3.36Å; L466-A470 PolarHBondContact O-N 3.11Å
467	L	98.5	Very high	98.1	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-64.2	-45.5	-179.5	-91.3	54.9	0	0	0	112.2	I401 I405 Y432 I433 M436 V437 V463 L465 R471	I401-L467 HydrophobicContact CG2-CD1 3.31Å; I405-L467 HydrophobicContact CD1-CB 4.1Å; I405-L467 HydrophobicContact CD1-CD1 3.73Å; I405-L467 HydrophobicContact CD1-CG 3.65Å; Y432-L467 HydrophobicContact CE1-CD2 4.26Å; I433-L467 HydrophobicContact CB-CD2 4.27Å; I433-L467 HydrophobicContact CG1-CD1 4.3Å; I433-L467 HydrophobicContact CG1-CD2 4.02Å; I433-L467 HydrophobicContact CG1-CG 4.5Å; I433-L467 HydrophobicContact CG2-CD2 4.22Å; I433-L467 HydrophobicContact CG2-CG 4.2Å; M436-L467 HydrophobicContact CB-CD2 4.46Å; M436-L467 HydrophobicContact CE-CB 3.74Å; M436-L467 HydrophobicContact CE-CD2 3.2Å; M436-L467 HydrophobicContact CE-CG 4.1Å; M436-L467 HydrophobicContact SD-CB 3.72Å; M436-L467 HydrophobicContact SD-CD2 3.73Å; M436-L467 HydrophobicContact SD-CG 4.3Å; V437-L467 HydrophobicContact CG2-CB 4.33Å; V437-L467 HydrophobicContact CG2-CG 4.21Å; V463-L467 HydrophobicContact CG1-CD1 3.7Å; V463-L467 HydrophobicContact CG1-CD2 4.26Å; V463-L467 VanDerWaalsContact O-CD1 3.24Å; V463-L467 WeakPolarHBondContact O-CD1 3.37Å; V463-L467 PolarHBondContact O-N 3.47Å; L465-L467 VanDerWaalsContact C-N 3.29Å; L465-L467 PolarHBondContact O-N 2.78Å; L467-R471 VanDerWaalsContact O-CB 3.24Å; L467-R471 WeakPolarHBondContact O-CB 3.24Å; L467-R471 PolarHBondContact O-N 3.45Å; L467-R471 VanDerWaalsContact O-N 3.11Å
468	M	98.3	Very high	98.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-59.1	-48.8	176.2	178	177	64.6	0	0	110.9	M88 Y94 S211 L212 F215 N464 L465 R471 M472	M88-M468 HydrophobicContact CE-CE 3.86Å; M88-M468 HydrophobicContact CE-SD 4.21Å; Y94-M468 HydrophobicContact CE1-CE 4.02Å; Y94-M468 WeakPolarHBondContact OH-CE 3.39Å; S211-M468 WeakPolarHBondContact CB-O 3.5Å; S211-M468 WeakPolarHBondContact O-CG 3.13Å; L212-M468 HydrophobicContact CB-SD 4.5Å; L212-M468 HydrophobicContact CD1-SD 3.86Å; F215-M468 HydrophobicContact CB-CB 4.43Å; F215-M468 HydrophobicContact CB-CG 4.45Å; F215-M468 HydrophobicContact CB-SD 3.69Å; F215-M468 HydrophobicContact CG-SD 4.22Å; N464-M468 WeakPolarHBondContact O-CB 3.03Å; N464-M468 PolarHBondContact O-N 3.3Å; N464-M468 VanDerWaalsContact O-N 3.07Å; L465-M468 HydrophobicContact CD2-CE 4.07Å; L465-M468 PolarHBondContact O-N 3.38Å; M468-R471 PolarHBondContact O-N 2.87Å; M468-M472 WeakPolarHBondContact O-CB 3.39Å; M468-M472 PolarHBondContact O-N 2.91Å
