A0A077Z0Z5_TRITR Loading...

Glypican 6

AlphaFold DB , UniProt , Accession A0A077Z0Z5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 722 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	27.7	Very low	244 Å²	244	141.5 Å²	141.5	100%	1.202	82%	0.819	S	S	*	*				0	92.2	0	-80	-176.9	175.6	0	0	108.4
2	V	32.5	Very low	27.4	Very low	130 Å²	130	140.4 Å²	140.4	79%	0.788	82%	0.816	S	S	*	*			trans	-143.8	105.5	150.5	-179.9	0	0	0	0	104.1
3	D	33	Very low	27.2	Very low	150 Å²	150	145.4 Å²	145.4	80%	0.802	81%	0.813	S	S	*	*			trans	175.1	99.5	135.4	-90.1	-21.2	0	0	0	109.8
4	S	29.5	Very low	27.2	Very low	106 Å²	106	150.4 Å²	150.4	74%	0.741	81%	0.813	S	S	*	*				29.2	120.5	123.2	-48.2	0	0	0	0	119.7
5	F	23.9	Very low	26.9	Very low	206 Å²	206	153.3 Å²	153.3	90%	0.904	82%	0.823	S	S	*	*			trans	-41.5	148.6	158	-81.8	-96.5	0	0	0	114.2
6	P	31.4	Very low	27.2	Very low	109 Å²	109	149.7 Å²	149.7	71%	0.708	82%	0.82	S	S	*	*				-149.1	145.1	103.1	37.9	-20.4	0	0	0	117.3
7	T	23.5	Very low	27.7	Very low	113 Å²	113	148.1 Å²	148.1	69%	0.693	82%	0.819	S	S	*	*			trans	50.3	118.2	139	57.6	0	0	0	0	124.4
8	I	22.6	Very low	27.6	Very low	149 Å²	149	147.1 Å²	147.1	76%	0.764	81%	0.811	S	S	*	*				50.2	114.8	123.7	-46.7	170.8	0	0	0	118.5
9	K	25.9	Very low	28.3	Very low	201 Å²	201	144.3 Å²	144.3	87%	0.874	80%	0.801	S	S	*	*				176.4	122.7	117.9	-97.8	173.4	-174.4	175.1	0	112.2
10	G	24.5	Very low	28.8	Very low	83 Å²	83	142.5 Å²	142.5	86%	0.856	79%	0.794	S	S	*	*				70.1	121.2	127.2	0	0	0	0	0	120.2
11	G	24.3	Very low	29.6	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	79%	0.785	S	S	*	*				113.4	97.1	124.1	0	0	0	0	0	118.1
12	T	24.1	Very low	30.1	Very low	128 Å²	128	133.9 Å²	133.9	79%	0.785	76%	0.757	S	S	*	*			trans	70.1	116.7	133.4	46.9	0	0	0	0	121.4
13	R	24.5	Very low	30.8	Very low	205 Å²	205	133.2 Å²	133.2	77%	0.774	75%	0.748	S	S	*	*				103.4	123.6	120.6	-82.6	178	-172.7	-156.2	2.5	119.3
14	R	27	Very low	31.3	Very low	216 Å²	216	131.1 Å²	131.1	82%	0.815	74%	0.737	S	S	*	*			trans	79.6	98.8	152.2	-64	174.3	-175.6	-174.1	1.2	115
15	M	23	Very low	32	Very low	194 Å²	194	134.5 Å²	134.5	96%	0.956	73%	0.734	S	S	*	*				41.4	95.7	75.6	-78	-170.7	178.1	0	0	114.3
16	A	31.3	Very low	32.8	Very low	95 Å²	95	127.9 Å²	127.9	79%	0.785	71%	0.713	S	S	*	*			trans	-170.9	153.2	145.3	0	0	0	0	0	109
17	P	35.3	Very low	33.4	Very low	123 Å²	123	127.6 Å²	127.6	80%	0.799	70%	0.702	S	S	*	*			trans	-101.7	136.2	-133.5	36.1	-33.3	0	0	0	114.8
18	L	26.7	Very low	34.4	Very low	130 Å²	130	126.1 Å²	126.1	68%	0.681	69%	0.69	S	S	*	*			trans	-75.9	141.9	137.6	-78.2	102.7	0	0	0	106.6	L22	L18-L22 HydrophobicContact CD2-CD1 3.78Å; L18-L22 HydrophobicContact CD2-CG 4.46Å
19	P	40.1	Very low	35.6	Very low	93 Å²	93	123.1 Å²	123.1	60%	0.604	68%	0.679	S	S	*	*				-157.6	119.7	62.5	36.1	-12.5	0	0	0	115.8
20	V	39.2	Very low	36.6	Very low	109 Å²	109	117.1 Å²	117.1	66%	0.661	66%	0.655	S	S	*	*	S	Bend	trans	-139.1	-31.9	153.4	-174.2	0	0	0	0	111.6	L22 L23 L24	V20-L22 VanDerWaalsContact C-N 3.35Å; V20-L22 PolarHBondContact O-N 3.47Å; V20-L23 PolarHBondContact O-N 3.02Å; V20-L24 PolarHBondContact O-N 3.34Å
21	S	45.9	Very low	37.3	Very low	88 Å²	88	118.4 Å²	118.4	62%	0.615	64%	0.642	S	S	*	*	H	α-helix	trans	-70.1	-24.7	-177.7	-55.9	0	0	0	0	115	Y25	S21-Y25 PolarHBondContact O-N 2.95Å
22	L	44.6	Very low	38.1	Very low	117 Å²	117	122.7 Å²	122.7	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-73.7	-29.5	176.5	-87.7	158.7	0	0	0	112.8	L18 V20 C26	L18-L22 HydrophobicContact CD2-CD1 3.78Å; L18-L22 HydrophobicContact CD2-CG 4.46Å; V20-L22 VanDerWaalsContact C-N 3.35Å; V20-L22 PolarHBondContact O-N 3.47Å; L22-C26 WeakPolarHBondContact O-CB 3.48Å; L22-C26 PolarHBondContact O-N 2.64Å
23	L	46.1	Very low	38.7	Very low	116 Å²	116	118.7 Å²	118.7	61%	0.607	63%	0.626	S	S	*	*	H	α-helix	trans	-73.5	-34	175.9	-78.6	165.3	0	0	0	111.6	V20 C26 Q27	V20-L23 PolarHBondContact O-N 3.02Å; L23-C26 PolarHBondContact O-N 3.27Å; L23-Q27 WeakPolarHBondContact O-CB 3.39Å; L23-Q27 VanDerWaalsContact O-CG 3.31Å; L23-Q27 WeakPolarHBondContact O-CG 3.14Å; L23-Q27 PolarHBondContact O-N 2.94Å
24	L	44.6	Very low	39.2	Very low	106 Å²	106	118.1 Å²	118.1	56%	0.555	62%	0.624	S	S	*	*	H	α-helix	trans	-69.1	-39.9	174.6	-80.8	162.5	0	0	0	112.1	V20 C26 Q27 L28	V20-L24 PolarHBondContact O-N 3.34Å; L24-C26 VanDerWaalsContact C-N 3.33Å; L24-C26 PolarHBondContact O-N 3.44Å; L24-Q27 PolarHBondContact O-N 3.32Å; L24-L28 WeakPolarHBondContact O-CB 3.42Å; L24-L28 WeakPolarHBondContact O-CD1 3.39Å; L24-L28 PolarHBondContact O-N 3.38Å
25	Y	43.3	Very low	39.5	Very low	177 Å²	177	115 Å²	115	69%	0.694	62%	0.622	S	S	*	*	H	α-helix	trans	-64.7	-38.4	173.1	-104.4	-86.5	0	0	0	112.1	S21 L28 T29	S21-Y25 PolarHBondContact O-N 2.95Å; Y25-L28 PolarHBondContact O-N 3.03Å; Y25-T29 PolarHBondContact O-N 3.44Å; Y25-T29 PolarHBondContact O-OG1 3.32Å
26	C	41.6	Very low	40.1	Very low	67 Å²	67	109.5 Å²	109.5	45%	0.453	61%	0.608	S	S	.	*	H	α-helix	trans	-68.8	-39.9	178.6	-147	0	0	0	0	112	L22 L23 L24 T29 I30	L22-C26 WeakPolarHBondContact O-CB 3.48Å; L22-C26 PolarHBondContact O-N 2.64Å; L23-C26 PolarHBondContact O-N 3.27Å; L24-C26 VanDerWaalsContact C-N 3.33Å; L24-C26 PolarHBondContact O-N 3.44Å; C26-T29 VanDerWaalsContact CA-OG1 3.29Å; C26-T29 WeakPolarHBondContact CA-OG1 3.24Å; C26-T29 PolarHBondContact O-N 3.47Å; C26-T29 PolarHBondContact O-OG1 2.98Å; C26-I30 WeakPolarHBondContact O-CB 3.12Å; C26-I30 WeakPolarHBondContact O-CD1 3.4Å; C26-I30 WeakPolarHBondContact O-CG1 3.45Å; C26-I30 PolarHBondContact O-N 2.86Å
27	Q	44.2	Very low	40.2	Very low	103 Å²	103	111.7 Å²	111.7	48%	0.481	61%	0.605	S	S	.	*	H	α-helix	trans	-68.5	-37.1	174.4	-69.7	-64.3	-36.7	0	0	112.2	L23 L24 I30 L31	L23-Q27 WeakPolarHBondContact O-CB 3.39Å; L23-Q27 VanDerWaalsContact O-CG 3.31Å; L23-Q27 WeakPolarHBondContact O-CG 3.14Å; L23-Q27 PolarHBondContact O-N 2.94Å; L24-Q27 PolarHBondContact O-N 3.32Å; Q27-I30 PolarHBondContact O-N 3.46Å; Q27-L31 WeakPolarHBondContact O-CB 3.35Å; Q27-L31 PolarHBondContact O-N 3.25Å
28	L	43.1	Very low	40	Very low	83 Å²	83	108.5 Å²	108.5	44%	0.435	59%	0.594	S	S	.	*	H	α-helix	trans	-65.8	-39.3	172.3	-88.3	149.7	0	0	0	111.6	L24 Y25 I30 L31 F32	L24-L28 WeakPolarHBondContact O-CB 3.42Å; L24-L28 WeakPolarHBondContact O-CD1 3.39Å; L24-L28 PolarHBondContact O-N 3.38Å; Y25-L28 PolarHBondContact O-N 3.03Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-I30 PolarHBondContact O-N 3.45Å; L28-L31 PolarHBondContact O-N 2.99Å; L28-F32 HydrophobicContact CB-CD2 4.47Å; L28-F32 HydrophobicContact CD2-CD2 3.84Å; L28-F32 HydrophobicContact CD2-CE2 3.42Å; L28-F32 VanDerWaalsContact CD2-CE2 3.42Å; L28-F32 VanDerWaalsContact O-CB 3.28Å; L28-F32 WeakPolarHBondContact O-CB 3.38Å; L28-F32 VanDerWaalsContact O-CD2 3.22Å; L28-F32 WeakPolarHBondContact O-CD2 3.49Å; L28-F32 PolarHBondContact O-N 2.87Å
29	T	48.2	Very low	40.2	Very low	86 Å²	86	111.4 Å²	111.4	53%	0.528	60%	0.602	S	S	.	*	H	α-helix	trans	-70.7	-26.6	173.2	47.2	0	0	0	0	113.5	Y25 C26 G33	Y25-T29 PolarHBondContact O-N 3.44Å; Y25-T29 PolarHBondContact O-OG1 3.32Å; C26-T29 VanDerWaalsContact CA-OG1 3.29Å; C26-T29 WeakPolarHBondContact CA-OG1 3.24Å; C26-T29 PolarHBondContact O-N 3.47Å; C26-T29 PolarHBondContact O-OG1 2.98Å; T29-G33 WeakPolarHBondContact O-CA 3.35Å; T29-G33 PolarHBondContact O-N 3.43Å
30	I	48.1	Very low	39.6	Very low	75 Å²	75	110.5 Å²	110.5	39%	0.385	61%	0.609	S	S	.	*	H	α-helix	trans	-79	-36	174.3	-67.2	163.7	0	0	0	110.7	C26 Q27 L28 R34	C26-I30 WeakPolarHBondContact O-CB 3.12Å; C26-I30 WeakPolarHBondContact O-CD1 3.4Å; C26-I30 WeakPolarHBondContact O-CG1 3.45Å; C26-I30 PolarHBondContact O-N 2.86Å; Q27-I30 PolarHBondContact O-N 3.46Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-I30 PolarHBondContact O-N 3.45Å; I30-R34 VanDerWaalsContact O-CB 3.32Å; I30-R34 WeakPolarHBondContact O-CB 3.48Å; I30-R34 WeakPolarHBondContact O-CG 3.09Å; I30-R34 PolarHBondContact O-N 2.92Å
31	L	38.7	Very low	39.1	Very low	109 Å²	109	114 Å²	114	57%	0.571	62%	0.615	S	S	*	*	H	α-helix	trans	-73.5	-39.9	175.2	-83.9	156.8	0	0	0	112.3	Q27 L28 L35	Q27-L31 WeakPolarHBondContact O-CB 3.35Å; Q27-L31 PolarHBondContact O-N 3.25Å; L28-L31 PolarHBondContact O-N 2.99Å; L31-L35 PolarHBondContact O-N 2.93Å
32	F	40.9	Very low	38.2	Very low	156 Å²	156	117.1 Å²	117.1	68%	0.684	62%	0.621	S	S	*	*	H	α-helix	trans	-77.1	-26.7	171.4	-76.4	-68.2	0	0	0	112.7	L28	L28-F32 HydrophobicContact CB-CD2 4.47Å; L28-F32 HydrophobicContact CD2-CD2 3.84Å; L28-F32 HydrophobicContact CD2-CE2 3.42Å; L28-F32 VanDerWaalsContact CD2-CE2 3.42Å; L28-F32 VanDerWaalsContact O-CB 3.28Å; L28-F32 WeakPolarHBondContact O-CB 3.38Å; L28-F32 VanDerWaalsContact O-CD2 3.22Å; L28-F32 WeakPolarHBondContact O-CD2 3.49Å; L28-F32 PolarHBondContact O-N 2.87Å
33	G	36.1	Very low	37.4	Very low	44 Å²	44	116.6 Å²	116.6	45%	0.454	62%	0.622	S	S	.	*	H	α-helix	trans	-76.2	-24.2	174.8	0	0	0	0	0	114.1	T29	T29-G33 WeakPolarHBondContact O-CA 3.35Å; T29-G33 PolarHBondContact O-N 3.43Å
34	R	36	Very low	36.4	Very low	194 Å²	194	116.3 Å²	116.3	73%	0.732	62%	0.621	S	S	*	*	H	α-helix	trans	-97.2	-7.2	177.1	-74	-173.4	173.7	-171.5	-0.9	115.1	I30	I30-R34 VanDerWaalsContact O-CB 3.32Å; I30-R34 WeakPolarHBondContact O-CB 3.48Å; I30-R34 WeakPolarHBondContact O-CG 3.09Å; I30-R34 PolarHBondContact O-N 2.92Å
35	L	32.7	Very low	35.7	Very low	149 Å²	149	116 Å²	116	78%	0.78	62%	0.619	S	S	*	*	S	Bend	trans	-92.4	-2.6	169.8	-107.9	85.1	0	0	0	114.5	L31	L31-L35 PolarHBondContact O-N 2.93Å
36	A	35.4	Very low	34.9	Very low	80 Å²	80	114.8 Å²	114.8	66%	0.661	62%	0.621	S	S	*	*			trans	-103.9	9	173.4	0	0	0	0	0	114	G38	A36-G38 PolarHBondContact O-N 3.06Å
37	I	33.3	Very low	34.4	Very low	141 Å²	141	117.2 Å²	117.2	72%	0.723	63%	0.634	S	S	*	*			trans	-79.4	43.5	155.2	-43.1	175.3	0	0	0	107.9	K39	I37-K39 PolarHBondContact O-N 3.45Å
38	G	30.9	Very low	33.8	Very low	55 Å²	55	116.3 Å²	116.3	57%	0.567	63%	0.632	S	S	*	*	S	Bend	trans	-64.7	115.9	151.1	0	0	0	0	0	103.7	A36 G40	A36-G38 PolarHBondContact O-N 3.06Å; G38-G40 PolarHBondContact O-N 3.18Å; G38-G40 VanDerWaalsContact O-N 3.17Å
39	K	31.8	Very low	33.3	Very low	191 Å²	191	117.1 Å²	117.1	83%	0.83	65%	0.645	S	S	*	*			trans	1.9	108	163.8	-65.3	173.7	178.6	177.2	0	109.5	I37 K41	I37-K39 PolarHBondContact O-N 3.45Å; K39-K41 PolarHBondContact O-N 2.86Å
40	G	27.3	Very low	32.6	Very low	74 Å²	74	119.4 Å²	119.4	76%	0.763	66%	0.659	S	S	*	*			trans	-45	103.7	156.5	0	0	0	0	0	104.2	G38 E42	G38-G40 PolarHBondContact O-N 3.18Å; G38-G40 VanDerWaalsContact O-N 3.17Å; G40-E42 PolarHBondContact O-N 3.18Å
41	K	27.8	Very low	32.1	Very low	182 Å²	182	116.3 Å²	116.3	79%	0.791	65%	0.645	S	S	*	*			trans	-59.5	93.2	148.2	-75.5	-178.8	177.9	178.6	0	98.9	K39 V43	K39-K41 PolarHBondContact O-N 2.86Å; K41-V43 HydrophobicContact CB-CG2 4.03Å; K41-V43 PolarHBondContact O-N 3.44Å
42	E	27.1	Very low	32.2	Very low	155 Å²	155	115.4 Å²	115.4	72%	0.724	64%	0.644	S	S	*	*				-30.3	84.2	108.9	-143.2	163.9	-155	0	0	104.8	G40 D44	G40-E42 PolarHBondContact O-N 3.18Å; E42-D44 PolarHBondContact O-N 3.43Å
43	V	28.3	Very low	32.5	Very low	106 Å²	106	111.8 Å²	111.8	64%	0.642	64%	0.643	S	S	*	*			trans	-63	77.3	134.1	-168.1	0	0	0	0	100	K41 I45	K41-V43 HydrophobicContact CB-CG2 4.03Å; K41-V43 PolarHBondContact O-N 3.44Å; V43-I45 HydrophobicContact CG1-CG1 3.81Å; V43-I45 PolarHBondContact O-N 3.13Å
44	D	25.4	Very low	33.4	Very low	109 Å²	109	115.2 Å²	115.2	58%	0.583	65%	0.651	S	S	*	*				-36.3	81.8	112.3	-78.9	-26.6	0	0	0	104.1	E42 M46	E42-D44 PolarHBondContact O-N 3.43Å; D44-M46 PolarHBondContact O-N 2.61Å
45	I	30.5	Very low	34.8	Very low	101 Å²	101	107.9 Å²	107.9	52%	0.518	63%	0.629	S	S	.	*				-44.6	106	127.2	-60.7	-179.3	0	0	0	98.8	V43 V47	V43-I45 HydrophobicContact CG1-CG1 3.81Å; V43-I45 PolarHBondContact O-N 3.13Å; I45-V47 PolarHBondContact O-N 2.81Å
46	M	26.4	Very low	36.6	Very low	150 Å²	150	103.7 Å²	103.7	74%	0.739	60%	0.603	S	S	*	*			trans	-48.5	90.7	156.9	-65.3	177.3	-178.6	0	0	102.8	D44 N48	D44-M46 PolarHBondContact O-N 2.61Å; M46-N48 PolarHBondContact O-N 2.04Å
47	V	31.4	Very low	38.3	Very low	118 Å²	118	103 Å²	103	72%	0.715	59%	0.588	S	S	*	*				-49.1	92.3	125.5	-172.5	0	0	0	0	99.5	I45 S49	I45-V47 PolarHBondContact O-N 2.81Å; V47-S49 PolarHBondContact O-N 3.3Å
48	N	30.7	Very low	40.2	Very low	84 Å²	84	103.2 Å²	103.2	45%	0.449	59%	0.586	S	S	.	*			trans	-56.6	79.6	158.8	-94.2	-8.9	0	0	0	102.7	M46 V50 G51	M46-N48 PolarHBondContact O-N 2.04Å; N48-V50 PolarHBondContact O-N 2.99Å; N48-G51 PolarHBondContact O-N 3.44Å; N48-G51 VanDerWaalsContact O-N 3.14Å
49	S	32.5	Very low	42.8	Very low	100 Å²	100	102.2 Å²	102.2	70%	0.699	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	103.4	158.1	46.4	0	0	0	0	101.1	V47	V47-S49 PolarHBondContact O-N 3.3Å
50	V	34.2	Very low	45.5	Very low	135 Å²	135	93.1 Å²	93.1	82%	0.818	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	72.2	-168.5	-160.8	0	0	0	0	112.2	N48 T52	N48-V50 PolarHBondContact O-N 2.99Å; V50-T52 PolarHBondContact O-N 3Å; V50-T52 VanDerWaalsContact O-N 3.12Å
51	G	37.4	Very low	48.3	Very low	9 Å²	9	90.2 Å²	90.2	9%	0.093	50%	0.499	C	S	.	.			trans	-45.8	124.7	155.5	0	0	0	0	0	108.5	N48	N48-G51 PolarHBondContact O-N 3.44Å; N48-G51 VanDerWaalsContact O-N 3.14Å
52	T	39.3	Very low	51.1	Low	91 Å²	91	86 Å²	86	56%	0.558	48%	0.482	S	S	*	.			trans	-47.9	150.3	165.7	53.8	0	0	0	0	108	V50 D54 S55 W56	V50-T52 PolarHBondContact O-N 3Å; V50-T52 VanDerWaalsContact O-N 3.12Å; T52-D54 PolarHBondContact O-N 3.25Å; T52-S55 WeakPolarHBondContact O-CB 3.47Å; T52-S55 PolarHBondContact O-N 3.45Å; T52-W56 PolarHBondContact O-N 3.3Å
53	A	48.6	Very low	54	Low	79 Å²	79	78.7 Å²	78.7	65%	0.653	45%	0.448	S	S	*	.	H	α-helix	trans	-47.4	-32.3	178.3	0	0	0	0	0	112.1	W56 N57	A53-W56 PolarHBondContact O-N 3.02Å; A53-N57 PolarHBondContact O-N 3.42Å
54	D	53.7	Low	56.8	Low	116 Å²	116	76.5 Å²	76.5	62%	0.62	43%	0.428	S	S	*	.	H	α-helix	trans	-63.4	-36.8	174.7	-57.2	-33.4	0	0	0	114.8	T52 Q58	T52-D54 PolarHBondContact O-N 3.25Å; D54-Q58 PolarHBondContact O-N 2.93Å
55	S	66.5	Low	59.6	Low	40 Å²	40	74.4 Å²	74.4	28%	0.28	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-41.1	177.9	-175.9	0	0	0	0	111.1	T52 T59	T52-S55 WeakPolarHBondContact O-CB 3.47Å; T52-S55 PolarHBondContact O-N 3.45Å; S55-T59 WeakPolarHBondContact O-CG2 3.38Å; S55-T59 PolarHBondContact O-N 3.45Å; S55-T59 PolarHBondContact O-OG1 3.16Å
56	W	70	Confident	62.2	Low	62 Å²	62	72.3 Å²	72.3	24%	0.235	41%	0.405	C	S	.	.	H	α-helix	trans	-73.2	-36.5	178.4	-82.3	103.4	0	0	0	112.2	T52 A53 Q58 T59 C60 A89 L102	T52-W56 PolarHBondContact O-N 3.3Å; A53-W56 PolarHBondContact O-N 3.02Å; W56-Q58 VanDerWaalsContact C-N 3.32Å; W56-Q58 PolarHBondContact O-N 2.96Å; W56-T59 WeakPolarHBondContact CA-OG1 3.01Å; W56-T59 PolarHBondContact O-N 3.14Å; W56-T59 VanDerWaalsContact O-N 3.15Å; W56-T59 PolarHBondContact O-OG1 3.41Å; W56-C60 PolarHBondContact O-N 3.15Å; W56-A89 HydrophobicContact CB-CB 3.92Å; W56-A89 HydrophobicContact CD2-CB 3.66Å; W56-A89 HydrophobicContact CE3-CB 3.47Å; W56-A89 VanDerWaalsContact CE3-CB 3.47Å; W56-A89 HydrophobicContact CG-CB 3.88Å; W56-A89 HydrophobicContact CZ3-CB 4.18Å; W56-L102 HydrophobicContact CD2-CD2 4.26Å; W56-L102 HydrophobicContact CH2-CD2 4.45Å; W56-L102 HydrophobicContact CZ2-CD2 3.69Å; W56-L102 HydrophobicContact CZ2-CG 4.33Å
57	N	71.6	Confident	65	Low	65 Å²	65	65.5 Å²	65.5	35%	0.348	37%	0.371	S	S	.	.	H	α-helix	trans	-56.6	-45.1	175.8	-162	-16.6	0	0	0	111.8	A53 G61 D88	A53-N57 PolarHBondContact O-N 3.42Å; N57-G61 PolarHBondContact O-N 2.92Å; N57-D88 WeakPolarHBondContact CA-OD1 3.42Å; N57-D88 WeakPolarHBondContact CB-OD1 3.49Å; N57-D88 PolarHBondContact ND2-OD1 3.32Å; N57-D88 PolarHBondContact OD1-OD1 2.91Å
58	Q	73.9	Confident	67.5	Low	145 Å²	145	65 Å²	65	68%	0.678	36%	0.357	S	S	*	.	H	α-helix	trans	-64.7	-42.6	176.1	-68.1	-177	13.3	0	0	112.4	D54 W56 G61 Q62	D54-Q58 PolarHBondContact O-N 2.93Å; W56-Q58 VanDerWaalsContact C-N 3.32Å; W56-Q58 PolarHBondContact O-N 2.96Å; Q58-G61 PolarHBondContact O-N 3.38Å; Q58-Q62 WeakPolarHBondContact O-CG 3.37Å; Q58-Q62 PolarHBondContact O-N 3.01Å
59	T	84.5	Confident	70	Confident	34 Å²	34	68.6 Å²	68.6	21%	0.209	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-48.4	179.5	58.9	0	0	0	0	112.6	S55 W56 G61 Q62 V63	S55-T59 WeakPolarHBondContact O-CG2 3.38Å; S55-T59 PolarHBondContact O-N 3.45Å; S55-T59 PolarHBondContact O-OG1 3.16Å; W56-T59 WeakPolarHBondContact CA-OG1 3.01Å; W56-T59 PolarHBondContact O-N 3.14Å; W56-T59 VanDerWaalsContact O-N 3.15Å; W56-T59 PolarHBondContact O-OG1 3.41Å; T59-G61 VanDerWaalsContact C-N 3.25Å; T59-G61 PolarHBondContact O-N 3Å; T59-Q62 WeakPolarHBondContact O-CB 3.39Å; T59-Q62 PolarHBondContact O-N 3.05Å; T59-V63 WeakPolarHBondContact O-CG2 3.47Å; T59-V63 PolarHBondContact O-N 3.13Å
60	C	88.5	Confident	72.2	Confident	1 Å²	1	65 Å²	65	1%	0.007	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-30.9	175.9	-64.4	0	0	0	0	111.5	W56 Q62 V63 R64 A89 C104	W56-C60 PolarHBondContact O-N 3.15Å; C60-Q62 PolarHBondContact O-N 3.26Å; C60-V63 PolarHBondContact O-N 2.8Å; C60-R64 VanDerWaalsContact O-CB 3.24Å; C60-R64 WeakPolarHBondContact O-CB 3.36Å; C60-R64 PolarHBondContact O-N 3.28Å; C60-A89 VanDerWaalsContact SG-CA 3.54Å; C60-A89 PolarHBondContact SG-N 3.04Å; C60-C104 WeakPolarHBondContact CA-SG 3Å; C60-C104 HydrophobicContact CB-CB 3.74Å; C60-C104 WeakPolarHBondContact CB-SG 3.43Å; C60-C104 WeakPolarHBondContact SG-CB 3.42Å; C60-C104 CovalentContact SG-SG 2.04Å; C60-C104 PolarHBondContact SG-SG 2.9Å
61	G	86.8	Confident	74.3	Confident	12 Å²	12	59 Å²	59	12%	0.124	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-42.6	168.4	0	0	0	0	0	113.3	N57 Q58 T59 N65	N57-G61 PolarHBondContact O-N 2.92Å; Q58-G61 PolarHBondContact O-N 3.38Å; T59-G61 VanDerWaalsContact C-N 3.25Å; T59-G61 PolarHBondContact O-N 3Å; G61-N65 VanDerWaalsContact O-CG 3.32Å; G61-N65 PolarHBondContact O-N 2.99Å; G61-N65 VanDerWaalsContact O-N 3.07Å; G61-N65 PolarHBondContact O-ND2 2.95Å
62	Q	86.1	Confident	75.9	Confident	94 Å²	94	61 Å²	61	44%	0.439	32%	0.322	S	S	.	.	H	α-helix	trans	-65.8	-45.2	174.1	-70.2	173.3	1.2	0	0	111.6	Q58 T59 C60 R64 N65 H66 T308	Q58-Q62 WeakPolarHBondContact O-CG 3.37Å; Q58-Q62 PolarHBondContact O-N 3.01Å; T59-Q62 WeakPolarHBondContact O-CB 3.39Å; T59-Q62 PolarHBondContact O-N 3.05Å; C60-Q62 PolarHBondContact O-N 3.26Å; Q62-R64 VanDerWaalsContact C-N 3.35Å; Q62-R64 PolarHBondContact O-N 3.27Å; Q62-N65 PolarHBondContact O-N 3.08Å; Q62-H66 WeakPolarHBondContact O-CB 3.48Å; Q62-H66 PolarHBondContact O-N 3.43Å; Q62-T308 HydrophobicContact CB-CG2 4.23Å
63	V	87.4	Confident	77.1	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	33%	0.333	C	S	.	.	H	α-helix	trans	-59.2	-45.6	176.9	174.1	0	0	0	0	111.4	T59 C60 N65 H66 F67 C104 M109 S303 T308	T59-V63 WeakPolarHBondContact O-CG2 3.47Å; T59-V63 PolarHBondContact O-N 3.13Å; C60-V63 PolarHBondContact O-N 2.8Å; V63-N65 VanDerWaalsContact C-N 3.34Å; V63-N65 PolarHBondContact O-N 3.33Å; V63-H66 PolarHBondContact O-N 3.32Å; V63-F67 WeakPolarHBondContact O-CB 3.5Å; V63-F67 PolarHBondContact O-N 3.22Å; V63-C104 HydrophobicContact CB-CB 4.23Å; V63-C104 HydrophobicContact CG1-CB 4.08Å; V63-C104 HydrophobicContact CG2-CB 4.34Å; V63-M109 HydrophobicContact CG1-CE 4.29Å; V63-S303 VanDerWaalsContact CG1-O 3.27Å; V63-S303 WeakPolarHBondContact CG1-O 3.23Å; V63-S303 WeakPolarHBondContact CG2-O 3.5Å; V63-T308 HydrophobicContact CB-CG2 4.26Å; V63-T308 HydrophobicContact CG2-CG2 3.72Å
64	R	87	Confident	77.5	Confident	60 Å²	60	63.8 Å²	63.8	23%	0.226	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-42.4	176.5	-178.9	172.2	62.3	138.1	-6.4	112.1	C60 Q62 Y68 K82 L85	C60-R64 VanDerWaalsContact O-CB 3.24Å; C60-R64 WeakPolarHBondContact O-CB 3.36Å; C60-R64 PolarHBondContact O-N 3.28Å; Q62-R64 VanDerWaalsContact C-N 3.35Å; Q62-R64 PolarHBondContact O-N 3.27Å; R64-Y68 WeakPolarHBondContact O-CB 3.2Å; R64-Y68 PolarHBondContact O-N 3.43Å; R64-K82 HydrophobicContact CG-CG 4.41Å; R64-K82 PolarHBondContact NH1-O 3.09Å; R64-L85 HydrophobicContact CG-CB 3.7Å; R64-L85 HydrophobicContact CG-CD1 3.71Å; R64-L85 HydrophobicContact CG-CG 4.36Å
65	N	85.3	Confident	77.2	Confident	65 Å²	65	67.7 Å²	67.7	35%	0.348	34%	0.337	S	S	.	.	H	α-helix	trans	-67.5	-40.4	175.5	-74.6	-30.3	0	0	0	112	G61 Q62 V63 K69 K82	G61-N65 VanDerWaalsContact O-CG 3.32Å; G61-N65 PolarHBondContact O-N 2.99Å; G61-N65 VanDerWaalsContact O-N 3.07Å; G61-N65 PolarHBondContact O-ND2 2.95Å; Q62-N65 PolarHBondContact O-N 3.08Å; V63-N65 VanDerWaalsContact C-N 3.34Å; V63-N65 PolarHBondContact O-N 3.33Å; N65-K69 WeakPolarHBondContact O-CB 3.27Å; N65-K69 WeakPolarHBondContact O-CG 3.43Å; N65-K69 PolarHBondContact O-N 3.28Å; N65-K82 WeakPolarHBondContact OD1-CE 3.27Å; N65-K82 PolarHBondContact OD1-NZ 3.07Å
66	H	84.2	Confident	76.5	Confident	57 Å²	57	69.7 Å²	69.7	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-51.6	175.5	177.9	-93.9	0	0	0	110.5	Q62 V63 Y68 K69 S70 T308	Q62-H66 WeakPolarHBondContact O-CB 3.48Å; Q62-H66 PolarHBondContact O-N 3.43Å; V63-H66 PolarHBondContact O-N 3.32Å; H66-Y68 PolarHBondContact O-N 3.21Å; H66-K69 PolarHBondContact O-N 2.96Å; H66-S70 WeakPolarHBondContact O-CB 3.38Å; H66-S70 PolarHBondContact O-N 3.41Å; H66-S70 PolarHBondContact O-OG 3.05Å; H66-T308 HydrophobicContact CB-CG2 3.86Å
67	F	86.4	Confident	75.5	Confident	7 Å²	7	68.2 Å²	68.2	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-54	-54.1	174.3	-176.3	-88.1	0	0	0	111	V63 K69 S70 F71 L80 L85 M109 Q112 F113	V63-F67 WeakPolarHBondContact O-CB 3.5Å; V63-F67 PolarHBondContact O-N 3.22Å; F67-K69 VanDerWaalsContact C-N 3.34Å; F67-K69 PolarHBondContact O-N 2.73Å; F67-S70 PolarHBondContact O-N 2.95Å; F67-F71 HydrophobicContact CD1-CD2 4.32Å; F67-F71 AromaticContact CD2-CD2 3.73Å; F67-F71 HydrophobicContact CD2-CD2 3.73Å; F67-F71 AromaticContact CD2-CE2 3.59Å; F67-F71 HydrophobicContact CD2-CE2 3.59Å; F67-F71 HydrophobicContact CE1-CD2 4.35Å; F67-F71 AromaticContact CE2-CD2 3.77Å; F67-F71 HydrophobicContact CE2-CD2 3.77Å; F67-F71 AromaticContact CE2-CE2 3.58Å; F67-F71 HydrophobicContact CE2-CE2 3.58Å; F67-F71 HydrophobicContact CE2-CG 4.49Å; F67-F71 HydrophobicContact CE2-CZ 4.14Å; F67-F71 HydrophobicContact CG-CD2 4.02Å; F67-F71 HydrophobicContact CG-CE2 4.3Å; F67-F71 HydrophobicContact CZ-CD2 4.09Å; F67-F71 HydrophobicContact CZ-CE2 4.3Å; F67-F71 HydrophobicContact CZ-CG 4.42Å; F67-F71 VanDerWaalsContact O-CD2 3.22Å; F67-F71 WeakPolarHBondContact O-CD2 3.17Å; F67-F71 PolarHBondContact O-N 3.37Å; F67-L80 HydrophobicContact CE1-CB 4.47Å; F67-L80 HydrophobicContact CE1-CD1 4.14Å; F67-L80 HydrophobicContact CZ-CD1 4.02Å; F67-L85 HydrophobicContact CD1-CD1 3.68Å; F67-L85 HydrophobicContact CD1-CD2 3.91Å; F67-L85 HydrophobicContact CD1-CG 4.48Å; F67-L85 HydrophobicContact CE1-CD1 4.24Å; F67-L85 HydrophobicContact CE1-CD2 3.89Å; F67-M109 HydrophobicContact CB-CE 4.3Å; F67-M109 HydrophobicContact CD2-CB 4.48Å; F67-M109 HydrophobicContact CD2-CE 4.02Å; F67-M109 HydrophobicContact CD2-CG 4.41Å; F67-M109 HydrophobicContact CE2-CB 4.02Å; F67-M109 HydrophobicContact CE2-CG 4.07Å; F67-M109 HydrophobicContact CG-CE 4.13Å; F67-M109 HydrophobicContact CZ-CG 4.2Å; F67-Q112 HydrophobicContact CE2-CB 3.98Å; F67-Q112 HydrophobicContact CZ-CB 3.99Å; F67-Q112 HydrophobicContact CZ-CG 4.16Å; F67-F113 AromaticContact CD2-CE1 3.73Å; F67-F113 HydrophobicContact CD2-CE1 3.73Å; F67-F113 HydrophobicContact CD2-CE2 4.27Å; F67-F113 AromaticContact CD2-CZ 3.58Å; F67-F113 HydrophobicContact CD2-CZ 3.58Å; F67-F113 HydrophobicContact CE2-CE1 4.26Å; F67-F113 HydrophobicContact CE2-CZ 4.24Å
68	Y	83.6	Confident	74.6	Confident	108 Å²	108	72.3 Å²	72.3	42%	0.424	39%	0.385	S	S	.	.	H	α-helix	trans	-56.7	-46.7	179.9	-174	-91.5	0	0	0	112.2	R64 H66 F71 A72 K82	R64-Y68 WeakPolarHBondContact O-CB 3.2Å; R64-Y68 PolarHBondContact O-N 3.43Å; H66-Y68 PolarHBondContact O-N 3.21Å; Y68-F71 PolarHBondContact O-N 3.46Å; Y68-A72 HydrophobicContact CE1-CB 4.3Å; Y68-A72 WeakPolarHBondContact O-CA 3.3Å; Y68-A72 WeakPolarHBondContact O-CB 3.27Å; Y68-A72 PolarHBondContact O-N 3.05Å; Y68-K82 HydrophobicContact CD2-CB 4.08Å; Y68-K82 HydrophobicContact CD2-CG 4.5Å; Y68-K82 HydrophobicContact CE2-CB 4.28Å
69	K	81.8	Confident	73.8	Confident	160 Å²	160	68.7 Å²	68.7	70%	0.696	38%	0.38	S	S	*	.	H	α-helix	trans	-63.9	-42.5	177.7	-76	-179.4	177.9	-173.7	0	113	N65 H66 F67 F71	N65-K69 WeakPolarHBondContact O-CB 3.27Å; N65-K69 WeakPolarHBondContact O-CG 3.43Å; N65-K69 PolarHBondContact O-N 3.28Å; H66-K69 PolarHBondContact O-N 2.96Å; F67-K69 VanDerWaalsContact C-N 3.34Å; F67-K69 PolarHBondContact O-N 2.73Å; K69-F71 VanDerWaalsContact C-N 3.3Å; K69-F71 PolarHBondContact O-N 2.79Å
70	S	79.1	Confident	72.9	Confident	23 Å²	23	69.2 Å²	69.2	16%	0.161	38%	0.381	C	S	.	.	H	α-helix	trans	-61.9	-42	179.9	-65.5	0	0	0	0	110.6	H66 F67 R116	H66-S70 WeakPolarHBondContact O-CB 3.38Å; H66-S70 PolarHBondContact O-N 3.41Å; H66-S70 PolarHBondContact O-OG 3.05Å; F67-S70 PolarHBondContact O-N 2.95Å; S70-R116 VanDerWaalsContact O-CZ 3.3Å; S70-R116 PolarHBondContact O-NH1 2.71Å; S70-R116 PolarHBondContact O-NH2 3.27Å; S70-R116 VanDerWaalsContact O-NH2 3.15Å
71	F	78.5	Confident	71.8	Confident	11 Å²	11	72.1 Å²	72.1	5%	0.048	40%	0.402	C	S	.	.	H	α-helix	trans	-101.2	-3.9	-171.4	-66.6	-93.1	0	0	0	114.8	F67 Y68 K69 D73 L74 Q112 F113 R116	F67-F71 HydrophobicContact CD1-CD2 4.32Å; F67-F71 AromaticContact CD2-CD2 3.73Å; F67-F71 HydrophobicContact CD2-CD2 3.73Å; F67-F71 AromaticContact CD2-CE2 3.59Å; F67-F71 HydrophobicContact CD2-CE2 3.59Å; F67-F71 HydrophobicContact CE1-CD2 4.35Å; F67-F71 AromaticContact CE2-CD2 3.77Å; F67-F71 HydrophobicContact CE2-CD2 3.77Å; F67-F71 AromaticContact CE2-CE2 3.58Å; F67-F71 HydrophobicContact CE2-CE2 3.58Å; F67-F71 HydrophobicContact CE2-CG 4.49Å; F67-F71 HydrophobicContact CE2-CZ 4.14Å; F67-F71 HydrophobicContact CG-CD2 4.02Å; F67-F71 HydrophobicContact CG-CE2 4.3Å; F67-F71 HydrophobicContact CZ-CD2 4.09Å; F67-F71 HydrophobicContact CZ-CE2 4.3Å; F67-F71 HydrophobicContact CZ-CG 4.42Å; F67-F71 VanDerWaalsContact O-CD2 3.22Å; F67-F71 WeakPolarHBondContact O-CD2 3.17Å; F67-F71 PolarHBondContact O-N 3.37Å; Y68-F71 PolarHBondContact O-N 3.46Å; K69-F71 VanDerWaalsContact C-N 3.3Å; K69-F71 PolarHBondContact O-N 2.79Å; F71-D73 VanDerWaalsContact C-N 3.28Å; F71-D73 PolarHBondContact O-N 3.45Å; F71-L74 HydrophobicContact CB-CD1 4.46Å; F71-L74 HydrophobicContact CD1-CD1 3.65Å; F71-L74 HydrophobicContact CE1-CD1 4.4Å; F71-L74 HydrophobicContact CG-CD1 4.44Å; F71-L74 PolarHBondContact O-N 3.21Å; F71-Q112 HydrophobicContact CD1-CB 4.35Å; F71-Q112 HydrophobicContact CE1-CB 3.74Å; F71-Q112 WeakPolarHBondContact CE1-O 3.35Å; F71-Q112 HydrophobicContact CZ-CB 3.95Å; F71-F113 AromaticContact CE2-CD1 3.78Å; F71-F113 HydrophobicContact CE2-CD1 3.78Å; F71-F113 AromaticContact CE2-CE1 3.69Å; F71-F113 HydrophobicContact CE2-CE1 3.69Å; F71-F113 AromaticContact CZ-CD1 3.75Å; F71-F113 HydrophobicContact CZ-CD1 3.75Å; F71-F113 HydrophobicContact CZ-CE1 4.16Å; F71-R116 HydrophobicContact CE1-CB 3.82Å; F71-R116 HydrophobicContact CE1-CG 4.28Å; F71-R116 HydrophobicContact CZ-CB 3.86Å; F71-R116 VanDerWaalsContact CZ-CD 3.45Å; F71-R116 HydrophobicContact CZ-CG 4.26Å
72	A	70.5	Confident	70.8	Confident	50 Å²	50	75.5 Å²	75.5	41%	0.413	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.5	-179	0	0	0	0	0	113.8	Y68 L74	Y68-A72 HydrophobicContact CE1-CB 4.3Å; Y68-A72 WeakPolarHBondContact O-CA 3.3Å; Y68-A72 WeakPolarHBondContact O-CB 3.27Å; Y68-A72 PolarHBondContact O-N 3.05Å; A72-L74 VanDerWaalsContact C-N 3.31Å; A72-L74 PolarHBondContact O-N 3.4Å
73	D	64.7	Low	69.8	Low	146 Å²	146	79.4 Å²	79.4	78%	0.781	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.3	-175.7	-57.6	-30	0	0	0	113.5	F71 E75	F71-D73 VanDerWaalsContact C-N 3.28Å; F71-D73 PolarHBondContact O-N 3.45Å; D73-E75 PolarHBondContact O-N 3.03Å
74	L	57	Low	69	Low	82 Å²	82	82.6 Å²	82.6	43%	0.429	45%	0.453	S	S	.	.			trans	-87	93.9	-179	-71.6	166.4	0	0	0	111.1	F71 A72 G76 S77	F71-L74 HydrophobicContact CB-CD1 4.46Å; F71-L74 HydrophobicContact CD1-CD1 3.65Å; F71-L74 HydrophobicContact CE1-CD1 4.4Å; F71-L74 HydrophobicContact CG-CD1 4.44Å; F71-L74 PolarHBondContact O-N 3.21Å; A72-L74 VanDerWaalsContact C-N 3.31Å; A72-L74 PolarHBondContact O-N 3.4Å; L74-G76 PolarHBondContact O-N 3.16Å; L74-S77 PolarHBondContact O-N 3.28Å; L74-S77 PolarHBondContact O-OG 3.09Å
75	E	47.4	Very low	68.6	Low	198 Å²	198	80 Å²	80	93%	0.925	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	125.7	166.7	-70.9	-176.5	162.5	0	0	110.6	D73 S77	D73-E75 PolarHBondContact O-N 3.03Å; E75-S77 PolarHBondContact O-N 3.33Å
76	G	52.2	Low	68.5	Low	83 Å²	83	77.9 Å²	77.9	86%	0.856	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-2.8	175.5	0	0	0	0	0	116.3	L74	L74-G76 PolarHBondContact O-N 3.16Å
77	S	50	Low	68.3	Low	31 Å²	31	78.6 Å²	78.6	22%	0.217	44%	0.442	C	S	.	.	S	Bend	trans	-70.6	137.7	158.5	66.2	0	0	0	0	108.1	L74 E75 A79	L74-S77 PolarHBondContact O-N 3.28Å; L74-S77 PolarHBondContact O-OG 3.09Å; E75-S77 PolarHBondContact O-N 3.33Å; S77-A79 PolarHBondContact O-N 3.34Å
78	N	52.5	Low	68.2	Low	151 Å²	151	81.7 Å²	81.7	81%	0.807	46%	0.459	S	S	*	.			trans	-60.3	83	160.5	-78.9	-21.2	0	0	0	105.8	L80	N78-L80 VanDerWaalsContact C-N 3.28Å; N78-L80 PolarHBondContact O-N 3.18Å
79	A	56.9	Low	68.4	Low	68 Å²	68	77.5 Å²	77.5	56%	0.562	45%	0.447	S	S	*	.			trans	-58.1	101.1	-179.4	0	0	0	0	0	105.2	S77 S81	S77-A79 PolarHBondContact O-N 3.34Å; A79-S81 PolarHBondContact O-N 2.86Å
80	L	64	Low	68.7	Low	45 Å²	45	73.3 Å²	73.3	24%	0.236	43%	0.429	C	S	.	.			trans	-51.5	120.8	179.7	-84.7	141.4	0	0	0	105.6	F67 N78 K82 S84 L85 E108	F67-L80 HydrophobicContact CE1-CB 4.47Å; F67-L80 HydrophobicContact CE1-CD1 4.14Å; F67-L80 HydrophobicContact CZ-CD1 4.02Å; N78-L80 VanDerWaalsContact C-N 3.28Å; N78-L80 PolarHBondContact O-N 3.18Å; L80-K82 PolarHBondContact O-N 2.87Å; L80-S84 WeakPolarHBondContact CD2-OG 3.46Å; L80-L85 HydrophobicContact CB-CD2 4.34Å; L80-E108 HydrophobicContact CD1-CB 4.28Å
81	S	65.9	Low	69.2	Low	63 Å²	63	76.6 Å²	76.6	44%	0.441	45%	0.448	S	S	.	.			trans	-50.5	138.2	177	174.3	0	0	0	0	107.8	A79 Q83 S84	A79-S81 PolarHBondContact O-N 2.86Å; S81-Q83 PolarHBondContact O-N 3.26Å; S81-Q83 PolarHBondContact OG-N 3.46Å; S81-S84 PolarHBondContact N-OG 2.98Å; S81-S84 PolarHBondContact O-N 3.28Å; S81-S84 PolarHBondContact O-OG 3.12Å
82	K	66.1	Low	69.6	Low	83 Å²	83	76.7 Å²	76.7	36%	0.361	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-20.3	176.3	-169	174.7	-177.2	175.3	0	112.4	R64 N65 Y68 L80	R64-K82 HydrophobicContact CG-CG 4.41Å; R64-K82 PolarHBondContact NH1-O 3.09Å; N65-K82 WeakPolarHBondContact OD1-CE 3.27Å; N65-K82 PolarHBondContact OD1-NZ 3.07Å; Y68-K82 HydrophobicContact CD2-CB 4.08Å; Y68-K82 HydrophobicContact CD2-CG 4.5Å; Y68-K82 HydrophobicContact CE2-CB 4.28Å; L80-K82 PolarHBondContact O-N 2.87Å
83	Q	65.1	Low	70.4	Confident	176 Å²	176	80.3 Å²	80.3	82%	0.822	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-24.7	175.2	-61.8	174.1	3.8	0	0	114.1	S81 L85	S81-Q83 PolarHBondContact O-N 3.26Å; S81-Q83 PolarHBondContact OG-N 3.46Å; Q83-L85 VanDerWaalsContact C-N 3.3Å
84	S	71.5	Confident	71.6	Confident	67 Å²	67	81.9 Å²	81.9	47%	0.469	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4	178.1	64.1	0	0	0	0	113.4	L80 S81	L80-S84 WeakPolarHBondContact CD2-OG 3.46Å; S81-S84 PolarHBondContact N-OG 2.98Å; S81-S84 PolarHBondContact O-N 3.28Å; S81-S84 PolarHBondContact O-OG 3.12Å
85	L	77.8	Confident	73.2	Confident	5 Å²	5	78 Å²	78	3%	0.026	43%	0.432	C	S	.	.	S	Bend	trans	-89	142.9	178.2	-65.1	170.4	0	0	0	110.4	R64 F67 L80 Q83 T87 M109	R64-L85 HydrophobicContact CG-CB 3.7Å; R64-L85 HydrophobicContact CG-CD1 3.71Å; R64-L85 HydrophobicContact CG-CG 4.36Å; F67-L85 HydrophobicContact CD1-CD1 3.68Å; F67-L85 HydrophobicContact CD1-CD2 3.91Å; F67-L85 HydrophobicContact CD1-CG 4.48Å; F67-L85 HydrophobicContact CE1-CD1 4.24Å; F67-L85 HydrophobicContact CE1-CD2 3.89Å; L80-L85 HydrophobicContact CB-CD2 4.34Å; Q83-L85 VanDerWaalsContact C-N 3.3Å; L85-T87 PolarHBondContact O-N 2.91Å; L85-M109 HydrophobicContact CD2-CE 4.25Å; L85-M109 HydrophobicContact CD2-CG 3.68Å; L85-M109 HydrophobicContact CD2-SD 3.65Å
86	P	82.4	Confident	75.3	Confident	22 Å²	22	76.5 Å²	76.5	14%	0.143	42%	0.422	C	S	.	.			trans	-52.8	132.9	179.1	-24.4	32.5	0	0	0	112.4	F90 T106 M109	P86-F90 HydrophobicContact CB-CD1 4.01Å; P86-F90 HydrophobicContact CB-CE1 3.73Å; P86-F90 HydrophobicContact CG-CD1 4.21Å; P86-F90 HydrophobicContact CG-CE1 3.44Å; P86-F90 VanDerWaalsContact CG-CE1 3.44Å; P86-F90 HydrophobicContact CG-CZ 4.15Å; P86-T106 HydrophobicContact CG-CG2 3.49Å; P86-T106 VanDerWaalsContact CG-CG2 3.49Å; P86-M109 HydrophobicContact CG-SD 4.31Å
87	T	80.9	Confident	77.3	Confident	72 Å²	72	74 Å²	74	44%	0.442	39%	0.39	S	S	.	.	S	Bend	trans	-80.7	-40.8	173.8	-49.4	0	0	0	0	110.9	L85	L85-T87 PolarHBondContact O-N 2.91Å
88	D	84.4	Confident	79.3	Confident	71 Å²	71	72.8 Å²	72.8	38%	0.38	38%	0.382	S	S	.	.	S	Bend	trans	-122.4	164.2	-177.4	-66.5	-51.4	0	0	0	111.4	N57	N57-D88 WeakPolarHBondContact CA-OD1 3.42Å; N57-D88 WeakPolarHBondContact CB-OD1 3.49Å; N57-D88 PolarHBondContact ND2-OD1 3.32Å; N57-D88 PolarHBondContact OD1-OD1 2.91Å
89	A	87.5	Confident	81	Confident	21 Å²	21	68.4 Å²	68.4	17%	0.174	37%	0.366	C	S	.	.			trans	-68.7	136.7	174	0	0	0	0	0	110.3	W56 C60 L102 T103	W56-A89 HydrophobicContact CB-CB 3.92Å; W56-A89 HydrophobicContact CD2-CB 3.66Å; W56-A89 HydrophobicContact CE3-CB 3.47Å; W56-A89 VanDerWaalsContact CE3-CB 3.47Å; W56-A89 HydrophobicContact CG-CB 3.88Å; W56-A89 HydrophobicContact CZ3-CB 4.18Å; C60-A89 VanDerWaalsContact SG-CA 3.54Å; C60-A89 PolarHBondContact SG-N 3.04Å; A89-L102 HydrophobicContact CB-CD1 3.68Å; A89-L102 HydrophobicContact CB-CD2 4.46Å; A89-L102 HydrophobicContact CB-CG 3.87Å; A89-T103 WeakPolarHBondContact CA-O 3.34Å
90	F	89.1	Confident	82.5	Confident	72 Å²	72	71.7 Å²	71.7	32%	0.316	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	161.3	179.9	66.7	-75.3	0	0	0	109.9	P86 N92 T103 C105 T106	P86-F90 HydrophobicContact CB-CD1 4.01Å; P86-F90 HydrophobicContact CB-CE1 3.73Å; P86-F90 HydrophobicContact CG-CD1 4.21Å; P86-F90 HydrophobicContact CG-CE1 3.44Å; P86-F90 VanDerWaalsContact CG-CE1 3.44Å; P86-F90 HydrophobicContact CG-CZ 4.15Å; F90-N92 HydrophobicContact CD2-CB 4.17Å; F90-N92 HydrophobicContact CE2-CB 3.63Å; F90-N92 HydrophobicContact CZ-CB 4.19Å; F90-N92 PolarHBondContact O-N 2.77Å; F90-T103 WeakPolarHBondContact CD1-O 3.35Å; F90-T103 PolarHBondContact N-O 3.43Å; F90-T103 PolarHBondContact O-N 3.19Å; F90-C105 VanDerWaalsContact CZ-O 3.25Å; F90-C105 WeakPolarHBondContact CZ-O 3.47Å; F90-T106 HydrophobicContact CE1-CG2 4.47Å; F90-T106 HydrophobicContact CZ-CG2 3.98Å
91	V	87.8	Confident	83.6	Confident	92 Å²	92	70.4 Å²	70.4	56%	0.558	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	110.8	179.7	-178	0	0	0	0	109.2	H93 G101	V91-H93 WeakPolarHBondContact CG1-CE1 3.43Å; V91-G101 CarbonylContact C-O 3.54Å; V91-G101 WeakPolarHBondContact CA-O 3.32Å
92	N	87.4	Confident	84.7	Confident	13 Å²	13	71.5 Å²	71.5	7%	0.07	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	117.8	176.4	-166.9	-7.9	0	0	0	111	F90 R94 L95 G101 T103 C105	F90-N92 HydrophobicContact CD2-CB 4.17Å; F90-N92 HydrophobicContact CE2-CB 3.63Å; F90-N92 HydrophobicContact CZ-CB 4.19Å; F90-N92 PolarHBondContact O-N 2.77Å; N92-R94 PolarHBondContact OD1-N 3.08Å; N92-L95 HydrophobicContact CB-CG 4.43Å; N92-G101 PolarHBondContact N-O 3.33Å; N92-G101 PolarHBondContact O-N 2.88Å; N92-T103 HydrophobicContact CB-CG2 3.47Å; N92-T103 VanDerWaalsContact CB-CG2 3.47Å; N92-C105 PolarHBondContact ND2-O 3.48Å
93	H	88.2	Confident	85.9	Confident	125 Å²	125	67.7 Å²	67.7	58%	0.579	35%	0.349	S	S	*	.			trans	-102.9	-1.9	177.3	-62.4	101	0	0	0	113.5	V91 K100	V91-H93 WeakPolarHBondContact CG1-CE1 3.43Å; H93-K100 WeakPolarHBondContact O-CD 3.41Å; H93-K100 WeakPolarHBondContact O-CE 3.06Å
94	R	89.7	Confident	87.2	Confident	180 Å²	180	59.5 Å²	59.5	68%	0.679	31%	0.311	S	S	*	.			trans	-95	-3.3	-174.2	-61.3	-178.3	179.7	-178.6	1.5	113.7	N92 K96 E107	N92-R94 PolarHBondContact OD1-N 3.08Å; R94-K96 PolarHBondContact O-N 3.07Å; R94-E107 VanDerWaalsContact CB-CD 3.44Å; R94-E107 HydrophobicContact CB-CG 3.82Å; R94-E107 WeakPolarHBondContact CB-OE1 3.31Å; R94-E107 WeakPolarHBondContact CD-OE1 3.44Å; R94-E107 IonicContact NH1-OE1 3.63Å
95	L	90.5	Very high	88.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.289	C	S	.	.			trans	-58.9	134.5	169.4	-63.1	-179.3	0	0	0	110.4	N92 C98 K100 T103 E110	N92-L95 HydrophobicContact CB-CG 4.43Å; L95-C98 HydrophobicContact CD1-CB 4.2Å; L95-K100 WeakPolarHBondContact O-CE 3.47Å; L95-T103 HydrophobicContact CD1-CG2 3.92Å; L95-E110 WeakPolarHBondContact CA-OE2 3.18Å; L95-E110 HydrophobicContact CD2-CB 3.86Å; L95-E110 HydrophobicContact CD2-CG 4.37Å
96	K	91.9	Very high	88.8	Confident	165 Å²	165	57.2 Å²	57.2	72%	0.717	30%	0.295	S	S	*	.	S	Bend	trans	-96.2	-31.3	-175.2	-65.5	178.6	-176.5	171.3	0	112.4	R94 E110	R94-K96 PolarHBondContact O-N 3.07Å; K96-E110 PolarHBondContact N-OE1 3.12Å; K96-E110 PolarHBondContact N-OE2 3.36Å
97	V	93.2	Very high	89.2	Confident	30 Å²	30	58.9 Å²	58.9	18%	0.182	30%	0.301	C	S	.	.	S	Bend	trans	-114.9	-49.1	-172.6	-179.1	0	0	0	0	111.3	E110 V114 S293 T296 Q297	V97-E110 WeakPolarHBondContact CA-OE1 3.48Å; V97-E110 PolarHBondContact N-OE1 2.69Å; V97-V114 HydrophobicContact CG2-CG2 4.27Å; V97-S293 WeakPolarHBondContact CG1-O 3.22Å; V97-S293 WeakPolarHBondContact CG1-OG 3.3Å; V97-T296 HydrophobicContact CG1-CG2 4.12Å; V97-Q297 HydrophobicContact CG1-CB 4.28Å
98	C	92.9	Very high	89.6	Confident	7 Å²	7	60.2 Å²	60.2	5%	0.047	30%	0.302	C	S	.	.	S	Bend	trans	-78.3	160.8	-179.6	-60	0	0	0	0	112.1	L95 K100 E110 C301 C304	L95-C98 HydrophobicContact CD1-CB 4.2Å; C98-K100 PolarHBondContact O-N 3.46Å; C98-E110 PolarHBondContact N-OE1 3.4Å; C98-C301 WeakPolarHBondContact CA-SG 3.36Å; C98-C301 HydrophobicContact CB-CB 3.8Å; C98-C301 WeakPolarHBondContact CB-SG 3.43Å; C98-C301 WeakPolarHBondContact SG-CA 3.34Å; C98-C301 WeakPolarHBondContact SG-CB 3.4Å; C98-C301 CovalentContact SG-SG 2.03Å; C98-C301 PolarHBondContact SG-SG 3.44Å; C98-C304 HydrophobicContact CB-CB 4.38Å
99	A	88.5	Confident	89.8	Confident	58 Å²	58	56.9 Å²	56.9	48%	0.479	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-55.9	132.5	179.2	0	0	0	0	0	111.8
100	K	88.4	Confident	90	Very high	138 Å²	138	56.1 Å²	56.1	60%	0.6	28%	0.277	S	S	*	.	S	Bend	trans	-80.2	145.2	176.9	-64.1	175	179.1	179.1	0	110.3	H93 L95 C98	H93-K100 WeakPolarHBondContact O-CD 3.41Å; H93-K100 WeakPolarHBondContact O-CE 3.06Å; L95-K100 WeakPolarHBondContact O-CE 3.47Å; C98-K100 PolarHBondContact O-N 3.46Å
101	G	86.9	Confident	90.2	Very high	17 Å²	17	56.2 Å²	56.2	18%	0.175	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.5	-141.6	179.7	0	0	0	0	0	112.2	V91 N92 T103	V91-G101 CarbonylContact C-O 3.54Å; V91-G101 WeakPolarHBondContact CA-O 3.32Å; N92-G101 PolarHBondContact N-O 3.33Å; N92-G101 PolarHBondContact O-N 2.88Å; G101-T103 PolarHBondContact O-N 3.02Å
102	L	89.4	Confident	90.3	Very high	87 Å²	87	54 Å²	54	46%	0.455	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	115.5	178	-171.6	66.4	0	0	0	110.2	W56 A89	W56-L102 HydrophobicContact CD2-CD2 4.26Å; W56-L102 HydrophobicContact CH2-CD2 4.45Å; W56-L102 HydrophobicContact CZ2-CD2 3.69Å; W56-L102 HydrophobicContact CZ2-CG 4.33Å; A89-L102 HydrophobicContact CB-CD1 3.68Å; A89-L102 HydrophobicContact CB-CD2 4.46Å; A89-L102 HydrophobicContact CB-CG 3.87Å
103	T	91.3	Very high	90.6	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	156.7	-173.4	-178.2	0	0	0	0	112	A89 F90 N92 L95 G101 C105 C304	A89-T103 WeakPolarHBondContact CA-O 3.34Å; F90-T103 WeakPolarHBondContact CD1-O 3.35Å; F90-T103 PolarHBondContact N-O 3.43Å; F90-T103 PolarHBondContact O-N 3.19Å; N92-T103 HydrophobicContact CB-CG2 3.47Å; N92-T103 VanDerWaalsContact CB-CG2 3.47Å; L95-T103 HydrophobicContact CD1-CG2 3.92Å; G101-T103 PolarHBondContact O-N 3.02Å; T103-C105 PolarHBondContact OG1-N 3.47Å; T103-C105 VanDerWaalsContact OG1-N 3.1Å; T103-C304 VanDerWaalsContact CA-O 3.31Å; T103-C304 WeakPolarHBondContact CA-O 3.36Å; T103-C304 WeakPolarHBondContact CB-O 3.39Å; T103-C304 WeakPolarHBondContact OG1-CB 3.33Å; T103-C304 PolarHBondContact OG1-O 3.41Å
104	C	91.6	Very high	90.9	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.02	25%	0.245	C	C	.	.	S	Bend	trans	-89.8	2.6	169.5	-55.8	0	0	0	0	113.4	C60 V63 C304	C60-C104 WeakPolarHBondContact CA-SG 3Å; C60-C104 HydrophobicContact CB-CB 3.74Å; C60-C104 WeakPolarHBondContact CB-SG 3.43Å; C60-C104 WeakPolarHBondContact SG-CB 3.42Å; C60-C104 CovalentContact SG-SG 2.04Å; C60-C104 PolarHBondContact SG-SG 2.9Å; V63-C104 HydrophobicContact CB-CB 4.23Å; V63-C104 HydrophobicContact CG1-CB 4.08Å; V63-C104 HydrophobicContact CG2-CB 4.34Å; C104-C304 PolarHBondContact N-O 3.44Å
105	C	91.8	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.			trans	-110.2	134.9	-172	-74	0	0	0	0	114.5	F90 N92 T103 M109 C304	F90-C105 VanDerWaalsContact CZ-O 3.25Å; F90-C105 WeakPolarHBondContact CZ-O 3.47Å; N92-C105 PolarHBondContact ND2-O 3.48Å; T103-C105 PolarHBondContact OG1-N 3.47Å; T103-C105 VanDerWaalsContact OG1-N 3.1Å; C105-M109 HydrophobicContact CB-CB 4.42Å; C105-C304 HydrophobicContact CB-CB 3.66Å; C105-C304 WeakPolarHBondContact CB-SG 3.35Å; C105-C304 WeakPolarHBondContact SG-CA 3.33Å; C105-C304 WeakPolarHBondContact SG-CB 3.43Å; C105-C304 CovalentContact SG-SG 2.04Å; C105-C304 PolarHBondContact SG-SG 3.24Å
106	T	91.3	Very high	91.1	Very high	25 Å²	25	48.4 Å²	48.4	15%	0.153	25%	0.248	C	C	.	.			trans	-86	169.5	165	77	0	0	0	0	111.6	P86 F90 E108 M109 E110	P86-T106 HydrophobicContact CG-CG2 3.49Å; P86-T106 VanDerWaalsContact CG-CG2 3.49Å; F90-T106 HydrophobicContact CE1-CG2 4.47Å; F90-T106 HydrophobicContact CZ-CG2 3.98Å; T106-E108 VanDerWaalsContact C-N 3.25Å; T106-E108 VanDerWaalsContact CB-OE2 3.24Å; T106-E108 WeakPolarHBondContact CB-OE2 3.44Å; T106-E108 PolarHBondContact O-N 3.37Å; T106-E108 PolarHBondContact OG1-N 3.41Å; T106-E108 PolarHBondContact OG1-OE2 3.15Å; T106-M109 HydrophobicContact CG2-SD 4.37Å; T106-M109 PolarHBondContact O-N 3.08Å; T106-M109 PolarHBondContact OG1-N 3.47Å; T106-E110 PolarHBondContact O-N 3.36Å
107	E	90.6	Very high	91.2	Very high	56 Å²	56	40.6 Å²	40.6	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-60.5	-37	173.2	-65.4	177.3	-126.1	0	0	111.5	R94 E110 N111	R94-E107 VanDerWaalsContact CB-CD 3.44Å; R94-E107 HydrophobicContact CB-CG 3.82Å; R94-E107 WeakPolarHBondContact CB-OE1 3.31Å; R94-E107 WeakPolarHBondContact CD-OE1 3.44Å; R94-E107 IonicContact NH1-OE1 3.63Å; E107-E110 PolarHBondContact O-N 2.87Å; E107-N111 PolarHBondContact O-N 3.47Å; E107-N111 PolarHBondContact O-ND2 2.9Å; E107-N111 VanDerWaalsContact O-ND2 3.08Å
108	E	88.4	Confident	91.3	Very high	101 Å²	101	42.4 Å²	42.4	47%	0.472	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-41	176.8	-60.4	71.4	-155.2	0	0	111.5	L80 T106 N111 Q112	L80-E108 HydrophobicContact CD1-CB 4.28Å; T106-E108 VanDerWaalsContact C-N 3.25Å; T106-E108 VanDerWaalsContact CB-OE2 3.24Å; T106-E108 WeakPolarHBondContact CB-OE2 3.44Å; T106-E108 PolarHBondContact O-N 3.37Å; T106-E108 PolarHBondContact OG1-N 3.41Å; T106-E108 PolarHBondContact OG1-OE2 3.15Å; E108-N111 PolarHBondContact O-N 3.33Å; E108-Q112 WeakPolarHBondContact O-CG 3.04Å; E108-Q112 PolarHBondContact O-N 3.04Å
109	M	89	Confident	91.3	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-44.6	174.7	-67.3	175.5	68.9	0	0	111.1	V63 F67 L85 P86 C105 T106 Q112 F113	V63-M109 HydrophobicContact CG1-CE 4.29Å; F67-M109 HydrophobicContact CB-CE 4.3Å; F67-M109 HydrophobicContact CD2-CB 4.48Å; F67-M109 HydrophobicContact CD2-CE 4.02Å; F67-M109 HydrophobicContact CD2-CG 4.41Å; F67-M109 HydrophobicContact CE2-CB 4.02Å; F67-M109 HydrophobicContact CE2-CG 4.07Å; F67-M109 HydrophobicContact CG-CE 4.13Å; F67-M109 HydrophobicContact CZ-CG 4.2Å; L85-M109 HydrophobicContact CD2-CE 4.25Å; L85-M109 HydrophobicContact CD2-CG 3.68Å; L85-M109 HydrophobicContact CD2-SD 3.65Å; P86-M109 HydrophobicContact CG-SD 4.31Å; C105-M109 HydrophobicContact CB-CB 4.42Å; T106-M109 HydrophobicContact CG2-SD 4.37Å; T106-M109 PolarHBondContact O-N 3.08Å; T106-M109 PolarHBondContact OG1-N 3.47Å; M109-Q112 PolarHBondContact O-N 3.12Å; M109-F113 HydrophobicContact CB-CE2 4.39Å; M109-F113 WeakPolarHBondContact O-CD2 3.49Å; M109-F113 WeakPolarHBondContact O-CG 3.48Å; M109-F113 PolarHBondContact O-N 3Å
110	E	92.6	Very high	91.5	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.019	22%	0.223	C	C	.	.	H	α-helix	trans	-60.9	-44.9	176.5	-173.2	-177.8	-121.2	0	0	111.7	L95 K96 V97 C98 T106 E107 Q112 F113 V114	L95-E110 WeakPolarHBondContact CA-OE2 3.18Å; L95-E110 HydrophobicContact CD2-CB 3.86Å; L95-E110 HydrophobicContact CD2-CG 4.37Å; K96-E110 PolarHBondContact N-OE1 3.12Å; K96-E110 PolarHBondContact N-OE2 3.36Å; V97-E110 WeakPolarHBondContact CA-OE1 3.48Å; V97-E110 PolarHBondContact N-OE1 2.69Å; C98-E110 PolarHBondContact N-OE1 3.4Å; T106-E110 PolarHBondContact O-N 3.36Å; E107-E110 PolarHBondContact O-N 2.87Å; E110-Q112 VanDerWaalsContact C-N 3.29Å; E110-Q112 PolarHBondContact O-N 3.34Å; E110-F113 WeakPolarHBondContact O-CB 3.33Å; E110-F113 PolarHBondContact O-N 3.34Å; E110-F113 VanDerWaalsContact O-N 3.1Å; E110-V114 WeakPolarHBondContact O-CG2 3.45Å; E110-V114 PolarHBondContact O-N 2.82Å
111	N	92.6	Very high	91.9	Very high	75 Å²	75	38.8 Å²	38.8	40%	0.401	20%	0.195	S	C	.	.	H	α-helix	trans	-59.7	-39.6	176.8	-70.7	-35.4	0	0	0	112.1	E107 E108 V114 L115	E107-N111 PolarHBondContact O-N 3.47Å; E107-N111 PolarHBondContact O-ND2 2.9Å; E107-N111 VanDerWaalsContact O-ND2 3.08Å; E108-N111 PolarHBondContact O-N 3.33Å; N111-V114 PolarHBondContact O-N 2.88Å; N111-L115 WeakPolarHBondContact O-CG 3.37Å; N111-L115 PolarHBondContact O-N 3.28Å
112	Q	90.8	Very high	92.3	Very high	45 Å²	45	43.2 Å²	43.2	21%	0.21	21%	0.206	C	C	.	.	H	α-helix	trans	-66.6	-38.8	174.9	-69.6	-64.7	-16.2	0	0	112	F67 F71 E108 M109 E110 L115 R116	F67-Q112 HydrophobicContact CE2-CB 3.98Å; F67-Q112 HydrophobicContact CZ-CB 3.99Å; F67-Q112 HydrophobicContact CZ-CG 4.16Å; F71-Q112 HydrophobicContact CD1-CB 4.35Å; F71-Q112 HydrophobicContact CE1-CB 3.74Å; F71-Q112 WeakPolarHBondContact CE1-O 3.35Å; F71-Q112 HydrophobicContact CZ-CB 3.95Å; E108-Q112 WeakPolarHBondContact O-CG 3.04Å; E108-Q112 PolarHBondContact O-N 3.04Å; M109-Q112 PolarHBondContact O-N 3.12Å; E110-Q112 VanDerWaalsContact C-N 3.29Å; E110-Q112 PolarHBondContact O-N 3.34Å; Q112-L115 PolarHBondContact O-N 3.17Å; Q112-R116 WeakPolarHBondContact O-CB 3.34Å; Q112-R116 PolarHBondContact O-N 3Å
113	F	92.4	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-38.7	173.2	-68.3	-46.1	0	0	0	112.9	F67 F71 M109 E110 R116 S117 T296 Y300	F67-F113 AromaticContact CD2-CE1 3.73Å; F67-F113 HydrophobicContact CD2-CE1 3.73Å; F67-F113 HydrophobicContact CD2-CE2 4.27Å; F67-F113 AromaticContact CD2-CZ 3.58Å; F67-F113 HydrophobicContact CD2-CZ 3.58Å; F67-F113 HydrophobicContact CE2-CE1 4.26Å; F67-F113 HydrophobicContact CE2-CZ 4.24Å; F71-F113 AromaticContact CE2-CD1 3.78Å; F71-F113 HydrophobicContact CE2-CD1 3.78Å; F71-F113 AromaticContact CE2-CE1 3.69Å; F71-F113 HydrophobicContact CE2-CE1 3.69Å; F71-F113 AromaticContact CZ-CD1 3.75Å; F71-F113 HydrophobicContact CZ-CD1 3.75Å; F71-F113 HydrophobicContact CZ-CE1 4.16Å; M109-F113 HydrophobicContact CB-CE2 4.39Å; M109-F113 WeakPolarHBondContact O-CD2 3.49Å; M109-F113 WeakPolarHBondContact O-CG 3.48Å; M109-F113 PolarHBondContact O-N 3Å; E110-F113 WeakPolarHBondContact O-CB 3.33Å; E110-F113 PolarHBondContact O-N 3.34Å; E110-F113 VanDerWaalsContact O-N 3.1Å; F113-R116 PolarHBondContact O-N 3.43Å; F113-S117 WeakPolarHBondContact O-CB 3.25Å; F113-S117 PolarHBondContact O-N 3.36Å; F113-S117 PolarHBondContact O-OG 3.21Å; F113-T296 HydrophobicContact CB-CG2 4.05Å; F113-Y300 HydrophobicContact CB-CD2 4.24Å; F113-Y300 HydrophobicContact CB-CG 3.94Å; F113-Y300 AromaticContact CD1-CD1 3.41Å; F113-Y300 HydrophobicContact CD1-CD1 3.41Å; F113-Y300 VanDerWaalsContact CD1-CD1 3.41Å; F113-Y300 HydrophobicContact CD1-CD2 4.42Å; F113-Y300 HydrophobicContact CD1-CE1 4.17Å; F113-Y300 AromaticContact CD1-CG 3.57Å; F113-Y300 HydrophobicContact CD1-CG 3.57Å; F113-Y300 AromaticContact CE1-CD1 3.72Å; F113-Y300 HydrophobicContact CE1-CD1 3.72Å; F113-Y300 HydrophobicContact CE1-CE1 4.49Å; F113-Y300 HydrophobicContact CE1-CG 4.25Å; F113-Y300 HydrophobicContact CG-CD1 4.23Å; F113-Y300 AromaticContact CG-CG 3.93Å; F113-Y300 HydrophobicContact CG-CG 3.93Å
114	V	94.5	Very high	92.8	Very high	39 Å²	39	44.6 Å²	44.6	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-59.6	-51.6	173.8	169.3	0	0	0	0	110.7	V97 E110 N111 R116 S117 Q118 V292 T296	V97-V114 HydrophobicContact CG2-CG2 4.27Å; E110-V114 WeakPolarHBondContact O-CG2 3.45Å; E110-V114 PolarHBondContact O-N 2.82Å; N111-V114 PolarHBondContact O-N 2.88Å; V114-R116 VanDerWaalsContact C-N 3.32Å; V114-R116 PolarHBondContact O-N 3.07Å; V114-S117 PolarHBondContact O-N 2.82Å; V114-S117 PolarHBondContact O-OG 3.14Å; V114-Q118 PolarHBondContact O-N 3.37Å; V114-V292 HydrophobicContact CG1-CG1 3.71Å; V114-V292 WeakPolarHBondContact O-CG1 3.33Å; V114-T296 WeakPolarHBondContact CA-OG1 3.43Å; V114-T296 HydrophobicContact CG2-CG2 3.94Å
115	L	92.8	Very high	93	Very high	98 Å²	98	44.7 Å²	44.7	51%	0.513	21%	0.206	S	C	.	.	H	α-helix	trans	-61.4	-40.6	178.5	-68.3	173.9	0	0	0	112.3	N111 Q112 Q118 H119	N111-L115 WeakPolarHBondContact O-CG 3.37Å; N111-L115 PolarHBondContact O-N 3.28Å; Q112-L115 PolarHBondContact O-N 3.17Å; L115-Q118 PolarHBondContact O-N 3.11Å; L115-H119 PolarHBondContact O-N 3.04Å
116	R	91.5	Very high	93.1	Very high	65 Å²	65	47.1 Å²	47.1	25%	0.245	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-45.8	179	-171.5	-178.8	-174.8	102	0.1	112.5	S70 F71 Q112 F113 V114 Q118 H119 E120 Y300	S70-R116 VanDerWaalsContact O-CZ 3.3Å; S70-R116 PolarHBondContact O-NH1 2.71Å; S70-R116 PolarHBondContact O-NH2 3.27Å; S70-R116 VanDerWaalsContact O-NH2 3.15Å; F71-R116 HydrophobicContact CE1-CB 3.82Å; F71-R116 HydrophobicContact CE1-CG 4.28Å; F71-R116 HydrophobicContact CZ-CB 3.86Å; F71-R116 VanDerWaalsContact CZ-CD 3.45Å; F71-R116 HydrophobicContact CZ-CG 4.26Å; Q112-R116 WeakPolarHBondContact O-CB 3.34Å; Q112-R116 PolarHBondContact O-N 3Å; F113-R116 PolarHBondContact O-N 3.43Å; V114-R116 VanDerWaalsContact C-N 3.32Å; V114-R116 PolarHBondContact O-N 3.07Å; R116-Q118 VanDerWaalsContact C-N 3.26Å; R116-Q118 PolarHBondContact O-N 2.96Å; R116-H119 PolarHBondContact O-N 3.34Å; R116-H119 VanDerWaalsContact O-N 3.15Å; R116-E120 WeakPolarHBondContact O-CB 2.93Å; R116-E120 PolarHBondContact O-N 3.06Å; R116-Y300 HydrophobicContact CB-CE2 4.43Å; R116-Y300 VanDerWaalsContact CD-CZ 3.49Å; R116-Y300 WeakPolarHBondContact CD-OH 3.39Å; R116-Y300 HydrophobicContact CG-CE2 4.33Å; R116-Y300 WeakPolarHBondContact CG-OH 3.4Å; R116-Y300 PolarHBondContact NE-OH 3.38Å; R116-Y300 VanDerWaalsContact NE-OH 3.08Å
117	S	94	Very high	93.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-40	178.5	71.1	0	0	0	0	111.5	F113 V114 F121 T296	F113-S117 WeakPolarHBondContact O-CB 3.25Å; F113-S117 PolarHBondContact O-N 3.36Å; F113-S117 PolarHBondContact O-OG 3.21Å; V114-S117 PolarHBondContact O-N 2.82Å; V114-S117 PolarHBondContact O-OG 3.14Å; S117-F121 VanDerWaalsContact O-CB 3.32Å; S117-F121 WeakPolarHBondContact O-CB 3.44Å; S117-F121 PolarHBondContact O-N 2.9Å; S117-T296 PolarHBondContact OG-OG1 3.44Å
118	Q	95.3	Very high	93.4	Very high	69 Å²	69	48 Å²	48	32%	0.322	22%	0.224	S	C	.	.	H	α-helix	trans	-61.4	-48.4	173.8	-175.2	178.6	22.9	0	0	111.7	V114 L115 R116 R122 P287 V292	V114-Q118 PolarHBondContact O-N 3.37Å; L115-Q118 PolarHBondContact O-N 3.11Å; R116-Q118 VanDerWaalsContact C-N 3.26Å; R116-Q118 PolarHBondContact O-N 2.96Å; Q118-R122 WeakPolarHBondContact O-CB 3.32Å; Q118-R122 PolarHBondContact O-N 2.82Å; Q118-P287 HydrophobicContact CG-CG 3.83Å; Q118-V292 HydrophobicContact CB-CG1 3.96Å; Q118-V292 HydrophobicContact CB-CG2 3.91Å; Q118-V292 HydrophobicContact CG-CG2 3.92Å
119	H	93.2	Very high	93.7	Very high	98 Å²	98	43.2 Å²	43.2	45%	0.454	20%	0.202	S	C	.	.	H	α-helix	trans	-63	-47	-179.9	-179.2	-82.5	0	0	0	111.9	L115 R116 R122 R123	L115-H119 PolarHBondContact O-N 3.04Å; R116-H119 PolarHBondContact O-N 3.34Å; R116-H119 VanDerWaalsContact O-N 3.15Å; H119-R122 PolarHBondContact O-N 3.34Å; H119-R123 WeakPolarHBondContact O-CB 3.37Å; H119-R123 PolarHBondContact O-N 3.47Å
120	E	93.2	Very high	94	Very high	24 Å²	24	46.6 Å²	46.6	11%	0.112	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-46.6	-178.6	-171.4	174.1	-172.9	0	0	111.8	R116 R122 R123 L124 Y300 F457	R116-E120 WeakPolarHBondContact O-CB 2.93Å; R116-E120 PolarHBondContact O-N 3.06Å; E120-R122 PolarHBondContact O-N 2.87Å; E120-R123 PolarHBondContact O-N 3.2Å; E120-L124 HydrophobicContact CG-CD1 4.39Å; E120-L124 WeakPolarHBondContact O-CG 3.36Å; E120-L124 PolarHBondContact O-N 3.08Å; E120-Y300 PolarHBondContact OE2-OH 3.26Å; E120-F457 HydrophobicContact CG-CE1 4.1Å
121	F	96.1	Very high	94	Very high	5 Å²	5	52.1 Å²	52.1	2%	0.022	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-49.5	174.5	176.2	-96.7	0	0	0	111.6	S117 R123 L124 V125 P287 L295 C324 L325 L453 F457	S117-F121 VanDerWaalsContact O-CB 3.32Å; S117-F121 WeakPolarHBondContact O-CB 3.44Å; S117-F121 PolarHBondContact O-N 2.9Å; F121-R123 VanDerWaalsContact C-N 3.33Å; F121-R123 PolarHBondContact O-N 3.21Å; F121-L124 PolarHBondContact O-N 3.12Å; F121-V125 HydrophobicContact CD1-CG2 4.29Å; F121-V125 HydrophobicContact CD2-CG2 4.42Å; F121-V125 HydrophobicContact CE1-CG2 3.92Å; F121-V125 HydrophobicContact CE2-CG2 4.08Å; F121-V125 HydrophobicContact CZ-CG2 3.82Å; F121-V125 WeakPolarHBondContact O-CB 3.43Å; F121-V125 VanDerWaalsContact O-CG2 3.31Å; F121-V125 WeakPolarHBondContact O-CG2 3.45Å; F121-V125 PolarHBondContact O-N 2.82Å; F121-P287 HydrophobicContact CD1-CB 3.94Å; F121-P287 HydrophobicContact CD1-CG 4.14Å; F121-P287 HydrophobicContact CE1-CB 3.93Å; F121-L295 HydrophobicContact CB-CD1 3.67Å; F121-L295 HydrophobicContact CD1-CD1 4.3Å; F121-L295 HydrophobicContact CD2-CD1 3.72Å; F121-L295 HydrophobicContact CD2-CD2 4.17Å; F121-L295 HydrophobicContact CE2-CD1 4.43Å; F121-L295 HydrophobicContact CG-CD1 3.63Å; F121-C324 HydrophobicContact CE2-CB 3.96Å; F121-C324 HydrophobicContact CZ-CB 3.87Å; F121-L325 HydrophobicContact CE2-CD2 4.36Å; F121-L325 HydrophobicContact CE2-CG 4.35Å; F121-L325 HydrophobicContact CZ-CD2 3.7Å; F121-L325 HydrophobicContact CZ-CG 4.05Å; F121-L453 HydrophobicContact CD2-CD1 3.99Å; F121-L453 HydrophobicContact CE2-CD1 3.56Å; F121-L453 HydrophobicContact CZ-CD1 4.42Å; F121-F457 HydrophobicContact CD2-CZ 4.36Å
122	R	95.6	Very high	94	Very high	109 Å²	109	49 Å²	49	41%	0.411	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-43.5	179.5	-175.1	178.7	64.1	154.8	1.6	111.6	Q118 H119 E120 V125 Q126	Q118-R122 WeakPolarHBondContact O-CB 3.32Å; Q118-R122 PolarHBondContact O-N 2.82Å; H119-R122 PolarHBondContact O-N 3.34Å; E120-R122 PolarHBondContact O-N 2.87Å; R122-V125 PolarHBondContact O-N 3.25Å; R122-Q126 HydrophobicContact CG-CG 4.33Å; R122-Q126 WeakPolarHBondContact O-CB 3.25Å; R122-Q126 VanDerWaalsContact O-CG 3.22Å; R122-Q126 WeakPolarHBondContact O-CG 3.44Å; R122-Q126 PolarHBondContact O-N 3.29Å
123	R	94.8	Very high	94.2	Very high	107 Å²	107	47.8 Å²	47.8	40%	0.404	23%	0.227	S	C	.	.	H	α-helix	trans	-58.4	-53.2	177	-175.6	-165.6	67.8	-168.4	-3.2	110.9	H119 E120 F121 V125 Q126 D127	H119-R123 WeakPolarHBondContact O-CB 3.37Å; H119-R123 PolarHBondContact O-N 3.47Å; E120-R123 PolarHBondContact O-N 3.2Å; F121-R123 VanDerWaalsContact C-N 3.33Å; F121-R123 PolarHBondContact O-N 3.21Å; R123-V125 VanDerWaalsContact C-N 3.31Å; R123-V125 PolarHBondContact O-N 3.23Å; R123-Q126 PolarHBondContact O-N 3.04Å; R123-Q126 VanDerWaalsContact O-N 3.14Å; R123-D127 WeakPolarHBondContact O-CB 3.27Å; R123-D127 PolarHBondContact O-N 2.83Å