469	E	98.6	Very high	98.4	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-72	-42.2	-174.2	-68.6	-59.2	131.6	0	0	113.1	Y94 K374 F375 A378 W402 L465 L466 R471 M472 Q473	Y94-E469 HydrophobicContact CE2-CG 4.12Å; Y94-E469 PolarHBondContact OH-OE1 3.13Å; K374-E469 IonicContact NZ-OE1 3.72Å; K374-E469 PolarHBondContact NZ-OE1 3.3Å; K374-E469 IonicContact NZ-OE2 2.77Å; K374-E469 PolarHBondContact NZ-OE2 3.27Å; F375-E469 HydrophobicContact CD1-CB 4.34Å; F375-E469 WeakPolarHBondContact CD1-OE2 3.45Å; F375-E469 VanDerWaalsContact CE1-OE2 3.26Å; F375-E469 WeakPolarHBondContact CE1-OE2 3.3Å; A378-E469 HydrophobicContact CB-CB 3.91Å; A378-E469 HydrophobicContact CB-CG 3.56Å; W402-E469 HydrophobicContact CH2-CB 3.97Å; W402-E469 HydrophobicContact CZ3-CB 3.85Å; L465-E469 WeakPolarHBondContact O-CB 3.19Å; L465-E469 VanDerWaalsContact O-CG 3.3Å; L465-E469 WeakPolarHBondContact O-CG 3.36Å; L465-E469 PolarHBondContact O-N 3.11Å; L466-E469 PolarHBondContact O-N 3.2Å; E469-R471 VanDerWaalsContact C-N 3.33Å; E469-R471 PolarHBondContact O-N 3.09Å; E469-M472 PolarHBondContact O-N 3.05Å; E469-Q473 WeakPolarHBondContact O-CB 3.5Å; E469-Q473 PolarHBondContact O-N 3Å
470	A	98.7	Very high	98.4	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-60.9	-43.3	174.2	0	0	0	0	0	111.4	W402 I405 H406 L466 Q473 A474	W402-A470 HydrophobicContact CD2-CB 3.61Å; W402-A470 HydrophobicContact CE3-CB 3.67Å; W402-A470 HydrophobicContact CG-CB 4.11Å; W402-A470 HydrophobicContact CH2-CB 4.28Å; W402-A470 HydrophobicContact CZ2-CB 4.21Å; W402-A470 HydrophobicContact CZ3-CB 4.02Å; I405-A470 HydrophobicContact CB-CB 4.05Å; I405-A470 HydrophobicContact CD1-CB 3.76Å; I405-A470 HydrophobicContact CG2-CB 3.9Å; H406-A470 PolarHBondContact NE2-O 3.11Å; L466-A470 VanDerWaalsContact O-CB 3.27Å; L466-A470 WeakPolarHBondContact O-CB 3.36Å; L466-A470 PolarHBondContact O-N 3.11Å; A470-Q473 PolarHBondContact O-N 3.3Å; A470-A474 WeakPolarHBondContact O-CB 3.23Å; A470-A474 PolarHBondContact O-N 3.11Å
471	R	98.4	Very high	98.4	Very high	1 Å²	1	4.4 Å²	4.4	0%	0.004	2%	0.019	C	C	.	.	H	α-helix	trans	-60.7	-49.6	175.8	178.9	-179.3	172.5	169.5	6.8	111.4	H128 A172 S214 F409 V437 L467 M468 E469 Q473 A474 E475	H128-R471 PolarHBondContact CE1-NH2 2.92Å; H128-R471 VanDerWaalsContact CE1-NH2 3.33Å; H128-R471 PolarHBondContact NE2-NH1 2.89Å; H128-R471 PolarHBondContact NE2-NH2 3.48Å; A172-R471 PolarHBondContact O-NH2 3.5Å; S214-R471 WeakPolarHBondContact OG-CD 3.39Å; S214-R471 PolarHBondContact OG-NH1 2.79Å; F409-R471 HydrophobicContact CE2-CG 4.23Å; F409-R471 HydrophobicContact CZ-CG 4.13Å; V437-R471 HydrophobicContact CG1-CB 4.28Å; V437-R471 HydrophobicContact CG1-CG 4.17Å; V437-R471 PolarHBondContact O-NE 2.81Å; V437-R471 PolarHBondContact O-NH1 