124	L	96	Very high	94.3	Very high	12 Å²	12	53.2 Å²	53.2	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-36.5	-177.8	-67.2	175.1	0	0	0	113.1	E120 F121 S128 L453 E456 F457	E120-L124 HydrophobicContact CG-CD1 4.39Å; E120-L124 WeakPolarHBondContact O-CG 3.36Å; E120-L124 PolarHBondContact O-N 3.08Å; F121-L124 PolarHBondContact O-N 3.12Å; L124-S128 VanDerWaalsContact O-CB 3.32Å; L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 3.37Å; L124-S128 VanDerWaalsContact O-N 3.13Å; L124-S128 PolarHBondContact O-OG 3.02Å; L124-L453 HydrophobicContact CB-CD2 3.45Å; L124-L453 VanDerWaalsContact CB-CD2 3.45Å; L124-L453 HydrophobicContact CD1-CD2 4.42Å; L124-E456 HydrophobicContact CD1-CB 3.95Å; L124-E456 HydrophobicContact CD2-CB 3.8Å; L124-E456 HydrophobicContact CD2-CG 4.07Å; L124-E456 HydrophobicContact CG-CB 4.49Å; L124-F457 HydrophobicContact CD1-CD1 3.83Å; L124-F457 HydrophobicContact CD1-CE1 3.47Å; L124-F457 VanDerWaalsContact CD1-CE1 3.47Å; L124-F457 HydrophobicContact CD1-CG 4.49Å; L124-F457 HydrophobicContact CD1-CZ 3.85Å
125	V	95.8	Very high	94.2	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.03	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-48.8	172.9	170.4	0	0	0	0	110.3	F121 R122 R123 S128 I129 L325 Y328 L453	F121-V125 HydrophobicContact CD1-CG2 4.29Å; F121-V125 HydrophobicContact CD2-CG2 4.42Å; F121-V125 HydrophobicContact CE1-CG2 3.92Å; F121-V125 HydrophobicContact CE2-CG2 4.08Å; F121-V125 HydrophobicContact CZ-CG2 3.82Å; F121-V125 WeakPolarHBondContact O-CB 3.43Å; F121-V125 VanDerWaalsContact O-CG2 3.31Å; F121-V125 WeakPolarHBondContact O-CG2 3.45Å; F121-V125 PolarHBondContact O-N 2.82Å; R122-V125 PolarHBondContact O-N 3.25Å; R123-V125 VanDerWaalsContact C-N 3.31Å; R123-V125 PolarHBondContact O-N 3.23Å; V125-S128 WeakPolarHBondContact O-CB 3.45Å; V125-S128 PolarHBondContact O-N 2.87Å; V125-I129 HydrophobicContact CG1-CD1 3.53Å; V125-I129 WeakPolarHBondContact O-CD1 3.46Å; V125-I129 VanDerWaalsContact O-CG1 3.24Å; V125-I129 WeakPolarHBondContact O-CG1 3.37Å; V125-I129 PolarHBondContact O-N 3.14Å; V125-I129 VanDerWaalsContact O-N 3.11Å; V125-L325 HydrophobicContact CG2-CD2 4.18Å; V125-Y328 HydrophobicContact CG1-CE1 4.17Å; V125-L453 HydrophobicContact CG2-CD1 3.9Å; V125-L453 HydrophobicContact CG2-CD2 4.26Å
126	Q	95.3	Very high	94.3	Very high	52 Å²	52	47.7 Å²	47.7	24%	0.243	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-52.9	178.3	-75.4	177	-20.8	0	0	111.4	R122 R123 S128 I129 M130 L283	R122-Q126 HydrophobicContact CG-CG 4.33Å; R122-Q126 WeakPolarHBondContact O-CB 3.25Å; R122-Q126 VanDerWaalsContact O-CG 3.22Å; R122-Q126 WeakPolarHBondContact O-CG 3.44Å; R122-Q126 PolarHBondContact O-N 3.29Å; R123-Q126 PolarHBondContact O-N 3.04Å; R123-Q126 VanDerWaalsContact O-N 3.14Å; Q126-S128 PolarHBondContact O-N 3.26Å; Q126-S128 VanDerWaalsContact O-N 3.15Å; Q126-I129 PolarHBondContact O-N 3.39Å; Q126-M130 HydrophobicContact CB-CE 4.13Å; Q126-M130 VanDerWaalsContact O-CG 3.28Å; Q126-M130 WeakPolarHBondContact O-CG 3.46Å; Q126-M130 PolarHBondContact O-N 3.15Å; Q126-L283 HydrophobicContact CB-CD2 4.35Å; Q126-L283 HydrophobicContact CG-CD2 4.14Å; Q126-L283 PolarHBondContact NE2-O 3.38Å
127	D	94.7	Very high	94.4	Very high	92 Å²	92	49.1 Å²	49.1	49%	0.492	24%	0.235	S	C	.	.	H	α-helix	trans	-54.8	-36.9	178.5	-66.9	-17.4	0	0	0	111.8	R123	R123-D127 WeakPolarHBondContact O-CB 3.27Å; R123-D127 PolarHBondContact O-N 2.83Å
128	S	93.2	Very high	94.5	Very high	8 Å²	8	52.1 Å²	52.1	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-35.4	177.1	-66.5	0	0	0	0	113.4	L124 V125 Q126 F445 K452	L124-S128 VanDerWaalsContact O-CB 3.32Å; L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 3.37Å; L124-S128 VanDerWaalsContact O-N 3.13Å; L124-S128 PolarHBondContact O-OG 3.02Å; V125-S128 WeakPolarHBondContact O-CB 3.45Å; V125-S128 PolarHBondContact O-N 2.87Å; Q126-S128 PolarHBondContact O-N 3.26Å; Q126-S128 VanDerWaalsContact O-N 3.15Å; S128-F445 VanDerWaalsContact O-CZ 3.28Å; S128-F445 WeakPolarHBondContact O-CZ 3.46Å; S128-K452 PolarHBondContact OG-NZ 3.46Å
129	I	94.2	Very high	94.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-88.9	-27.2	-175.7	-62.1	164.1	0	0	0	112	V125 Q126 N131 L132 V133 I279 L283 Y328 F445 W446	V125-I129 HydrophobicContact CG1-CD1 3.53Å; V125-I129 WeakPolarHBondContact O-CD1 3.46Å; V125-I129 VanDerWaalsContact O-CG1 3.24Å; V125-I129 WeakPolarHBondContact O-CG1 3.37Å; V125-I129 PolarHBondContact O-N 3.14Å; V125-I129 VanDerWaalsContact O-N 3.11Å; Q126-I129 PolarHBondContact O-N 3.39Å; I129-N131 VanDerWaalsContact C-N 3.31Å; I129-N131 PolarHBondContact O-N 3.47Å; I129-L132 WeakPolarHBondContact O-CA 3.14Å; I129-L132 VanDerWaalsContact O-CB 3.24Å; I129-L132 WeakPolarHBondContact O-CB 3.48Å; I129-L132 PolarHBondContact O-N 2.9Å; I129-V133 HydrophobicContact CG2-CG2 4.01Å; I129-V133 PolarHBondContact O-N 3.03Å; I129-V133 VanDerWaalsContact O-N 3.09Å; I129-I279 HydrophobicContact CG2-CG2 3.64Å; I129-L283 HydrophobicContact CB-CD2 3.71Å; I129-L283 HydrophobicContact CD1-CD2 4.35Å; I129-L283 HydrophobicContact CG2-CD2 3.63Å; I129-L283 HydrophobicContact CG2-CG 4.21Å; I129-Y328 HydrophobicContact CD1-CE1 4.04Å; I129-F445 HydrophobicContact CG1-CE1 4.06Å; I129-F445 HydrophobicContact CG1-CZ 4.22Å; I129-W446 HydrophobicContact CD1-CH2 4.04Å; I129-W446 HydrophobicContact CD1-CZ3 3.56Å; I129-W446 HydrophobicContact CG1-CH2 3.91Å; I129-W446 HydrophobicContact CG1-CZ3 3.62Å; I129-W446 HydrophobicContact CG2-CH2 4.02Å
130	M	94.8	Very high	94.4	Very high	72 Å²	72	46.6 Å²	46.6	36%	0.355	23%	0.229	S	C	.	.	H	α-helix	trans	-55.7	-42.8	-173.5	-77	-52.3	169.2	0	0	113.5	Q126 L132 V133 L134 L283	Q126-M130 HydrophobicContact CB-CE 4.13Å; Q126-M130 VanDerWaalsContact O-CG 3.28Å; Q126-M130 WeakPolarHBondContact O-CG 3.46Å; Q126-M130 PolarHBondContact O-N 3.15Å; M130-L132 PolarHBondContact O-N 3.16Å; M130-V133 PolarHBondContact O-N 3.32Å; M130-L134 WeakPolarHBondContact O-CG 3.35Å; M130-L134 PolarHBondContact O-N 2.91Å; M130-L283 HydrophobicContact CE-CD1 3.56Å; M130-L283 HydrophobicContact CE-CD2 3.74Å; M130-L283 HydrophobicContact CE-CG 4.21Å; M130-L283 HydrophobicContact SD-CD1 3.58Å; M130-L283 VanDerWaalsContact SD-CD1 3.58Å; M130-L283 HydrophobicContact SD-CD2 4.1Å
131	N	92.4	Very high	94.4	Very high	120 Å²	120	49.2 Å²	49.2	64%	0.642	24%	0.244	S	C	*	.	H	α-helix	trans	-60.6	-35.4	177.6	-72	-26.3	0	0	0	112.2	I129 A135	I129-N131 VanDerWaalsContact C-N 3.31Å; I129-N131 PolarHBondContact O-N 3.47Å; N131-A135 VanDerWaalsContact O-CB 3.25Å; N131-A135 WeakPolarHBondContact O-CB 3.46Å; N131-A135 PolarHBondContact O-N 3.48Å
132	L	93	Very high	94.3	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.052	25%	0.25	C	C	.	.	H	α-helix	trans	-68.3	-45	176.7	-175.1	63.4	0	0	0	111.2	I129 M130 A135 F136 I279 T442 F445 W446	I129-L132 WeakPolarHBondContact O-CA 3.14Å; I129-L132 VanDerWaalsContact O-CB 3.24Å; I129-L132 WeakPolarHBondContact O-CB 3.48Å; I129-L132 PolarHBondContact O-N 2.9Å; M130-L132 PolarHBondContact O-N 3.16Å; L132-A135 PolarHBondContact O-N 3.39Å; L132-F136 HydrophobicContact CD1-CD2 3.68Å; L132-F136 HydrophobicContact CD1-CE2 3.53Å; L132-F136 HydrophobicContact CG-CD2 4.23Å; L132-F136 HydrophobicContact CG-CE2 4.43Å; L132-F136 WeakPolarHBondContact O-CD2 3.41Å; L132-F136 PolarHBondContact O-N 2.89Å; L132-I279 HydrophobicContact CB-CG2 4.34Å; L132-I279 HydrophobicContact CD1-CD1 4.4Å; L132-I279 HydrophobicContact CD2-CD1 3.93Å; L132-I279 HydrophobicContact CD2-CG1 4.2Å; L132-I279 HydrophobicContact CD2-CG2 3.81Å; L132-I279 HydrophobicContact CG-CD1 3.76Å; L132-I279 HydrophobicContact CG-CG1 4.47Å; L132-I279 HydrophobicContact CG-CG2 3.97Å; L132-T442 HydrophobicContact CD1-CG2 3.27Å; L132-F445 HydrophobicContact CD2-CD1 4.29Å; L132-F445 HydrophobicContact CD2-CE1 4.43Å; L132-W446 HydrophobicContact CD2-CH2 4.42Å; L132-W446 HydrophobicContact CD2-CZ2 3.89Å
133	V	94.8	Very high	94.3	Very high	19 Å²	19	44.5 Å²	44.5	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-50.5	176.6	173.5	0	0	0	0	111	I129 M130 A135 F136 K137 I279 L283	I129-V133 HydrophobicContact CG2-CG2 4.01Å; I129-V133 PolarHBondContact O-N 3.03Å; I129-V133 VanDerWaalsContact O-N 3.09Å; M130-V133 PolarHBondContact O-N 3.32Å; V133-A135 VanDerWaalsContact C-N 3.34Å; V133-A135 PolarHBondContact O-N 3.49Å; V133-F136 PolarHBondContact O-N 3.5Å; V133-K137 VanDerWaalsContact O-CB 3.29Å; V133-K137 WeakPolarHBondContact O-CB 3.48Å; V133-K137 PolarHBondContact O-N 3.15Å; V133-I279 HydrophobicContact CG2-CB 4.21Å; V133-I279 HydrophobicContact CG2-CG2 3.46Å; V133-I279 VanDerWaalsContact CG2-CG2 3.46Å; V133-L283 HydrophobicContact CG2-CD1 3.91Å; V133-L283 HydrophobicContact CG2-CG 4.36Å
134	L	94.8	Very high	94.2	Very high	114 Å²	114	41.5 Å²	41.5	60%	0.597	22%	0.222	S	C	*	.	H	α-helix	trans	-63.2	-41.2	-179.4	-67.1	175.6	0	0	0	111.7	M130 S138	M130-L134 WeakPolarHBondContact O-CG 3.35Å; M130-L134 PolarHBondContact O-N 2.91Å; L134-S138 WeakPolarHBondContact O-CB 3.48Å; L134-S138 PolarHBondContact O-N 2.84Å
135	A	92.6	Very high	94.1	Very high	18 Å²	18	47.6 Å²	47.6	15%	0.149	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-53.2	177.4	0	0	0	0	0	111.5	N131 L132 V133 K137 S138 R139	N131-A135 VanDerWaalsContact O-CB 3.25Å; N131-A135 WeakPolarHBondContact O-CB 3.46Å; N131-A135 PolarHBondContact O-N 3.48Å; L132-A135 PolarHBondContact O-N 3.39Å; V133-A135 VanDerWaalsContact C-N 3.34Å; V133-A135 PolarHBondContact O-N 3.49Å; A135-K137 PolarHBondContact O-N 2.86Å; A135-S138 PolarHBondContact O-N 2.93Å; A135-R139 WeakPolarHBondContact O-CD 3.17Å; A135-R139 PolarHBondContact O-N 3.5Å; A135-R139 VanDerWaalsContact O-N 3.09Å
136	F	94.8	Very high	94	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.013	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-42.8	-179.8	-90.7	-100.6	0	0	0	112.2	L132 V133 R139 T140 I279 W335 Y338 L339 M435	L132-F136 HydrophobicContact CD1-CD2 3.68Å; L132-F136 HydrophobicContact CD1-CE2 3.53Å; L132-F136 HydrophobicContact CG-CD2 4.23Å; L132-F136 HydrophobicContact CG-CE2 4.43Å; L132-F136 WeakPolarHBondContact O-CD2 3.41Å; L132-F136 PolarHBondContact O-N 2.89Å; V133-F136 PolarHBondContact O-N 3.5Å; F136-R139 PolarHBondContact O-N 2.93Å; F136-T140 WeakPolarHBondContact O-CB 3.08Å; F136-T140 PolarHBondContact O-N 3.17Å; F136-T140 PolarHBondContact O-OG1 2.64Å; F136-I279 HydrophobicContact CB-CD1 4.28Å; F136-I279 HydrophobicContact CD1-CD1 4.22Å; F136-I279 HydrophobicContact CD2-CD1 3.79Å; F136-I279 HydrophobicContact CE2-CD1 4.22Å; F136-I279 HydrophobicContact CG-CD1 3.8Å; F136-W335 HydrophobicContact CD1-CH2 4.24Å; F136-W335 AromaticContact CE1-CH2 3.64Å; F136-W335 HydrophobicContact CE1-CH2 3.64Å; F136-W335 HydrophobicContact CE1-CZ2 4.08Å; F136-W335 HydrophobicContact CE2-CH2 4.06Å; F136-W335 AromaticContact CE2-CZ2 3.8Å; F136-W335 HydrophobicContact CE2-CZ2 3.8Å; F136-W335 AromaticContact CZ-CH2 3.55Å; F136-W335 HydrophobicContact CZ-CH2 3.55Å; F136-W335 AromaticContact CZ-CZ2 3.48Å; F136-W335 HydrophobicContact CZ-CZ2 3.48Å; F136-W335 VanDerWaalsContact CZ-CZ2 3.48Å; F136-Y338 HydrophobicContact CE1-CE1 4.34Å; F136-L339 HydrophobicContact CE1-CD2 4.39Å; F136-L339 HydrophobicContact CZ-CD2 3.79Å; F136-M435 HydrophobicContact CD1-CE 4.36Å; F136-M435 HydrophobicContact CE1-CE 3.72Å; F136-M435 HydrophobicContact CZ-CE 3.86Å
137	K	94.9	Very high	93.9	Very high	95 Å²	95	45.7 Å²	45.7	41%	0.413	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-46	179.4	-170.1	63.9	171.7	-174.4	0	111.9	V133 A135 R139 T140 N141	V133-K137 VanDerWaalsContact O-CB 3.29Å; V133-K137 WeakPolarHBondContact O-CB 3.48Å; V133-K137 PolarHBondContact O-N 3.15Å; A135-K137 PolarHBondContact O-N 2.86Å; K137-R139 PolarHBondContact O-N 3.49Å; K137-T140 PolarHBondContact O-N 3.31Å; K137-N141 VanDerWaalsContact O-CG 3.28Å; K137-N141 PolarHBondContact O-N 3.18Å; K137-N141 VanDerWaalsContact O-N 3.08Å; K137-N141 PolarHBondContact O-ND2 3.04Å
138	S	94.5	Very high	93.9	Very high	63 Å²	63	45.2 Å²	45.2	44%	0.441	23%	0.227	S	C	.	.	H	α-helix	trans	-59.6	-46.1	178.3	171.6	0	0	0	0	111.8	L134 A135 N141 G142	L134-S138 WeakPolarHBondContact O-CB 3.48Å; L134-S138 PolarHBondContact O-N 2.84Å; A135-S138 PolarHBondContact O-N 2.93Å; S138-N141 PolarHBondContact O-N 3.23Å; S138-G142 PolarHBondContact O-N 2.92Å
139	R	93.4	Very high	93.9	Very high	44 Å²	44	50.2 Å²	50.2	17%	0.166	25%	0.249	C	C	.	.	H	α-helix	trans	-70.2	-39.8	-178.9	-84.1	72.3	-170.1	158.9	2.7	111.6	A135 F136 K137 N141 G142 F143 D434 M435	A135-R139 WeakPolarHBondContact O-CD 3.17Å; A135-R139 PolarHBondContact O-N 3.5Å; A135-R139 VanDerWaalsContact O-N 3.09Å; F136-R139 PolarHBondContact O-N 2.93Å; K137-R139 PolarHBondContact O-N 3.49Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 3.41Å; R139-G142 PolarHBondContact O-N 3.02Å; R139-G142 VanDerWaalsContact O-N 3.09Å; R139-F143 VanDerWaalsContact O-CD2 3.31Å; R139-F143 WeakPolarHBondContact O-CD2 3.45Å; R139-F143 PolarHBondContact O-N 3.26Å; R139-D434 IonicContact CZ-OD1 2.83Å; R139-D434 IonicContact CZ-OD2 3.64Å; R139-D434 IonicContact NE-OD1 3.71Å; R139-D434 IonicContact NE-OD2 3.71Å; R139-D434 PolarHBondContact NE-OD2 3.26Å; R139-D434 VanDerWaalsContact NH2-CG 3.27Å; R139-D434 IonicContact NH2-OD1 3.86Å; R139-D434 PolarHBondContact NH2-OD1 2.72Å; R139-D434 IonicContact NH2-OD2 2.73Å; R139-D434 PolarHBondContact NH2-OD2 3.09Å; R139-M435 HydrophobicContact CB-SD 3.9Å; R139-M435 HydrophobicContact CG-SD 4.03Å
140	T	94	Very high	93.9	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.043	25%	0.251	C	S	.	.	H	α-helix	trans	-53.9	-48.7	173	-54.7	0	0	0	0	111	F136 K137 G142 D144 L272 T273	F136-T140 WeakPolarHBondContact O-CB 3.08Å; F136-T140 PolarHBondContact O-N 3.17Å; F136-T140 PolarHBondContact O-OG1 2.64Å; K137-T140 PolarHBondContact O-N 3.31Å; T140-G142 VanDerWaalsContact C-N 3.35Å; T140-G142 PolarHBondContact O-N 3.15Å; T140-D144 WeakPolarHBondContact O-CB 3.44Å; T140-D144 PolarHBondContact O-N 3.34Å; T140-L272 HydrophobicContact CG2-CB 4.17Å; T140-T273 WeakPolarHBondContact CG2-OG1 3.19Å
141	N	93.7	Very high	94	Very high	78 Å²	78	47.2 Å²	47.2	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-66.4	-36.5	177.6	-66.1	-14.1	0	0	0	112.4	K137 S138 R139 D144 R145	K137-N141 VanDerWaalsContact O-CG 3.28Å; K137-N141 PolarHBondContact O-N 3.18Å; K137-N141 VanDerWaalsContact O-N 3.08Å; K137-N141 PolarHBondContact O-ND2 3.04Å; S138-N141 PolarHBondContact O-N 3.23Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 3.41Å; N141-D144 PolarHBondContact O-N 2.86Å; N141-R145 VanDerWaalsContact O-CB 3.31Å; N141-R145 WeakPolarHBondContact O-CB 3.38Å; N141-R145 PolarHBondContact O-N 3.48Å
142	G	93.3	Very high	94.1	Very high	14 Å²	14	43.3 Å²	43.3	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-51.7	177.4	0	0	0	0	0	112.6	S138 R139 T140 F146	S138-G142 PolarHBondContact O-N 2.92Å; R139-G142 PolarHBondContact O-N 3.02Å; R139-G142 VanDerWaalsContact O-N 3.09Å; T140-G142 VanDerWaalsContact C-N 3.35Å; T140-G142 PolarHBondContact O-N 3.15Å; G142-F146 WeakPolarHBondContact O-CB 3.45Å; G142-F146 PolarHBondContact O-N 3.3Å
143	F	94.7	Very high	94.2	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-64.7	-40.6	176	-77.5	-81.1	0	0	0	112.3	R139 R145 F146 F147 F268 I269 L272 L346 L431 M435	R139-F143 VanDerWaalsContact O-CD2 3.31Å; R139-F143 WeakPolarHBondContact O-CD2 3.45Å; R139-F143 PolarHBondContact O-N 3.26Å; F143-R145 PolarHBondContact O-N 3.48Å; F143-F146 PolarHBondContact O-N 2.8Å; F143-F147 HydrophobicContact CB-CE2 4.29Å; F143-F147 HydrophobicContact CD1-CE2 4.44Å; F143-F147 HydrophobicContact CD1-CZ 4.22Å; F143-F147 WeakPolarHBondContact O-CD2 3.26Å; F143-F147 WeakPolarHBondContact O-CG 2.95Å; F143-F147 PolarHBondContact O-N 2.73Å; F143-F268 AromaticContact CD1-CE1 3.9Å; F143-F268 HydrophobicContact CD1-CE1 3.9Å; F143-F268 AromaticContact CD2-CE1 3.79Å; F143-F268 HydrophobicContact CD2-CE1 3.79Å; F143-F268 HydrophobicContact CD2-CZ 4.49Å; F143-F268 AromaticContact CE1-CE1 3.82Å; F143-F268 HydrophobicContact CE1-CE1 3.82Å; F143-F268 HydrophobicContact CE1-CZ 4.47Å; F143-F268 AromaticContact CE2-CE1 3.72Å; F143-F268 HydrophobicContact CE2-CE1 3.72Å; F143-F268 HydrophobicContact CE2-CZ 4.04Å; F143-F268 AromaticContact CG-CE1 3.89Å; F143-F268 HydrophobicContact CG-CE1 3.89Å; F143-F268 AromaticContact CZ-CE1 3.73Å; F143-F268 HydrophobicContact CZ-CE1 3.73Å; F143-F268 HydrophobicContact CZ-CZ 4.02Å; F143-I269 HydrophobicContact CB-CD1 3.27Å; F143-I269 HydrophobicContact CG-CD1 4.41Å; F143-L272 HydrophobicContact CD2-CD1 3.8Å; F143-L272 HydrophobicContact CE2-CD1 4.3Å; F143-L272 HydrophobicContact CG-CD1 4.46Å; F143-L346 HydrophobicContact CE1-CD1 4.17Å; F143-L346 HydrophobicContact CZ-CD1 3.97Å; F143-L431 HydrophobicContact CD1-CB 4.12Å; F143-L431 HydrophobicContact CD1-CD1 4.18Å; F143-L431 HydrophobicContact CE1-CB 3.62Å; F143-L431 HydrophobicContact CE1-CD1 4.47Å; F143-L431 HydrophobicContact CE2-CB 4.3Å; F143-L431 HydrophobicContact CZ-CB 3.72Å; F143-L431 WeakPolarHBondContact CZ-O 3.32Å; F143-M435 HydrophobicContact CE2-CB 3.88Å; F143-M435 HydrophobicContact CE2-CG 4.23Å; F143-M435 HydrophobicContact CZ-CB 4.16Å
144	D	93	Very high	94.2	Very high	43 Å²	43	45.7 Å²	45.7	23%	0.23	23%	0.227	C	C	.	.	H	α-helix	trans	-63.5	-43.7	179.8	-177.9	58.8	0	0	0	111.9	T140 N141 R148 Y188 I269	T140-D144 WeakPolarHBondContact O-CB 3.44Å; T140-D144 PolarHBondContact O-N 3.34Å; N141-D144 PolarHBondContact O-N 2.86Å; D144-R148 VanDerWaalsContact CG-NE 3.3Å; D144-R148 WeakPolarHBondContact O-CD 3.48Å; D144-R148 VanDerWaalsContact O-CG 3.23Å; D144-R148 WeakPolarHBondContact O-CG 3.05Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 IonicContact OD1-CZ 2.62Å; D144-R148 IonicContact OD1-NE 2.99Å; D144-R148 PolarHBondContact OD1-NE 3.44Å; D144-R148 VanDerWaalsContact OD1-NE 3.15Å; D144-R148 IonicContact OD1-NH2 2.85Å; D144-R148 IonicContact OD2-CZ 2.69Å; D144-R148 IonicContact OD2-NE 3.19Å; D144-R148 PolarHBondContact OD2-NE 3.46Å; D144-R148 IonicContact OD2-NH2 2.67Å; D144-Y188 WeakPolarHBondContact CA-OH 3.21Å; D144-Y188 WeakPolarHBondContact OD1-CE1 3.43Å; D144-Y188 PolarHBondContact OD1-OH 3.11Å; D144-I269 HydrophobicContact CB-CD1 4.26Å
145	R	93.9	Very high	94.3	Very high	141 Å²	141	40.9 Å²	40.9	53%	0.532	20%	0.202	S	C	.	.	H	α-helix	trans	-57.8	-51.2	173.7	-179.1	-176.1	-59	116.8	-0.3	110.8	N141 F143 F147 R148 E149	N141-R145 VanDerWaalsContact O-CB 3.31Å; N141-R145 WeakPolarHBondContact O-CB 3.38Å; N141-R145 PolarHBondContact O-N 3.48Å; F143-R145 PolarHBondContact O-N 3.48Å; R145-F147 PolarHBondContact O-N 3.06Å; R145-R148 PolarHBondContact O-N 2.96Å; R145-E149 VanDerWaalsContact CD-OE1 3.32Å; R145-E149 WeakPolarHBondContact CD-OE1 3.41Å; R145-E149 HydrophobicContact CG-CG 4.3Å; R145-E149 WeakPolarHBondContact CG-OE1 3.48Å; R145-E149 WeakPolarHBondContact O-CG 3.33Å; R145-E149 PolarHBondContact O-N 2.75Å
146	F	94.1	Very high	94.5	Very high	17 Å²	17	43.7 Å²	43.7	8%	0.075	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-48	-177.8	163	-110.6	0	0	0	112.8	G142 F143 R148 E149 L150 E356 S427 M428 L431	G142-F146 WeakPolarHBondContact O-CB 3.45Å; G142-F146 PolarHBondContact O-N 3.3Å; F143-F146 PolarHBondContact O-N 2.8Å; F146-R148 VanDerWaalsContact C-N 3.32Å; F146-R148 PolarHBondContact O-N 2.97Å; F146-E149 PolarHBondContact O-N 3.32Å; F146-L150 HydrophobicContact CE2-CB 4.5Å; F146-L150 HydrophobicContact CZ-CD2 4.28Å; F146-L150 WeakPolarHBondContact O-CB 3.39Å; F146-L150 PolarHBondContact O-N 3.28Å; F146-E356 HydrophobicContact CE2-CG 4.25Å; F146-E356 HydrophobicContact CZ-CG 3.54Å; F146-E356 VanDerWaalsContact CZ-OE2 3.3Å; F146-E356 WeakPolarHBondContact CZ-OE2 3.21Å; F146-S427 WeakPolarHBondContact CE2-OG 3.34Å; F146-M428 HydrophobicContact CE1-CB 3.89Å; F146-M428 HydrophobicContact CE1-CG 4.5Å; F146-M428 HydrophobicContact CZ-CB 3.99Å; F146-L431 HydrophobicContact CB-CD1 3.54Å; F146-L431 HydrophobicContact CD1-CD1 3.7Å; F146-L431 HydrophobicContact CD2-CD1 4.33Å; F146-L431 HydrophobicContact CG-CD1 3.56Å
147	F	93.9	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-35.4	179.5	-66.9	-37.6	0	0	0	113	F143 R145 L151 Y188 A265 I269 I355	F143-F147 HydrophobicContact CB-CE2 4.29Å; F143-F147 HydrophobicContact CD1-CE2 4.44Å; F143-F147 HydrophobicContact CD1-CZ 4.22Å; F143-F147 WeakPolarHBondContact O-CD2 3.26Å; F143-F147 WeakPolarHBondContact O-CG 2.95Å; F143-F147 PolarHBondContact O-N 2.73Å; R145-F147 PolarHBondContact O-N 3.06Å; F147-L151 WeakPolarHBondContact O-CG 3.42Å; F147-L151 PolarHBondContact O-N 2.86Å; F147-Y188 HydrophobicContact CB-CD2 4.4Å; F147-Y188 HydrophobicContact CB-CE1 4.19Å; F147-Y188 HydrophobicContact CB-CE2 3.66Å; F147-Y188 AromaticContact CD2-CE2 3.61Å; F147-Y188 HydrophobicContact CD2-CE2 3.61Å; F147-Y188 AromaticContact CD2-CZ 3.89Å; F147-Y188 AromaticContact CG-CE2 3.97Å; F147-Y188 HydrophobicContact CG-CE2 3.97Å; F147-A265 HydrophobicContact CD2-CB 4.26Å; F147-A265 HydrophobicContact CE1-CB 4.2Å; F147-A265 HydrophobicContact CE2-CB 3.84Å; F147-A265 HydrophobicContact CZ-CB 3.81Å; F147-I269 HydrophobicContact CD2-CD1 3.97Å; F147-I269 HydrophobicContact CD2-CG1 3.76Å; F147-I269 HydrophobicContact CE2-CD1 3.88Å; F147-I269 HydrophobicContact CE2-CG1 3.7Å; F147-I355 HydrophobicContact CD1-CD1 4.38Å; F147-I355 HydrophobicContact CD1-CG2 3.68Å; F147-I355 HydrophobicContact CE1-CG2 3.44Å; F147-I355 VanDerWaalsContact CE1-CG2 3.44Å
148	R	93.5	Very high	94.6	Very high	82 Å²	82	41 Å²	41	31%	0.309	20%	0.199	S	C	.	.	H	α-helix	trans	-67.5	-46.3	175.6	-68.4	165.8	178.1	-73	-10.4	111.9	D144 R145 F146 L150 L151 A152 Y188 M189	D144-R148 VanDerWaalsContact CG-NE 3.3Å; D144-R148 WeakPolarHBondContact O-CD 3.48Å; D144-R148 VanDerWaalsContact O-CG 3.23Å; D144-R148 WeakPolarHBondContact O-CG 3.05Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 IonicContact OD1-CZ 2.62Å; D144-R148 IonicContact OD1-NE 2.99Å; D144-R148 PolarHBondContact OD1-NE 3.44Å; D144-R148 VanDerWaalsContact OD1-NE 3.15Å; D144-R148 IonicContact OD1-NH2 2.85Å; D144-R148 IonicContact OD2-CZ 2.69Å; D144-R148 IonicContact OD2-NE 3.19Å; D144-R148 PolarHBondContact OD2-NE 3.46Å; D144-R148 IonicContact OD2-NH2 2.67Å; R145-R148 PolarHBondContact O-N 2.96Å; F146-R148 VanDerWaalsContact C-N 3.32Å; F146-R148 PolarHBondContact O-N 2.97Å; R148-L150 VanDerWaalsContact C-N 3.32Å; R148-L150 PolarHBondContact O-N 3Å; R148-L151 PolarHBondContact O-N 3.42Å; R148-A152 PolarHBondContact O-N 3.07Å; R148-Y188 HydrophobicContact CG-CD1 4.44Å; R148-Y188 HydrophobicContact CG-CE1 3.85Å; R148-M189 VanDerWaalsContact NH1-CG 3.32Å; R148-M189 PolarHBondContact NH1-SD 3.33Å
149	E	93.8	Very high	94.7	Very high	113 Å²	113	40.4 Å²	40.4	53%	0.528	19%	0.189	S	C	.	.	H	α-helix	trans	-64.3	-38.8	178.6	-74.5	173.1	-176.7	0	0	111.4	R145 F146 L151 A152 K153	R145-E149 VanDerWaalsContact CD-OE1 3.32Å; R145-E149 WeakPolarHBondContact CD-OE1 3.41Å; R145-E149 HydrophobicContact CG-CG 4.3Å; R145-E149 WeakPolarHBondContact CG-OE1 3.48Å; R145-E149 WeakPolarHBondContact O-CG 3.33Å; R145-E149 PolarHBondContact O-N 2.75Å; F146-E149 PolarHBondContact O-N 3.32Å; E149-L151 PolarHBondContact O-N 3.05Å; E149-A152 PolarHBondContact O-N 2.88Å; E149-K153 WeakPolarHBondContact O-CB 3.45Å; E149-K153 PolarHBondContact O-N 2.87Å
150	L	95	Very high	94.9	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-57.9	-46.9	174.5	178.8	65.4	0	0	0	111.9	F146 R148 S154 I355 E356 I359 N360	F146-L150 HydrophobicContact CE2-CB 4.5Å; F146-L150 HydrophobicContact CZ-CD2 4.28Å; F146-L150 WeakPolarHBondContact O-CB 3.39Å; F146-L150 PolarHBondContact O-N 3.28Å; R148-L150 VanDerWaalsContact C-N 3.32Å; R148-L150 PolarHBondContact O-N 3Å; L150-S154 VanDerWaalsContact O-CB 3.28Å; L150-S154 WeakPolarHBondContact O-CB 3.19Å; L150-S154 PolarHBondContact O-N 3.25Å; L150-I355 HydrophobicContact CD2-CB 4.4Å; L150-I355 HydrophobicContact CD2-CG1 4.08Å; L150-I355 HydrophobicContact CD2-CG2 3.76Å; L150-E356 HydrophobicContact CD1-CG 3.96Å; L150-E356 HydrophobicContact CD2-CB 4.49Å; L150-E356 HydrophobicContact CD2-CG 3.76Å; L150-I359 HydrophobicContact CD1-CG2 4.45Å; L150-I359 HydrophobicContact CD2-CB 4.43Å; L150-I359 HydrophobicContact CD2-CG2 4.46Å; L150-I359 HydrophobicContact CG-CB 4.45Å; L150-I359 HydrophobicContact CG-CG2 3.98Å; L150-N360 VanDerWaalsContact CD1-OD1 3.29Å; L150-N360 WeakPolarHBondContact CD1-OD1 3.41Å
151	L	95	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-47.9	178.2	-69.9	169.5	0	0	0	111.7	F147 R148 E149 K153 S154 Q155 Y188 F262 I359	F147-L151 WeakPolarHBondContact O-CG 3.42Å; F147-L151 PolarHBondContact O-N 2.86Å; R148-L151 PolarHBondContact O-N 3.42Å; E149-L151 PolarHBondContact O-N 3.05Å; L151-K153 VanDerWaalsContact C-N 3.33Å; L151-K153 PolarHBondContact O-N 3.03Å; L151-S154 PolarHBondContact O-N 3.41Å; L151-Q155 PolarHBondContact O-N 2.92Å; L151-Y188 HydrophobicContact CD1-CD1 4.43Å; L151-Y188 HydrophobicContact CD1-CG 4.34Å; L151-F262 HydrophobicContact CD1-CE1 4.43Å; L151-F262 HydrophobicContact CD2-CE1 3.92Å; L151-F262 HydrophobicContact CD2-CZ 3.61Å; L151-I359 HydrophobicContact CD2-CD1 4.34Å; L151-I359 HydrophobicContact CD2-CG1 4.23Å; L151-I359 HydrophobicContact CD2-CG2 4.26Å
152	A	95.1	Very high	95	Very high	39 Å²	39	40.4 Å²	40.4	32%	0.322	20%	0.195	S	C	.	.	H	α-helix	trans	-64	-38.4	179	0	0	0	0	0	112.1	R148 E149 R156	R148-A152 PolarHBondContact O-N 3.07Å; E149-A152 PolarHBondContact O-N 2.88Å; A152-R156 WeakPolarHBondContact O-CG 3.48Å; A152-R156 PolarHBondContact O-N 3.05Å; A152-R156 PolarHBondContact O-NE 3.12Å
153	K	95.2	Very high	95.2	Very high	79 Å²	79	43.1 Å²	43.1	34%	0.343	21%	0.205	S	C	.	.	H	α-helix	trans	-64.7	-49	174.4	-172.6	-168	-178.9	-52.9	0	110.9	E149 L151 Q155 R156 D157 R419	E149-K153 WeakPolarHBondContact O-CB 3.45Å; E149-K153 PolarHBondContact O-N 2.87Å; L151-K153 VanDerWaalsContact C-N 3.33Å; L151-K153 PolarHBondContact O-N 3.03Å; K153-Q155 VanDerWaalsContact C-N 3.27Å; K153-Q155 PolarHBondContact O-N 2.83Å; K153-R156 WeakPolarHBondContact O-CB 3.31Å; K153-R156 PolarHBondContact O-N 3.13Å; K153-R156 VanDerWaalsContact O-N 3.1Å; K153-D157 IonicContact NZ-OD1 3.66Å; K153-D157 PolarHBondContact NZ-OD1 3.38Å; K153-D157 IonicContact NZ-OD2 3.57Å; K153-D157 PolarHBondContact NZ-OD2 3.32Å; K153-D157 VanDerWaalsContact O-CG 3.26Å; K153-D157 PolarHBondContact O-N 3.14Å; K153-R419 VanDerWaalsContact NZ-NH2 3.16Å
154	S	95.7	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-36.5	179.7	174.8	0	0	0	0	112.5	L150 L151 D157 L158 F181 I359 I362	L150-S154 VanDerWaalsContact O-CB 3.28Å; L150-S154 WeakPolarHBondContact O-CB 3.19Å; L150-S154 PolarHBondContact O-N 3.25Å; L151-S154 PolarHBondContact O-N 3.41Å; S154-D157 PolarHBondContact O-N 2.99Å; S154-L158 PolarHBondContact O-N 2.87Å; S154-F181 WeakPolarHBondContact OG-CE1 3.3Å; S154-F181 WeakPolarHBondContact OG-CZ 3.26Å; S154-I359 WeakPolarHBondContact OG-CG2 3.49Å; S154-I359 PolarHBondContact OG-O 3.2Å; S154-I362 WeakPolarHBondContact OG-CG2 3.48Å
155	Q	97	Very high	95	Very high	13 Å²	13	51.6 Å²	51.6	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-42.2	173.5	-165.7	-177.5	-0.1	0	0	112.7	L151 K153 H159 F181 W650	L151-Q155 PolarHBondContact O-N 2.92Å; K153-Q155 VanDerWaalsContact C-N 3.27Å; K153-Q155 PolarHBondContact O-N 2.83Å; Q155-H159 PolarHBondContact O-N 3.48Å; Q155-F181 HydrophobicContact CB-CB 4.13Å; Q155-F181 HydrophobicContact CB-CD1 3.67Å; Q155-F181 HydrophobicContact CB-CD2 3.91Å; Q155-F181 HydrophobicContact CB-CE1 3.94Å; Q155-F181 HydrophobicContact CB-CE2 4.15Å; Q155-F181 HydrophobicContact CB-CG 3.64Å; Q155-F181 HydrophobicContact CB-CZ 4.16Å; Q155-F181 HydrophobicContact CG-CB 3.69Å; Q155-F181 HydrophobicContact CG-CD1 4.11Å; Q155-F181 HydrophobicContact CG-CD2 3.57Å; Q155-F181 HydrophobicContact CG-CE2 4.14Å; Q155-F181 HydrophobicContact CG-CG 3.53Å; Q155-W650 HydrophobicContact CB-CH2 4.15Å; Q155-W650 HydrophobicContact CB-CZ3 4.3Å; Q155-W650 VanDerWaalsContact CD-CH2 3.42Å; Q155-W650 HydrophobicContact CG-CH2 3.54Å; Q155-W650 HydrophobicContact CG-CZ3 4Å