2.65Å; L467-R471 VanDerWaalsContact O-CB 3.24Å; L467-R471 WeakPolarHBondContact O-CB 3.24Å; L467-R471 PolarHBondContact O-N 3.45Å; L467-R471 VanDerWaalsContact O-N 3.11Å; M468-R471 PolarHBondContact O-N 2.87Å; E469-R471 VanDerWaalsContact C-N 3.33Å; E469-R471 PolarHBondContact O-N 3.09Å; R471-Q473 VanDerWaalsContact C-N 3.31Å; R471-Q473 PolarHBondContact O-N 2.06Å; R471-A474 PolarHBondContact O-N 3.12Å; R471-E475 IonicContact CZ-OE1 2.58Å; R471-E475 IonicContact NE-OE1 3.59Å; R471-E475 PolarHBondContact NE-OE1 2.88Å; R471-E475 IonicContact NH2-OE1 2.64Å; R471-E475 PolarHBondContact NH2-OE1 3.39Å; R471-E475 VanDerWaalsContact NH2-OE1 3.12Å; R471-E475 WeakPolarHBondContact O-CG 3.09Å; R471-E475 PolarHBondContact O-N 3.33Å
472	M	98.6	Very high	98.4	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-58.9	-44.3	179.5	-175.1	177.6	177.8	0	0	111.3	V204 H208 L371 K374 F375 M468 E469 E475 L476	V204-M472 HydrophobicContact CG1-CE 4.27Å; H208-M472 HydrophobicContact CB-CE 3.75Å; H208-M472 HydrophobicContact CB-SD 4.23Å; L371-M472 HydrophobicContact CD2-CE 3.52Å; K374-M472 PolarHBondContact NZ-SD 3.23Å; F375-M472 HydrophobicContact CE1-CB 4.32Å; F375-M472 HydrophobicContact CE1-CG 4.36Å; F375-M472 HydrophobicContact CE1-SD 4.43Å; F375-M472 HydrophobicContact CZ-CG 4.37Å; M468-M472 WeakPolarHBondContact O-CB 3.39Å; M468-M472 PolarHBondContact O-N 2.91Å; E469-M472 PolarHBondContact O-N 3.05Å; M472-E475 PolarHBondContact O-N 3.14Å; M472-L476 HydrophobicContact CE-CD1 4.03Å; M472-L476 HydrophobicContact CG-CD1 4.16Å; M472-L476 WeakPolarHBondContact O-CB 3.41Å; M472-L476 WeakPolarHBondContact O-CG 3.41Å; M472-L476 PolarHBondContact O-N 3.05Å
473	Q	98.6	Very high	98.4	Very high	18 Å²	18	3.5 Å²	3.5	8%	0.084	2%	0.016	C	C	.	.	H	α-helix	trans	-62.6	-44.8	178.5	-169.9	179.8	88.5	0	0	111.4	F375 W402 H406 E469 A470 R471 E475 L476 L477	F375-Q473 HydrophobicContact CD1-CB 4.28Å; F375-Q473 HydrophobicContact CE1-CB 3.89Å; F375-Q473 HydrophobicContact CE2-CB 4.44Å; F375-Q473 HydrophobicContact CE2-CG 4.36Å; F375-Q473 HydrophobicContact CZ-CB 3.99Å; F375-Q473 HydrophobicContact CZ-CG 4.39Å; W402-Q473 HydrophobicContact CZ2-CB 4.13Å; H406-Q473 PolarHBondContact CE1-OE1 3.1Å; H406-Q473 VanDerWaalsContact CE1-OE1 3.29Å; E469-Q473 WeakPolarHBondContact O-CB 3.5Å; E469-Q473 PolarHBondContact O-N 3Å; A470-Q473 PolarHBondContact O-N 3.3Å; R471-Q473 VanDerWaalsContact C-N 3.31Å; R471-Q473 PolarHBondContact O-N 2.06Å; Q473-E475 PolarHBondContact O-N 3.31Å; Q473-L476 PolarHBondContact O-N 3.07Å; Q473-L477 HydrophobicContact CG-CD1 4.1Å; Q473-L477 HydrophobicContact CG-CG 4.28Å; Q473-L477 VanDerWaalsContact O-CG 3.26Å; Q473-L477 WeakPolarHBondContact O-CG 3.5Å; Q473-L477 PolarHBondContact O-N 2.98Å
474	A	98.4	Very high	98.3	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-58.8	-47.8	177.3	0	0	0	0	0	112.3	F409 I411 A470 R471 L476 L477 Y478	F409-A474 HydrophobicContact CB-CB 4.17Å; F409-A474 HydrophobicContact CD2-CB 3.91Å; F409-A474 HydrophobicContact CG-CB 4.06Å; I411-A474 HydrophobicContact CD1-CB 3.75Å; A470-A474 WeakPolarHBondContact O-CB 3.23Å; A470-A474 PolarHBondContact O-N 3.11Å; R471-A474 PolarHBondContact O-N 3.12Å; A474-L476 PolarHBondContact O-N 2.88Å; A474-L477 PolarHBondContact O-N 2.92Å; A474-Y478 VanDerWaalsContact O-CD2 3.27Å; A474-Y478 WeakPolarHBondContact O-CD2 3.21Å; A474-Y478 PolarHBondContact O-N 3.03Å
475	E	98.5	Very high	98.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.2	-43.7	177.7	-65.9	-177.8	-158.9	0	0	111.7	L171 P175 T207 H210 R471 M472 Q473 Y478 A479	L171-E475 VanDerWaalsContact O-CD 3.26Å; L171-E475 WeakPolarHBondContact O-CG 3.45Å; P175-E475 HydrophobicContact CB-CG 4.36Å; P175-E475 HydrophobicContact CG-CG 4.26Å; T207-E475 HydrophobicContact CG2-CB 3.52Å; H210-E475 IonicContact CE1-OE2 3.9Å; H210-E475 IonicContact CG-OE2 3.96Å; H210-E475 IonicContact ND1-OE2 3.53Å; H210-E475 PolarHBondContact ND1-OE2 3.43Å; R471-E475 IonicContact CZ-OE1 2.58Å; R471-E475 IonicContact NE-OE1 3.59Å; R471-E475 PolarHBondContact NE-OE1 2.88Å; R471-E475 IonicContact NH2-OE1 2.64Å; R471-E475 PolarHBondContact NH2-OE1 3.39Å; R471-E475 VanDerWaalsContact NH2-OE1 3.12Å; R471-E475 WeakPolarHBondContact O-CG 3.09Å; R471-E475 PolarHBondContact O-N 3.33Å; M472-E475 PolarHBondContact O-N 3.14Å; Q473-E475 PolarHBondContact O-N 3.31Å; E475-Y478 PolarHBondContact O-N 3.28Å; E475-A479 PolarHBondContact O-N 3.01Å
476	L	98.3	Very high	98.1	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	6%	0.063	C	C	.	.	H	α-helix	trans	-63.3	-44.2	177.1	-78.6	176.8	0	0	0	112.5	V203 V204 T207 L371 F375 M472 Q473 A474 Y478 A479 L480	V203-L476 HydrophobicContact CG1-CD2 3.69Å; V204-L476 HydrophobicContact CG2-CD2 4.23Å; T207-L476 HydrophobicContact CG2-CD2 4.01Å; T207-L476 HydrophobicContact CG2-CG 4.11Å; T207-L476 WeakPolarHBondContact OG1-CD2 3.09Å; L371-L476 HydrophobicContact CD1-CD1 4.16Å; F375-L476 HydrophobicContact CE2-CD1 4.37Å; F375-L476 HydrophobicContact CZ-CD1 3.91Å; M472-L476 HydrophobicContact CE-CD1 4.03Å; M472-L476 HydrophobicContact CG-CD1 4.16Å; M472-L476 WeakPolarHBondContact O-CB 3.41Å; M472-L476 WeakPolarHBondContact O-CG 3.41Å; M472-L476 PolarHBondContact O-N 3.05Å; Q473-L476 PolarHBondContact O-N 3.07Å; A474-L476 PolarHBondContact O-N 2.88Å; L476-Y478 VanDerWaalsContact C-N 3.3Å; L476-Y478 PolarHBondContact O-N 2.84Å; L476-A479 PolarHBondContact O-N 3.1Å; L476-A479 VanDerWaalsContact O-N 3.12Å; L476-L480 HydrophobicContact CB-CD1 4.33Å; L476-L480 WeakPolarHBondContact O-CB 3.46Å; L476-L480 WeakPolarHBondContact O-CG 3.32Å; L476-L480 PolarHBondContact O-N 3.07Å