156	R	96.1	Very high	94.9	Very high	77 Å²	77	45.8 Å²	45.8	29%	0.291	22%	0.22	S	C	.	.	H	α-helix	trans	-64.6	-46.3	174.5	-73.1	-177.6	-70.7	168.2	-4.1	111.4	A152 K153 L158 H159 T160 W650 D660	A152-R156 WeakPolarHBondContact O-CG 3.48Å; A152-R156 PolarHBondContact O-N 3.05Å; A152-R156 PolarHBondContact O-NE 3.12Å; K153-R156 WeakPolarHBondContact O-CB 3.31Å; K153-R156 PolarHBondContact O-N 3.13Å; K153-R156 VanDerWaalsContact O-N 3.1Å; R156-L158 VanDerWaalsContact C-N 3.32Å; R156-L158 PolarHBondContact O-N 3.14Å; R156-H159 PolarHBondContact O-N 3.1Å; R156-H159 VanDerWaalsContact O-N 3.14Å; R156-T160 PolarHBondContact O-N 3.45Å; R156-T160 PolarHBondContact O-OG1 3.17Å; R156-W650 HydrophobicContact CG-CD2 3.62Å; R156-W650 HydrophobicContact CG-CE3 3.79Å; R156-W650 HydrophobicContact CG-CG 4.12Å; R156-W650 HydrophobicContact CG-CH2 4.3Å; R156-W650 HydrophobicContact CG-CZ2 4.11Å; R156-W650 HydrophobicContact CG-CZ3 4.12Å; R156-D660 IonicContact NH1-OD1 3.34Å; R156-D660 PolarHBondContact NH1-OD1 2.9Å; R156-D660 VanDerWaalsContact NH1-OD1 3.11Å; R156-D660 IonicContact NH1-OD2 3.31Å
157	D	95.4	Very high	94.9	Very high	40 Å²	40	46 Å²	46	21%	0.214	23%	0.228	C	C	.	.	H	α-helix	trans	-56.2	-47.7	177.9	-66.8	-15	0	0	0	110.4	K153 S154 H159 T160 M161 R419	K153-D157 IonicContact NZ-OD1 3.66Å; K153-D157 PolarHBondContact NZ-OD1 3.38Å; K153-D157 IonicContact NZ-OD2 3.57Å; K153-D157 PolarHBondContact NZ-OD2 3.32Å; K153-D157 VanDerWaalsContact O-CG 3.26Å; K153-D157 PolarHBondContact O-N 3.14Å; S154-D157 PolarHBondContact O-N 2.99Å; D157-H159 PolarHBondContact O-N 2.81Å; D157-T160 PolarHBondContact O-N 3.24Å; D157-M161 WeakPolarHBondContact O-CB 3.34Å; D157-M161 PolarHBondContact O-N 2.95Å; D157-R419 IonicContact OD2-CZ 2.82Å; D157-R419 IonicContact OD2-NH1 3.38Å; D157-R419 PolarHBondContact OD2-NH1 3.48Å; D157-R419 IonicContact OD2-NH2 3.85Å; D157-R419 PolarHBondContact OD2-NH2 3.04Å
158	L	97.1	Very high	94.8	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-49	175.3	-173.7	148.2	0	0	0	111.3	S154 R156 T160 M161 F162 Y170 F177 F181 D363 I366	S154-L158 PolarHBondContact O-N 2.87Å; R156-L158 VanDerWaalsContact C-N 3.32Å; R156-L158 PolarHBondContact O-N 3.14Å; L158-T160 PolarHBondContact O-N 2.69Å; L158-M161 PolarHBondContact O-N 3.49Å; L158-F162 HydrophobicContact CD1-CE2 4.35Å; L158-F162 HydrophobicContact CD1-CZ 4.43Å; L158-F162 HydrophobicContact CD2-CB 4.42Å; L158-F162 HydrophobicContact CD2-CD1 4.21Å; L158-F162 HydrophobicContact CD2-CD2 4.11Å; L158-F162 HydrophobicContact CD2-CE2 4.48Å; L158-F162 HydrophobicContact CD2-CG 3.98Å; L158-F162 HydrophobicContact CG-CD2 3.89Å; L158-F162 HydrophobicContact CG-CE2 3.97Å; L158-F162 HydrophobicContact CG-CG 4.28Å; L158-F162 HydrophobicContact CG-CZ 4.42Å; L158-F162 VanDerWaalsContact O-CB 3.29Å; L158-F162 WeakPolarHBondContact O-CB 3.47Å; L158-F162 WeakPolarHBondContact O-CD2 3.27Å; L158-F162 PolarHBondContact O-N 2.99Å; L158-Y170 HydrophobicContact CD2-CE2 4Å; L158-F177 HydrophobicContact CD1-CD1 4.31Å; L158-F177 HydrophobicContact CD2-CB 3.89Å; L158-F177 HydrophobicContact CD2-CD1 4.18Å; L158-F177 HydrophobicContact CD2-CG 4.05Å; L158-F181 HydrophobicContact CB-CE2 4.18Å; L158-F181 HydrophobicContact CB-CZ 4.49Å; L158-F181 HydrophobicContact CD1-CE2 3.92Å; L158-D363 HydrophobicContact CB-CB 3.85Å; L158-D363 HydrophobicContact CD1-CB 4.23Å; L158-D363 HydrophobicContact CG-CB 4.02Å; L158-I366 HydrophobicContact CD1-CD1 3.88Å
159	H	96.7	Very high	94.7	Very high	49 Å²	49	48.8 Å²	48.8	23%	0.227	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-47.7	-179.5	175.5	90.3	0	0	0	111.7	Q155 R156 D157 F162 M163 Y170 W650	Q155-H159 PolarHBondContact O-N 3.48Å; R156-H159 PolarHBondContact O-N 3.1Å; R156-H159 VanDerWaalsContact O-N 3.14Å; D157-H159 PolarHBondContact O-N 2.81Å; H159-F162 PolarHBondContact O-N 3.24Å; H159-M163 WeakPolarHBondContact O-CB 3.3Å; H159-M163 VanDerWaalsContact O-CG 3.25Å; H159-M163 WeakPolarHBondContact O-CG 3.06Å; H159-M163 PolarHBondContact O-N 3.09Å; H159-Y170 VanDerWaalsContact CA-OH 3.32Å; H159-Y170 WeakPolarHBondContact CA-OH 3.35Å; H159-Y170 WeakPolarHBondContact CB-OH 3.19Å; H159-Y170 AromaticContact ND1-CE1 3.5Å; H159-Y170 AromaticContact ND1-CZ 3.75Å; H159-Y170 PolarHBondContact ND1-OH 3.18Å; H159-Y170 VanDerWaalsContact ND1-OH 3.09Å; H159-W650 HydrophobicContact CB-CZ2 4.42Å
160	T	96.1	Very high	94.7	Very high	96 Å²	96	43.9 Å²	43.9	59%	0.589	22%	0.224	S	C	*	.	H	α-helix	trans	-62	-46.5	178.6	-61.8	0	0	0	0	111.7	R156 D157 L158 K164	R156-T160 PolarHBondContact O-N 3.45Å; R156-T160 PolarHBondContact O-OG1 3.17Å; D157-T160 PolarHBondContact O-N 3.24Å; L158-T160 PolarHBondContact O-N 2.69Å; T160-K164 PolarHBondContact O-N 3.06Å
161	M	94.8	Very high	94.7	Very high	32 Å²	32	48.6 Å²	48.6	16%	0.158	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-44.8	178.8	-174.4	-139.3	-91.5	0	0	111.5	D157 L158 K164 T165 D363 I364	D157-M161 WeakPolarHBondContact O-CB 3.34Å; D157-M161 PolarHBondContact O-N 2.95Å; L158-M161 PolarHBondContact O-N 3.49Å; M161-K164 PolarHBondContact O-N 3.28Å; M161-T165 VanDerWaalsContact O-CB 3.29Å; M161-T165 WeakPolarHBondContact O-CB 3.37Å; M161-T165 PolarHBondContact O-N 3.09Å; M161-T165 PolarHBondContact O-OG1 2.96Å; M161-D363 HydrophobicContact CE-CB 3.79Å; M161-D363 VanDerWaalsContact CE-CG 3.43Å; M161-D363 VanDerWaalsContact CE-OD2 3.26Å; M161-D363 WeakPolarHBondContact CE-OD2 3.35Å; M161-D363 HydrophobicContact SD-CB 4.15Å; M161-I364 HydrophobicContact CE-CB 4.32Å; M161-I364 HydrophobicContact CE-CG1 3.41Å; M161-I364 VanDerWaalsContact CE-CG1 3.41Å
162	F	96.6	Very high	94.5	Very high	1 Å²	1	55 Å²	55	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-74.7	-35.1	-175	-83.3	-131.5	0	0	0	112.4	L158 H159 K164 T165 Y166 G167 Y170 F177 D363 I366 I370	L158-F162 HydrophobicContact CD1-CE2 4.35Å; L158-F162 HydrophobicContact CD1-CZ 4.43Å; L158-F162 HydrophobicContact CD2-CB 4.42Å; L158-F162 HydrophobicContact CD2-CD1 4.21Å; L158-F162 HydrophobicContact CD2-CD2 4.11Å; L158-F162 HydrophobicContact CD2-CE2 4.48Å; L158-F162 HydrophobicContact CD2-CG 3.98Å; L158-F162 HydrophobicContact CG-CD2 3.89Å; L158-F162 HydrophobicContact CG-CE2 3.97Å; L158-F162 HydrophobicContact CG-CG 4.28Å; L158-F162 HydrophobicContact CG-CZ 4.42Å; L158-F162 VanDerWaalsContact O-CB 3.29Å; L158-F162 WeakPolarHBondContact O-CB 3.47Å; L158-F162 WeakPolarHBondContact O-CD2 3.27Å; L158-F162 PolarHBondContact O-N 2.99Å; H159-F162 PolarHBondContact O-N 3.24Å; F162-K164 VanDerWaalsContact C-N 3.28Å; F162-K164 PolarHBondContact O-N 3.17Å; F162-T165 PolarHBondContact O-N 3.5Å; F162-Y166 HydrophobicContact CB-CD2 4.17Å; F162-Y166 AromaticContact CD1-CD2 3.71Å; F162-Y166 HydrophobicContact CD1-CD2 3.71Å; F162-Y166 AromaticContact CD1-CE2 3.86Å; F162-Y166 HydrophobicContact CD1-CE2 3.86Å; F162-Y166 HydrophobicContact CD2-CE2 4.41Å; F162-Y166 HydrophobicContact CE1-CD2 4.19Å; F162-Y166 AromaticContact CE1-CE2 3.88Å; F162-Y166 HydrophobicContact CE1-CE2 3.88Å; F162-Y166 HydrophobicContact CE2-CE2 4.4Å; F162-Y166 AromaticContact CG-CD2 3.91Å; F162-Y166 HydrophobicContact CG-CD2 3.91Å; F162-Y166 HydrophobicContact CG-CE2 4.14Å; F162-Y166 HydrophobicContact CZ-CE2 4.15Å; F162-Y166 WeakPolarHBondContact O-CA 3.34Å; F162-Y166 WeakPolarHBondContact O-CB 3.18Å; F162-Y166 PolarHBondContact O-N 3.42Å; F162-G167 PolarHBondContact O-N 2.65Å; F162-Y170 HydrophobicContact CB-CD1 3.9Å; F162-Y170 HydrophobicContact CB-CD2 3.53Å; F162-Y170 HydrophobicContact CB-CE1 4.13Å; F162-Y170 HydrophobicContact CB-CE2 3.77Å; F162-Y170 HydrophobicContact CB-CG 3.58Å; F162-Y170 AromaticContact CD1-CD2 3.68Å; F162-Y170 HydrophobicContact CD1-CD2 3.68Å; F162-Y170 HydrophobicContact CD1-CE2 4.08Å; F162-Y170 HydrophobicContact CD1-CG 4.39Å; F162-Y170 HydrophobicContact CG-CD2 4.06Å; F162-Y170 HydrophobicContact CG-CE2 4.26Å; F162-F177 HydrophobicContact CD1-CE1 4.29Å; F162-F177 HydrophobicContact CD1-CE2 4.44Å; F162-F177 HydrophobicContact CD1-CZ 4.12Å; F162-F177 HydrophobicContact CE1-CD1 4.34Å; F162-F177 AromaticContact CE1-CE1 3.7Å; F162-F177 HydrophobicContact CE1-CE1 3.7Å; F162-F177 AromaticContact CE1-CZ 3.81Å; F162-F177 HydrophobicContact CE1-CZ 3.81Å; F162-D363 HydrophobicContact CE2-CB 4.32Å; F162-D363 WeakPolarHBondContact CE2-O 3.35Å; F162-I366 HydrophobicContact CE1-CG2 4.04Å; F162-I366 HydrophobicContact CZ-CB 4.13Å; F162-I366 HydrophobicContact CZ-CG2 3.73Å; F162-I370 HydrophobicContact CE1-CD1 3.82Å; F162-I370 HydrophobicContact CZ-CD1 4.31Å
163	M	95.5	Very high	94.4	Very high	72 Å²	72	53.9 Å²	53.9	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-58.7	-42.8	169.1	-76.5	-62.4	-69.7	0	0	111	H159 G167 Y170 E171	H159-M163 WeakPolarHBondContact O-CB 3.3Å; H159-M163 VanDerWaalsContact O-CG 3.25Å; H159-M163 WeakPolarHBondContact O-CG 3.06Å; H159-M163 PolarHBondContact O-N 3.09Å; M163-G167 WeakPolarHBondContact O-CA 3.37Å; M163-G167 PolarHBondContact O-N 3.01Å; M163-Y170 HydrophobicContact CG-CD1 3.81Å; M163-Y170 HydrophobicContact CG-CE1 3.72Å; M163-Y170 HydrophobicContact SD-CD1 3.52Å; M163-Y170 VanDerWaalsContact SD-CD1 3.52Å; M163-Y170 HydrophobicContact SD-CE1 3.8Å; M163-E171 HydrophobicContact SD-CB 4.37Å
164	K	94.1	Very high	94.5	Very high	189 Å²	189	50.6 Å²	50.6	82%	0.822	25%	0.252	S	S	*	.	H	α-helix	trans	-69.5	-38	177.8	-173.6	178.1	179.4	-178.2	0	112.8	T160 M161 F162	T160-K164 PolarHBondContact O-N 3.06Å; M161-K164 PolarHBondContact O-N 3.28Å; F162-K164 VanDerWaalsContact C-N 3.28Å; F162-K164 PolarHBondContact O-N 3.17Å
165	T	91	Very high	94.5	Very high	34 Å²	34	54.5 Å²	54.5	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-88.1	-37.4	-171	-52.5	0	0	0	0	112.9	M161 F162 L411 F413	M161-T165 VanDerWaalsContact O-CB 3.29Å; M161-T165 WeakPolarHBondContact O-CB 3.37Å; M161-T165 PolarHBondContact O-N 3.09Å; M161-T165 PolarHBondContact O-OG1 2.96Å; F162-T165 PolarHBondContact O-N 3.5Å; T165-L411 WeakPolarHBondContact O-CD2 3.29Å; T165-F413 HydrophobicContact CG2-CD1 3.84Å; T165-F413 HydrophobicContact CG2-CE1 3.82Å
166	Y	92.1	Very high	94.5	Very high	18 Å²	18	54.3 Å²	54.3	7%	0.071	27%	0.272	C	S	.	.	H	α-helix	trans	-120	-15.8	-174	-58.9	-69.1	0	0	0	113.5	F162 I168 L169 S367 I370 L411	F162-Y166 HydrophobicContact CB-CD2 4.17Å; F162-Y166 AromaticContact CD1-CD2 3.71Å; F162-Y166 HydrophobicContact CD1-CD2 3.71Å; F162-Y166 AromaticContact CD1-CE2 3.86Å; F162-Y166 HydrophobicContact CD1-CE2 3.86Å; F162-Y166 HydrophobicContact CD2-CE2 4.41Å; F162-Y166 HydrophobicContact CE1-CD2 4.19Å; F162-Y166 AromaticContact CE1-CE2 3.88Å; F162-Y166 HydrophobicContact CE1-CE2 3.88Å; F162-Y166 HydrophobicContact CE2-CE2 4.4Å; F162-Y166 AromaticContact CG-CD2 3.91Å; F162-Y166 HydrophobicContact CG-CD2 3.91Å; F162-Y166 HydrophobicContact CG-CE2 4.14Å; F162-Y166 HydrophobicContact CZ-CE2 4.15Å; F162-Y166 WeakPolarHBondContact O-CA 3.34Å; F162-Y166 WeakPolarHBondContact O-CB 3.18Å; F162-Y166 PolarHBondContact O-N 3.42Å; Y166-I168 PolarHBondContact O-N 3.27Å; Y166-L169 PolarHBondContact O-N 3.07Å; Y166-S367 PolarHBondContact OH-OG 3.31Å; Y166-I370 HydrophobicContact CE1-CG2 3.94Å; Y166-I370 HydrophobicContact CE2-CD1 4.44Å; Y166-I370 WeakPolarHBondContact OH-CG2 3.44Å; Y166-L411 HydrophobicContact CD1-CD1 4.24Å
167	G	93.1	Very high	94.5	Very high	23 Å²	23	51.1 Å²	51.1	24%	0.237	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	-126.6	177	0	0	0	0	0	113.2	F162 M163 L169 Y170 E171	F162-G167 PolarHBondContact O-N 2.65Å; M163-G167 WeakPolarHBondContact O-CA 3.37Å; M163-G167 PolarHBondContact O-N 3.01Å; G167-L169 PolarHBondContact O-N 3.19Å; G167-Y170 WeakPolarHBondContact O-CB 3.49Å; G167-Y170 PolarHBondContact O-N 3.22Å; G167-E171 PolarHBondContact O-N 2.95Å; G167-E171 VanDerWaalsContact O-N 3.07Å
168	I	92.5	Very high	94.6	Very high	114 Å²	114	50.9 Å²	50.9	59%	0.585	26%	0.26	S	S	*	.	H	α-helix	trans	-57.5	-33.3	-175.5	-61.3	166.8	0	0	0	112	Y166 Y170 E171 Q172	Y166-I168 PolarHBondContact O-N 3.27Å; I168-Y170 VanDerWaalsContact C-N 3.29Å; I168-Y170 PolarHBondContact O-N 2.84Å; I168-E171 PolarHBondContact O-N 2.98Å; I168-Q172 HydrophobicContact CG2-CG 4.17Å; I168-Q172 WeakPolarHBondContact O-CB 3.4Å; I168-Q172 VanDerWaalsContact O-CG 3.31Å; I168-Q172 WeakPolarHBondContact O-CG 3.37Å; I168-Q172 PolarHBondContact O-N 3.32Å
169	L	90.3	Very high	94.5	Very high	26 Å²	26	53.4 Å²	53.4	14%	0.136	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-38.4	178.7	-67.9	177.1	0	0	0	111.7	Y166 G167 N173 M222 L408 L411	Y166-L169 PolarHBondContact O-N 3.07Å; G167-L169 PolarHBondContact O-N 3.19Å; L169-N173 PolarHBondContact O-ND2 3.36Å; L169-M222 HydrophobicContact CD2-SD 4.36Å; L169-L408 HydrophobicContact CD1-CD1 3.64Å; L169-L411 HydrophobicContact CD1-CD1 3.96Å
170	Y	94.7	Very high	94.4	Very high	10 Å²	10	51.3 Å²	51.3	4%	0.039	27%	0.268	C	S	.	.	H	α-helix	trans	-71.2	-45.9	173.1	164.3	-105.6	0	0	0	111.1	L158 H159 F162 M163 G167 I168 Q172 N173 S174 F177	L158-Y170 HydrophobicContact CD2-CE2 4Å; H159-Y170 VanDerWaalsContact CA-OH 3.32Å; H159-Y170 WeakPolarHBondContact CA-OH 3.35Å; H159-Y170 WeakPolarHBondContact CB-OH 3.19Å; H159-Y170 AromaticContact ND1-CE1 3.5Å; H159-Y170 AromaticContact ND1-CZ 3.75Å; H159-Y170 PolarHBondContact ND1-OH 3.18Å; H159-Y170 VanDerWaalsContact ND1-OH 3.09Å; F162-Y170 HydrophobicContact CB-CD1 3.9Å; F162-Y170 HydrophobicContact CB-CD2 3.53Å; F162-Y170 HydrophobicContact CB-CE1 4.13Å; F162-Y170 HydrophobicContact CB-CE2 3.77Å; F162-Y170 HydrophobicContact CB-CG 3.58Å; F162-Y170 AromaticContact CD1-CD2 3.68Å; F162-Y170 HydrophobicContact CD1-CD2 3.68Å; F162-Y170 HydrophobicContact CD1-CE2 4.08Å; F162-Y170 HydrophobicContact CD1-CG 4.39Å; F162-Y170 HydrophobicContact CG-CD2 4.06Å; F162-Y170 HydrophobicContact CG-CE2 4.26Å; M163-Y170 HydrophobicContact CG-CD1 3.81Å; M163-Y170 HydrophobicContact CG-CE1 3.72Å; M163-Y170 HydrophobicContact SD-CD1 3.52Å; M163-Y170 VanDerWaalsContact SD-CD1 3.52Å; M163-Y170 HydrophobicContact SD-CE1 3.8Å; G167-Y170 WeakPolarHBondContact O-CB 3.49Å; G167-Y170 PolarHBondContact O-N 3.22Å; I168-Y170 VanDerWaalsContact C-N 3.29Å; I168-Y170 PolarHBondContact O-N 2.84Å; Y170-Q172 VanDerWaalsContact C-N 3.27Å; Y170-Q172 PolarHBondContact O-N 3.05Å; Y170-N173 CarbonylContact O-C 3.46Å; Y170-N173 PolarHBondContact O-N 3.19Å; Y170-S174 WeakPolarHBondContact O-CA 3.35Å; Y170-S174 WeakPolarHBondContact O-CB 3.4Å; Y170-S174 PolarHBondContact O-N 3.18Å; Y170-F177 AromaticContact CD2-CD2 3.76Å; Y170-F177 HydrophobicContact CD2-CD2 3.76Å; Y170-F177 AromaticContact CD2-CE2 3.73Å; Y170-F177 HydrophobicContact CD2-CE2 3.73Å; Y170-F177 HydrophobicContact CE2-CB 4.37Å; Y170-F177 AromaticContact CE2-CD2 3.48Å; Y170-F177 HydrophobicContact CE2-CD2 3.48Å; Y170-F177 VanDerWaalsContact CE2-CD2 3.48Å; Y170-F177 AromaticContact CE2-CE2 3.96Å; Y170-F177 HydrophobicContact CE2-CE2 3.96Å; Y170-F177 HydrophobicContact CE2-CG 4.05Å
171	E	93.6	Very high	94.4	Very high	106 Å²	106	46.8 Å²	46.8	50%	0.495	24%	0.24	S	C	.	.	H	α-helix	trans	-52.4	-46	179.6	-171.9	-179.9	-173.9	0	0	111.8	M163 G167 I168 N173 S174	M163-E171 HydrophobicContact SD-CB 4.37Å; G167-E171 PolarHBondContact O-N 2.95Å; G167-E171 VanDerWaalsContact O-N 3.07Å; I168-E171 PolarHBondContact O-N 2.98Å; E171-N173 VanDerWaalsContact C-N 3.26Å; E171-N173 PolarHBondContact O-N 3.38Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 2.84Å; E171-S174 PolarHBondContact O-OG 3.22Å
172	Q	92.3	Very high	94.3	Very high	134 Å²	134	48.9 Å²	48.9	63%	0.626	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.6	178.5	-71.2	177.6	-2.2	0	0	114.9	I168 Y170	I168-Q172 HydrophobicContact CG2-CG 4.17Å; I168-Q172 WeakPolarHBondContact O-CB 3.4Å; I168-Q172 VanDerWaalsContact O-CG 3.31Å; I168-Q172 WeakPolarHBondContact O-CG 3.37Å; I168-Q172 PolarHBondContact O-N 3.32Å; Y170-Q172 VanDerWaalsContact C-N 3.27Å; Y170-Q172 PolarHBondContact O-N 3.05Å
173	N	93.3	Very high	94.1	Very high	17 Å²	17	50.9 Å²	50.9	9%	0.091	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	16.3	-177.5	-62.7	-88.5	0	0	0	112.3	L169 Y170 E171 D175 L176	L169-N173 PolarHBondContact O-ND2 3.36Å; Y170-N173 CarbonylContact O-C 3.46Å; Y170-N173 PolarHBondContact O-N 3.19Å; E171-N173 VanDerWaalsContact C-N 3.26Å; E171-N173 PolarHBondContact O-N 3.38Å; N173-D175 VanDerWaalsContact C-OD1 3.25Å; N173-D175 PolarHBondContact O-N 3.39Å; N173-L176 WeakPolarHBondContact O-CB 3.16Å; N173-L176 PolarHBondContact O-N 3.38Å; N173-L176 VanDerWaalsContact O-N 3.17Å
174	S	95.8	Very high	94	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-26.9	-173.1	54.7	0	0	0	0	112.5	Y170 E171 L176 F177 V178	Y170-S174 WeakPolarHBondContact O-CA 3.35Å; Y170-S174 WeakPolarHBondContact O-CB 3.4Å; Y170-S174 PolarHBondContact O-N 3.18Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 2.84Å; E171-S174 PolarHBondContact O-OG 3.22Å; S174-L176 PolarHBondContact O-N 3.5Å; S174-L176 VanDerWaalsContact O-N 3.14Å; S174-F177 PolarHBondContact O-N 2.93Å; S174-F177 VanDerWaalsContact O-N 3.1Å; S174-V178 WeakPolarHBondContact O-CG2 3.29Å; S174-V178 PolarHBondContact O-N 3.22Å
175	D	96.5	Very high	93.9	Very high	83 Å²	83	40.1 Å²	40.1	44%	0.444	22%	0.217	S	C	.	.	H	α-helix	trans	-52.1	-34.2	174.3	71.2	-61.6	0	0	0	112.8	N173 F177 S179 R218	N173-D175 VanDerWaalsContact C-OD1 3.25Å; N173-D175 PolarHBondContact O-N 3.39Å; D175-F177 PolarHBondContact O-N 2.72Å; D175-S179 VanDerWaalsContact O-CB 3.22Å; D175-S179 WeakPolarHBondContact O-CB 3.1Å; D175-S179 PolarHBondContact O-N 2.84Å; D175-R218 VanDerWaalsContact CG-NH1 3.28Å; D175-R218 IonicContact OD1-NH1 2.82Å; D175-R218 PolarHBondContact OD1-NH1 3.44Å; D175-R218 IonicContact OD2-CZ 3.37Å; D175-R218 IonicContact OD2-NH1 3.57Å; D175-R218 PolarHBondContact OD2-NH1 3.45Å; D175-R218 IonicContact OD2-NH2 2.96Å; D175-R218 PolarHBondContact OD2-NH2 3.32Å
176	L	96.2	Very high	93.8	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-48.9	179.1	-168	51.9	0	0	0	111.6	N173 S174 L180 F211 N214 L215	N173-L176 WeakPolarHBondContact O-CB 3.16Å; N173-L176 PolarHBondContact O-N 3.38Å; N173-L176 VanDerWaalsContact O-N 3.17Å; S174-L176 PolarHBondContact O-N 3.5Å; S174-L176 VanDerWaalsContact O-N 3.14Å; L176-L180 PolarHBondContact O-N 3.47Å; L176-L180 VanDerWaalsContact O-N 3.08Å; L176-F211 HydrophobicContact CD1-CD2 4.01Å; L176-F211 HydrophobicContact CD1-CE2 4.39Å; L176-F211 HydrophobicContact CD2-CD2 4.42Å; L176-F211 HydrophobicContact CD2-CE2 4.05Å; L176-F211 HydrophobicContact CG-CD2 3.84Å; L176-F211 HydrophobicContact CG-CE2 3.71Å; L176-N214 HydrophobicContact CD1-CB 3.51Å; L176-L215 HydrophobicContact CD2-CB 3.87Å; L176-L215 HydrophobicContact CD2-CD1 3.68Å; L176-L215 HydrophobicContact CD2-CG 4.37Å
177	F	96.8	Very high	93.6	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-80.1	-39.1	-171	-53.4	-81.6	0	0	0	109.9	L158 F162 Y170 S174 D175 S179 L180 F181 F211 L215 I366 I370	L158-F177 HydrophobicContact CD1-CD1 4.31Å; L158-F177 HydrophobicContact CD2-CB 3.89Å; L158-F177 HydrophobicContact CD2-CD1 4.18Å; L158-F177 HydrophobicContact CD2-CG 4.05Å; F162-F177 HydrophobicContact CD1-CE1 4.29Å; F162-F177 HydrophobicContact CD1-CE2 4.44Å; F162-F177 HydrophobicContact CD1-CZ 4.12Å; F162-F177 HydrophobicContact CE1-CD1 4.34Å; F162-F177 AromaticContact CE1-CE1 3.7Å; F162-F177 HydrophobicContact CE1-CE1 3.7Å; F162-F177 AromaticContact CE1-CZ 3.81Å; F162-F177 HydrophobicContact CE1-CZ 3.81Å; Y170-F177 AromaticContact CD2-CD2 3.76Å; Y170-F177 HydrophobicContact CD2-CD2 3.76Å; Y170-F177 AromaticContact CD2-CE2 3.73Å; Y170-F177 HydrophobicContact CD2-CE2 3.73Å; Y170-F177 HydrophobicContact CE2-CB 4.37Å; Y170-F177 AromaticContact CE2-CD2 3.48Å; Y170-F177 HydrophobicContact CE2-CD2 3.48Å; Y170-F177 VanDerWaalsContact CE2-CD2 3.48Å; Y170-F177 AromaticContact CE2-CE2 3.96Å; Y170-F177 HydrophobicContact CE2-CE2 3.96Å; Y170-F177 HydrophobicContact CE2-CG 4.05Å; S174-F177 PolarHBondContact O-N 2.93Å; S174-F177 VanDerWaalsContact O-N 3.1Å; D175-F177 PolarHBondContact O-N 2.72Å; F177-S179 VanDerWaalsContact C-N 3.32Å; F177-S179 PolarHBondContact O-N 3.43Å; F177-L180 WeakPolarHBondContact O-CB 3.26Å; F177-L180 PolarHBondContact O-N 3.34Å; F177-F181 WeakPolarHBondContact O-CD2 3.4Å; F177-F181 PolarHBondContact O-N 3.48Å; F177-F181 VanDerWaalsContact O-N 3.13Å; F177-F211 AromaticContact CD1-CE2 3.89Å; F177-F211 HydrophobicContact CD1-CE2 3.89Å; F177-F211 HydrophobicContact CD1-CZ 4.05Å; F177-F211 HydrophobicContact CE1-CE2 4.12Å; F177-F211 AromaticContact CE1-CZ 4Å; F177-F211 HydrophobicContact CE1-CZ 4Å; F177-L215 HydrophobicContact CZ-CD1 4.35Å; F177-I366 HydrophobicContact CD1-CG2 4.35Å; F177-I366 HydrophobicContact CE1-CG2 3.71Å; F177-I370 HydrophobicContact CZ-CD1 4.47Å
178	V	96.6	Very high	93.5	Very high	34 Å²	34	41.9 Å²	41.9	21%	0.206	22%	0.224	C	C	.	.	H	α-helix	trans	-57.3	-48.1	170.4	175.8	0	0	0	0	110.2	S174 L180 F181 D182	S174-V178 WeakPolarHBondContact O-CG2 3.29Å; S174-V178 PolarHBondContact O-N 3.22Å; V178-L180 VanDerWaalsContact C-N 3.32Å; V178-L180 PolarHBondContact O-N 3.44Å; V178-F181 PolarHBondContact O-N 2.94Å; V178-D182 PolarHBondContact O-N 3.41Å
179	S	95	Very high	93.1	Very high	56 Å²	56	40.7 Å²	40.7	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-61.3	-38.1	177.5	-171.9	0	0	0	0	112.7	D175 F177 D182 N183	D175-S179 VanDerWaalsContact O-CB 3.22Å; D175-S179 WeakPolarHBondContact O-CB 3.1Å; D175-S179 PolarHBondContact O-N 2.84Å; F177-S179 VanDerWaalsContact C-N 3.32Å; F177-S179 PolarHBondContact O-N 3.43Å; S179-D182 PolarHBondContact O-N 3.05Å; S179-N183 WeakPolarHBondContact O-CB 3.3Å; S179-N183 VanDerWaalsContact O-CG 3.23Å; S179-N183 PolarHBondContact O-N 3.14Å; S179-N183 PolarHBondContact O-ND2 2.91Å; S179-N183 PolarHBondContact OG-ND2 2.9Å
180	L	95.6	Very high	92.5	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-57.4	-54.1	174.8	174.1	63.2	0	0	0	110.9	L176 F177 V178 D182 N183 L184 V207 M208 F211 I366	L176-L180 PolarHBondContact O-N 3.47Å; L176-L180 VanDerWaalsContact O-N 3.08Å; F177-L180 WeakPolarHBondContact O-CB 3.26Å; F177-L180 PolarHBondContact O-N 3.34Å; V178-L180 VanDerWaalsContact C-N 3.32Å; V178-L180 PolarHBondContact O-N 3.44Å; L180-D182 VanDerWaalsContact C-N 3.35Å; L180-D182 PolarHBondContact O-N 2.91Å; L180-N183 PolarHBondContact O-N 3.08Å; L180-L184 HydrophobicContact CD1-CD1 4.18Å; L180-L184 HydrophobicContact CD1-CG 4.17Å; L180-L184 HydrophobicContact CG-CD1 4.12Å; L180-L184 HydrophobicContact CG-CG 4.46Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 3Å; L180-V207 HydrophobicContact CD1-CG1 4.43Å; L180-M208 HydrophobicContact CD1-SD 4.05Å; L180-F211 HydrophobicContact CB-CD2 3.82Å; L180-F211 HydrophobicContact CB-CE2 4.15Å; L180-F211 HydrophobicContact CB-CG 4.48Å; L180-F211 HydrophobicContact CD1-CB 4.15Å; L180-F211 HydrophobicContact CD1-CD2 4.3Å; L180-F211 HydrophobicContact CD1-CG 4.12Å; L180-F211 HydrophobicContact CD2-CD1 4.24Å; L180-F211 HydrophobicContact CD2-CD2 3.85Å; L180-F211 HydrophobicContact CD2-CE1 4.16Å; L180-F211 HydrophobicContact CD2-CE2 3.73Å; L180-F211 HydrophobicContact CD2-CG 4.09Å; L180-F211 HydrophobicContact CD2-CZ 3.91Å; L180-F211 HydrophobicContact CG-CD2 4.19Å; L180-F211 HydrophobicContact CG-CE2 4.48Å; L180-F211 HydrophobicContact CG-CG 4.46Å; L180-I366 HydrophobicContact CD2-CD1 3.84Å
181	F	95.7	Very high	91	Very high	1 Å²	1	51 Å²	51	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-35.1	-179.2	-81.5	-82.9	0	0	0	113.2	S154 Q155 L158 F177 V178 N183 L184 T185 I362	S154-F181 WeakPolarHBondContact OG-CE1 3.3Å; S154-F181 WeakPolarHBondContact OG-CZ 3.26Å; Q155-F181 HydrophobicContact CB-CB 4.13Å; Q155-F181 HydrophobicContact CB-CD1 3.67Å; Q155-F181 HydrophobicContact CB-CD2 3.91Å; Q155-F181 HydrophobicContact CB-CE1 3.94Å; Q155-F181 HydrophobicContact CB-CE2 4.15Å; Q155-F181 HydrophobicContact CB-CG 3.64Å; Q155-F181 HydrophobicContact CB-CZ 4.16Å; Q155-F181 HydrophobicContact CG-CB 3.69Å; Q155-F181 HydrophobicContact CG-CD1 4.11Å; Q155-F181 HydrophobicContact CG-CD2 3.57Å; Q155-F181 HydrophobicContact CG-CE2 4.14Å; Q155-F181 HydrophobicContact CG-CG 3.53Å; L158-F181 HydrophobicContact CB-CE2 4.18Å; L158-F181 HydrophobicContact CB-CZ 4.49Å; L158-F181 HydrophobicContact CD1-CE2 3.92Å; F177-F181 WeakPolarHBondContact O-CD2 3.4Å; F177-F181 PolarHBondContact O-N 3.48Å; F177-F181 VanDerWaalsContact O-N 3.13Å; V178-F181 PolarHBondContact O-N 2.94Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 3.3Å; F181-L184 PolarHBondContact O-N 3.34Å; F181-T185 VanDerWaalsContact O-CB 3.24Å; F181-T185 WeakPolarHBondContact O-CB 3.09Å; F181-T185 PolarHBondContact O-N 2.87Å; F181-T185 PolarHBondContact O-OG1 3.47Å; F181-I362 HydrophobicContact CE1-CG2 4.44Å; F181-I362 HydrophobicContact CZ-CG2 3.74Å
182	D	93.2	Very high	89.3	Confident	77 Å²	77	50.3 Å²	50.3	41%	0.412	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-42.5	172.7	-74.5	-15.9	0	0	0	111.3	V178 S179 L180 S186	V178-D182 PolarHBondContact O-N 3.41Å; S179-D182 PolarHBondContact O-N 3.05Å; L180-D182 VanDerWaalsContact C-N 3.35Å; L180-D182 PolarHBondContact O-N 2.91Å; D182-S186 WeakPolarHBondContact O-CB 3.5Å; D182-S186 PolarHBondContact O-N 3.05Å; D182-S186 PolarHBondContact O-OG 3.37Å
183	N	91.9	Very high	87.3	Confident	43 Å²	43	49.2 Å²	49.2	23%	0.23	25%	0.246	C	C	.	.	H	α-helix	trans	-67.6	-42.6	176.7	-71.3	-58.5	0	0	0	111.8	S179 L180 F181 S186 Y187 V207 R210	S179-N183 WeakPolarHBondContact O-CB 3.3Å; S179-N183 VanDerWaalsContact O-CG 3.23Å; S179-N183 PolarHBondContact O-N 3.14Å; S179-N183 PolarHBondContact O-ND2 2.91Å; S179-N183 PolarHBondContact OG-ND2 2.9Å; L180-N183 PolarHBondContact O-N 3.08Å; F181-N183 VanDerWaalsContact C-N 3.33Å; F181-N183 PolarHBondContact O-N 3.3Å; N183-S186 PolarHBondContact O-N 2.89Å; N183-Y187 WeakPolarHBondContact O-CB 3.39Å; N183-Y187 PolarHBondContact O-N 2.9Å; N183-V207 HydrophobicContact CB-CG1 3.56Å; N183-V207 HydrophobicContact CB-CG2 4.31Å; N183-R210 VanDerWaalsContact CG-NH2 3.29Å; N183-R210 PolarHBondContact ND2-NH2 3.04Å; N183-R210 PolarHBondContact OD1-NH2 2.69Å
184	L	93.2	Very high	85.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-45.8	176.6	-69.3	178.9	0	0	0	111.3	L180 F181 Y187 Y188 L204 V258 F262 I359 I362	L180-L184 HydrophobicContact CD1-CD1 4.18Å; L180-L184 HydrophobicContact CD1-CG 4.17Å; L180-L184 HydrophobicContact CG-CD1 4.12Å; L180-L184 HydrophobicContact CG-CG 4.46Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 3Å; F181-L184 PolarHBondContact O-N 3.34Å; L184-Y187 PolarHBondContact O-N 3.2Å; L184-Y188 PolarHBondContact O-N 2.78Å; L184-L204 HydrophobicContact CD2-CD1 3.53Å; L184-V258 HydrophobicContact CD2-CG1 3.96Å; L184-F262 HydrophobicContact CB-CE1 3.93Å; L184-F262 HydrophobicContact CB-CZ 4.05Å; L184-F262 HydrophobicContact CD1-CZ 4.28Å; L184-F262 HydrophobicContact CD2-CE1 4.17Å; L184-F262 HydrophobicContact CD2-CZ 3.99Å; L184-F262 HydrophobicContact CG-CZ 4.33Å; L184-I359 HydrophobicContact CD1-CD1 4.41Å; L184-I362 HydrophobicContact CD1-CD1 4.2Å
185	T	92.4	Very high	82.9	Confident	34 Å²	34	59 Å²	59	21%	0.209	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-44.9	176.6	-58.4	0	0	0	0	110.8	F181 Y187 Y188 M189	F181-T185 VanDerWaalsContact O-CB 3.24Å; F181-T185 WeakPolarHBondContact O-CB 3.09Å; F181-T185 PolarHBondContact O-N 2.87Å; F181-T185 PolarHBondContact O-OG1 3.47Å; T185-Y187 VanDerWaalsContact C-N 3.35Å; T185-Y187 PolarHBondContact O-N 2.76Å; T185-Y188 PolarHBondContact O-N 3.27Å; T185-M189 HydrophobicContact CG2-CG 4.16Å; T185-M189 HydrophobicContact CG2-SD 3.77Å; T185-M189 WeakPolarHBondContact O-CB 3.22Å; T185-M189 VanDerWaalsContact O-CG 3.27Å; T185-M189 WeakPolarHBondContact O-CG 3.24Å; T185-M189 PolarHBondContact O-N 3.31Å