477	L	98.5	Very high	97.9	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-59.2	-42.4	-179	-73.3	172.9	0	0	0	111.6	F345 Y350 W352 I411 Q473 A474 R481	F345-L477 HydrophobicContact CE1-CB 4.03Å; F345-L477 HydrophobicContact CZ-CB 4.41Å; Y350-L477 HydrophobicContact CD1-CD2 4.21Å; Y350-L477 HydrophobicContact CE1-CD2 4.4Å; W352-L477 HydrophobicContact CB-CD2 4.13Å; I411-L477 HydrophobicContact CD1-CD1 4.33Å; Q473-L477 HydrophobicContact CG-CD1 4.1Å; Q473-L477 HydrophobicContact CG-CG 4.28Å; Q473-L477 VanDerWaalsContact O-CG 3.26Å; Q473-L477 WeakPolarHBondContact O-CG 3.5Å; Q473-L477 PolarHBondContact O-N 2.98Å; A474-L477 PolarHBondContact O-N 2.92Å; L477-R481 WeakPolarHBondContact O-CB 3.34Å; L477-R481 PolarHBondContact O-N 3.07Å
478	Y	98.5	Very high	97.5	Very high	1 Å²	1	25 Å²	25	0%	0.004	12%	0.121	C	C	.	.	H	α-helix	trans	-63.3	-43.3	174.7	-79.9	-64.7	0	0	0	112.7	P175 W176 F335 F345 F409 I411 A474 E475 L476 A482	P175-Y478 HydrophobicContact CB-CD2 3.78Å; P175-Y478 HydrophobicContact CB-CG 4.2Å; P175-Y478 HydrophobicContact CG-CD2 3.94Å; P175-Y478 HydrophobicContact CG-CE2 4.39Å; P175-Y478 WeakPolarHBondContact O-CB 3.36Å; W176-Y478 HydrophobicContact CB-CD1 4.21Å; W176-Y478 HydrophobicContact CB-CE1 3.63Å; W176-Y478 HydrophobicContact CB-CE2 4.09Å; F335-Y478 WeakPolarHBondContact CE2-OH 3.07Å; F345-Y478 HydrophobicContact CB-CE1 4.17Å; F345-Y478 HydrophobicContact CD1-CD1 4.08Å; F345-Y478 AromaticContact CD1-CE1 3.48Å; F345-Y478 HydrophobicContact CD1-CE1 3.48Å; F345-Y478 VanDerWaalsContact CD1-CE1 3.48Å; F345-Y478 HydrophobicContact CD1-CE2 4.17Å; F345-Y478 AromaticContact CD1-CZ 3.54Å; F345-Y478 HydrophobicContact CE1-CD1 4.41Å; F345-Y478 HydrophobicContact CE1-CE1 4.23Å; F345-Y478 HydrophobicContact CG-CE1 4.16Å; F409-Y478 HydrophobicContact CB-CE2 4.33Å; F409-Y478 WeakPolarHBondContact O-CE2 3.32Å; F409-Y478 PolarHBondContact O-OH 3.2Å; I411-Y478 HydrophobicContact CD1-CE2 4.04Å; I411-Y478 HydrophobicContact CG1-CE2 3.99Å; A474-Y478 VanDerWaalsContact O-CD2 3.27Å; A474-Y478 WeakPolarHBondContact O-CD2 3.21Å; A474-Y478 PolarHBondContact O-N 3.03Å; E475-Y478 PolarHBondContact O-N 3.28Å; L476-Y478 VanDerWaalsContact C-N 3.3Å; L476-Y478 PolarHBondContact O-N 2.84Å; Y478-A482 PolarHBondContact O-N 3.42Å