186	S	89.7	Confident	80.5	Confident	72 Å²	72	57.4 Å²	57.4	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176	-62.9	0	0	0	0	111.8	D182 N183 Y188 M189 Y190	D182-S186 WeakPolarHBondContact O-CB 3.5Å; D182-S186 PolarHBondContact O-N 3.05Å; D182-S186 PolarHBondContact O-OG 3.37Å; N183-S186 PolarHBondContact O-N 2.89Å; S186-Y188 VanDerWaalsContact C-N 3.35Å; S186-Y188 PolarHBondContact O-N 2.72Å; S186-M189 PolarHBondContact O-N 2.69Å; S186-Y190 VanDerWaalsContact O-CB 3.3Å; S186-Y190 WeakPolarHBondContact O-CB 3.33Å; S186-Y190 PolarHBondContact O-N 2.92Å
187	Y	88.2	Confident	77.7	Confident	31 Å²	31	58.8 Å²	58.8	12%	0.122	33%	0.327	C	S	.	.	H	α-helix	trans	-60.1	-44.6	176.7	177.5	-84.5	0	0	0	111.8	N183 L184 T185 L204 F262 R266	N183-Y187 WeakPolarHBondContact O-CB 3.39Å; N183-Y187 PolarHBondContact O-N 2.9Å; L184-Y187 PolarHBondContact O-N 3.2Å; T185-Y187 VanDerWaalsContact C-N 3.35Å; T185-Y187 PolarHBondContact O-N 2.76Å; Y187-L204 HydrophobicContact CD1-CD2 4.07Å; Y187-L204 HydrophobicContact CD2-CB 3.97Å; Y187-L204 HydrophobicContact CE1-CD2 3.85Å; Y187-L204 HydrophobicContact CE2-CB 3.77Å; Y187-L204 HydrophobicContact CE2-CD2 4.39Å; Y187-L204 HydrophobicContact CG-CD2 4.44Å; Y187-F262 HydrophobicContact CD1-CB 4.03Å; Y187-F262 AromaticContact CD1-CD1 3.98Å; Y187-F262 HydrophobicContact CD1-CD1 3.98Å; Y187-F262 HydrophobicContact CD1-CG 4.45Å; Y187-F262 HydrophobicContact CE1-CB 3.73Å; Y187-R266 WeakPolarHBondContact O-CD 3.46Å; Y187-R266 PolarHBondContact O-NH1 2.89Å
188	Y	89.7	Confident	75	Confident	10 Å²	10	63.4 Å²	63.4	4%	0.039	36%	0.356	C	S	.	.	H	α-helix	trans	-64.6	-50	176.7	170	-97.4	0	0	0	111.7	D144 F147 R148 L151 L184 T185 S186 Y190 I269	D144-Y188 WeakPolarHBondContact CA-OH 3.21Å; D144-Y188 WeakPolarHBondContact OD1-CE1 3.43Å; D144-Y188 PolarHBondContact OD1-OH 3.11Å; F147-Y188 HydrophobicContact CB-CD2 4.4Å; F147-Y188 HydrophobicContact CB-CE1 4.19Å; F147-Y188 HydrophobicContact CB-CE2 3.66Å; F147-Y188 AromaticContact CD2-CE2 3.61Å; F147-Y188 HydrophobicContact CD2-CE2 3.61Å; F147-Y188 AromaticContact CD2-CZ 3.89Å; F147-Y188 AromaticContact CG-CE2 3.97Å; F147-Y188 HydrophobicContact CG-CE2 3.97Å; R148-Y188 HydrophobicContact CG-CD1 4.44Å; R148-Y188 HydrophobicContact CG-CE1 3.85Å; L151-Y188 HydrophobicContact CD1-CD1 4.43Å; L151-Y188 HydrophobicContact CD1-CG 4.34Å; L184-Y188 PolarHBondContact O-N 2.78Å; T185-Y188 PolarHBondContact O-N 3.27Å; S186-Y188 VanDerWaalsContact C-N 3.35Å; S186-Y188 PolarHBondContact O-N 2.72Å; Y188-Y190 VanDerWaalsContact C-N 3.25Å; Y188-Y190 PolarHBondContact O-N 3.12Å; Y188-I269 HydrophobicContact CE2-CG1 4.44Å
189	M	84.9	Confident	72.2	Confident	88 Å²	88	65.6 Å²	65.6	43%	0.433	37%	0.366	S	S	.	.	H	α-helix	trans	-69.6	-18.8	-176.6	-71.6	-172.4	59.4	0	0	114.2	R148 T185 S186 K191	R148-M189 VanDerWaalsContact NH1-CG 3.32Å; R148-M189 PolarHBondContact NH1-SD 3.33Å; T185-M189 HydrophobicContact CG2-CG 4.16Å; T185-M189 HydrophobicContact CG2-SD 3.77Å; T185-M189 WeakPolarHBondContact O-CB 3.22Å; T185-M189 VanDerWaalsContact O-CG 3.27Å; T185-M189 WeakPolarHBondContact O-CG 3.24Å; T185-M189 PolarHBondContact O-N 3.31Å; S186-M189 PolarHBondContact O-N 2.69Å; M189-K191 PolarHBondContact O-N 3.04Å
190	Y	78	Confident	69.6	Low	68 Å²	68	66.8 Å²	66.8	27%	0.267	38%	0.379	S	S	.	.			trans	-60.7	106.5	-171.3	-172.5	-89.2	0	0	0	111.7	S186 Y188 R192 L199 R266	S186-Y190 VanDerWaalsContact O-CB 3.3Å; S186-Y190 WeakPolarHBondContact O-CB 3.33Å; S186-Y190 PolarHBondContact O-N 2.92Å; Y188-Y190 VanDerWaalsContact C-N 3.25Å; Y188-Y190 PolarHBondContact O-N 3.12Å; Y190-R192 PolarHBondContact O-N 3.07Å; Y190-L199 VanDerWaalsContact OH-CB 3.22Å; Y190-L199 WeakPolarHBondContact OH-CB 3.31Å; Y190-L199 VanDerWaalsContact OH-CD1 3.3Å; Y190-L199 WeakPolarHBondContact OH-CD1 3.29Å; Y190-L199 WeakPolarHBondContact OH-CG 3.48Å; Y190-R266 VanDerWaalsContact CD1-NH2 3.34Å; Y190-R266 PolarHBondContact O-NE 2.87Å; Y190-R266 PolarHBondContact O-NH2 3.24Å
191	K	63.3	Low	67.3	Low	184 Å²	184	68 Å²	68	80%	0.8	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-73.3	121.5	171.1	-71	-175.5	178.7	-179.9	0	108.8	M189 K193	M189-K191 PolarHBondContact O-N 3.04Å; K191-K193 PolarHBondContact O-N 2.96Å
192	R	57.6	Low	65.3	Low	93 Å²	93	69.8 Å²	69.8	35%	0.351	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-58.4	128.5	170	-170	-178	-75.6	153.2	-16.3	107.6	Y190 E519	Y190-R192 PolarHBondContact O-N 3.07Å; R192-E519 IonicContact CZ-OE2 2.69Å; R192-E519 IonicContact NH1-OE2 3.56Å; R192-E519 IonicContact NH2-OE2 3.05Å; R192-E519 PolarHBondContact NH2-OE2 2.74Å
193	K	49.1	Very low	64.3	Low	111 Å²	111	69.4 Å²	69.4	48%	0.483	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-59.7	146.4	171.2	-77.3	-176.6	174.8	176.1	0	109.1	K191 D195 G196 L199	K191-K193 PolarHBondContact O-N 2.96Å; K193-D195 WeakPolarHBondContact CB-OD1 3.44Å; K193-D195 PolarHBondContact O-N 3.14Å; K193-D195 VanDerWaalsContact O-N 3.16Å; K193-G196 PolarHBondContact O-N 3.02Å; K193-L199 HydrophobicContact CD-CD1 4.09Å
194	A	48.9	Very low	64	Low	117 Å²	117	67.4 Å²	67.4	97%	0.967	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.9	-179.1	0	0	0	0	0	113.4	G196	A194-G196 PolarHBondContact O-N 2.88Å
195	D	48.1	Very low	63.8	Low	115 Å²	115	69.6 Å²	69.6	62%	0.615	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	3.4	178.4	64.1	4.2	0	0	0	114.2	K193 S197	K193-D195 WeakPolarHBondContact CB-OD1 3.44Å; K193-D195 PolarHBondContact O-N 3.14Å; K193-D195 VanDerWaalsContact O-N 3.16Å; D195-S197 VanDerWaalsContact CG-OG 3.3Å; D195-S197 PolarHBondContact O-N 3.18Å; D195-S197 VanDerWaalsContact O-N 3.07Å; D195-S197 VanDerWaalsContact OD1-CB 3.25Å; D195-S197 WeakPolarHBondContact OD1-CB 3.41Å; D195-S197 PolarHBondContact OD1-N 3Å; D195-S197 PolarHBondContact OD1-OG 3.27Å; D195-S197 PolarHBondContact OD2-OG 3.01Å
196	G	45.6	Very low	63.7	Low	49 Å²	49	72.2 Å²	72.2	51%	0.505	41%	0.414	S	S	.	.			trans	68.6	4.1	-178.9	0	0	0	0	0	113.4	K193 A194 V198	K193-G196 PolarHBondContact O-N 3.02Å; A194-G196 PolarHBondContact O-N 2.88Å; G196-V198 PolarHBondContact O-N 2.74Å
197	S	37.6	Very low	63.7	Low	37 Å²	37	69.2 Å²	69.2	26%	0.259	39%	0.393	S	S	.	.			trans	-65.2	109.6	171.3	69.3	0	0	0	0	108.1	D195 L199	D195-S197 VanDerWaalsContact CG-OG 3.3Å; D195-S197 PolarHBondContact O-N 3.18Å; D195-S197 VanDerWaalsContact O-N 3.07Å; D195-S197 VanDerWaalsContact OD1-CB 3.25Å; D195-S197 WeakPolarHBondContact OD1-CB 3.41Å; D195-S197 PolarHBondContact OD1-N 3Å; D195-S197 PolarHBondContact OD1-OG 3.27Å; D195-S197 PolarHBondContact OD2-OG 3.01Å; S197-L199 PolarHBondContact O-N 3.35Å
198	V	40.5	Very low	64	Low	107 Å²	107	67.8 Å²	67.8	65%	0.648	39%	0.387	S	S	*	.			trans	-68.1	80.2	157.8	-175.7	0	0	0	0	104.8	G196 A200	G196-V198 PolarHBondContact O-N 2.74Å; V198-A200 PolarHBondContact O-N 3.39Å
199	L	38.7	Very low	64.1	Low	81 Å²	81	70 Å²	70	42%	0.424	40%	0.4	S	S	.	.			trans	-59.3	118.4	153	-47.8	179.1	0	0	0	102.9	Y190 K193 S197 S201	Y190-L199 VanDerWaalsContact OH-CB 3.22Å; Y190-L199 WeakPolarHBondContact OH-CB 3.31Å; Y190-L199 VanDerWaalsContact OH-CD1 3.3Å; Y190-L199 WeakPolarHBondContact OH-CD1 3.29Å; Y190-L199 WeakPolarHBondContact OH-CG 3.48Å; K193-L199 HydrophobicContact CD-CD1 4.09Å; S197-L199 PolarHBondContact O-N 3.35Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 2.89Å
200	A	39.9	Very low	64.5	Low	81 Å²	81	69.5 Å²	69.5	67%	0.669	39%	0.393	S	S	*	.			trans	-40.8	102.8	-178	0	0	0	0	0	108	V198 G202	V198-A200 PolarHBondContact O-N 3.39Å; A200-G202 PolarHBondContact O-N 3.33Å
201	S	46.6	Very low	65.4	Low	29 Å²	29	66.6 Å²	66.6	20%	0.203	38%	0.382	C	S	.	.			trans	-53.2	105.9	150.9	49	0	0	0	0	101.4	L199 D203 R266	L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 2.89Å; S201-D203 PolarHBondContact O-N 3.21Å; S201-R266 VanDerWaalsContact CB-NH1 3.3Å
202	G	54.2	Low	67	Low	39 Å²	39	58.2 Å²	58.2	40%	0.402	35%	0.345	S	S	.	.			trans	-42.3	123.9	-170.8	0	0	0	0	0	106.4	A200 L204	A200-G202 PolarHBondContact O-N 3.33Å; G202-L204 PolarHBondContact O-N 3.45Å
203	D	73.2	Confident	68.7	Low	68 Å²	68	55.3 Å²	55.3	36%	0.364	34%	0.336	S	S	.	.			trans	-46.6	118	-167.7	-162.6	-17.2	0	0	0	106.1	S201 D205 F206 V207 R531	S201-D203 PolarHBondContact O-N 3.21Å; D203-D205 HydrophobicContact CB-CB 4.29Å; D203-D205 CarbonylContact O-C 3.59Å; D203-D205 PolarHBondContact O-N 3.08Å; D203-D205 WeakPolarHBondContact OD1-CB 3.42Å; D203-D205 PolarHBondContact OD1-N 3.48Å; D203-F206 HydrophobicContact CB-CB 3.92Å; D203-F206 CarbonylContact O-C 3.52Å; D203-F206 VanDerWaalsContact O-CA 3.3Å; D203-F206 WeakPolarHBondContact O-CA 3.23Å; D203-F206 VanDerWaalsContact O-CB 3.3Å; D203-F206 WeakPolarHBondContact O-CB 3.49Å; D203-F206 PolarHBondContact O-N 3.45Å; D203-V207 PolarHBondContact O-N 3.35Å; D203-R531 IonicContact OD2-NH1 2.7Å
204	L	85.3	Confident	70.9	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-24.4	-175.8	174.7	60.1	0	0	0	108.7	L184 Y187 G202 V207 M208 V258 L259 F262	L184-L204 HydrophobicContact CD2-CD1 3.53Å; Y187-L204 HydrophobicContact CD1-CD2 4.07Å; Y187-L204 HydrophobicContact CD2-CB 3.97Å; Y187-L204 HydrophobicContact CE1-CD2 3.85Å; Y187-L204 HydrophobicContact CE2-CB 3.77Å; Y187-L204 HydrophobicContact CE2-CD2 4.39Å; Y187-L204 HydrophobicContact CG-CD2 4.44Å; G202-L204 PolarHBondContact O-N 3.45Å; L204-V207 HydrophobicContact CD1-CB 4.42Å; L204-V207 PolarHBondContact O-N 3.12Å; L204-M208 WeakPolarHBondContact O-CB 3.49Å; L204-M208 VanDerWaalsContact O-CG 3.24Å; L204-M208 WeakPolarHBondContact O-CG 3.37Å; L204-M208 PolarHBondContact O-N 3.32Å; L204-V258 HydrophobicContact CD1-CG1 3.72Å; L204-V258 HydrophobicContact CD2-CG1 3.73Å; L204-V258 HydrophobicContact CG-CG1 3.8Å; L204-L259 HydrophobicContact CB-CD2 3.62Å; L204-L259 HydrophobicContact CB-CG 4.49Å; L204-L259 HydrophobicContact CD2-CD2 4.18Å; L204-L259 HydrophobicContact CG-CD2 3.98Å; L204-L259 HydrophobicContact CG-CG 4.36Å; L204-F262 HydrophobicContact CD2-CB 3.63Å; L204-F262 HydrophobicContact CD2-CG 4.02Å
205	D	88.1	Confident	73.1	Confident	47 Å²	47	47.2 Å²	47.2	25%	0.251	28%	0.281	S	S	.	.	H	α-helix	trans	-53.6	-56.2	162.9	-163	65.7	0	0	0	112.6	D203 V207 M208 D209 K255 L259	D203-D205 HydrophobicContact CB-CB 4.29Å; D203-D205 CarbonylContact O-C 3.59Å; D203-D205 PolarHBondContact O-N 3.08Å; D203-D205 WeakPolarHBondContact OD1-CB 3.42Å; D203-D205 PolarHBondContact OD1-N 3.48Å; D205-V207 PolarHBondContact O-N 2.91Å; D205-M208 PolarHBondContact O-N 3.38Å; D205-D209 WeakPolarHBondContact O-CB 3.45Å; D205-D209 PolarHBondContact O-N 3.18Å; D205-K255 HydrophobicContact CB-CD 4.5Å; D205-K255 WeakPolarHBondContact OD1-CD 3.17Å; D205-K255 WeakPolarHBondContact OD1-CE 3.36Å; D205-K255 IonicContact OD1-NZ 3.52Å; D205-K255 PolarHBondContact OD1-NZ 2.71Å; D205-K255 IonicContact OD2-NZ 3.58Å; D205-L259 HydrophobicContact CB-CD1 4.23Å
206	F	89.9	Confident	75.3	Confident	89 Å²	89	41.9 Å²	41.9	39%	0.39	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-37.4	176.1	-179.9	-97.7	0	0	0	113.2	D203 M208 R210 W540	D203-F206 HydrophobicContact CB-CB 3.92Å; D203-F206 CarbonylContact O-C 3.52Å; D203-F206 VanDerWaalsContact O-CA 3.3Å; D203-F206 WeakPolarHBondContact O-CA 3.23Å; D203-F206 VanDerWaalsContact O-CB 3.3Å; D203-F206 WeakPolarHBondContact O-CB 3.49Å; D203-F206 PolarHBondContact O-N 3.45Å; F206-M208 VanDerWaalsContact C-N 3.35Å; F206-R210 WeakPolarHBondContact O-CB 3.47Å; F206-R210 PolarHBondContact O-N 3.14Å; F206-W540 AromaticContact CE2-CH2 4Å; F206-W540 HydrophobicContact CE2-CH2 4Å; F206-W540 HydrophobicContact CE2-CZ3 4.03Å; F206-W540 HydrophobicContact CZ-CZ3 4.39Å
207	V	91.1	Very high	77.6	Confident	9 Å²	9	42.4 Å²	42.4	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-46.5	176	172	0	0	0	0	110.4	L180 N183 D203 L204 D205 F211	L180-V207 HydrophobicContact CD1-CG1 4.43Å; N183-V207 HydrophobicContact CB-CG1 3.56Å; N183-V207 HydrophobicContact CB-CG2 4.31Å; D203-V207 PolarHBondContact O-N 3.35Å; L204-V207 HydrophobicContact CD1-CB 4.42Å; L204-V207 PolarHBondContact O-N 3.12Å; D205-V207 PolarHBondContact O-N 2.91Å; V207-F211 PolarHBondContact O-N 3.08Å; V207-F211 VanDerWaalsContact O-N 3.07Å
208	M	93.8	Very high	80.2	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-45.6	179.2	-68.7	-55.1	-61.3	0	0	111.9	L180 L204 D205 F206 R210 F211 Y212 M254 K255 V258	L180-M208 HydrophobicContact CD1-SD 4.05Å; L204-M208 WeakPolarHBondContact O-CB 3.49Å; L204-M208 VanDerWaalsContact O-CG 3.24Å; L204-M208 WeakPolarHBondContact O-CG 3.37Å; L204-M208 PolarHBondContact O-N 3.32Å; D205-M208 PolarHBondContact O-N 3.38Å; F206-M208 VanDerWaalsContact C-N 3.35Å; M208-R210 PolarHBondContact O-N 3.21Å; M208-F211 WeakPolarHBondContact O-CB 3.47Å; M208-F211 PolarHBondContact O-N 3.46Å; M208-Y212 HydrophobicContact CE-CE2 3.94Å; M208-Y212 WeakPolarHBondContact O-CD2 3.49Å; M208-Y212 PolarHBondContact O-N 2.96Å; M208-Y212 VanDerWaalsContact O-N 3.14Å; M208-M254 HydrophobicContact CE-CE 3.58Å; M208-M254 HydrophobicContact CE-CG 3.94Å; M208-M254 HydrophobicContact CE-SD 3.77Å; M208-K255 HydrophobicContact CB-CB 4.12Å; M208-K255 HydrophobicContact CB-CD 3.98Å; M208-K255 HydrophobicContact CB-CG 3.86Å; M208-K255 HydrophobicContact CG-CB 4.41Å; M208-K255 HydrophobicContact CG-CG 4.24Å; M208-V258 HydrophobicContact CE-CG2 4.45Å; M208-V258 HydrophobicContact CG-CG1 4.28Å; M208-V258 HydrophobicContact SD-CG1 4.1Å; M208-V258 HydrophobicContact SD-CG2 4.45Å
209	D	92.5	Very high	82.7	Confident	56 Å²	56	38.5 Å²	38.5	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-60.8	-47	178.1	-73.5	-17.7	0	0	0	110.9	D205 F211 Y212 E213 K255	D205-D209 WeakPolarHBondContact O-CB 3.45Å; D205-D209 PolarHBondContact O-N 3.18Å; D209-F211 VanDerWaalsContact C-N 3.3Å; D209-F211 PolarHBondContact O-N 3.46Å; D209-Y212 PolarHBondContact O-N 2.95Å; D209-E213 WeakPolarHBondContact O-CB 3.01Å; D209-E213 WeakPolarHBondContact O-CG 3.06Å; D209-E213 PolarHBondContact O-N 2.91Å; D209-K255 VanDerWaalsContact CG-NZ 3.27Å; D209-K255 VanDerWaalsContact OD1-CD 3.26Å; D209-K255 WeakPolarHBondContact OD1-CD 3.44Å; D209-K255 WeakPolarHBondContact OD1-CE 3.24Å; D209-K255 IonicContact OD1-NZ 3.25Å; D209-K255 PolarHBondContact OD1-NZ 3.4Å; D209-K255 IonicContact OD2-NZ 3.69Å; D209-K255 PolarHBondContact OD2-NZ 3.25Å
210	R	93	Very high	85.3	Confident	79 Å²	79	34.6 Å²	34.6	30%	0.298	19%	0.188	S	C	.	.	H	α-helix	trans	-61.1	-37.2	177.1	-177.7	-179.5	62.6	179.7	-0.5	112.5	N183 F206 M208 N214	N183-R210 VanDerWaalsContact CG-NH2 3.29Å; N183-R210 PolarHBondContact ND2-NH2 3.04Å; N183-R210 PolarHBondContact OD1-NH2 2.69Å; F206-R210 WeakPolarHBondContact O-CB 3.47Å; F206-R210 PolarHBondContact O-N 3.14Å; M208-R210 PolarHBondContact O-N 3.21Å; R210-N214 WeakPolarHBondContact O-CB 3.42Å; R210-N214 VanDerWaalsContact O-CG 3.24Å; R210-N214 PolarHBondContact O-N 3.49Å; R210-N214 PolarHBondContact O-ND2 2.99Å; R210-N214 VanDerWaalsContact O-ND2 3.12Å
211	F	96.1	Very high	87.7	Confident	7 Å²	7	37.2 Å²	37.2	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-51.2	175.8	166.2	-100.3	0	0	0	111	L176 F177 L180 V207 M208 D209 N214 L215 I366	L176-F211 HydrophobicContact CD1-CD2 4.01Å; L176-F211 HydrophobicContact CD1-CE2 4.39Å; L176-F211 HydrophobicContact CD2-CD2 4.42Å; L176-F211 HydrophobicContact CD2-CE2 4.05Å; L176-F211 HydrophobicContact CG-CD2 3.84Å; L176-F211 HydrophobicContact CG-CE2 3.71Å; F177-F211 AromaticContact CD1-CE2 3.89Å; F177-F211 HydrophobicContact CD1-CE2 3.89Å; F177-F211 HydrophobicContact CD1-CZ 4.05Å; F177-F211 HydrophobicContact CE1-CE2 4.12Å; F177-F211 AromaticContact CE1-CZ 4Å; F177-F211 HydrophobicContact CE1-CZ 4Å; L180-F211 HydrophobicContact CB-CD2 3.82Å; L180-F211 HydrophobicContact CB-CE2 4.15Å; L180-F211 HydrophobicContact CB-CG 4.48Å; L180-F211 HydrophobicContact CD1-CB 4.15Å; L180-F211 HydrophobicContact CD1-CD2 4.3Å; L180-F211 HydrophobicContact CD1-CG 4.12Å; L180-F211 HydrophobicContact CD2-CD1 4.24Å; L180-F211 HydrophobicContact CD2-CD2 3.85Å; L180-F211 HydrophobicContact CD2-CE1 4.16Å; L180-F211 HydrophobicContact CD2-CE2 3.73Å; L180-F211 HydrophobicContact CD2-CG 4.09Å; L180-F211 HydrophobicContact CD2-CZ 3.91Å; L180-F211 HydrophobicContact CG-CD2 4.19Å; L180-F211 HydrophobicContact CG-CE2 4.48Å; L180-F211 HydrophobicContact CG-CG 4.46Å; V207-F211 PolarHBondContact O-N 3.08Å; V207-F211 VanDerWaalsContact O-N 3.07Å; M208-F211 WeakPolarHBondContact O-CB 3.47Å; M208-F211 PolarHBondContact O-N 3.46Å; D209-F211 VanDerWaalsContact C-N 3.3Å; D209-F211 PolarHBondContact O-N 3.46Å; F211-N214 PolarHBondContact O-N 3.05Å; F211-L215 HydrophobicContact CE1-CD2 4.37Å; F211-L215 HydrophobicContact CZ-CD2 4.41Å; F211-L215 WeakPolarHBondContact O-CB 3.47Å; F211-L215 PolarHBondContact O-N 3.38Å; F211-I366 HydrophobicContact CE1-CD1 4.1Å; F211-I366 HydrophobicContact CE1-CG1 4.12Å; F211-I366 HydrophobicContact CE1-CG2 4.48Å; F211-I366 HydrophobicContact CZ-CD1 3.8Å; F211-I366 HydrophobicContact CZ-CG1 4.14Å; F211-I366 HydrophobicContact CZ-CG2 4Å
212	Y	96.2	Very high	89.8	Confident	7 Å²	7	38 Å²	38	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-69.6	-33.6	-179.6	-78.8	-72.3	0	0	0	113.2	M208 D209 N214 L215 Y216 F247 P251 M254 A369	M208-Y212 HydrophobicContact CE-CE2 3.94Å; M208-Y212 WeakPolarHBondContact O-CD2 3.49Å; M208-Y212 PolarHBondContact O-N 2.96Å; M208-Y212 VanDerWaalsContact O-N 3.14Å; D209-Y212 PolarHBondContact O-N 2.95Å; Y212-N214 VanDerWaalsContact C-N 3.35Å; Y212-L215 HydrophobicContact CD1-CD2 4.09Å; Y212-L215 HydrophobicContact CE1-CD2 4.31Å; Y212-L215 PolarHBondContact O-N 2.92Å; Y212-Y216 WeakPolarHBondContact O-CB 3.25Å; Y212-Y216 PolarHBondContact O-N 2.91Å; Y212-F247 AromaticContact CD1-CD2 3.73Å; Y212-F247 HydrophobicContact CD1-CD2 3.73Å; Y212-F247 HydrophobicContact CD1-CE2 4.02Å; Y212-F247 HydrophobicContact CD1-CG 4.17Å; Y212-F247 HydrophobicContact CG-CD2 4.46Å; Y212-F247 WeakPolarHBondContact O-CE2 3.32Å; Y212-P251 HydrophobicContact CD1-CB 4.15Å; Y212-P251 HydrophobicContact CD1-CG 3.69Å; Y212-P251 HydrophobicContact CD2-CB 3.57Å; Y212-P251 HydrophobicContact CD2-CG 4.07Å; Y212-P251 HydrophobicContact CE1-CB 4.26Å; Y212-P251 HydrophobicContact CE1-CG 3.77Å; Y212-P251 HydrophobicContact CE2-CB 3.69Å; Y212-P251 HydrophobicContact CE2-CG 4.14Å; Y212-P251 HydrophobicContact CG-CB 3.79Å; Y212-P251 HydrophobicContact CG-CG 3.83Å; Y212-M254 HydrophobicContact CE2-SD 4.34Å; Y212-M254 PolarHBondContact OH-SD 2.88Å; Y212-A369 HydrophobicContact CE1-CB 4Å
213	E	93.9	Very high	91.4	Very high	32 Å²	32	38.5 Å²	38.5	15%	0.15	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-44	171.6	-77.5	-178.5	172.2	0	0	112	D209 Y216 R217 M241 W540	D209-E213 WeakPolarHBondContact O-CB 3.01Å; D209-E213 WeakPolarHBondContact O-CG 3.06Å; D209-E213 PolarHBondContact O-N 2.91Å; E213-Y216 WeakPolarHBondContact O-CB 3.36Å; E213-Y216 PolarHBondContact O-N 3.25Å; E213-R217 WeakPolarHBondContact O-CG 3.09Å; E213-R217 PolarHBondContact O-N 3.37Å; E213-M241 HydrophobicContact CB-SD 4.47Å; E213-M241 HydrophobicContact CG-CE 3.42Å; E213-M241 VanDerWaalsContact CG-CE 3.42Å; E213-M241 HydrophobicContact CG-SD 3.72Å; E213-W540 WeakPolarHBondContact OE2-CH2 3.13Å
214	N	94.7	Very high	92.1	Very high	52 Å²	52	35.9 Å²	35.9	28%	0.278	16%	0.161	S	C	.	.	H	α-helix	trans	-68	-40.1	176.9	-76	-30.9	0	0	0	111.5	L176 R210 F211 Y212 Y216 R217 R218	L176-N214 HydrophobicContact CD1-CB 3.51Å; R210-N214 WeakPolarHBondContact O-CB 3.42Å; R210-N214 VanDerWaalsContact O-CG 3.24Å; R210-N214 PolarHBondContact O-N 3.49Å; R210-N214 PolarHBondContact O-ND2 2.99Å; R210-N214 VanDerWaalsContact O-ND2 3.12Å; F211-N214 PolarHBondContact O-N 3.05Å; Y212-N214 VanDerWaalsContact C-N 3.35Å; N214-Y216 VanDerWaalsContact C-N 3.31Å; N214-Y216 PolarHBondContact O-N 3.09Å; N214-R217 PolarHBondContact O-N 3.2Å; N214-R218 WeakPolarHBondContact O-CB 3.49Å; N214-R218 WeakPolarHBondContact O-CD 3.47Å; N214-R218 VanDerWaalsContact O-CG 3.26Å; N214-R218 WeakPolarHBondContact O-CG 3.45Å; N214-R218 PolarHBondContact O-N 3.15Å
215	L	95.9	Very high	91.9	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-45.4	172.9	-172.4	60.6	0	0	0	110.5	L176 F177 F211 Y212 R217 R218 M219 F247 I370	L176-L215 HydrophobicContact CD2-CB 3.87Å; L176-L215 HydrophobicContact CD2-CD1 3.68Å; L176-L215 HydrophobicContact CD2-CG 4.37Å; F177-L215 HydrophobicContact CZ-CD1 4.35Å; F211-L215 HydrophobicContact CE1-CD2 4.37Å; F211-L215 HydrophobicContact CZ-CD2 4.41Å; F211-L215 WeakPolarHBondContact O-CB 3.47Å; F211-L215 PolarHBondContact O-N 3.38Å; Y212-L215 HydrophobicContact CD1-CD2 4.09Å; Y212-L215 HydrophobicContact CE1-CD2 4.31Å; Y212-L215 PolarHBondContact O-N 2.92Å; L215-R217 PolarHBondContact O-N 3.47Å; L215-R218 PolarHBondContact O-N 3.25Å; L215-M219 HydrophobicContact CD1-CG 4.14Å; L215-M219 HydrophobicContact CD1-SD 4.06Å; L215-M219 HydrophobicContact CG-CG 4.36Å; L215-M219 HydrophobicContact CG-SD 3.98Å; L215-M219 WeakPolarHBondContact O-CB 3.22Å; L215-M219 VanDerWaalsContact O-CG 3.31Å; L215-M219 WeakPolarHBondContact O-CG 3.29Å; L215-M219 PolarHBondContact O-N 3.13Å; L215-F247 HydrophobicContact CB-CE2 4.48Å; L215-F247 HydrophobicContact CB-CZ 3.99Å; L215-F247 HydrophobicContact CD2-CE1 3.88Å; L215-F247 HydrophobicContact CD2-CZ 3.87Å; L215-F247 HydrophobicContact CG-CE1 4.03Å; L215-F247 HydrophobicContact CG-CZ 3.73Å; L215-I370 HydrophobicContact CD1-CD1 4.39Å; L215-I370 HydrophobicContact CD1-CG1 4.35Å; L215-I370 HydrophobicContact CD2-CG1 4.17Å
216	Y	95.3	Very high	91.6	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-59.4	-48.4	178.6	178.6	-145.8	0	0	0	111.8	Y212 E213 N214 R218 M219 F220 M237 M241 P246 F373 I380 V384	Y212-Y216 WeakPolarHBondContact O-CB 3.25Å; Y212-Y216 PolarHBondContact O-N 2.91Å; E213-Y216 WeakPolarHBondContact O-CB 3.36Å; E213-Y216 PolarHBondContact O-N 3.25Å; N214-Y216 VanDerWaalsContact C-N 3.31Å; N214-Y216 PolarHBondContact O-N 3.09Å; Y216-R218 PolarHBondContact O-N 2.87Å; Y216-M219 PolarHBondContact O-N 2.95Å; Y216-F220 HydrophobicContact CD2-CB 4.47Å; Y216-F220 HydrophobicContact CE2-CB 4.33Å; Y216-F220 HydrophobicContact CE2-CD2 4.22Å; Y216-F220 VanDerWaalsContact O-CB 3.25Å; Y216-F220 WeakPolarHBondContact O-CB 2.96Å; Y216-F220 PolarHBondContact O-N 3.5Å; Y216-M237 HydrophobicContact CD1-CE 3.32Å; Y216-M237 HydrophobicContact CD1-SD 4.48Å; Y216-M237 HydrophobicContact CD2-CE 4.21Å; Y216-M237 HydrophobicContact CE1-CE 3.14Å; Y216-M237 HydrophobicContact CE1-CG 3.61Å; Y216-M237 HydrophobicContact CE1-SD 3.78Å; Y216-M237 HydrophobicContact CE2-CE 4.05Å; Y216-M237 HydrophobicContact CE2-SD 4.15Å; Y216-M237 HydrophobicContact CG-CE 3.87Å; Y216-M237 VanDerWaalsContact CZ-SD 3.58Å; Y216-M237 WeakPolarHBondContact OH-CG 3.34Å; Y216-M241 HydrophobicContact CD1-CB 4.17Å; Y216-M241 HydrophobicContact CD1-CG 3.71Å; Y216-M241 HydrophobicContact CD1-SD 3.71Å; Y216-M241 HydrophobicContact CE1-CB 3.95Å; Y216-M241 HydrophobicContact CE1-CG 3.91Å; Y216-M241 HydrophobicContact CE1-SD 4.45Å; Y216-M241 HydrophobicContact CG-SD 4.41Å; Y216-P246 HydrophobicContact CD2-CB 4.08Å; Y216-P246 HydrophobicContact CD2-CG 4.07Å; Y216-P246 HydrophobicContact CE2-CB 4.09Å; Y216-P246 HydrophobicContact CE2-CG 4.25Å; Y216-P246 HydrophobicContact CG-CG 4.22Å; Y216-F373 HydrophobicContact CD2-CD2 4.41Å; Y216-F373 AromaticContact CD2-CE2 3.49Å; Y216-F373 HydrophobicContact CD2-CE2 3.49Å; Y216-F373 VanDerWaalsContact CD2-CE2 3.49Å; Y216-F373 HydrophobicContact CD2-CZ 4.13Å; Y216-F373 AromaticContact CE2-CE2 3.66Å; Y216-F373 HydrophobicContact CE2-CE2 3.66Å; Y216-F373 HydrophobicContact CE2-CZ 4.17Å; Y216-I380 HydrophobicContact CE2-CG2 4.1Å; Y216-V384 WeakPolarHBondContact OH-CG2 3.41Å
217	R	93.3	Very high	91.4	Very high	61 Å²	61	39.8 Å²	39.8	23%	0.23	18%	0.183	C	C	.	.	H	α-helix	trans	-58.2	-46.7	176.7	-72.2	172.6	-179.9	-108.4	-0.5	111.8	E213 N214 L215 R221 E231 W234 M237	E213-R217 WeakPolarHBondContact O-CG 3.09Å; E213-R217 PolarHBondContact O-N 3.37Å; N214-R217 PolarHBondContact O-N 3.2Å; L215-R217 PolarHBondContact O-N 3.47Å; R217-R221 WeakPolarHBondContact O-CB 3.31Å; R217-R221 PolarHBondContact O-N 3.43Å; R217-E231 IonicContact NH1-OE2 3.83Å; R217-E231 PolarHBondContact NH1-OE2 2.97Å; R217-W234 HydrophobicContact CB-CH2 4.37Å; R217-W234 HydrophobicContact CB-CZ3 4.32Å; R217-W234 HydrophobicContact CG-CD2 4.38Å; R217-W234 HydrophobicContact CG-CE3 4.09Å; R217-W234 HydrophobicContact CG-CZ3 4.26Å; R217-W234 VanDerWaalsContact NH1-CG 3.32Å; R217-W234 WeakPolarHBondContact O-CH2 3.22Å; R217-M237 HydrophobicContact CG-CE 4.14Å
218	R	92.7	Very high	90.9	Very high	48 Å²	48	44.3 Å²	44.3	18%	0.181	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-46.3	-177.9	-70	154.6	-167.3	-136.4	-1.4	111	D175 N214 L215 Y216 R221 M222	D175-R218 VanDerWaalsContact CG-NH1 3.28Å; D175-R218 IonicContact OD1-NH1 2.82Å; D175-R218 PolarHBondContact OD1-NH1 3.44Å; D175-R218 IonicContact OD2-CZ 3.37Å; D175-R218 IonicContact OD2-NH1 3.57Å; D175-R218 PolarHBondContact OD2-NH1 3.45Å; D175-R218 IonicContact OD2-NH2 2.96Å; D175-R218 PolarHBondContact OD2-NH2 3.32Å; N214-R218 WeakPolarHBondContact O-CB 3.49Å; N214-R218 WeakPolarHBondContact O-CD 3.47Å; N214-R218 VanDerWaalsContact O-CG 3.26Å; N214-R218 WeakPolarHBondContact O-CG 3.45Å; N214-R218 PolarHBondContact O-N 3.15Å; L215-R218 PolarHBondContact O-N 3.25Å; Y216-R218 PolarHBondContact O-N 2.87Å; R218-R221 PolarHBondContact O-N 3.19Å; R218-M222 WeakPolarHBondContact O-CG 3.46Å; R218-M222 PolarHBondContact O-N 3.33Å
219	M	92.3	Very high	90.4	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.064	21%	0.209	C	C	.	.	H	α-helix	trans	-67.3	-43	178.7	-68.2	-170.9	75.9	0	0	113	L215 Y216 R221 M222 L223 F247 I370 F373 Q374	L215-M219 HydrophobicContact CD1-CG 4.14Å; L215-M219 HydrophobicContact CD1-SD 4.06Å; L215-M219 HydrophobicContact CG-CG 4.36Å; L215-M219 HydrophobicContact CG-SD 3.98Å; L215-M219 WeakPolarHBondContact O-CB 3.22Å; L215-M219 VanDerWaalsContact O-CG 3.31Å; L215-M219 WeakPolarHBondContact O-CG 3.29Å; L215-M219 PolarHBondContact O-N 3.13Å; Y216-M219 PolarHBondContact O-N 2.95Å; M219-R221 VanDerWaalsContact C-N 3.32Å; M219-R221 PolarHBondContact O-N 3.1Å; M219-M222 HydrophobicContact CG-CE 4.12Å; M219-M222 PolarHBondContact O-N 3.39Å; M219-L223 WeakPolarHBondContact O-CB 3.44Å; M219-L223 PolarHBondContact O-N 2.98Å; M219-F247 HydrophobicContact SD-CE1 3.68Å; M219-F247 HydrophobicContact SD-CZ 4.28Å; M219-I370 HydrophobicContact CE-CB 4.15Å; M219-I370 HydrophobicContact CE-CG1 4.31Å; M219-I370 HydrophobicContact CE-CG2 3.65Å; M219-I370 HydrophobicContact SD-CB 4.4Å; M219-I370 HydrophobicContact SD-CG1 3.94Å; M219-I370 HydrophobicContact SD-CG2 4.39Å; M219-F373 HydrophobicContact CB-CD1 3.9Å; M219-F373 HydrophobicContact CB-CE1 3.67Å; M219-F373 HydrophobicContact CB-CG 4.4Å; M219-F373 HydrophobicContact CB-CZ 4.03Å; M219-F373 HydrophobicContact CE-CB 3.69Å; M219-F373 HydrophobicContact CE-CD1 3.45Å; M219-F373 VanDerWaalsContact CE-CD1 3.45Å; M219-F373 HydrophobicContact CE-CE1 4.34Å; M219-F373 HydrophobicContact CE-CG 3.72Å; M219-F373 HydrophobicContact SD-CB 4.11Å; M219-F373 HydrophobicContact SD-CD1 4.13Å; M219-F373 HydrophobicContact SD-CG 4.01Å; M219-Q374 HydrophobicContact CE-CG 4.01Å