479	A	98.4	Very high	97.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-50.1	177.2	0	0	0	0	0	112.6	L171 L178 V203 E475 L476 R481 A482 I483	L171-A479 HydrophobicContact CD2-CB 3.96Å; L178-A479 HydrophobicContact CD2-CB 3.88Å; V203-A479 HydrophobicContact CG1-CB 3.6Å; E475-A479 PolarHBondContact O-N 3.01Å; L476-A479 PolarHBondContact O-N 3.1Å; L476-A479 VanDerWaalsContact O-N 3.12Å; A479-R481 VanDerWaalsContact C-N 3.33Å; A479-R481 PolarHBondContact O-N 3.4Å; A479-A482 WeakPolarHBondContact O-CB 3.49Å; A479-A482 PolarHBondContact O-N 3.11Å; A479-A482 VanDerWaalsContact O-N 3.16Å; A479-I483 WeakPolarHBondContact O-CG1 3.35Å; A479-I483 PolarHBondContact O-N 3.31Å
480	L	98.4	Very high	97.4	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-65.7	-37.4	-178.1	-65.2	173.3	0	0	0	111.2	I200 Y350 W352 L359 V360 L476 I483 T484	I200-L480 HydrophobicContact CD1-CD2 3.46Å; I200-L480 VanDerWaalsContact CD1-CD2 3.46Å; Y350-L480 HydrophobicContact CE1-CB 3.86Å; Y350-L480 VanDerWaalsContact OH-C 3.28Å; Y350-L480 WeakPolarHBondContact OH-CB 3.32Å; Y350-L480 PolarHBondContact OH-O 3.3Å; W352-L480 HydrophobicContact CE3-CD1 4.37Å; W352-L480 HydrophobicContact CZ3-CD1 3.99Å; L359-L480 HydrophobicContact CD2-CB 3.98Å; L359-L480 HydrophobicContact CD2-CD2 3.82Å; L359-L480 HydrophobicContact CD2-CG 4.49Å; L359-L480 WeakPolarHBondContact CD2-O 3.13Å; L359-L480 HydrophobicContact CG-CD2 4.34Å; V360-L480 HydrophobicContact CG2-CD1 3.73Å; V360-L480 HydrophobicContact CG2-CD2 3.65Å; V360-L480 HydrophobicContact CG2-CG 4.36Å; L476-L480 HydrophobicContact CB-CD1 4.33Å; L476-L480 WeakPolarHBondContact O-CB 3.46Å; L476-L480 WeakPolarHBondContact O-CG 3.32Å; L476-L480 PolarHBondContact O-N 3.07Å; L480-I483 PolarHBondContact O-N 2.98Å; L480-T484 WeakPolarHBondContact O-CB 3.46Å; L480-T484 PolarHBondContact O-N 3.32Å; L480-T484 PolarHBondContact O-OG1 3.24Å; L480-T484 VanDerWaalsContact O-OG1 3.07Å
481	R	97.9	Very high	97.3	Very high	39 Å²	39	29.1 Å²	29.1	15%	0.147	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-43.2	172.4	-169.7	-176.7	77.2	-176.3	4.3	111.7	Y350 L477 A479 T484 R485	Y350-R481 HydrophobicContact CD1-CB 3.9Å; Y350-R481 HydrophobicContact CD1-CG 4.41Å; Y350-R481 HydrophobicContact CD2-CB 4.18Å; Y350-R481 HydrophobicContact CD2-CG 4.03Å; Y350-R481 HydrophobicContact CE1-CB 4.11Å; Y350-R481 HydrophobicContact CE2-CB 4.34Å; Y350-R481 HydrophobicContact CG-CB 3.96Å; Y350-R481 HydrophobicContact CG-CG 3.96Å; L477-R481 WeakPolarHBondContact O-CB 3.34Å; L477-R481 PolarHBondContact O-N 3.07Å; A479-R481 VanDerWaalsContact C-N 3.33Å; A479-R481 PolarHBondContact O-N 3.4Å; R481-T484 PolarHBondContact O-N 2.85Å; R481-R485 WeakPolarHBondContact O-CB 3.47Å; R481-R485 WeakPolarHBondContact O-CG 3.4Å; R481-R485 PolarHBondContact O-N 2.96Å