220	F	92.6	Very high	90.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-41	177.7	-169.9	-89.6	0	0	0	111.6	Y216 L223 N224 L229 Y233 W234 M237 F373 I380 V384 F385	Y216-F220 HydrophobicContact CD2-CB 4.47Å; Y216-F220 HydrophobicContact CE2-CB 4.33Å; Y216-F220 HydrophobicContact CE2-CD2 4.22Å; Y216-F220 VanDerWaalsContact O-CB 3.25Å; Y216-F220 WeakPolarHBondContact O-CB 2.96Å; Y216-F220 PolarHBondContact O-N 3.5Å; F220-L223 PolarHBondContact O-N 2.92Å; F220-N224 HydrophobicContact CE1-CB 4.34Å; F220-N224 WeakPolarHBondContact CE2-ND2 3.15Å; F220-N224 WeakPolarHBondContact CZ-ND2 3.29Å; F220-N224 VanDerWaalsContact O-CB 3.31Å; F220-N224 WeakPolarHBondContact O-CB 3.25Å; F220-N224 PolarHBondContact O-N 2.62Å; F220-N224 PolarHBondContact O-ND2 3.03Å; F220-N224 VanDerWaalsContact O-ND2 3.15Å; F220-L229 HydrophobicContact CD1-CD1 3.64Å; F220-L229 HydrophobicContact CE1-CD1 3.89Å; F220-L229 HydrophobicContact CE1-CD2 4.21Å; F220-Y233 HydrophobicContact CE1-CE1 4.19Å; F220-W234 HydrophobicContact CB-CH2 4.49Å; F220-W234 HydrophobicContact CB-CZ3 4.25Å; F220-W234 HydrophobicContact CD1-CH2 4.16Å; F220-W234 AromaticContact CD1-CZ3 3.89Å; F220-W234 HydrophobicContact CD1-CZ3 3.89Å; F220-W234 HydrophobicContact CG-CZ3 4.4Å; F220-M237 HydrophobicContact CB-SD 4.1Å; F220-M237 HydrophobicContact CD1-SD 3.78Å; F220-M237 HydrophobicContact CD2-SD 4.01Å; F220-M237 HydrophobicContact CE1-SD 4.2Å; F220-M237 HydrophobicContact CE2-SD 4.39Å; F220-M237 HydrophobicContact CG-SD 3.68Å; F220-M237 HydrophobicContact CZ-SD 4.49Å; F220-F373 HydrophobicContact CB-CZ 4.35Å; F220-I380 HydrophobicContact CD2-CG2 4.4Å; F220-V384 HydrophobicContact CE2-CB 4Å; F220-V384 HydrophobicContact CE2-CG1 4.1Å; F220-V384 HydrophobicContact CE2-CG2 4.04Å; F220-V384 HydrophobicContact CZ-CB 4.06Å; F220-V384 HydrophobicContact CZ-CG1 3.78Å; F220-F385 HydrophobicContact CZ-CE1 4.15Å; F220-F385 HydrophobicContact CZ-CZ 4.46Å
221	R	91.4	Very high	89.8	Confident	135 Å²	135	50.1 Å²	50.1	51%	0.509	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-42.7	173.4	-175.3	179.8	66.2	-177.1	0.9	111.9	R217 R218 M219 N224 Q225 W234	R217-R221 WeakPolarHBondContact O-CB 3.31Å; R217-R221 PolarHBondContact O-N 3.43Å; R218-R221 PolarHBondContact O-N 3.19Å; M219-R221 VanDerWaalsContact C-N 3.32Å; M219-R221 PolarHBondContact O-N 3.1Å; R221-N224 CarbonylContact O-C 3.59Å; R221-N224 PolarHBondContact O-N 2.67Å; R221-Q225 WeakPolarHBondContact O-CA 3.43Å; R221-Q225 WeakPolarHBondContact O-CG 3.31Å; R221-Q225 PolarHBondContact O-N 3.24Å; R221-Q225 VanDerWaalsContact O-N 3.08Å; R221-W234 HydrophobicContact CB-CH2 4.11Å; R221-W234 HydrophobicContact CB-CZ2 4.37Å
222	M	89.3	Confident	89.5	Confident	45 Å²	45	56.5 Å²	56.5	22%	0.222	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-39.2	177.8	-73.8	-173.3	-66.7	0	0	112.5	L169 R218 M219 N224	L169-M222 HydrophobicContact CD2-SD 4.36Å; R218-M222 WeakPolarHBondContact O-CG 3.46Å; R218-M222 PolarHBondContact O-N 3.33Å; M219-M222 HydrophobicContact CG-CE 4.12Å; M219-M222 PolarHBondContact O-N 3.39Å; M222-N224 VanDerWaalsContact C-N 3.33Å
223	L	88.8	Confident	89.2	Confident	50 Å²	50	57.4 Å²	57.4	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-70.5	-30.6	177.1	-172.5	65.2	0	0	0	112.4	M219 F220 F373 G377 L408	M219-L223 WeakPolarHBondContact O-CB 3.44Å; M219-L223 PolarHBondContact O-N 2.98Å; F220-L223 PolarHBondContact O-N 2.92Å; L223-F373 HydrophobicContact CD2-CE1 4.27Å; L223-G377 WeakPolarHBondContact CD2-O 3.44Å; L223-L408 HydrophobicContact CD1-CD2 4.47Å
224	N	88.5	Confident	89	Confident	14 Å²	14	56.8 Å²	56.8	8%	0.075	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	36.4	-172.7	-65.2	-69	0	0	0	113.2	F220 R221 M222 P226 Y227 S381 F385	F220-N224 HydrophobicContact CE1-CB 4.34Å; F220-N224 WeakPolarHBondContact CE2-ND2 3.15Å; F220-N224 WeakPolarHBondContact CZ-ND2 3.29Å; F220-N224 VanDerWaalsContact O-CB 3.31Å; F220-N224 WeakPolarHBondContact O-CB 3.25Å; F220-N224 PolarHBondContact O-N 2.62Å; F220-N224 PolarHBondContact O-ND2 3.03Å; F220-N224 VanDerWaalsContact O-ND2 3.15Å; R221-N224 CarbonylContact O-C 3.59Å; R221-N224 PolarHBondContact O-N 2.67Å; M222-N224 VanDerWaalsContact C-N 3.33Å; N224-P226 WeakPolarHBondContact O-CD 3.47Å; N224-P226 VanDerWaalsContact O-N 3.15Å; N224-Y227 HydrophobicContact CB-CD2 3.94Å; N224-Y227 WeakPolarHBondContact O-CB 3.47Å; N224-Y227 WeakPolarHBondContact O-CD2 3.43Å; N224-Y227 PolarHBondContact O-N 2.9Å; N224-S381 PolarHBondContact ND2-OG 3.09Å; N224-S381 PolarHBondContact OD1-OG 3.39Å; N224-F385 WeakPolarHBondContact OD1-CZ 3.4Å
225	Q	81.6	Confident	88.9	Confident	99 Å²	99	57 Å²	57	46%	0.463	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-36.7	-176.4	-80.2	-166.5	-13.3	0	0	118.5	R221 Y227 M404	R221-Q225 WeakPolarHBondContact O-CA 3.43Å; R221-Q225 WeakPolarHBondContact O-CG 3.31Å; R221-Q225 PolarHBondContact O-N 3.24Å; R221-Q225 VanDerWaalsContact O-N 3.08Å; Q225-Y227 PolarHBondContact O-N 3.2Å; Q225-Y227 VanDerWaalsContact O-N 3.12Å; Q225-M404 VanDerWaalsContact CD-SD 3.51Å; Q225-M404 PolarHBondContact NE2-SD 2.85Å; Q225-M404 PolarHBondContact OE1-SD 2.84Å; Q225-M404 VanDerWaalsContact OE1-SD 3.37Å
226	P	81.5	Confident	88.7	Confident	68 Å²	68	57.9 Å²	57.9	44%	0.442	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.2	-179.4	23.8	-33.5	0	0	0	113.6	N224 I393 T394	N224-P226 WeakPolarHBondContact O-CD 3.47Å; N224-P226 VanDerWaalsContact O-N 3.15Å; P226-I393 HydrophobicContact CB-CG2 4.48Å; P226-I393 WeakPolarHBondContact O-CA 2.99Å; P226-T394 PolarHBondContact O-N 3.05Å
227	Y	84.7	Confident	88.6	Confident	52 Å²	52	57.8 Å²	57.8	20%	0.204	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-95.1	135.8	-176.4	-60.9	-76.9	0	0	0	112.3	N224 Q225 F385 P391 K392 I393	N224-Y227 HydrophobicContact CB-CD2 3.94Å; N224-Y227 WeakPolarHBondContact O-CB 3.47Å; N224-Y227 WeakPolarHBondContact O-CD2 3.43Å; N224-Y227 PolarHBondContact O-N 2.9Å; Q225-Y227 PolarHBondContact O-N 3.2Å; Q225-Y227 VanDerWaalsContact O-N 3.12Å; Y227-F385 HydrophobicContact CD2-CZ 4.33Å; Y227-F385 AromaticContact CE2-CZ 4Å; Y227-F385 HydrophobicContact CE2-CZ 4Å; Y227-P391 HydrophobicContact CD1-CB 4.19Å; Y227-P391 HydrophobicContact CD1-CG 3.66Å; Y227-P391 VanDerWaalsContact CD1-O 3.27Å; Y227-P391 WeakPolarHBondContact CD1-O 3.47Å; Y227-P391 HydrophobicContact CE1-CG 4.39Å; Y227-P391 HydrophobicContact CG-CB 4.42Å; Y227-P391 HydrophobicContact CG-CG 3.72Å; Y227-K392 WeakPolarHBondContact CA-O 3.3Å; Y227-I393 HydrophobicContact CD1-CG1 3.67Å; Y227-I393 HydrophobicContact CE1-CD1 4.04Å; Y227-I393 HydrophobicContact CE1-CG1 3.39Å
228	Q	80	Confident	88.4	Confident	104 Å²	104	55.7 Å²	55.7	49%	0.486	27%	0.27	S	S	.	.			trans	-80.7	124	164.9	-86.4	167.4	14.1	0	0	109.4	K392 T394	Q228-K392 PolarHBondContact N-O 3.19Å; Q228-T394 VanDerWaalsContact CG-OG1 3.25Å; Q228-T394 WeakPolarHBondContact CG-OG1 3.37Å; Q228-T394 PolarHBondContact NE2-OG1 2.84Å; Q228-T394 VanDerWaalsContact NE2-OG1 3.12Å
229	L	83.8	Confident	88.3	Confident	24 Å²	24	61 Å²	61	13%	0.126	29%	0.29	C	S	.	.			trans	-112.9	100	-179.1	-57.4	174.3	0	0	0	108.5	F220 Y233 W234 P391	F220-L229 HydrophobicContact CD1-CD1 3.64Å; F220-L229 HydrophobicContact CE1-CD1 3.89Å; F220-L229 HydrophobicContact CE1-CD2 4.21Å; L229-Y233 HydrophobicContact CD2-CD1 3.62Å; L229-Y233 HydrophobicContact CD2-CE1 3.65Å; L229-Y233 HydrophobicContact CD2-CG 4.26Å; L229-W234 HydrophobicContact CB-CD2 4.36Å; L229-W234 HydrophobicContact CB-CH2 4.1Å; L229-W234 HydrophobicContact CB-CZ2 3.51Å; L229-W234 HydrophobicContact CD1-CH2 3.22Å; L229-W234 HydrophobicContact CD1-CZ2 3.49Å; L229-W234 VanDerWaalsContact CD1-CZ2 3.49Å; L229-W234 HydrophobicContact CD1-CZ3 3.87Å; L229-W234 HydrophobicContact CG-CH2 4.28Å; L229-W234 HydrophobicContact CG-CZ2 4.14Å; L229-W234 PolarHBondContact O-NE1 3.09Å; L229-W234 VanDerWaalsContact O-NE1 3.11Å; L229-P391 HydrophobicContact CD2-CB 3.82Å; L229-P391 HydrophobicContact CD2-CG 3.67Å
230	D	86.3	Confident	88.2	Confident	99 Å²	99	62.7 Å²	62.7	53%	0.529	30%	0.297	S	S	.	.			trans	-75.5	164.5	178.5	-58.8	-23.1	0	0	0	111	D232 Y233 W234	D230-D232 VanDerWaalsContact C-N 3.27Å; D230-D232 PolarHBondContact O-N 3.22Å; D230-Y233 WeakPolarHBondContact O-CB 3.34Å; D230-Y233 PolarHBondContact O-N 3.37Å; D230-W234 VanDerWaalsContact O-CD1 3.29Å; D230-W234 PolarHBondContact O-N 3Å; D230-W234 VanDerWaalsContact O-N 3.09Å
231	E	87.8	Confident	88.1	Confident	133 Å²	133	64.5 Å²	64.5	62%	0.621	31%	0.306	S	S	*	.	H	α-helix	trans	-59.2	-34.9	179.6	-74.9	-62.3	170.7	0	0	113.8	R217 Y233 W234 Q235	R217-E231 IonicContact NH1-OE2 3.83Å; R217-E231 PolarHBondContact NH1-OE2 2.97Å; E231-Y233 VanDerWaalsContact C-N 3.28Å; E231-Y233 PolarHBondContact O-N 3.12Å; E231-W234 PolarHBondContact O-N 2.92Å; E231-Q235 PolarHBondContact O-N 2.79Å
232	D	88.5	Confident	88	Confident	141 Å²	141	64.7 Å²	64.7	75%	0.754	31%	0.313	S	S	*	.	H	α-helix	trans	-63.9	-36.9	175.7	-66.9	-27	0	0	0	111.7	D230 Q235 C236	D230-D232 VanDerWaalsContact C-N 3.27Å; D230-D232 PolarHBondContact O-N 3.22Å; D232-Q235 PolarHBondContact O-N 3.36Å; D232-C236 PolarHBondContact O-N 3.41Å
233	Y	90.5	Very high	88.1	Confident	26 Å²	26	70 Å²	70	10%	0.102	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-41.2	176.3	-167.1	-86.3	0	0	0	110.7	F220 L229 D230 E231 Q235 C236 M237 V384 F385 C388 G389 P391	F220-Y233 HydrophobicContact CE1-CE1 4.19Å; L229-Y233 HydrophobicContact CD2-CD1 3.62Å; L229-Y233 HydrophobicContact CD2-CE1 3.65Å; L229-Y233 HydrophobicContact CD2-CG 4.26Å; D230-Y233 WeakPolarHBondContact O-CB 3.34Å; D230-Y233 PolarHBondContact O-N 3.37Å; E231-Y233 VanDerWaalsContact C-N 3.28Å; E231-Y233 PolarHBondContact O-N 3.12Å; Y233-Q235 VanDerWaalsContact C-N 3.32Å; Y233-Q235 PolarHBondContact O-N 3.22Å; Y233-C236 WeakPolarHBondContact O-CB 3.45Å; Y233-C236 PolarHBondContact O-N 3Å; Y233-M237 WeakPolarHBondContact O-CB 3.35Å; Y233-M237 PolarHBondContact O-N 3.35Å; Y233-V384 HydrophobicContact CE1-CG1 3.99Å; Y233-V384 WeakPolarHBondContact OH-CG1 3.41Å; Y233-F385 WeakPolarHBondContact OH-CD1 3.28Å; Y233-C388 HydrophobicContact CD2-CB 4.18Å; Y233-C388 HydrophobicContact CE2-CB 3.62Å; Y233-G389 WeakPolarHBondContact CE2-O 3.4Å; Y233-G389 PolarHBondContact OH-O 3.15Å; Y233-P391 HydrophobicContact CD2-CB 4.39Å; Y233-P391 HydrophobicContact CE2-CB 4.14Å; Y233-P391 HydrophobicContact CE2-CG 4.16Å
234	W	90.5	Very high	88.3	Confident	20 Å²	20	68.1 Å²	68.1	8%	0.076	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-37.6	174.4	-64.5	127.6	0	0	0	113	R217 F220 R221 L229 D230 E231 C236 M237 S238	R217-W234 HydrophobicContact CB-CH2 4.37Å; R217-W234 HydrophobicContact CB-CZ3 4.32Å; R217-W234 HydrophobicContact CG-CD2 4.38Å; R217-W234 HydrophobicContact CG-CE3 4.09Å; R217-W234 HydrophobicContact CG-CZ3 4.26Å; R217-W234 VanDerWaalsContact NH1-CG 3.32Å; R217-W234 WeakPolarHBondContact O-CH2 3.22Å; F220-W234 HydrophobicContact CB-CH2 4.49Å; F220-W234 HydrophobicContact CB-CZ3 4.25Å; F220-W234 HydrophobicContact CD1-CH2 4.16Å; F220-W234 AromaticContact CD1-CZ3 3.89Å; F220-W234 HydrophobicContact CD1-CZ3 3.89Å; F220-W234 HydrophobicContact CG-CZ3 4.4Å; R221-W234 HydrophobicContact CB-CH2 4.11Å; R221-W234 HydrophobicContact CB-CZ2 4.37Å; L229-W234 HydrophobicContact CB-CD2 4.36Å; L229-W234 HydrophobicContact CB-CH2 4.1Å; L229-W234 HydrophobicContact CB-CZ2 3.51Å; L229-W234 HydrophobicContact CD1-CH2 3.22Å; L229-W234 HydrophobicContact CD1-CZ2 3.49Å; L229-W234 VanDerWaalsContact CD1-CZ2 3.49Å; L229-W234 HydrophobicContact CD1-CZ3 3.87Å; L229-W234 HydrophobicContact CG-CH2 4.28Å; L229-W234 HydrophobicContact CG-CZ2 4.14Å; L229-W234 PolarHBondContact O-NE1 3.09Å; L229-W234 VanDerWaalsContact O-NE1 3.11Å; D230-W234 VanDerWaalsContact O-CD1 3.29Å; D230-W234 PolarHBondContact O-N 3Å; D230-W234 VanDerWaalsContact O-N 3.09Å; E231-W234 PolarHBondContact O-N 2.92Å; W234-C236 VanDerWaalsContact C-N 3.29Å; W234-C236 PolarHBondContact O-N 3.36Å; W234-M237 HydrophobicContact CE3-CE 3.38Å; W234-M237 HydrophobicContact CE3-SD 3.63Å; W234-M237 HydrophobicContact CZ3-CE 3.37Å; W234-M237 HydrophobicContact CZ3-SD 3.44Å; W234-M237 WeakPolarHBondContact CZ3-SD 3.34Å; W234-M237 PolarHBondContact O-N 3.09Å; W234-S238 WeakPolarHBondContact O-CB 3.3Å; W234-S238 PolarHBondContact O-N 2.95Å
235	Q	91	Very high	88.6	Confident	57 Å²	57	70.6 Å²	70.6	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-37.4	174.9	-165.8	65.8	15.1	0	0	111.4	E231 D232 Y233 R239	E231-Q235 PolarHBondContact O-N 2.79Å; D232-Q235 PolarHBondContact O-N 3.36Å; Y233-Q235 VanDerWaalsContact C-N 3.32Å; Y233-Q235 PolarHBondContact O-N 3.22Å; Q235-R239 WeakPolarHBondContact O-CG 3.32Å
236	C	93	Very high	89.2	Confident	24 Å²	24	66.1 Å²	66.1	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-50.2	171.5	179.8	0	0	0	0	111.7	D232 Y233 W234 S238 R239 H240 C388	D232-C236 PolarHBondContact O-N 3.41Å; Y233-C236 WeakPolarHBondContact O-CB 3.45Å; Y233-C236 PolarHBondContact O-N 3Å; W234-C236 VanDerWaalsContact C-N 3.29Å; W234-C236 PolarHBondContact O-N 3.36Å; C236-S238 VanDerWaalsContact C-N 3.31Å; C236-S238 PolarHBondContact O-N 3.12Å; C236-R239 WeakPolarHBondContact O-CB 3.16Å; C236-R239 PolarHBondContact O-N 3.03Å; C236-R239 VanDerWaalsContact O-N 3.09Å; C236-H240 PolarHBondContact O-CD2 3.43Å; C236-C388 HydrophobicContact CB-CB 3.89Å; C236-C388 WeakPolarHBondContact CB-SG 3.37Å; C236-C388 WeakPolarHBondContact SG-CA 3.34Å; C236-C388 WeakPolarHBondContact SG-CB 3.48Å; C236-C388 CovalentContact SG-SG 2.04Å; C236-C388 PolarHBondContact SG-SG 3.03Å
237	M	91.8	Very high	89.9	Confident	1 Å²	1	63 Å²	63	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-40.7	-178.5	-170.4	-171.5	83.2	0	0	112.4	Y216 R217 F220 Y233 W234 R239 H240 M241 V384	Y216-M237 HydrophobicContact CD1-CE 3.32Å; Y216-M237 HydrophobicContact CD1-SD 4.48Å; Y216-M237 HydrophobicContact CD2-CE 4.21Å; Y216-M237 HydrophobicContact CE1-CE 3.14Å; Y216-M237 HydrophobicContact CE1-CG 3.61Å; Y216-M237 HydrophobicContact CE1-SD 3.78Å; Y216-M237 HydrophobicContact CE2-CE 4.05Å; Y216-M237 HydrophobicContact CE2-SD 4.15Å; Y216-M237 HydrophobicContact CG-CE 3.87Å; Y216-M237 VanDerWaalsContact CZ-SD 3.58Å; Y216-M237 WeakPolarHBondContact OH-CG 3.34Å; R217-M237 HydrophobicContact CG-CE 4.14Å; F220-M237 HydrophobicContact CB-SD 4.1Å; F220-M237 HydrophobicContact CD1-SD 3.78Å; F220-M237 HydrophobicContact CD2-SD 4.01Å; F220-M237 HydrophobicContact CE1-SD 4.2Å; F220-M237 HydrophobicContact CE2-SD 4.39Å; F220-M237 HydrophobicContact CG-SD 3.68Å; F220-M237 HydrophobicContact CZ-SD 4.49Å; Y233-M237 WeakPolarHBondContact O-CB 3.35Å; Y233-M237 PolarHBondContact O-N 3.35Å; W234-M237 HydrophobicContact CE3-CE 3.38Å; W234-M237 HydrophobicContact CE3-SD 3.63Å; W234-M237 HydrophobicContact CZ3-CE 3.37Å; W234-M237 HydrophobicContact CZ3-SD 3.44Å; W234-M237 WeakPolarHBondContact CZ3-SD 3.34Å; W234-M237 PolarHBondContact O-N 3.09Å; M237-R239 PolarHBondContact O-N 2.73Å; M237-H240 PolarHBondContact O-N 2.79Å; M237-M241 PolarHBondContact O-N 3.07Å; M237-V384 HydrophobicContact CB-CG1 4.3Å; M237-V384 HydrophobicContact CG-CG1 3.87Å; M237-V384 HydrophobicContact CG-CG2 4.11Å
238	S	89.6	Confident	90.4	Very high	17 Å²	17	61.4 Å²	61.4	12%	0.119	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-35.9	176.8	174.4	0	0	0	0	112.2	W234 C236 H240 M241	W234-S238 WeakPolarHBondContact O-CB 3.3Å; W234-S238 PolarHBondContact O-N 2.95Å; C236-S238 VanDerWaalsContact C-N 3.31Å; C236-S238 PolarHBondContact O-N 3.12Å; S238-H240 PolarHBondContact O-N 2.83Å; S238-M241 WeakPolarHBondContact O-CB 3.23Å; S238-M241 PolarHBondContact O-N 3.17Å
239	R	90.4	Very high	91.2	Very high	159 Å²	159	60.4 Å²	60.4	60%	0.6	29%	0.292	S	S	*	.	H	α-helix	trans	-64.5	-28.6	176.1	-63.4	172.3	-168.6	152.8	3.3	112.9	Q235 C236 M237	Q235-R239 WeakPolarHBondContact O-CG 3.32Å; C236-R239 WeakPolarHBondContact O-CB 3.16Å; C236-R239 PolarHBondContact O-N 3.03Å; C236-R239 VanDerWaalsContact O-N 3.09Å; M237-R239 PolarHBondContact O-N 2.73Å
240	H	90.1	Very high	91.7	Very high	48 Å²	48	60 Å²	60	22%	0.222	29%	0.29	C	S	.	.	H	α-helix	trans	-87.2	-13.6	178.3	-69.3	-74.8	0	0	0	113.4	C236 M237 S238 H242 Q243 L244	C236-H240 PolarHBondContact O-CD2 3.43Å; M237-H240 PolarHBondContact O-N 2.79Å; S238-H240 PolarHBondContact O-N 2.83Å; H240-H242 PolarHBondContact O-N 3.45Å; H240-Q243 PolarHBondContact O-N 3.2Å; H240-Q243 VanDerWaalsContact O-N 3.16Å; H240-L244 HydrophobicContact CB-CD1 3.82Å; H240-L244 HydrophobicContact CB-CG 4.22Å; H240-L244 WeakPolarHBondContact O-CB 3.41Å; H240-L244 VanDerWaalsContact O-CG 3.27Å; H240-L244 WeakPolarHBondContact O-CG 3.32Å; H240-L244 PolarHBondContact O-N 3.01Å
241	M	90.7	Very high	92.2	Very high	38 Å²	38	56.5 Å²	56.5	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-57.2	-45.6	-172.9	-170	-179	71.2	0	0	112.7	E213 Y216 M237 S238 Q243 L244 Q245 P246	E213-M241 HydrophobicContact CB-SD 4.47Å; E213-M241 HydrophobicContact CG-CE 3.42Å; E213-M241 VanDerWaalsContact CG-CE 3.42Å; E213-M241 HydrophobicContact CG-SD 3.72Å; Y216-M241 HydrophobicContact CD1-CB 4.17Å; Y216-M241 HydrophobicContact CD1-CG 3.71Å; Y216-M241 HydrophobicContact CD1-SD 3.71Å; Y216-M241 HydrophobicContact CE1-CB 3.95Å; Y216-M241 HydrophobicContact CE1-CG 3.91Å; Y216-M241 HydrophobicContact CE1-SD 4.45Å; Y216-M241 HydrophobicContact CG-SD 4.41Å; M237-M241 PolarHBondContact O-N 3.07Å; S238-M241 WeakPolarHBondContact O-CB 3.23Å; S238-M241 PolarHBondContact O-N 3.17Å; M241-Q243 PolarHBondContact O-N 3.33Å; M241-L244 PolarHBondContact O-N 3.41Å; M241-Q245 PolarHBondContact O-N 3.08Å; M241-P246 HydrophobicContact CG-CG 3.97Å; M241-P246 VanDerWaalsContact O-CD 3.27Å; M241-P246 WeakPolarHBondContact O-CD 3.46Å
242	H	89.2	Confident	92.4	Very high	140 Å²	140	55.2 Å²	55.2	65%	0.648	27%	0.267	S	S	*	.	H	α-helix	trans	-64	-39.3	-179.9	-175.4	-63	0	0	0	112.3	H240 Q245	H240-H242 PolarHBondContact O-N 3.45Å; H242-Q245 VanDerWaalsContact O-CG 3.3Å; H242-Q245 WeakPolarHBondContact O-CG 3.4Å
243	Q	91.2	Very high	92.6	Very high	157 Å²	157	54.9 Å²	54.9	73%	0.734	26%	0.259	S	S	*	.	H	α-helix	trans	-74.3	-37.1	179.9	-172.2	-176.7	14.4	0	0	111.8	H240 M241	H240-Q243 PolarHBondContact O-N 3.2Å; H240-Q243 VanDerWaalsContact O-N 3.16Å; M241-Q243 PolarHBondContact O-N 3.33Å
244	L	93.5	Very high	92.8	Very high	9 Å²	9	53.7 Å²	53.7	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-76	-29	-177.2	-67.7	176.3	0	0	0	112.8	H240 M241 R376 I380 K383 V384	H240-L244 HydrophobicContact CB-CD1 3.82Å; H240-L244 HydrophobicContact CB-CG 4.22Å; H240-L244 WeakPolarHBondContact O-CB 3.41Å; H240-L244 VanDerWaalsContact O-CG 3.27Å; H240-L244 WeakPolarHBondContact O-CG 3.32Å; H240-L244 PolarHBondContact O-N 3.01Å; M241-L244 PolarHBondContact O-N 3.41Å; L244-R376 PolarHBondContact O-NH1 3.45Å; L244-R376 PolarHBondContact O-NH2 2.87Å; L244-I380 HydrophobicContact CD1-CG2 4.46Å; L244-K383 HydrophobicContact CD2-CB 3.69Å; L244-K383 HydrophobicContact CD2-CD 3.32Å; L244-K383 HydrophobicContact CD2-CG 4.14Å; L244-V384 HydrophobicContact CD1-CG2 3.64Å
245	Q	94.8	Very high	92.9	Very high	67 Å²	67	54.2 Å²	54.2	31%	0.313	26%	0.257	S	S	.	.			trans	42.9	65.7	-171.9	-63.6	-168.3	-47.8	0	0	110.4	M241 H242 F247 G248 R376	M241-Q245 PolarHBondContact O-N 3.08Å; H242-Q245 VanDerWaalsContact O-CG 3.3Å; H242-Q245 WeakPolarHBondContact O-CG 3.4Å; Q245-F247 PolarHBondContact O-N 3.33Å; Q245-G248 PolarHBondContact O-N 2.91Å; Q245-R376 PolarHBondContact O-NH1 3.39Å
246	P	94.5	Very high	92.9	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.026	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.3	-169.7	22.9	-33.7	0	0	0	113.4	Y216 M241 F373 I380	Y216-P246 HydrophobicContact CD2-CB 4.08Å; Y216-P246 HydrophobicContact CD2-CG 4.07Å; Y216-P246 HydrophobicContact CE2-CB 4.09Å; Y216-P246 HydrophobicContact CE2-CG 4.25Å; Y216-P246 HydrophobicContact CG-CG 4.22Å; M241-P246 HydrophobicContact CG-CG 3.97Å; M241-P246 VanDerWaalsContact O-CD 3.27Å; M241-P246 WeakPolarHBondContact O-CD 3.46Å; P246-F373 HydrophobicContact CB-CD2 3.67Å; P246-F373 HydrophobicContact CB-CE2 3.78Å; P246-F373 WeakPolarHBondContact O-CA 3.5Å; P246-I380 HydrophobicContact CB-CD1 3.92Å
247	F	96.9	Very high	92.9	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.018	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	15.5	178.9	-55.6	-62.4	0	0	0	113.1	Y212 L215 M219 Q245 P251 A369 F373	Y212-F247 AromaticContact CD1-CD2 3.73Å; Y212-F247 HydrophobicContact CD1-CD2 3.73Å; Y212-F247 HydrophobicContact CD1-CE2 4.02Å; Y212-F247 HydrophobicContact CD1-CG 4.17Å; Y212-F247 HydrophobicContact CG-CD2 4.46Å; Y212-F247 WeakPolarHBondContact O-CE2 3.32Å; L215-F247 HydrophobicContact CB-CE2 4.48Å; L215-F247 HydrophobicContact CB-CZ 3.99Å; L215-F247 HydrophobicContact CD2-CE1 3.88Å; L215-F247 HydrophobicContact CD2-CZ 3.87Å; L215-F247 HydrophobicContact CG-CE1 4.03Å; L215-F247 HydrophobicContact CG-CZ 3.73Å; M219-F247 HydrophobicContact SD-CE1 3.68Å; M219-F247 HydrophobicContact SD-CZ 4.28Å; Q245-F247 PolarHBondContact O-N 3.33Å; F247-P251 HydrophobicContact CB-CG 3.61Å; F247-P251 HydrophobicContact CD2-CG 4.11Å; F247-P251 HydrophobicContact CG-CG 4.27Å; F247-A369 HydrophobicContact CB-CB 3.97Å; F247-A369 HydrophobicContact CD1-CB 4.05Å; F247-A369 WeakPolarHBondContact CD1-O 3.24Å; F247-A369 HydrophobicContact CG-CB 4.26Å; F247-F373 HydrophobicContact CD1-CB 3.96Å; F247-F373 HydrophobicContact CD1-CD2 4.29Å; F247-F373 HydrophobicContact CE1-CB 3.87Å; F247-F373 AromaticContact CE1-CD2 3.82Å; F247-F373 HydrophobicContact CE1-CD2 3.82Å; F247-F373 HydrophobicContact CE1-CG 4.1Å; F247-F373 HydrophobicContact CZ-CD2 4.25Å
248	G	95.2	Very high	93	Very high	18 Å²	18	57.2 Å²	57.2	19%	0.186	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	-141.1	-173.2	0	0	0	0	0	112.4	Q245	Q245-G248 PolarHBondContact O-N 2.91Å
249	Q	95.1	Very high	93	Very high	83 Å²	83	57.4 Å²	57.4	39%	0.388	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-2.7	-177.6	-56.4	-56.1	-37.5	0	0	113.7	E252 K253	Q249-E252 PolarHBondContact O-N 3.04Å; Q249-K253 HydrophobicContact CB-CD 4.29Å; Q249-K253 WeakPolarHBondContact O-CB 3.37Å; Q249-K253 WeakPolarHBondContact O-CG 3.44Å; Q249-K253 PolarHBondContact O-N 3.47Å; Q249-K253 VanDerWaalsContact O-N 3.08Å
250	V	95.8	Very high	93	Very high	16 Å²	16	52.9 Å²	52.9	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-59.4	-49.2	-174.7	-177	0	0	0	0	111.9	E252 K253 M254 Q365 E368 A369 I372	V250-E252 PolarHBondContact O-N 3.37Å; V250-K253 PolarHBondContact O-N 3.28Å; V250-M254 WeakPolarHBondContact O-CB 3.28Å; V250-M254 PolarHBondContact O-N 2.68Å; V250-Q365 HydrophobicContact CG1-CB 4.36Å; V250-Q365 WeakPolarHBondContact CG1-O 3.31Å; V250-E368 HydrophobicContact CG2-CG 4.4Å; V250-A369 HydrophobicContact CB-CB 4.12Å; V250-A369 HydrophobicContact CG1-CB 4.06Å; V250-A369 HydrophobicContact CG2-CB 4.46Å; V250-I372 HydrophobicContact CG2-CD1 3.87Å
251	P	95.4	Very high	93.2	Very high	24 Å²	24	50.6 Å²	50.6	16%	0.156	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-45.2	-178.6	-24.8	34.9	0	0	0	113.4	Y212 F247 K255	Y212-P251 HydrophobicContact CD1-CB 4.15Å; Y212-P251 HydrophobicContact CD1-CG 3.69Å; Y212-P251 HydrophobicContact CD2-CB 3.57Å; Y212-P251 HydrophobicContact CD2-CG 4.07Å; Y212-P251 HydrophobicContact CE1-CB 4.26Å; Y212-P251 HydrophobicContact CE1-CG 3.77Å; Y212-P251 HydrophobicContact CE2-CB 3.69Å; Y212-P251 HydrophobicContact CE2-CG 4.14Å; Y212-P251 HydrophobicContact CG-CB 3.79Å; Y212-P251 HydrophobicContact CG-CG 3.83Å; F247-P251 HydrophobicContact CB-CG 3.61Å; F247-P251 HydrophobicContact CD2-CG 4.11Å; F247-P251 HydrophobicContact CG-CG 4.27Å; P251-K255 WeakPolarHBondContact O-CB 3.18Å; P251-K255 PolarHBondContact O-N 3.45Å
252	E	92.9	Very high	93.3	Very high	106 Å²	106	48.8 Å²	48.8	50%	0.495	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-46.8	-177.5	-170.5	-179.7	168	0	0	111.2	Q249 V250 L256	Q249-E252 PolarHBondContact O-N 3.04Å; V250-E252 PolarHBondContact O-N 3.37Å; E252-L256 HydrophobicContact CG-CD1 4.49Å; E252-L256 VanDerWaalsContact O-CG 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.1Å; E252-L256 PolarHBondContact O-N 3.31Å; E252-L256 VanDerWaalsContact O-N 3.15Å
253	K	92.8	Very high	93.4	Very high	135 Å²	135	43.1 Å²	43.1	59%	0.587	21%	0.211	S	C	*	.	H	α-helix	trans	-62.2	-49.1	177.4	-73.3	-179.5	179.1	179.8	0	111.7	Q249 V250 K255 L256 Q257	Q249-K253 HydrophobicContact CB-CD 4.29Å; Q249-K253 WeakPolarHBondContact O-CB 3.37Å; Q249-K253 WeakPolarHBondContact O-CG 3.44Å; Q249-K253 PolarHBondContact O-N 3.47Å; Q249-K253 VanDerWaalsContact O-N 3.08Å; V250-K253 PolarHBondContact O-N 3.28Å; K253-K255 PolarHBondContact O-N 3.31Å; K253-L256 PolarHBondContact O-N 2.85Å; K253-Q257 WeakPolarHBondContact O-CG 3.25Å; K253-Q257 PolarHBondContact O-N 2.9Å
254	M	94.1	Very high	93.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-43.3	-178.2	-174.9	-176.5	169.7	0	0	111	M208 Y212 V250 L256 Q257 V258 I362 I366	M208-M254 HydrophobicContact CE-CE 3.58Å; M208-M254 HydrophobicContact CE-CG 3.94Å; M208-M254 HydrophobicContact CE-SD 3.77Å; Y212-M254 HydrophobicContact CE2-SD 4.34Å; Y212-M254 PolarHBondContact OH-SD 2.88Å; V250-M254 WeakPolarHBondContact O-CB 3.28Å; V250-M254 PolarHBondContact O-N 2.68Å; M254-L256 VanDerWaalsContact C-N 3.34Å; M254-L256 PolarHBondContact O-N 3.49Å; M254-Q257 PolarHBondContact O-N 3.5Å; M254-V258 HydrophobicContact CE-CG2 4.15Å; M254-V258 HydrophobicContact CG-CG2 4.12Å; M254-V258 WeakPolarHBondContact O-CB 3.35Å; M254-V258 VanDerWaalsContact O-CG2 3.29Å; M254-V258 WeakPolarHBondContact O-CG2 2.96Å; M254-V258 PolarHBondContact O-N 3.01Å; M254-I362 HydrophobicContact CE-CB 4.4Å; M254-I362 HydrophobicContact CE-CD1 3.2Å; M254-I362 HydrophobicContact CE-CG1 3.26Å; M254-I366 HydrophobicContact SD-CG1 4.43Å
255	K	92.4	Very high	93.5	Very high	31 Å²	31	35.2 Å²	35.2	14%	0.135	17%	0.174	C	C	.	.	H	α-helix	trans	-56.3	-46.9	176	-177.1	166.8	79.3	155.5	0	112	D205 M208 D209 P251 K253 Q257 V258 L259	D205-K255 HydrophobicContact CB-CD 4.5Å; D205-K255 WeakPolarHBondContact OD1-CD 3.17Å; D205-K255 WeakPolarHBondContact OD1-CE 3.36Å; D205-K255 IonicContact OD1-NZ 3.52Å; D205-K255 PolarHBondContact OD1-NZ 2.71Å; D205-K255 IonicContact OD2-NZ 3.58Å; M208-K255 HydrophobicContact CB-CB 4.12Å; M208-K255 HydrophobicContact CB-CD 3.98Å; M208-K255 HydrophobicContact CB-CG 3.86Å; M208-K255 HydrophobicContact CG-CB 4.41Å; M208-K255 HydrophobicContact CG-CG 4.24Å; D209-K255 VanDerWaalsContact CG-NZ 3.27Å; D209-K255 VanDerWaalsContact OD1-CD 3.26Å; D209-K255 WeakPolarHBondContact OD1-CD 3.44Å; D209-K255 WeakPolarHBondContact OD1-CE 3.24Å; D209-K255 IonicContact OD1-NZ 3.25Å; D209-K255 PolarHBondContact OD1-NZ 3.4Å; D209-K255 IonicContact OD2-NZ 3.69Å; D209-K255 PolarHBondContact OD2-NZ 3.25Å; P251-K255 WeakPolarHBondContact O-CB 3.18Å; P251-K255 PolarHBondContact O-N 3.45Å; K253-K255 PolarHBondContact O-N 3.31Å; K255-Q257 PolarHBondContact O-N 2.86Å; K255-V258 PolarHBondContact O-N 2.97Å; K255-L259 HydrophobicContact CG-CD1 3.97Å; K255-L259 VanDerWaalsContact O-CB 3.3Å; K255-L259 WeakPolarHBondContact O-CB 3.3Å; K255-L259 WeakPolarHBondContact O-CD1 3.05Å; K255-L259 VanDerWaalsContact O-CG 3.27Å; K255-L259 WeakPolarHBondContact O-CG 3.33Å; K255-L259 PolarHBondContact O-N 3.41Å
256	L	91.4	Very high	93.3	Very high	60 Å²	60	34.1 Å²	34.1	31%	0.314	17%	0.167	S	C	.	.	H	α-helix	trans	-62.8	-41.2	177.1	-68.5	170.6	0	0	0	112.5	E252 K253 M254 K260 P528	E252-L256 HydrophobicContact CG-CD1 4.49Å; E252-L256 VanDerWaalsContact O-CG 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.1Å; E252-L256 PolarHBondContact O-N 3.31Å; E252-L256 VanDerWaalsContact O-N 3.15Å; K253-L256 PolarHBondContact O-N 2.85Å; M254-L256 VanDerWaalsContact C-N 3.34Å; M254-L256 PolarHBondContact O-N 3.49Å; L256-K260 WeakPolarHBondContact O-CG 3.38Å; L256-K260 PolarHBondContact O-N 2.85Å; L256-K260 VanDerWaalsContact O-N 3.16Å; L256-P528 HydrophobicContact CD2-CB 3.49Å; L256-P528 VanDerWaalsContact CD2-CB 3.49Å; L256-P528 HydrophobicContact CD2-CG 3.71Å
257	Q	92.5	Very high	93.3	Very high	85 Å²	85	34.9 Å²	34.9	40%	0.397	17%	0.171	S	C	.	.	H	α-helix	trans	-66.2	-48.2	178	-74.1	175.8	-23.8	0	0	111.8	K253 M254 K255 L259 K260 A261 V358	K253-Q257 WeakPolarHBondContact O-CG 3.25Å; K253-Q257 PolarHBondContact O-N 2.9Å; M254-Q257 PolarHBondContact O-N 3.5Å; K255-Q257 PolarHBondContact O-N 2.86Å; Q257-L259 PolarHBondContact O-N 3.48Å; Q257-K260 PolarHBondContact O-N 3.05Å; Q257-A261 WeakPolarHBondContact O-CB 3.3Å; Q257-A261 PolarHBondContact O-N 2.84Å; Q257-V358 HydrophobicContact CB-CG1 4Å; Q257-V358 HydrophobicContact CB-CG2 3.94Å