482	A	97.8	Very high	97.2	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-40.2	176.5	0	0	0	0	0	111.9	L178 I183 Y478 A479 R485 Y486	L178-A482 HydrophobicContact CG-CB 4.1Å; I183-A482 HydrophobicContact CD1-CB 4.31Å; I183-A482 HydrophobicContact CG1-CB 3.94Å; Y478-A482 PolarHBondContact O-N 3.42Å; A479-A482 WeakPolarHBondContact O-CB 3.49Å; A479-A482 PolarHBondContact O-N 3.11Å; A479-A482 VanDerWaalsContact O-N 3.16Å; A482-R485 PolarHBondContact O-N 3.02Å; A482-Y486 PolarHBondContact O-N 3.28Å; A482-Y486 VanDerWaalsContact O-N 3.14Å
483	I	97.9	Very high	97.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-47	175	-67.3	167.2	0	0	0	110.6	I183 L196 L199 I200 L359 L363 A479 L480 R485 Y486 M487	I183-I483 HydrophobicContact CD1-CG1 3.79Å; I183-I483 HydrophobicContact CG1-CG1 4.11Å; I183-I483 HydrophobicContact CG2-CG1 4.16Å; L196-I483 HydrophobicContact CD2-CG2 4.02Å; L199-I483 HydrophobicContact CD2-CD1 4.4Å; L199-I483 HydrophobicContact CD2-CG1 4.46Å; L199-I483 HydrophobicContact CG-CD1 4.49Å; I200-I483 HydrophobicContact CD1-CD1 3.61Å; I200-I483 HydrophobicContact CG1-CD1 4.46Å; L359-I483 HydrophobicContact CD2-CB 4.31Å; L359-I483 HydrophobicContact CD2-CG2 4.1Å; L363-I483 HydrophobicContact CD1-CG2 4.43Å; A479-I483 WeakPolarHBondContact O-CG1 3.35Å; A479-I483 PolarHBondContact O-N 3.31Å; L480-I483 PolarHBondContact O-N 2.98Å; I483-R485 VanDerWaalsContact C-N 3.31Å; I483-R485 PolarHBondContact O-N 3.33Å; I483-Y486 WeakPolarHBondContact O-CB 3.44Å; I483-Y486 PolarHBondContact O-N 3.34Å; I483-M487 HydrophobicContact CG2-CG 4.4Å; I483-M487 HydrophobicContact CG2-SD 4.07Å; I483-M487 WeakPolarHBondContact O-CG 3.36Å; I483-M487 PolarHBondContact O-N 3.14Å
484	T	97.4	Very high	97.1	Very high	41 Å²	41	33.7 Å²	33.7	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-58.1	-43.7	176.8	-64	0	0	0	0	111.8	Y350 L359 L480 R481 Y486 M487 T488	Y350-T484 HydrophobicContact CE2-CG2 4.22Å; Y350-T484 PolarHBondContact OH-OG1 3.15Å; Y350-T484 VanDerWaalsContact OH-OG1 3.07Å; L359-T484 WeakPolarHBondContact CD2-OG1 3.49Å; L480-T484 WeakPolarHBondContact O-CB 3.46Å; L480-T484 PolarHBondContact O-N 3.32Å; L480-T484 PolarHBondContact O-OG1 3.24Å; L480-T484 VanDerWaalsContact O-OG1 3.07Å; R481-T484 PolarHBondContact O-N 2.85Å; T484-Y486 PolarHBondContact O-N 3.37Å; T484-M487 PolarHBondContact O-N 3.39Å; T484-M487 VanDerWaalsContact O-N 3.14Å; T484-T488 PolarHBondContact O-N 3.21Å; T484-T488 VanDerWaalsContact O-N 3.13Å; T484-T488 PolarHBondContact O-OG1 3.46Å