258	V	93.7	Very high	93.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.1	-45.9	177.5	167.4	0	0	0	0	110.6	L184 L204 M208 M254 K255 K260 A261 F262 V358	L184-V258 HydrophobicContact CD2-CG1 3.96Å; L204-V258 HydrophobicContact CD1-CG1 3.72Å; L204-V258 HydrophobicContact CD2-CG1 3.73Å; L204-V258 HydrophobicContact CG-CG1 3.8Å; M208-V258 HydrophobicContact CE-CG2 4.45Å; M208-V258 HydrophobicContact CG-CG1 4.28Å; M208-V258 HydrophobicContact SD-CG1 4.1Å; M208-V258 HydrophobicContact SD-CG2 4.45Å; M254-V258 HydrophobicContact CE-CG2 4.15Å; M254-V258 HydrophobicContact CG-CG2 4.12Å; M254-V258 WeakPolarHBondContact O-CB 3.35Å; M254-V258 VanDerWaalsContact O-CG2 3.29Å; M254-V258 WeakPolarHBondContact O-CG2 2.96Å; M254-V258 PolarHBondContact O-N 3.01Å; K255-V258 PolarHBondContact O-N 2.97Å; V258-K260 PolarHBondContact O-N 2.84Å; V258-A261 PolarHBondContact O-N 2.96Å; V258-F262 HydrophobicContact CG1-CD2 3.95Å; V258-F262 HydrophobicContact CG1-CE2 4.05Å; V258-F262 WeakPolarHBondContact O-CB 3.06Å; V258-F262 VanDerWaalsContact O-CD2 3.23Å; V258-F262 WeakPolarHBondContact O-CD2 3.47Å; V258-F262 PolarHBondContact O-N 3.38Å; V258-V358 HydrophobicContact CB-CG1 4.44Å; V258-V358 HydrophobicContact CG2-CG1 3.67Å
259	L	90.9	Very high	93.1	Very high	20 Å²	20	34.7 Å²	34.7	11%	0.105	17%	0.166	C	C	.	.	H	α-helix	trans	-56.8	-48.2	176.2	-81.3	165.9	0	0	0	112.8	L204 D205 K255 Q257 S263	L204-L259 HydrophobicContact CB-CD2 3.62Å; L204-L259 HydrophobicContact CB-CG 4.49Å; L204-L259 HydrophobicContact CD2-CD2 4.18Å; L204-L259 HydrophobicContact CG-CD2 3.98Å; L204-L259 HydrophobicContact CG-CG 4.36Å; D205-L259 HydrophobicContact CB-CD1 4.23Å; K255-L259 HydrophobicContact CG-CD1 3.97Å; K255-L259 VanDerWaalsContact O-CB 3.3Å; K255-L259 WeakPolarHBondContact O-CB 3.3Å; K255-L259 WeakPolarHBondContact O-CD1 3.05Å; K255-L259 VanDerWaalsContact O-CG 3.27Å; K255-L259 WeakPolarHBondContact O-CG 3.33Å; K255-L259 PolarHBondContact O-N 3.41Å; Q257-L259 PolarHBondContact O-N 3.48Å; L259-S263 WeakPolarHBondContact O-CB 3.4Å; L259-S263 PolarHBondContact O-N 2.85Å; L259-S263 VanDerWaalsContact O-N 3.14Å; L259-S263 PolarHBondContact O-OG 3.01Å
260	K	91	Very high	93	Very high	64 Å²	64	34 Å²	34	28%	0.278	16%	0.163	S	C	.	.	H	α-helix	trans	-66	-50.5	-179.3	-73.4	178.4	-179.8	-172.3	0	112	L256 Q257 V258 S263 A264 Y353 P528	L256-K260 WeakPolarHBondContact O-CG 3.38Å; L256-K260 PolarHBondContact O-N 2.85Å; L256-K260 VanDerWaalsContact O-N 3.16Å; Q257-K260 PolarHBondContact O-N 3.05Å; V258-K260 PolarHBondContact O-N 2.84Å; K260-S263 PolarHBondContact O-OG 3.24Å; K260-S263 VanDerWaalsContact O-OG 3.08Å; K260-A264 VanDerWaalsContact O-CB 3.29Å; K260-A264 WeakPolarHBondContact O-CB 3.41Å; K260-A264 PolarHBondContact O-N 2.78Å; K260-A264 VanDerWaalsContact O-N 3.09Å; K260-Y353 HydrophobicContact CB-CD1 3.94Å; K260-Y353 HydrophobicContact CB-CE1 4.27Å; K260-Y353 HydrophobicContact CB-CG 4.49Å; K260-Y353 HydrophobicContact CD-CD1 4.24Å; K260-Y353 HydrophobicContact CD-CE1 3.92Å; K260-Y353 HydrophobicContact CG-CD1 4.5Å; K260-Y353 HydrophobicContact CG-CE1 4.35Å; K260-P528 HydrophobicContact CD-CG 4.43Å; K260-P528 HydrophobicContact CG-CG 4.43Å
261	A	93.3	Very high	93	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-46.6	-176.4	0	0	0	0	0	112.3	Q257 V258 A264 A265 Y353 I355 V358	Q257-A261 WeakPolarHBondContact O-CB 3.3Å; Q257-A261 PolarHBondContact O-N 2.84Å; V258-A261 PolarHBondContact O-N 2.96Å; A261-A264 PolarHBondContact O-N 3.02Å; A261-A265 VanDerWaalsContact O-CB 3.32Å; A261-A265 WeakPolarHBondContact O-CB 3.2Å; A261-A265 PolarHBondContact O-N 3.36Å; A261-Y353 WeakPolarHBondContact CA-O 3.4Å; A261-I355 HydrophobicContact CB-CB 4.19Å; A261-I355 HydrophobicContact CB-CG1 4.37Å; A261-V358 HydrophobicContact CB-CB 4.24Å; A261-V358 HydrophobicContact CB-CG2 3.93Å
262	F	93.3	Very high	93	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-72.6	-38.3	-177.2	-81.1	-111.9	0	0	0	112.8	L151 L184 Y187 L204 V258 A264 R266 I355 I359	L151-F262 HydrophobicContact CD1-CE1 4.43Å; L151-F262 HydrophobicContact CD2-CE1 3.92Å; L151-F262 HydrophobicContact CD2-CZ 3.61Å; L184-F262 HydrophobicContact CB-CE1 3.93Å; L184-F262 HydrophobicContact CB-CZ 4.05Å; L184-F262 HydrophobicContact CD1-CZ 4.28Å; L184-F262 HydrophobicContact CD2-CE1 4.17Å; L184-F262 HydrophobicContact CD2-CZ 3.99Å; L184-F262 HydrophobicContact CG-CZ 4.33Å; Y187-F262 HydrophobicContact CD1-CB 4.03Å; Y187-F262 AromaticContact CD1-CD1 3.98Å; Y187-F262 HydrophobicContact CD1-CD1 3.98Å; Y187-F262 HydrophobicContact CD1-CG 4.45Å; Y187-F262 HydrophobicContact CE1-CB 3.73Å; L204-F262 HydrophobicContact CD2-CB 3.63Å; L204-F262 HydrophobicContact CD2-CG 4.02Å; V258-F262 HydrophobicContact CG1-CD2 3.95Å; V258-F262 HydrophobicContact CG1-CE2 4.05Å; V258-F262 WeakPolarHBondContact O-CB 3.06Å; V258-F262 VanDerWaalsContact O-CD2 3.23Å; V258-F262 WeakPolarHBondContact O-CD2 3.47Å; V258-F262 PolarHBondContact O-N 3.38Å; F262-A264 VanDerWaalsContact C-N 3.34Å; F262-R266 WeakPolarHBondContact O-CB 3.43Å; F262-R266 PolarHBondContact O-N 3.39Å; F262-I355 HydrophobicContact CD2-CD1 4.35Å; F262-I355 HydrophobicContact CE2-CD1 4.29Å; F262-I355 HydrophobicContact CE2-CG1 4.43Å; F262-I359 HydrophobicContact CE2-CD1 3.52Å; F262-I359 HydrophobicContact CE2-CG1 3.69Å; F262-I359 HydrophobicContact CZ-CD1 3.66Å; F262-I359 HydrophobicContact CZ-CG1 3.92Å
263	S	90.8	Very high	93.1	Very high	22 Å²	22	29.2 Å²	29.2	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-64.1	-41.5	175.9	60.2	0	0	0	0	111.4	L259 K260 T267	L259-S263 WeakPolarHBondContact O-CB 3.4Å; L259-S263 PolarHBondContact O-N 2.85Å; L259-S263 VanDerWaalsContact O-N 3.14Å; L259-S263 PolarHBondContact O-OG 3.01Å; K260-S263 PolarHBondContact O-OG 3.24Å; K260-S263 VanDerWaalsContact O-OG 3.08Å; S263-T267 VanDerWaalsContact O-CB 3.23Å; S263-T267 WeakPolarHBondContact O-CB 3.34Å; S263-T267 PolarHBondContact O-N 3.4Å; S263-T267 PolarHBondContact O-OG1 3.24Å
264	A	92.7	Very high	93.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-53.9	174.1	0	0	0	0	0	111.9	K260 A261 F262 R266 T267 F268 L345 L349 Y353 V523	K260-A264 VanDerWaalsContact O-CB 3.29Å; K260-A264 WeakPolarHBondContact O-CB 3.41Å; K260-A264 PolarHBondContact O-N 2.78Å; K260-A264 VanDerWaalsContact O-N 3.09Å; A261-A264 PolarHBondContact O-N 3.02Å; F262-A264 VanDerWaalsContact C-N 3.34Å; A264-R266 PolarHBondContact O-N 3.24Å; A264-T267 PolarHBondContact O-N 3.26Å; A264-F268 VanDerWaalsContact O-CB 3.3Å; A264-F268 WeakPolarHBondContact O-CB 3.46Å; A264-F268 PolarHBondContact O-N 2.87Å; A264-L345 HydrophobicContact CB-CD1 3.97Å; A264-L349 HydrophobicContact CB-CD2 3.65Å; A264-L349 HydrophobicContact CB-CG 4.22Å; A264-Y353 HydrophobicContact CB-CD2 3.87Å; A264-Y353 HydrophobicContact CB-CG 4.32Å; A264-V523 HydrophobicContact CB-CG1 4.3Å
265	A	94	Very high	93.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.6	-45.4	-177.1	0	0	0	0	0	111.9	F147 A261 F268 I269 L349 I355	F147-A265 HydrophobicContact CD2-CB 4.26Å; F147-A265 HydrophobicContact CE1-CB 4.2Å; F147-A265 HydrophobicContact CE2-CB 3.84Å; F147-A265 HydrophobicContact CZ-CB 3.81Å; A261-A265 VanDerWaalsContact O-CB 3.32Å; A261-A265 WeakPolarHBondContact O-CB 3.2Å; A261-A265 PolarHBondContact O-N 3.36Å; A265-F268 PolarHBondContact O-N 3.04Å; A265-I269 WeakPolarHBondContact O-CG1 3.24Å; A265-I269 PolarHBondContact O-N 2.84Å; A265-L349 HydrophobicContact CB-CD2 4.24Å; A265-I355 HydrophobicContact CB-CD1 4.09Å
266	R	91.7	Very high	93.4	Very high	43 Å²	43	22.1 Å²	22.1	16%	0.162	11%	0.111	C	C	.	.	H	α-helix	trans	-65.2	-43.5	178.6	-178.4	171.3	171.8	-150.2	-14.2	112.5	Y187 Y190 S201 F262 A264 F268 H270	Y187-R266 WeakPolarHBondContact O-CD 3.46Å; Y187-R266 PolarHBondContact O-NH1 2.89Å; Y190-R266 VanDerWaalsContact CD1-NH2 3.34Å; Y190-R266 PolarHBondContact O-NE 2.87Å; Y190-R266 PolarHBondContact O-NH2 3.24Å; S201-R266 VanDerWaalsContact CB-NH1 3.3Å; F262-R266 WeakPolarHBondContact O-CB 3.43Å; F262-R266 PolarHBondContact O-N 3.39Å; A264-R266 PolarHBondContact O-N 3.24Å; R266-F268 VanDerWaalsContact C-N 3.3Å; R266-F268 PolarHBondContact O-N 3.4Å; R266-H270 WeakPolarHBondContact O-CB 3.34Å; R266-H270 PolarHBondContact O-N 3.29Å
267	T	92.7	Very high	93.5	Very high	20 Å²	20	22.1 Å²	22.1	12%	0.123	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-37.5	179	-56.8	0	0	0	0	110.9	S263 A264 H270 A271 L345 E519 L520 V523	S263-T267 VanDerWaalsContact O-CB 3.23Å; S263-T267 WeakPolarHBondContact O-CB 3.34Å; S263-T267 PolarHBondContact O-N 3.4Å; S263-T267 PolarHBondContact O-OG1 3.24Å; A264-T267 PolarHBondContact O-N 3.26Å; T267-H270 PolarHBondContact O-N 3.22Å; T267-A271 VanDerWaalsContact O-CB 3.24Å; T267-A271 WeakPolarHBondContact O-CB 3.47Å; T267-A271 PolarHBondContact O-N 3.38Å; T267-L345 HydrophobicContact CG2-CD2 4.33Å; T267-E519 HydrophobicContact CG2-CB 4.43Å; T267-L520 HydrophobicContact CG2-CD2 4.16Å; T267-V523 HydrophobicContact CG2-CG2 4.01Å; T267-V523 WeakPolarHBondContact OG1-CG2 3.39Å
268	F	95.5	Very high	93.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.8	-50	175.9	-178.1	-103.3	0	0	0	112.5	F143 A264 A265 R266 H270 A271 L272 L342 L345 L346 L349	F143-F268 AromaticContact CD1-CE1 3.9Å; F143-F268 HydrophobicContact CD1-CE1 3.9Å; F143-F268 AromaticContact CD2-CE1 3.79Å; F143-F268 HydrophobicContact CD2-CE1 3.79Å; F143-F268 HydrophobicContact CD2-CZ 4.49Å; F143-F268 AromaticContact CE1-CE1 3.82Å; F143-F268 HydrophobicContact CE1-CE1 3.82Å; F143-F268 HydrophobicContact CE1-CZ 4.47Å; F143-F268 AromaticContact CE2-CE1 3.72Å; F143-F268 HydrophobicContact CE2-CE1 3.72Å; F143-F268 HydrophobicContact CE2-CZ 4.04Å; F143-F268 AromaticContact CG-CE1 3.89Å; F143-F268 HydrophobicContact CG-CE1 3.89Å; F143-F268 AromaticContact CZ-CE1 3.73Å; F143-F268 HydrophobicContact CZ-CE1 3.73Å; F143-F268 HydrophobicContact CZ-CZ 4.02Å; A264-F268 VanDerWaalsContact O-CB 3.3Å; A264-F268 WeakPolarHBondContact O-CB 3.46Å; A264-F268 PolarHBondContact O-N 2.87Å; A265-F268 PolarHBondContact O-N 3.04Å; R266-F268 VanDerWaalsContact C-N 3.3Å; R266-F268 PolarHBondContact O-N 3.4Å; F268-H270 PolarHBondContact O-N 3.47Å; F268-A271 WeakPolarHBondContact O-CB 3.24Å; F268-A271 PolarHBondContact O-N 2.83Å; F268-L272 HydrophobicContact CD1-CD1 3.89Å; F268-L272 HydrophobicContact CD1-CG 4.47Å; F268-L272 HydrophobicContact CE1-CD1 3.35Å; F268-L272 HydrophobicContact CE1-CG 4.11Å; F268-L272 HydrophobicContact CE2-CG 4.5Å; F268-L272 HydrophobicContact CZ-CD1 3.71Å; F268-L272 HydrophobicContact CZ-CD2 4.38Å; F268-L272 HydrophobicContact CZ-CG 4.1Å; F268-L272 WeakPolarHBondContact O-CG 3.27Å; F268-L272 PolarHBondContact O-N 3.33Å; F268-L342 HydrophobicContact CD2-CD1 3.67Å; F268-L342 HydrophobicContact CD2-CG 4.39Å; F268-L342 HydrophobicContact CE2-CD1 3.61Å; F268-L342 HydrophobicContact CE2-CG 3.91Å; F268-L345 HydrophobicContact CB-CD2 3.94Å; F268-L346 HydrophobicContact CD2-CB 4.49Å; F268-L346 HydrophobicContact CE1-CD1 4.15Å; F268-L346 HydrophobicContact CE2-CB 3.77Å; F268-L346 HydrophobicContact CE2-CD1 4.01Å; F268-L346 HydrophobicContact CE2-CD2 4.43Å; F268-L346 HydrophobicContact CE2-CG 4.28Å; F268-L346 HydrophobicContact CZ-CB 4.23Å; F268-L346 HydrophobicContact CZ-CD1 3.64Å; F268-L346 HydrophobicContact CZ-CD2 4.2Å; F268-L346 HydrophobicContact CZ-CG 4.24Å; F268-L349 HydrophobicContact CB-CD1 3.59Å; F268-L349 HydrophobicContact CD1-CD1 3.91Å; F268-L349 HydrophobicContact CD2-CD1 4.12Å; F268-L349 HydrophobicContact CG-CD1 3.6Å
269	I	94	Very high	93.7	Very high	18 Å²	18	18.1 Å²	18.1	9%	0.092	9%	0.093	C	C	.	.	H	α-helix	trans	-60.8	-44.4	175.8	-67.8	-66.9	0	0	0	111.8	F143 D144 F147 Y188 A265 A271 L272 T273	F143-I269 HydrophobicContact CB-CD1 3.27Å; F143-I269 HydrophobicContact CG-CD1 4.41Å; D144-I269 HydrophobicContact CB-CD1 4.26Å; F147-I269 HydrophobicContact CD2-CD1 3.97Å; F147-I269 HydrophobicContact CD2-CG1 3.76Å; F147-I269 HydrophobicContact CE2-CD1 3.88Å; F147-I269 HydrophobicContact CE2-CG1 3.7Å; Y188-I269 HydrophobicContact CE2-CG1 4.44Å; A265-I269 WeakPolarHBondContact O-CG1 3.24Å; A265-I269 PolarHBondContact O-N 2.84Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.3Å; I269-L272 PolarHBondContact O-N 3.34Å; I269-T273 WeakPolarHBondContact O-CB 3.36Å; I269-T273 PolarHBondContact O-N 2.79Å; I269-T273 PolarHBondContact O-OG1 3.11Å
270	H	92.7	Very high	93.9	Very high	69 Å²	69	19.3 Å²	19.3	32%	0.319	10%	0.103	S	C	.	.	H	α-helix	trans	-60.6	-44	177.2	176.5	-80	0	0	0	110.8	R266 T267 F268 T273 V274	R266-H270 WeakPolarHBondContact O-CB 3.34Å; R266-H270 PolarHBondContact O-N 3.29Å; T267-H270 PolarHBondContact O-N 3.22Å; F268-H270 PolarHBondContact O-N 3.47Å; H270-T273 PolarHBondContact O-N 3.5Å; H270-V274 WeakPolarHBondContact O-CG2 3.34Å; H270-V274 PolarHBondContact O-N 3.49Å
271	A	95.2	Very high	94.1	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.4	-48.3	177.2	0	0	0	0	0	111.6	T267 F268 I269 T273 V274 G275 Y338 L342 T516 L520	T267-A271 VanDerWaalsContact O-CB 3.24Å; T267-A271 WeakPolarHBondContact O-CB 3.47Å; T267-A271 PolarHBondContact O-N 3.38Å; F268-A271 WeakPolarHBondContact O-CB 3.24Å; F268-A271 PolarHBondContact O-N 2.83Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.3Å; A271-T273 VanDerWaalsContact C-N 3.31Å; A271-T273 PolarHBondContact O-N 3.49Å; A271-V274 PolarHBondContact O-N 2.99Å; A271-G275 PolarHBondContact O-N 3.43Å; A271-Y338 HydrophobicContact CB-CE2 4.26Å; A271-Y338 PolarHBondContact O-OH 2.89Å; A271-L342 HydrophobicContact CB-CD1 3.77Å; A271-T516 HydrophobicContact CB-CG2 3.46Å; A271-T516 VanDerWaalsContact CB-CG2 3.46Å; A271-L520 HydrophobicContact CB-CD1 4.05Å; A271-L520 HydrophobicContact CB-CD2 3.77Å; A271-L520 HydrophobicContact CB-CG 4.09Å
272	L	95.5	Very high	94	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-55.3	-45.1	174.3	-77.6	179.2	0	0	0	112.7	T140 F143 F268 I269 G275 S276 L342 M435	T140-L272 HydrophobicContact CG2-CB 4.17Å; F143-L272 HydrophobicContact CD2-CD1 3.8Å; F143-L272 HydrophobicContact CE2-CD1 4.3Å; F143-L272 HydrophobicContact CG-CD1 4.46Å; F268-L272 HydrophobicContact CD1-CD1 3.89Å; F268-L272 HydrophobicContact CD1-CG 4.47Å; F268-L272 HydrophobicContact CE1-CD1 3.35Å; F268-L272 HydrophobicContact CE1-CG 4.11Å; F268-L272 HydrophobicContact CE2-CG 4.5Å; F268-L272 HydrophobicContact CZ-CD1 3.71Å; F268-L272 HydrophobicContact CZ-CD2 4.38Å; F268-L272 HydrophobicContact CZ-CG 4.1Å; F268-L272 WeakPolarHBondContact O-CG 3.27Å; F268-L272 PolarHBondContact O-N 3.33Å; I269-L272 PolarHBondContact O-N 3.34Å; L272-G275 PolarHBondContact O-N 3.29Å; L272-S276 WeakPolarHBondContact O-CB 3.33Å; L272-S276 PolarHBondContact O-N 3.21Å; L272-L342 HydrophobicContact CD2-CD1 4.23Å; L272-L342 HydrophobicContact CD2-CD2 3.79Å; L272-L342 HydrophobicContact CG-CD1 4.25Å; L272-M435 HydrophobicContact CD2-CE 3.56Å; L272-M435 HydrophobicContact CD2-SD 4.08Å
273	T	94.7	Very high	94	Very high	46 Å²	46	19.2 Å²	19.2	28%	0.282	11%	0.105	S	C	.	.	H	α-helix	trans	-60.7	-49.1	178	-55.6	0	0	0	0	110.4	T140 I269 H270 A271 G275 S276 D277	T140-T273 WeakPolarHBondContact CG2-OG1 3.19Å; I269-T273 WeakPolarHBondContact O-CB 3.36Å; I269-T273 PolarHBondContact O-N 2.79Å; I269-T273 PolarHBondContact O-OG1 3.11Å; H270-T273 PolarHBondContact O-N 3.5Å; A271-T273 VanDerWaalsContact C-N 3.31Å; A271-T273 PolarHBondContact O-N 3.49Å; T273-G275 VanDerWaalsContact C-N 3.33Å; T273-G275 PolarHBondContact O-N 3.47Å; T273-S276 WeakPolarHBondContact O-CB 3.46Å; T273-S276 PolarHBondContact O-N 3.25Å; T273-D277 WeakPolarHBondContact O-CB 3.33Å; T273-D277 PolarHBondContact O-N 2.95Å
274	V	95	Very high	94	Very high	14 Å²	14	25 Å²	25	9%	0.085	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-43.7	176.9	170.7	0	0	0	0	111.5	H270 A271 D277 V278 R512 I513 T516	H270-V274 WeakPolarHBondContact O-CG2 3.34Å; H270-V274 PolarHBondContact O-N 3.49Å; A271-V274 PolarHBondContact O-N 2.99Å; V274-D277 PolarHBondContact O-N 3.05Å; V274-V278 HydrophobicContact CG1-CG2 4.21Å; V274-V278 WeakPolarHBondContact O-CB 3.47Å; V274-V278 VanDerWaalsContact O-CG2 3.27Å; V274-V278 WeakPolarHBondContact O-CG2 3.38Å; V274-V278 PolarHBondContact O-N 3.36Å; V274-R512 HydrophobicContact CG1-CG 3.72Å; V274-I513 HydrophobicContact CG1-CD1 4.44Å; V274-T516 WeakPolarHBondContact CG1-OG1 3.27Å
275	G	95.4	Very high	93.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-47	175.8	0	0	0	0	0	112	A271 L272 T273 D277 V278 I279	A271-G275 PolarHBondContact O-N 3.43Å; L272-G275 PolarHBondContact O-N 3.29Å; T273-G275 VanDerWaalsContact C-N 3.33Å; T273-G275 PolarHBondContact O-N 3.47Å; G275-D277 VanDerWaalsContact C-N 3.34Å; G275-D277 PolarHBondContact O-N 2.92Å; G275-V278 PolarHBondContact O-N 3.3Å; G275-I279 WeakPolarHBondContact O-CD1 3.2Å; G275-I279 VanDerWaalsContact O-CG1 3.22Å; G275-I279 WeakPolarHBondContact O-CG1 3.44Å; G275-I279 PolarHBondContact O-N 2.9Å
276	S	95.1	Very high	93.8	Very high	3 Å²	3	33 Å²	33	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-43.3	176.4	-175.1	0	0	0	0	112.2	L272 T273 S280	L272-S276 WeakPolarHBondContact O-CB 3.33Å; L272-S276 PolarHBondContact O-N 3.21Å; T273-S276 WeakPolarHBondContact O-CB 3.46Å; T273-S276 PolarHBondContact O-N 3.25Å; S276-S280 WeakPolarHBondContact O-CB 3.5Å; S276-S280 PolarHBondContact O-N 3.31Å
277	D	94.4	Very high	93.8	Very high	61 Å²	61	32 Å²	32	33%	0.326	16%	0.162	S	C	.	.	H	α-helix	trans	-68.4	-43.7	-179.2	-67.4	-16.3	0	0	0	110.9	T273 V274 G275 S280 D281	T273-D277 WeakPolarHBondContact O-CB 3.33Å; T273-D277 PolarHBondContact O-N 2.95Å; V274-D277 PolarHBondContact O-N 3.05Å; G275-D277 VanDerWaalsContact C-N 3.34Å; G275-D277 PolarHBondContact O-N 2.92Å; D277-S280 CarbonylContact O-C 3.41Å; D277-S280 WeakPolarHBondContact O-CB 3.45Å; D277-S280 PolarHBondContact O-N 3.49Å; D277-S280 VanDerWaalsContact O-N 3.14Å; D277-D281 PolarHBondContact O-N 2.79Å
278	V	95.6	Very high	93.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-45.3	178	168.2	0	0	0	0	111.6	V274 G275 S280 D281 M282 F331 M509 R512 I513	V274-V278 HydrophobicContact CG1-CG2 4.21Å; V274-V278 WeakPolarHBondContact O-CB 3.47Å; V274-V278 VanDerWaalsContact O-CG2 3.27Å; V274-V278 WeakPolarHBondContact O-CG2 3.38Å; V274-V278 PolarHBondContact O-N 3.36Å; G275-V278 PolarHBondContact O-N 3.3Å; V278-S280 VanDerWaalsContact C-N 3.26Å; V278-S280 PolarHBondContact O-N 2.99Å; V278-D281 PolarHBondContact O-N 3.42Å; V278-M282 HydrophobicContact CG1-CE 4.37Å; V278-M282 WeakPolarHBondContact O-CG 3.36Å; V278-M282 PolarHBondContact O-N 2.92Å; V278-M282 VanDerWaalsContact O-N 3.1Å; V278-F331 HydrophobicContact CG1-CE2 3.55Å; V278-F331 HydrophobicContact CG1-CZ 3.42Å; V278-F331 VanDerWaalsContact CG1-CZ 3.42Å; V278-M509 HydrophobicContact CG1-CB 3.91Å; V278-M509 HydrophobicContact CG1-CG 4.13Å; V278-M509 HydrophobicContact CG1-SD 4.18Å; V278-R512 HydrophobicContact CG2-CB 4.46Å; V278-R512 HydrophobicContact CG2-CG 4.5Å; V278-I513 HydrophobicContact CB-CD1 4.36Å; V278-I513 HydrophobicContact CG1-CD1 4.38Å; V278-I513 HydrophobicContact CG1-CG1 4.15Å; V278-I513 HydrophobicContact CG2-CD1 4.21Å; V278-I513 HydrophobicContact CG2-CG1 4.23Å
279	I	94.7	Very high	93.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-37.8	175.4	-58.1	159.5	0	0	0	110.2	I129 L132 V133 F136 G275 D281 M282 W335 W446	I129-I279 HydrophobicContact CG2-CG2 3.64Å; L132-I279 HydrophobicContact CB-CG2 4.34Å; L132-I279 HydrophobicContact CD1-CD1 4.4Å; L132-I279 HydrophobicContact CD2-CD1 3.93Å; L132-I279 HydrophobicContact CD2-CG1 4.2Å; L132-I279 HydrophobicContact CD2-CG2 3.81Å; L132-I279 HydrophobicContact CG-CD1 3.76Å; L132-I279 HydrophobicContact CG-CG1 4.47Å; L132-I279 HydrophobicContact CG-CG2 3.97Å; V133-I279 HydrophobicContact CG2-CB 4.21Å; V133-I279 HydrophobicContact CG2-CG2 3.46Å; V133-I279 VanDerWaalsContact CG2-CG2 3.46Å; F136-I279 HydrophobicContact CB-CD1 4.28Å; F136-I279 HydrophobicContact CD1-CD1 4.22Å; F136-I279 HydrophobicContact CD2-CD1 3.79Å; F136-I279 HydrophobicContact CE2-CD1 4.22Å; F136-I279 HydrophobicContact CG-CD1 3.8Å; G275-I279 WeakPolarHBondContact O-CD1 3.2Å; G275-I279 VanDerWaalsContact O-CG1 3.22Å; G275-I279 WeakPolarHBondContact O-CG1 3.44Å; G275-I279 PolarHBondContact O-N 2.9Å; I279-D281 VanDerWaalsContact C-N 3.32Å; I279-D281 PolarHBondContact O-N 2.99Å; I279-M282 WeakPolarHBondContact O-CB 3.31Å; I279-M282 PolarHBondContact O-N 3.22Å; I279-W335 HydrophobicContact CD1-CH2 3.19Å; I279-W335 HydrophobicContact CD1-CZ2 3.74Å; I279-W335 HydrophobicContact CD1-CZ3 3.84Å; I279-W335 HydrophobicContact CG1-CH2 3.74Å; I279-W335 HydrophobicContact CG1-CZ2 4.34Å; I279-W335 HydrophobicContact CG1-CZ3 3.87Å; I279-W446 HydrophobicContact CG2-CH2 4.34Å; I279-W446 HydrophobicContact CG2-CZ2 4.39Å
280	S	95.2	Very high	93.6	Very high	45 Å²	45	45.6 Å²	45.6	32%	0.315	24%	0.24	S	C	.	.	H	α-helix	trans	-65.6	-35.5	176.2	-172.7	0	0	0	0	112.4	S276 D277 V278 M282 L283	S276-S280 WeakPolarHBondContact O-CB 3.5Å; S276-S280 PolarHBondContact O-N 3.31Å; D277-S280 CarbonylContact O-C 3.41Å; D277-S280 WeakPolarHBondContact O-CB 3.45Å; D277-S280 PolarHBondContact O-N 3.49Å; D277-S280 VanDerWaalsContact O-N 3.14Å; V278-S280 VanDerWaalsContact C-N 3.26Å; V278-S280 PolarHBondContact O-N 2.99Å; S280-M282 VanDerWaalsContact C-N 3.33Å; S280-L283 WeakPolarHBondContact O-CB 3.26Å; S280-L283 PolarHBondContact O-N 3.21Å
281	D	93.9	Very high	93.7	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.193	23%	0.227	C	C	.	.	H	α-helix	trans	-69.4	-30.1	176.1	-72.4	-27.3	0	0	0	112.2	D277 V278 I279 L283 K284 M509	D277-D281 PolarHBondContact O-N 2.79Å; V278-D281 PolarHBondContact O-N 3.42Å; I279-D281 VanDerWaalsContact C-N 3.32Å; I279-D281 PolarHBondContact O-N 2.99Å; D281-L283 PolarHBondContact O-N 3.12Å; D281-K284 WeakPolarHBondContact O-CB 3.4Å; D281-K284 PolarHBondContact O-N 2.99Å; D281-K284 IonicContact OD1-NZ 2.83Å; D281-K284 PolarHBondContact OD1-NZ 2.87Å; D281-M509 HydrophobicContact CB-CE 3.61Å; D281-M509 HydrophobicContact CB-SD 3.96Å
282	M	92.3	Very high	93.8	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-29.9	173.8	-66.5	-75.6	178.1	0	0	112.7	V278 I279 S280 K284 M285 Y328 F331 W446 I506 M509	V278-M282 HydrophobicContact CG1-CE 4.37Å; V278-M282 WeakPolarHBondContact O-CG 3.36Å; V278-M282 PolarHBondContact O-N 2.92Å; V278-M282 VanDerWaalsContact O-N 3.1Å; I279-M282 WeakPolarHBondContact O-CB 3.31Å; I279-M282 PolarHBondContact O-N 3.22Å; S280-M282 VanDerWaalsContact C-N 3.33Å; M282-K284 PolarHBondContact O-N 3.5Å; M282-M285 HydrophobicContact CB-CE 4.19Å; M282-M285 HydrophobicContact CG-CE 4.38Å; M282-M285 PolarHBondContact O-N 3.4Å; M282-M285 HydrophobicContact SD-CE 3.23Å; M282-M285 WeakPolarHBondContact SD-CE 3.48Å; M282-M285 HydrophobicContact SD-SD 3.66Å; M282-M285 VanDerWaalsContact SD-SD 3.66Å; M282-Y328 HydrophobicContact SD-CD1 4.42Å; M282-Y328 HydrophobicContact SD-CE1 4.47Å; M282-F331 HydrophobicContact CE-CB 3.87Å; M282-F331 HydrophobicContact CE-CD1 3.49Å; M282-F331 VanDerWaalsContact CE-CD1 3.49Å; M282-F331 HydrophobicContact CE-CD2 3.28Å; M282-F331 HydrophobicContact CE-CE1 3.74Å; M282-F331 HydrophobicContact CE-CE2 3.56Å; M282-F331 HydrophobicContact CE-CG 3.24Å; M282-F331 HydrophobicContact CE-CZ 3.79Å; M282-W446 HydrophobicContact CB-CH2 4.24Å; M282-W446 HydrophobicContact CG-CH2 4.18Å; M282-I506 HydrophobicContact CE-CD1 3.72Å; M282-I506 HydrophobicContact SD-CD1 3.72Å; M282-M509 HydrophobicContact CE-CB 4.33Å; M282-M509 HydrophobicContact CE-SD 3.51Å; M282-M509 VanDerWaalsContact CE-SD 3.51Å; M282-M509 HydrophobicContact CG-SD 3.98Å; M282-M509 HydrophobicContact SD-SD 3.77Å
283	L	92.3	Very high	93.8	Very high	26 Å²	26	44.8 Å²	44.8	14%	0.136	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.5	176.6	-63.6	174.3	0	0	0	113.7	Q126 I129 M130 V133 S280 D281	Q126-L283 HydrophobicContact CB-CD2 4.35Å; Q126-L283 HydrophobicContact CG-CD2 4.14Å; Q126-L283 PolarHBondContact NE2-O 3.38Å; I129-L283 HydrophobicContact CB-CD2 3.71Å; I129-L283 HydrophobicContact CD1-CD2 4.35Å; I129-L283 HydrophobicContact CG2-CD2 3.63Å; I129-L283 HydrophobicContact CG2-CG 4.21Å; M130-L283 HydrophobicContact CE-CD1 3.56Å; M130-L283 HydrophobicContact CE-CD2 3.74Å; M130-L283 HydrophobicContact CE-CG 4.21Å; M130-L283 HydrophobicContact SD-CD1 3.58Å; M130-L283 VanDerWaalsContact SD-CD1 3.58Å; M130-L283 HydrophobicContact SD-CD2 4.1Å; V133-L283 HydrophobicContact CG2-CD1 3.91Å; V133-L283 HydrophobicContact CG2-CG 4.36Å; S280-L283 WeakPolarHBondContact O-CB 3.26Å; S280-L283 PolarHBondContact O-N 3.21Å; D281-L283 PolarHBondContact O-N 3.12Å
284	K	91.5	Very high	93.9	Very high	143 Å²	143	45.1 Å²	45.1	62%	0.622	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-12.8	-177.3	-56.8	172	-174.5	162.2	0	112.6	D281 M282	D281-K284 WeakPolarHBondContact O-CB 3.4Å; D281-K284 PolarHBondContact O-N 2.99Å; D281-K284 IonicContact OD1-NZ 2.83Å; D281-K284 PolarHBondContact OD1-NZ 2.87Å; M282-K284 PolarHBondContact O-N 3.5Å
285	M	91	Very high	94	Very high	9 Å²	9	44.4 Å²	44.4	4%	0.044	24%	0.236	C	C	.	.			trans	-68	140.5	-177.5	-62.4	-170	-46.3	0	0	111	M282 Y328 I506 M509	M282-M285 HydrophobicContact CB-CE 4.19Å; M282-M285 HydrophobicContact CG-CE 4.38Å; M282-M285 PolarHBondContact O-N 3.4Å; M282-M285 HydrophobicContact SD-CE 3.23Å; M282-M285 WeakPolarHBondContact SD-CE 3.48Å; M282-M285 HydrophobicContact SD-SD 3.66Å; M282-M285 VanDerWaalsContact SD-SD 3.66Å; M285-Y328 HydrophobicContact CE-CD1 3.8Å; M285-Y328 HydrophobicContact CE-CD2 4.05Å; M285-Y328 HydrophobicContact CE-CE1 3.22Å; M285-Y328 HydrophobicContact CE-CE2 3.49Å; M285-Y328 VanDerWaalsContact CE-CE2 3.49Å; M285-Y328 HydrophobicContact CE-CG 4.21Å; M285-Y328 VanDerWaalsContact CE-OH 3.28Å; M285-Y328 WeakPolarHBondContact CE-OH 3.22Å; M285-I506 HydrophobicContact CE-CD1 3.8Å; M285-I506 HydrophobicContact SD-CD1 3.27Å; M285-I506 WeakPolarHBondContact SD-CD1 3.39Å; M285-I506 HydrophobicContact SD-CG1 3.62Å; M285-M509 HydrophobicContact CG-CE 4.3Å; M285-M509 HydrophobicContact SD-CE 4.14Å
286	K	90.4	Very high	94	Very high	161 Å²	161	44.4 Å²	44.4	70%	0.7	24%	0.236	S	C	*	.			trans	-108.1	140.2	-177.8	-64.7	179.3	-177.1	175.8	0	109.5
287	P	91.8	Very high	94.1	Very high	21 Å²	21	46.6 Å²	46.6	14%	0.136	25%	0.245	C	C	.	.			trans	-64.4	146.5	173.7	28.6	-35.1	0	0	0	110.7	Q118 F121 C291 V292	Q118-P287 HydrophobicContact CG-CG 3.83Å; F121-P287 HydrophobicContact CD1-CB 3.94Å; F121-P287 HydrophobicContact CD1-CG 4.14Å; F121-P287 HydrophobicContact CE1-CB 3.93Å; P287-C291 HydrophobicContact CB-CB 4.45Å; P287-V292 HydrophobicContact CB-CG2 4.04Å; P287-V292 HydrophobicContact CG-CG2 3.83Å
288	S	92.5	Very high	94.1	Very high	67 Å²	67	43.7 Å²	43.7	47%	0.469	23%	0.23	S	C	.	.			trans	-66.6	158	175.2	69.6	0	0	0	0	111.6	E290 C291 V292	S288-E290 VanDerWaalsContact C-N 3.25Å; S288-E290 PolarHBondContact O-N 3.07Å; S288-C291 WeakPolarHBondContact O-CB 3.37Å; S288-C291 PolarHBondContact O-N 2.7Å; S288-C291 VanDerWaalsContact OG-CB 3.28Å; S288-C291 WeakPolarHBondContact OG-CB 3.49Å; S288-C291 PolarHBondContact OG-N 2.96Å; S288-C291 VanDerWaalsContact OG-N 3.12Å; S288-V292 WeakPolarHBondContact O-CG2 3.25Å; S288-V292 PolarHBondContact O-N 2.95Å
289	T	93.1	Very high	94	Very high	130 Å²	130	45 Å²	45	80%	0.798	24%	0.237	S	C	*	.	H	α-helix	trans	-61.2	-35.8	177	49.8	0	0	0	0	112.3	V292 S293	T289-V292 PolarHBondContact O-N 3.29Å; T289-S293 WeakPolarHBondContact O-CB 3.3Å; T289-S293 PolarHBondContact O-N 3.49Å
290	E	92.8	Very high	93.9	Very high	127 Å²	127	45.8 Å²	45.8	59%	0.593	24%	0.24	S	C	*	.	H	α-helix	trans	-65.7	-45.3	174.7	-175.8	176.3	179.8	0	0	111.4	S288 V292 S293 Q294	S288-E290 VanDerWaalsContact C-N 3.25Å; S288-E290 PolarHBondContact O-N 3.07Å; E290-V292 PolarHBondContact O-N 3.33Å; E290-S293 WeakPolarHBondContact O-CB 3.39Å; E290-S293 PolarHBondContact O-N 2.77Å; E290-Q294 WeakPolarHBondContact O-CG 3.46Å; E290-Q294 PolarHBondContact O-N 2.57Å