485	R	96.4	Very high	97	Very high	135 Å²	135	36.1 Å²	36.1	51%	0.509	18%	0.175	S	C	.	.	H	α-helix	trans	-66.7	-17.8	176.2	-73.8	177.6	178.3	-176	-0.1	114.5	K180 R481 A482 I483	K180-R485 HydrophobicContact CB-CB 4.23Å; R481-R485 WeakPolarHBondContact O-CB 3.47Å; R481-R485 WeakPolarHBondContact O-CG 3.4Å; R481-R485 PolarHBondContact O-N 2.96Å; A482-R485 PolarHBondContact O-N 3.02Å; I483-R485 VanDerWaalsContact C-N 3.31Å; I483-R485 PolarHBondContact O-N 3.33Å
486	Y	96.4	Very high	96.8	Very high	66 Å²	66	38.8 Å²	38.8	26%	0.259	19%	0.189	S	C	.	.	H	α-helix	trans	-84.7	-35.8	171.4	164.4	-99.5	0	0	0	111.5	I183 E184 L187 A482 I483 T484 T488	I183-Y486 HydrophobicContact CB-CG 4.43Å; I183-Y486 HydrophobicContact CG2-CD1 3.98Å; I183-Y486 HydrophobicContact CG2-CG 3.91Å; E184-Y486 HydrophobicContact CB-CD2 4.37Å; E184-Y486 HydrophobicContact CB-CE2 4.35Å; E184-Y486 HydrophobicContact CG-CD2 3.28Å; E184-Y486 HydrophobicContact CG-CE2 3.49Å; E184-Y486 VanDerWaalsContact CG-CE2 3.49Å; E184-Y486 HydrophobicContact CG-CG 4.45Å; L187-Y486 HydrophobicContact CB-CE1 4.48Å; L187-Y486 HydrophobicContact CD1-CD1 3.54Å; L187-Y486 HydrophobicContact CD1-CE1 3.1Å; L187-Y486 HydrophobicContact CD1-CG 4.42Å; L187-Y486 HydrophobicContact CG-CE1 4.38Å; A482-Y486 PolarHBondContact O-N 3.28Å; A482-Y486 VanDerWaalsContact O-N 3.14Å; I483-Y486 WeakPolarHBondContact O-CB 3.44Å; I483-Y486 PolarHBondContact O-N 3.34Å; T484-Y486 PolarHBondContact O-N 3.37Å; Y486-T488 VanDerWaalsContact C-N 3.27Å; Y486-T488 PolarHBondContact O-N 2.88Å
487	M	93.8	Very high	96.7	Very high	68 Å²	68	42 Å²	42	34%	0.335	20%	0.204	S	C	.	.	H	α-helix	trans	-76.1	-15.6	-179.3	-64.6	-176.8	75.2	0	0	113.8	L196 L359 R362 L363 I483 T484	L196-M487 HydrophobicContact CD1-CE 3.76Å; L196-M487 HydrophobicContact CD1-CG 4.36Å; L196-M487 HydrophobicContact CD1-SD 4.08Å; L196-M487 HydrophobicContact CD2-SD 4.49Å; L359-M487 HydrophobicContact CD1-SD 3.99Å; R362-M487 VanDerWaalsContact NH1-CE 3.3Å; R362-M487 VanDerWaalsContact NH2-CE 3.29Å; L363-M487 HydrophobicContact CD1-SD 4.43Å; I483-M487 HydrophobicContact CG2-CG 4.4Å; I483-M487 HydrophobicContact CG2-SD 4.07Å; I483-M487 WeakPolarHBondContact O-CG 3.36Å; I483-M487 PolarHBondContact O-N 3.14Å; T484-M487 PolarHBondContact O-N 3.39Å; T484-M487 VanDerWaalsContact O-N 3.14Å
488	T	89.1	Confident	96.6	Very high	148 Å²	148	45.5 Å²	45.5	91%	0.908	22%	0.221	S	C	*	.			trans	-109.4	0	178.3	49.8	0	0	0	0	109.6	T484 Y486	T484-T488 PolarHBondContact O-N 3.21Å; T484-T488 VanDerWaalsContact O-N 3.13Å; T484-T488 PolarHBondContact O-OG1 3.46Å; Y486-T488 VanDerWaalsContact C-N 3.27Å; Y486-T488 PolarHBondContact O-N 2.88Å

Retrieved 488 of 488 residues in 594 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).