291	C	95.2	Very high	93.9	Very high	7 Å²	7	43.8 Å²	43.8	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-57.6	-48	174.8	166.9	0	0	0	0	111.4	P287 S288 S293 Q294 L295 C324	P287-C291 HydrophobicContact CB-CB 4.45Å; S288-C291 WeakPolarHBondContact O-CB 3.37Å; S288-C291 PolarHBondContact O-N 2.7Å; S288-C291 VanDerWaalsContact OG-CB 3.28Å; S288-C291 WeakPolarHBondContact OG-CB 3.49Å; S288-C291 PolarHBondContact OG-N 2.96Å; S288-C291 VanDerWaalsContact OG-N 3.12Å; C291-S293 VanDerWaalsContact C-N 3.3Å; C291-S293 PolarHBondContact O-N 3.09Å; C291-Q294 PolarHBondContact O-N 3.07Å; C291-L295 WeakPolarHBondContact O-CB 3.47Å; C291-L295 VanDerWaalsContact O-CG 3.27Å; C291-L295 WeakPolarHBondContact O-CG 3.35Å; C291-L295 PolarHBondContact O-N 3.07Å; C291-L295 VanDerWaalsContact SG-CD1 3.51Å; C291-C324 VanDerWaalsContact CA-SG 3.52Å; C291-C324 HydrophobicContact CB-CB 4.01Å; C291-C324 WeakPolarHBondContact CB-SG 3.35Å; C291-C324 WeakPolarHBondContact SG-CB 3.34Å; C291-C324 CovalentContact SG-SG 2.03Å; C291-C324 PolarHBondContact SG-SG 2.92Å
292	V	97	Very high	93.8	Very high	8 Å²	8	42.2 Å²	42.2	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-39.8	178.5	177.8	0	0	0	0	111.3	V114 Q118 P287 S288 T289 E290 L295 T296	V114-V292 HydrophobicContact CG1-CG1 3.71Å; V114-V292 WeakPolarHBondContact O-CG1 3.33Å; Q118-V292 HydrophobicContact CB-CG1 3.96Å; Q118-V292 HydrophobicContact CB-CG2 3.91Å; Q118-V292 HydrophobicContact CG-CG2 3.92Å; P287-V292 HydrophobicContact CB-CG2 4.04Å; P287-V292 HydrophobicContact CG-CG2 3.83Å; S288-V292 WeakPolarHBondContact O-CG2 3.25Å; S288-V292 PolarHBondContact O-N 2.95Å; T289-V292 PolarHBondContact O-N 3.29Å; E290-V292 PolarHBondContact O-N 3.33Å; V292-L295 PolarHBondContact O-N 3.35Å; V292-T296 WeakPolarHBondContact O-CB 3.4Å; V292-T296 PolarHBondContact O-N 3.35Å; V292-T296 PolarHBondContact O-OG1 2.87Å
293	S	96.5	Very high	93.7	Very high	36 Å²	36	42.4 Å²	42.4	25%	0.252	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-47.4	175	177.6	0	0	0	0	111.7	V97 T289 E290 C291 T296 Q297	V97-S293 WeakPolarHBondContact CG1-O 3.22Å; V97-S293 WeakPolarHBondContact CG1-OG 3.3Å; T289-S293 WeakPolarHBondContact O-CB 3.3Å; T289-S293 PolarHBondContact O-N 3.49Å; E290-S293 WeakPolarHBondContact O-CB 3.39Å; E290-S293 PolarHBondContact O-N 2.77Å; C291-S293 VanDerWaalsContact C-N 3.3Å; C291-S293 PolarHBondContact O-N 3.09Å; S293-T296 WeakPolarHBondContact O-CB 3.38Å; S293-T296 PolarHBondContact O-N 3.17Å; S293-Q297 PolarHBondContact O-N 2.92Å
294	Q	96.1	Very high	93.7	Very high	53 Å²	53	41.2 Å²	41.2	25%	0.248	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-42.1	177.8	-68.4	-64.3	-53.7	0	0	112.2	E290 C291 T296 Q297 M298 I320	E290-Q294 WeakPolarHBondContact O-CG 3.46Å; E290-Q294 PolarHBondContact O-N 2.57Å; C291-Q294 PolarHBondContact O-N 3.07Å; Q294-T296 VanDerWaalsContact C-N 3.3Å; Q294-T296 PolarHBondContact O-N 3.47Å; Q294-Q297 WeakPolarHBondContact O-CB 3.49Å; Q294-Q297 PolarHBondContact O-N 3.29Å; Q294-M298 WeakPolarHBondContact O-CB 3.35Å; Q294-M298 PolarHBondContact O-N 3.42Å; Q294-I320 HydrophobicContact CB-CD1 4.27Å; Q294-I320 HydrophobicContact CB-CG1 4.28Å; Q294-I320 HydrophobicContact CB-CG2 3.88Å
295	L	97.3	Very high	93.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-40.4	173.7	-72.8	167.8	0	0	0	111.6	F121 C291 V292 M298 L299 I320 F457	F121-L295 HydrophobicContact CB-CD1 3.67Å; F121-L295 HydrophobicContact CD1-CD1 4.3Å; F121-L295 HydrophobicContact CD2-CD1 3.72Å; F121-L295 HydrophobicContact CD2-CD2 4.17Å; F121-L295 HydrophobicContact CE2-CD1 4.43Å; F121-L295 HydrophobicContact CG-CD1 3.63Å; C291-L295 WeakPolarHBondContact O-CB 3.47Å; C291-L295 VanDerWaalsContact O-CG 3.27Å; C291-L295 WeakPolarHBondContact O-CG 3.35Å; C291-L295 PolarHBondContact O-N 3.07Å; C291-L295 VanDerWaalsContact SG-CD1 3.51Å; V292-L295 PolarHBondContact O-N 3.35Å; L295-M298 HydrophobicContact CD2-CE 3.89Å; L295-M298 PolarHBondContact O-N 3.17Å; L295-L299 WeakPolarHBondContact O-CB 3.19Å; L295-L299 WeakPolarHBondContact O-CG 3.48Å; L295-L299 PolarHBondContact O-N 3.21Å; L295-I320 HydrophobicContact CD2-CG2 3.97Å; L295-I320 HydrophobicContact CG-CG2 4.23Å; L295-F457 HydrophobicContact CD2-CE2 4.39Å; L295-F457 HydrophobicContact CD2-CZ 4.32Å
296	T	96.1	Very high	93.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-42.9	175.8	-56	0	0	0	0	111.1	V97 F113 V114 S117 V292 S293 Q294 M298 Y300 C301	V97-T296 HydrophobicContact CG1-CG2 4.12Å; F113-T296 HydrophobicContact CB-CG2 4.05Å; V114-T296 WeakPolarHBondContact CA-OG1 3.43Å; V114-T296 HydrophobicContact CG2-CG2 3.94Å; S117-T296 PolarHBondContact OG-OG1 3.44Å; V292-T296 WeakPolarHBondContact O-CB 3.4Å; V292-T296 PolarHBondContact O-N 3.35Å; V292-T296 PolarHBondContact O-OG1 2.87Å; S293-T296 WeakPolarHBondContact O-CB 3.38Å; S293-T296 PolarHBondContact O-N 3.17Å; Q294-T296 VanDerWaalsContact C-N 3.3Å; Q294-T296 PolarHBondContact O-N 3.47Å; T296-M298 VanDerWaalsContact C-N 3.25Å; T296-M298 PolarHBondContact O-N 3.01Å; T296-Y300 PolarHBondContact O-N 2.88Å; T296-C301 PolarHBondContact O-N 3.46Å; T296-C301 VanDerWaalsContact O-N 3.1Å
297	Q	95.8	Very high	93.3	Very high	48 Å²	48	32 Å²	32	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-58	-39.4	174.3	-171	-178.9	2.5	0	0	112.4	V97 S293 Q294 C301 W471 G473	V97-Q297 HydrophobicContact CG1-CB 4.28Å; S293-Q297 PolarHBondContact O-N 2.92Å; Q294-Q297 WeakPolarHBondContact O-CB 3.49Å; Q294-Q297 PolarHBondContact O-N 3.29Å; Q297-C301 WeakPolarHBondContact CA-SG 3.4Å; Q297-W471 PolarHBondContact O-NE1 3.23Å; Q297-G473 PolarHBondContact NE2-O 3.04Å; Q297-G473 VanDerWaalsContact NE2-O 3.1Å
298	M	95.2	Very high	93	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-75.8	-46.2	-178.7	-176.1	-177.6	75.8	0	0	113.8	Q294 L295 T296 P312 F316 C317 I320 F457 W471	Q294-M298 WeakPolarHBondContact O-CB 3.35Å; Q294-M298 PolarHBondContact O-N 3.42Å; L295-M298 HydrophobicContact CD2-CE 3.89Å; L295-M298 PolarHBondContact O-N 3.17Å; T296-M298 VanDerWaalsContact C-N 3.25Å; T296-M298 PolarHBondContact O-N 3.01Å; M298-P312 HydrophobicContact CG-CB 3.53Å; M298-P312 HydrophobicContact CG-CG 4.01Å; M298-P312 HydrophobicContact SD-CB 4.2Å; M298-P312 HydrophobicContact SD-CG 4.33Å; M298-F316 HydrophobicContact CB-CD1 4.45Å; M298-F316 HydrophobicContact CB-CE1 3.83Å; M298-F316 HydrophobicContact CB-CZ 4.44Å; M298-F316 HydrophobicContact CG-CD1 3.95Å; M298-F316 HydrophobicContact CG-CE1 3.82Å; M298-C317 VanDerWaalsContact SD-CA 3.52Å; M298-C317 HydrophobicContact SD-CB 3.91Å; M298-I320 HydrophobicContact CB-CD1 3.71Å; M298-I320 HydrophobicContact CG-CD1 4.18Å; M298-I320 HydrophobicContact SD-CB 4.12Å; M298-I320 HydrophobicContact SD-CD1 4.01Å; M298-I320 HydrophobicContact SD-CG2 4.3Å; M298-F457 HydrophobicContact CE-CD2 4.07Å; M298-F457 HydrophobicContact CE-CE2 4.21Å; M298-W471 VanDerWaalsContact O-CD1 3.31Å
299	L	93.8	Very high	92.4	Very high	28 Å²	28	30.7 Å²	30.7	15%	0.147	17%	0.171	C	C	.	.	H	α-helix	trans	-91.6	-38.1	-168.5	-64.4	172.2	0	0	0	113	L295 F457	L295-L299 WeakPolarHBondContact O-CB 3.19Å; L295-L299 WeakPolarHBondContact O-CG 3.48Å; L295-L299 PolarHBondContact O-N 3.21Å; L299-F457 HydrophobicContact CD1-CD1 4.02Å; L299-F457 HydrophobicContact CD1-CE1 3.73Å; L299-F457 HydrophobicContact CD1-CZ 4.25Å; L299-F457 HydrophobicContact CD2-CB 4.11Å; L299-F457 HydrophobicContact CD2-CD1 3.75Å; L299-F457 HydrophobicContact CD2-CE1 4.3Å; L299-F457 HydrophobicContact CD2-CG 3.94Å
300	Y	93	Very high	92.1	Very high	16 Å²	16	26 Å²	26	6%	0.063	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-27.1	-164.1	-65.9	-69.1	0	0	0	114.5	F113 R116 E120 T296 P302 S303	F113-Y300 HydrophobicContact CB-CD2 4.24Å; F113-Y300 HydrophobicContact CB-CG 3.94Å; F113-Y300 AromaticContact CD1-CD1 3.41Å; F113-Y300 HydrophobicContact CD1-CD1 3.41Å; F113-Y300 VanDerWaalsContact CD1-CD1 3.41Å; F113-Y300 HydrophobicContact CD1-CD2 4.42Å; F113-Y300 HydrophobicContact CD1-CE1 4.17Å; F113-Y300 AromaticContact CD1-CG 3.57Å; F113-Y300 HydrophobicContact CD1-CG 3.57Å; F113-Y300 AromaticContact CE1-CD1 3.72Å; F113-Y300 HydrophobicContact CE1-CD1 3.72Å; F113-Y300 HydrophobicContact CE1-CE1 4.49Å; F113-Y300 HydrophobicContact CE1-CG 4.25Å; F113-Y300 HydrophobicContact CG-CD1 4.23Å; F113-Y300 AromaticContact CG-CG 3.93Å; F113-Y300 HydrophobicContact CG-CG 3.93Å; R116-Y300 HydrophobicContact CB-CE2 4.43Å; R116-Y300 VanDerWaalsContact CD-CZ 3.49Å; R116-Y300 WeakPolarHBondContact CD-OH 3.39Å; R116-Y300 HydrophobicContact CG-CE2 4.33Å; R116-Y300 WeakPolarHBondContact CG-OH 3.4Å; R116-Y300 PolarHBondContact NE-OH 3.38Å; R116-Y300 VanDerWaalsContact NE-OH 3.08Å; E120-Y300 PolarHBondContact OE2-OH 3.26Å; T296-Y300 PolarHBondContact O-N 2.88Å; Y300-P302 VanDerWaalsContact C-N 3.32Å; Y300-S303 VanDerWaalsContact O-CB 3.28Å; Y300-S303 WeakPolarHBondContact O-CB 3.38Å; Y300-S303 PolarHBondContact O-N 2.89Å
301	C	93.9	Very high	92	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.027	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-26.1	176.7	-65.5	0	0	0	0	116.4	C98 T296 Q297 S303 C304 Q305	C98-C301 WeakPolarHBondContact CA-SG 3.36Å; C98-C301 HydrophobicContact CB-CB 3.8Å; C98-C301 WeakPolarHBondContact CB-SG 3.43Å; C98-C301 WeakPolarHBondContact SG-CA 3.34Å; C98-C301 WeakPolarHBondContact SG-CB 3.4Å; C98-C301 CovalentContact SG-SG 2.03Å; C98-C301 PolarHBondContact SG-SG 3.44Å; T296-C301 PolarHBondContact O-N 3.46Å; T296-C301 VanDerWaalsContact O-N 3.1Å; Q297-C301 WeakPolarHBondContact CA-SG 3.4Å; C301-S303 PolarHBondContact O-N 3.21Å; C301-C304 WeakPolarHBondContact O-CB 3.38Å; C301-C304 PolarHBondContact O-N 2.95Å; C301-Q305 PolarHBondContact O-N 3.33Å
302	P	92.5	Very high	91.9	Very high	2 Å²	2	22 Å²	22	1%	0.013	12%	0.12	C	C	.	.	H	α-helix	trans	-55.2	-38.8	169	-24.9	32.9	0	0	0	112.3	Y300 C304 Q305 G306 L307 Q310 W471	Y300-P302 VanDerWaalsContact C-N 3.32Å; P302-C304 PolarHBondContact O-N 3.45Å; P302-Q305 CarbonylContact O-C 3.32Å; P302-Q305 WeakPolarHBondContact O-CA 3.38Å; P302-Q305 PolarHBondContact O-N 3.06Å; P302-G306 PolarHBondContact O-N 3.38Å; P302-L307 CarbonylContact C-O 3.07Å; P302-L307 HydrophobicContact CB-CB 3.99Å; P302-L307 WeakPolarHBondContact O-CA 3.48Å; P302-L307 WeakPolarHBondContact O-CB 3.35Å; P302-L307 PolarHBondContact O-N 3.18Å; P302-Q310 HydrophobicContact CB-CB 4.35Å; P302-W471 HydrophobicContact CB-CD2 4.33Å; P302-W471 HydrophobicContact CB-CE3 4.46Å; P302-W471 HydrophobicContact CG-CB 4.19Å; P302-W471 HydrophobicContact CG-CD2 3.6Å; P302-W471 HydrophobicContact CG-CE3 4.2Å; P302-W471 HydrophobicContact CG-CG 3.57Å; P302-W471 HydrophobicContact CG-CZ2 4.32Å
303	S	91	Very high	91.7	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.028	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-34.6	178.2	-64.1	0	0	0	0	111.1	V63 Y300 C301 Q305 G306 L307	V63-S303 VanDerWaalsContact CG1-O 3.27Å; V63-S303 WeakPolarHBondContact CG1-O 3.23Å; V63-S303 WeakPolarHBondContact CG2-O 3.5Å; Y300-S303 VanDerWaalsContact O-CB 3.28Å; Y300-S303 WeakPolarHBondContact O-CB 3.38Å; Y300-S303 PolarHBondContact O-N 2.89Å; C301-S303 PolarHBondContact O-N 3.21Å; S303-Q305 PolarHBondContact O-N 3.21Å; S303-G306 PolarHBondContact O-N 3.35Å; S303-G306 VanDerWaalsContact O-N 3.11Å; S303-L307 WeakPolarHBondContact CA-O 3.34Å; S303-L307 PolarHBondContact N-O 3.03Å
304	C	91.3	Very high	91.4	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.014	12%	0.121	C	C	.	.	H	α-helix	trans	-67.7	-20	175.4	-63	0	0	0	0	113.8	C98 T103 C104 C105 C301 P302	C98-C304 HydrophobicContact CB-CB 4.38Å; T103-C304 VanDerWaalsContact CA-O 3.31Å; T103-C304 WeakPolarHBondContact CA-O 3.36Å; T103-C304 WeakPolarHBondContact CB-O 3.39Å; T103-C304 WeakPolarHBondContact OG1-CB 3.33Å; T103-C304 PolarHBondContact OG1-O 3.41Å; C104-C304 PolarHBondContact N-O 3.44Å; C105-C304 HydrophobicContact CB-CB 3.66Å; C105-C304 WeakPolarHBondContact CB-SG 3.35Å; C105-C304 WeakPolarHBondContact SG-CA 3.33Å; C105-C304 WeakPolarHBondContact SG-CB 3.43Å; C105-C304 CovalentContact SG-SG 2.04Å; C105-C304 PolarHBondContact SG-SG 3.24Å; C301-C304 WeakPolarHBondContact O-CB 3.38Å; C301-C304 PolarHBondContact O-N 2.95Å; P302-C304 PolarHBondContact O-N 3.45Å
305	Q	89.4	Confident	91.2	Very high	62 Å²	62	22.2 Å²	22.2	29%	0.29	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	11.5	174.2	-63	-174.5	-13.2	0	0	113.3	C301 P302 S303	C301-Q305 PolarHBondContact O-N 3.33Å; P302-Q305 CarbonylContact O-C 3.32Å; P302-Q305 WeakPolarHBondContact O-CA 3.38Å; P302-Q305 PolarHBondContact O-N 3.06Å; S303-Q305 PolarHBondContact O-N 3.21Å
306	G	88.3	Confident	90.9	Very high	8 Å²	8	23.9 Å²	23.9	8%	0.082	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	6.7	-178.5	0	0	0	0	0	114.5	P302 S303	P302-G306 PolarHBondContact O-N 3.38Å; S303-G306 PolarHBondContact O-N 3.35Å; S303-G306 VanDerWaalsContact O-N 3.11Å
307	L	87.3	Confident	90.9	Very high	50 Å²	50	23.9 Å²	23.9	26%	0.262	13%	0.13	S	C	.	.			trans	-103.3	105.8	-178.7	-54.7	171.2	0	0	0	110.6	P302 S303 W471 L476	P302-L307 CarbonylContact C-O 3.07Å; P302-L307 HydrophobicContact CB-CB 3.99Å; P302-L307 WeakPolarHBondContact O-CA 3.48Å; P302-L307 WeakPolarHBondContact O-CB 3.35Å; P302-L307 PolarHBondContact O-N 3.18Å; S303-L307 WeakPolarHBondContact CA-O 3.34Å; S303-L307 PolarHBondContact N-O 3.03Å; L307-W471 HydrophobicContact CD1-CE3 4.47Å; L307-W471 HydrophobicContact CD1-CZ3 4.36Å; L307-L476 HydrophobicContact CD1-CD1 4.21Å; L307-L476 HydrophobicContact CD1-CD2 4Å; L307-L476 HydrophobicContact CD1-CG 3.9Å; L307-L476 HydrophobicContact CD2-CD1 4.1Å
308	T	84.8	Confident	90.8	Very high	38 Å²	38	22.1 Å²	22.1	23%	0.233	12%	0.123	C	C	.	.			trans	-101.4	135.9	178.9	59.3	0	0	0	0	112.2	Q62 V63 H66	Q62-T308 HydrophobicContact CB-CG2 4.23Å; V63-T308 HydrophobicContact CB-CG2 4.26Å; V63-T308 HydrophobicContact CG2-CG2 3.72Å; H66-T308 HydrophobicContact CB-CG2 3.86Å
309	G	81.4	Confident	90.6	Very high	21 Å²	21	24.2 Å²	24.2	22%	0.216	14%	0.139	C	C	.	.	S	Bend	trans	72.4	26.4	176.3	0	0	0	0	0	114.2	A461	G309-A461 CarbonylContact C-O 3.57Å; G309-A461 WeakPolarHBondContact CA-O 3.4Å
310	Q	86.1	Confident	90.6	Very high	33 Å²	33	23.1 Å²	23.1	15%	0.154	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-85.6	123.9	177.1	-177.6	57	63.8	0	0	110.4	P302 Y469 W471 L476	P302-Q310 HydrophobicContact CB-CB 4.35Å; Q310-Y469 PolarHBondContact NE2-O 3.49Å; Q310-W471 HydrophobicContact CG-CB 3.87Å; Q310-L476 HydrophobicContact CG-CD2 3.59Å
311	K	90.7	Very high	90.6	Very high	48 Å²	48	22.3 Å²	22.3	21%	0.209	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-71.6	141.4	172.8	70.6	-172.9	179.1	-167.4	0	111.3	A461 D467 C470 W471	K311-A461 HydrophobicContact CB-CB 3.81Å; K311-D467 PolarHBondContact NZ-O 3.28Å; K311-D467 IonicContact NZ-OD1 2.82Å; K311-D467 PolarHBondContact NZ-OD1 3.43Å; K311-C470 WeakPolarHBondContact O-CA 3.27Å; K311-W471 PolarHBondContact O-N 3.17Å
312	P	92.8	Very high	90.5	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.013	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-64.3	153.4	169.7	28.3	-34.6	0	0	0	111.1	M298 F316 C317 H458 W471	M298-P312 HydrophobicContact CG-CB 3.53Å; M298-P312 HydrophobicContact CG-CG 4.01Å; M298-P312 HydrophobicContact SD-CB 4.2Å; M298-P312 HydrophobicContact SD-CG 4.33Å; P312-F316 HydrophobicContact CB-CD1 4.41Å; P312-C317 HydrophobicContact CB-CB 4.38Å; P312-C317 HydrophobicContact CG-CB 4.21Å; P312-H458 PolarHBondContact O-NE2 3.41Å; P312-W471 CarbonylContact C-O 3.52Å; P312-W471 WeakPolarHBondContact CA-O 3.34Å
313	C	92.5	Very high	90.4	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.027	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-63.6	141.5	169.6	-61.3	0	0	0	0	109.4	S315 F316 C317 C470 W471	C313-S315 VanDerWaalsContact C-N 3.32Å; C313-S315 PolarHBondContact O-N 3.03Å; C313-F316 HydrophobicContact CB-CB 4.12Å; C313-F316 WeakPolarHBondContact O-CB 3.34Å; C313-F316 PolarHBondContact O-N 2.88Å; C313-F316 VanDerWaalsContact O-N 3.12Å; C313-C317 PolarHBondContact O-N 3.36Å; C313-C470 WeakPolarHBondContact CA-SG 3.24Å; C313-C470 HydrophobicContact CB-CB 3.86Å; C313-C470 WeakPolarHBondContact CB-SG 3.46Å; C313-C470 WeakPolarHBondContact SG-CB 3.16Å; C313-C470 PolarHBondContact SG-O 3.33Å; C313-C470 CovalentContact SG-SG 2.03Å; C313-C470 PolarHBondContact SG-SG 3.22Å; C313-W471 PolarHBondContact N-O 3.22Å; C313-W471 VanDerWaalsContact SG-C 3.5Å; C313-W471 PolarHBondContact SG-O 3.18Å
314	N	91.2	Very high	90.6	Very high	55 Å²	55	31.4 Å²	31.4	29%	0.294	17%	0.167	S	C	.	.	H	α-helix	trans	-60.4	-41.9	-174	-176	59.8	0	0	0	112.4	C317 L318	N314-C317 PolarHBondContact O-N 2.88Å; N314-L318 WeakPolarHBondContact O-CB 3.33Å; N314-L318 WeakPolarHBondContact O-CG 3.47Å; N314-L318 PolarHBondContact O-N 3.01Å
315	S	90.2	Very high	90.7	Very high	41 Å²	41	31.3 Å²	31.3	29%	0.287	17%	0.166	S	C	.	.	H	α-helix	trans	-60.8	-44.6	175.3	52.5	0	0	0	0	112.4	C313 L318 A319 V484	C313-S315 VanDerWaalsContact C-N 3.32Å; C313-S315 PolarHBondContact O-N 3.03Å; S315-L318 PolarHBondContact O-N 2.9Å; S315-A319 WeakPolarHBondContact O-CB 3.4Å; S315-A319 PolarHBondContact O-N 3.21Å; S315-V484 VanDerWaalsContact CB-CG2 3.45Å
316	F	92.8	Very high	90.6	Very high	36 Å²	36	30.3 Å²	30.3	16%	0.158	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-42.5	177.5	-176.3	-127.5	0	0	0	111.5	M298 P312 C313 A319 I320 G473	M298-F316 HydrophobicContact CB-CD1 4.45Å; M298-F316 HydrophobicContact CB-CE1 3.83Å; M298-F316 HydrophobicContact CB-CZ 4.44Å; M298-F316 HydrophobicContact CG-CD1 3.95Å; M298-F316 HydrophobicContact CG-CE1 3.82Å; P312-F316 HydrophobicContact CB-CD1 4.41Å; C313-F316 HydrophobicContact CB-CB 4.12Å; C313-F316 WeakPolarHBondContact O-CB 3.34Å; C313-F316 PolarHBondContact O-N 2.88Å; C313-F316 VanDerWaalsContact O-N 3.12Å; F316-A319 PolarHBondContact O-N 3.04Å; F316-I320 HydrophobicContact CD1-CD1 4.32Å; F316-I320 HydrophobicContact CD2-CD1 4.03Å; F316-I320 HydrophobicContact CD2-CG1 4.48Å; F316-I320 HydrophobicContact CE1-CD1 3.79Å; F316-I320 HydrophobicContact CE2-CD1 3.45Å; F316-I320 VanDerWaalsContact CE2-CD1 3.45Å; F316-I320 HydrophobicContact CE2-CG1 4.17Å; F316-I320 HydrophobicContact CG-CD1 4.43Å; F316-I320 HydrophobicContact CZ-CD1 3.31Å; F316-I320 HydrophobicContact CZ-CG1 4.46Å; F316-I320 PolarHBondContact O-N 2.94Å; F316-I320 VanDerWaalsContact O-N 3.11Å; F316-G473 VanDerWaalsContact CZ-CA 3.44Å
317	C	94.9	Very high	90.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-48.3	175.5	-176.9	0	0	0	0	112.4	M298 P312 C313 N314 A319 I320 T321 C454	M298-C317 VanDerWaalsContact SD-CA 3.52Å; M298-C317 HydrophobicContact SD-CB 3.91Å; P312-C317 HydrophobicContact CB-CB 4.38Å; P312-C317 HydrophobicContact CG-CB 4.21Å; C313-C317 PolarHBondContact O-N 3.36Å; N314-C317 PolarHBondContact O-N 2.88Å; C317-A319 VanDerWaalsContact C-N 3.31Å; C317-A319 PolarHBondContact O-N 2.98Å; C317-I320 PolarHBondContact O-N 3.09Å; C317-T321 WeakPolarHBondContact O-CB 3.31Å; C317-T321 WeakPolarHBondContact O-CG2 3.32Å; C317-T321 PolarHBondContact O-N 2.79Å; C317-T321 PolarHBondContact O-OG1 2.67Å; C317-C454 HydrophobicContact CB-CB 4Å; C317-C454 WeakPolarHBondContact CB-SG 3.14Å; C317-C454 PolarHBondContact O-SG 3.15Å; C317-C454 WeakPolarHBondContact SG-CA 3.1Å; C317-C454 WeakPolarHBondContact SG-CB 3.43Å; C317-C454 CovalentContact SG-SG 2.04Å; C317-C454 PolarHBondContact SG-SG 2.83Å
318	L	93.2	Very high	90.9	Very high	11 Å²	11	29 Å²	29	6%	0.058	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-40.1	178.2	-73.1	172.4	0	0	0	111.6	N314 S315 T321 S322 K451 C454 V484	N314-L318 WeakPolarHBondContact O-CB 3.33Å; N314-L318 WeakPolarHBondContact O-CG 3.47Å; N314-L318 PolarHBondContact O-N 3.01Å; S315-L318 PolarHBondContact O-N 2.9Å; L318-T321 WeakPolarHBondContact CA-OG1 3.4Å; L318-T321 PolarHBondContact O-OG1 2.9Å; L318-S322 WeakPolarHBondContact O-CB 3.03Å; L318-S322 PolarHBondContact O-N 2.81Å; L318-S322 PolarHBondContact O-OG 3.44Å; L318-K451 HydrophobicContact CD2-CB 4.08Å; L318-C454 PolarHBondContact N-SG 2.84Å; L318-V484 HydrophobicContact CD1-CB 4.34Å
319	A	91.1	Very high	90.9	Very high	43 Å²	43	27.9 Å²	27.9	36%	0.355	15%	0.149	S	C	.	.	H	α-helix	trans	-61.8	-46.5	177.9	0	0	0	0	0	112.2	S315 F316 C317 R323	S315-A319 WeakPolarHBondContact O-CB 3.4Å; S315-A319 PolarHBondContact O-N 3.21Å; F316-A319 PolarHBondContact O-N 3.04Å; C317-A319 VanDerWaalsContact C-N 3.31Å; C317-A319 PolarHBondContact O-N 2.98Å; A319-R323 WeakPolarHBondContact O-CG 3.33Å; A319-R323 PolarHBondContact O-N 3.23Å
320	I	93.8	Very high	91.2	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.026	14%	0.139	C	C	.	.	H	α-helix	trans	-69.9	-49.5	-179.9	-70.5	176.7	0	0	0	111	Q294 L295 M298 F316 C317 S322 R323 C324	Q294-I320 HydrophobicContact CB-CD1 4.27Å; Q294-I320 HydrophobicContact CB-CG1 4.28Å; Q294-I320 HydrophobicContact CB-CG2 3.88Å; L295-I320 HydrophobicContact CD2-CG2 3.97Å; L295-I320 HydrophobicContact CG-CG2 4.23Å; M298-I320 HydrophobicContact CB-CD1 3.71Å; M298-I320 HydrophobicContact CG-CD1 4.18Å; M298-I320 HydrophobicContact SD-CB 4.12Å; M298-I320 HydrophobicContact SD-CD1 4.01Å; M298-I320 HydrophobicContact SD-CG2 4.3Å; F316-I320 HydrophobicContact CD1-CD1 4.32Å; F316-I320 HydrophobicContact CD2-CD1 4.03Å; F316-I320 HydrophobicContact CD2-CG1 4.48Å; F316-I320 HydrophobicContact CE1-CD1 3.79Å; F316-I320 HydrophobicContact CE2-CD1 3.45Å; F316-I320 VanDerWaalsContact CE2-CD1 3.45Å; F316-I320 HydrophobicContact CE2-CG1 4.17Å; F316-I320 HydrophobicContact CG-CD1 4.43Å; F316-I320 HydrophobicContact CZ-CD1 3.31Å; F316-I320 HydrophobicContact CZ-CG1 4.46Å; F316-I320 PolarHBondContact O-N 2.94Å; F316-I320 VanDerWaalsContact O-N 3.11Å; C317-I320 PolarHBondContact O-N 3.09Å; I320-S322 VanDerWaalsContact C-N 3.33Å; I320-S322 PolarHBondContact O-N 3.02Å; I320-R323 PolarHBondContact O-N 2.63Å; I320-C324 WeakPolarHBondContact O-CB 3.21Å; I320-C324 PolarHBondContact O-N 3.44Å; I320-C324 PolarHBondContact O-SG 3.49Å
321	T	94.6	Very high	91.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-36.7	-177.9	52.7	0	0	0	0	112.4	C317 L318 C324 L325 L453 C454 F457	C317-T321 WeakPolarHBondContact O-CB 3.31Å; C317-T321 WeakPolarHBondContact O-CG2 3.32Å; C317-T321 PolarHBondContact O-N 2.79Å; C317-T321 PolarHBondContact O-OG1 2.67Å; L318-T321 WeakPolarHBondContact CA-OG1 3.4Å; L318-T321 PolarHBondContact O-OG1 2.9Å; T321-C324 WeakPolarHBondContact O-CB 3.16Å; T321-C324 PolarHBondContact O-N 2.95Å; T321-L325 WeakPolarHBondContact O-CB 3.4Å; T321-L325 WeakPolarHBondContact O-CG 3.4Å; T321-L325 PolarHBondContact O-N 3.37Å; T321-L453 HydrophobicContact CG2-CB 4.31Å; T321-C454 PolarHBondContact OG1-SG 2.95Å; T321-F457 HydrophobicContact CG2-CD2 4.29Å; T321-F457 HydrophobicContact CG2-CE2 3.86Å
322	S	91.7	Very high	91.6	Very high	5 Å²	5	23.5 Å²	23.5	4%	0.035	12%	0.124	C	C	.	.	H	α-helix	trans	-66.6	-40.3	176.2	-56.8	0	0	0	0	112.1	L318 I320 L325 V326	L318-S322 WeakPolarHBondContact O-CB 3.03Å; L318-S322 PolarHBondContact O-N 2.81Å; L318-S322 PolarHBondContact O-OG 3.44Å; I320-S322 VanDerWaalsContact C-N 3.33Å; I320-S322 PolarHBondContact O-N 3.02Å; S322-L325 CarbonylContact O-C 3.54Å; S322-L325 PolarHBondContact O-N 2.95Å; S322-V326 PolarHBondContact O-N 3.04Å; S322-V326 VanDerWaalsContact O-N 3.09Å
323	R	90.4	Very high	91.6	Very high	176 Å²	176	30.4 Å²	30.4	66%	0.664	15%	0.15	S	C	*	.	H	α-helix	trans	-64.9	-44.4	173.9	-71.6	176.7	-172.3	178.3	3	111.8	A319 I320 L325 V326	A319-R323 WeakPolarHBondContact O-CG 3.33Å; A319-R323 PolarHBondContact O-N 3.23Å; I320-R323 PolarHBondContact O-N 2.63Å; R323-L325 PolarHBondContact O-N 3.09Å; R323-V326 WeakPolarHBondContact O-CB 3.11Å; R323-V326 WeakPolarHBondContact O-CG1 3.44Å; R323-V326 PolarHBondContact O-N 3.49Å
324	C	93.8	Very high	91.6	Very high	19 Å²	19	30.6 Å²	30.6	13%	0.128	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-31.8	174.2	-80.5	0	0	0	0	113.3	F121 C291 I320 T321	F121-C324 HydrophobicContact CE2-CB 3.96Å; F121-C324 HydrophobicContact CZ-CB 3.87Å; C291-C324 VanDerWaalsContact CA-SG 3.52Å; C291-C324 HydrophobicContact CB-CB 4.01Å; C291-C324 WeakPolarHBondContact CB-SG 3.35Å; C291-C324 WeakPolarHBondContact SG-CB 3.34Å; C291-C324 CovalentContact SG-SG 2.03Å; C291-C324 PolarHBondContact SG-SG 2.92Å; I320-C324 WeakPolarHBondContact O-CB 3.21Å; I320-C324 PolarHBondContact O-N 3.44Å; I320-C324 PolarHBondContact O-SG 3.49Å; T321-C324 WeakPolarHBondContact O-CB 3.16Å; T321-C324 PolarHBondContact O-N 2.95Å
325	L	92.8	Very high	91.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	14.2	-177.3	-68	173.2	0	0	0	113.6	F121 V125 T321 S322 R323 S327 Y328 V329 L449 P450 L453	F121-L325 HydrophobicContact CE2-CD2 4.36Å; F121-L325 HydrophobicContact CE2-CG 4.35Å; F121-L325 HydrophobicContact CZ-CD2 3.7Å; F121-L325 HydrophobicContact CZ-CG 4.05Å; V125-L325 HydrophobicContact CG2-CD2 4.18Å; T321-L325 WeakPolarHBondContact O-CB 3.4Å; T321-L325 WeakPolarHBondContact O-CG 3.4Å; T321-L325 PolarHBondContact O-N 3.37Å; S322-L325 CarbonylContact O-C 3.54Å; S322-L325 PolarHBondContact O-N 2.95Å; R323-L325 PolarHBondContact O-N 3.09Å; L325-S327 PolarHBondContact O-N 3.36Å; L325-S327 VanDerWaalsContact O-N 3.15Å; L325-Y328 HydrophobicContact CB-CD2 4.16Å; L325-Y328 HydrophobicContact CD2-CD2 3.36Å; L325-Y328 HydrophobicContact CD2-CE2 3.51Å; L325-Y328 HydrophobicContact CD2-CG 3.9Å; L325-Y328 HydrophobicContact CG-CD2 4.37Å; L325-Y328 WeakPolarHBondContact O-CA 3.42Å; L325-Y328 WeakPolarHBondContact O-CB 3.47Å; L325-Y328 PolarHBondContact O-N 3.49Å; L325-V329 PolarHBondContact O-N 3.05Å; L325-L449 HydrophobicContact CD1-CB 4.09Å; L325-L449 HydrophobicContact CD1-CD2 3.96Å; L325-L449 HydrophobicContact CD1-CG 3.79Å; L325-L449 HydrophobicContact CD2-CD2 4.05Å; L325-P450 HydrophobicContact CB-CG 4.38Å; L325-P450 HydrophobicContact CD1-CB 4.3Å; L325-P450 HydrophobicContact CD1-CG 3.75Å; L325-L453 HydrophobicContact CD1-CD1 3.67Å; L325-L453 HydrophobicContact CG-CD1 4.45Å
326	V	88.8	Confident	92.1	Very high	42 Å²	42	27.5 Å²	27.5	26%	0.255	13%	0.131	S	C	.	.	H	α-helix	trans	-51.9	-43.1	-176.9	67.1	0	0	0	0	112.4	S322 R323 Y328 V329 V330 L496	S322-V326 PolarHBondContact O-N 3.04Å; S322-V326 VanDerWaalsContact O-N 3.09Å; R323-V326 WeakPolarHBondContact O-CB 3.11Å; R323-V326 WeakPolarHBondContact O-CG1 3.44Å; R323-V326 PolarHBondContact O-N 3.49Å; V326-Y328 VanDerWaalsContact C-N 3.29Å; V326-Y328 PolarHBondContact O-N 2.93Å; V326-V329 PolarHBondContact O-N 2.96Å; V326-V330 WeakPolarHBondContact O-CG2 3.33Å; V326-V330 PolarHBondContact O-N 3.29Å; V326-L496 HydrophobicContact CG2-CD1 4.13Å; V326-L496 HydrophobicContact CG2-CD2 4.43Å
327	S	89.5	Confident	92.3	Very high	16 Å²	16	28.9 Å²	28.9	11%	0.112	14%	0.138	C	C	.	.	H	α-helix	trans	-54.9	-39.9	173.7	-76.7	0	0	0	0	113.9	L325 F331	L325-S327 PolarHBondContact O-N 3.36Å; L325-S327 VanDerWaalsContact O-N 3.15Å; S327-F331 PolarHBondContact O-N 2.79Å
328	Y	91.2	Very high	92.4	Very high	14 Å²	14	28.9 Å²	28.9	6%	0.055	14%	0.138	C	C	.	.	H	α-helix	trans	-75.2	-37.4	179.9	-62.8	-101.7	0	0	0	111.3	V125 I129 M282 M285 L325 V326 F331 D332 W446	V125-Y328 HydrophobicContact CG1-CE1 4.17Å; I129-Y328 HydrophobicContact CD1-CE1 4.04Å; M282-Y328 HydrophobicContact SD-CD1 4.42Å; M282-Y328 HydrophobicContact SD-CE1 4.47Å; M285-Y328 HydrophobicContact CE-CD1 3.8Å; M285-Y328 HydrophobicContact CE-CD2 4.05Å; M285-Y328 HydrophobicContact CE-CE1 3.22Å; M285-Y328 HydrophobicContact CE-CE2 3.49Å; M285-Y328 VanDerWaalsContact CE-CE2 3.49Å; M285-Y328 HydrophobicContact CE-CG 4.21Å; M285-Y328 VanDerWaalsContact CE-OH 3.28Å; M285-Y328 WeakPolarHBondContact CE-OH 3.22Å; L325-Y328 HydrophobicContact CB-CD2 4.16Å; L325-Y328 HydrophobicContact CD2-CD2 3.36Å; L325-Y328 HydrophobicContact CD2-CE2 3.51Å; L325-Y328 HydrophobicContact CD2-CG 3.9Å; L325-Y328 HydrophobicContact CG-CD2 4.37Å; L325-Y328 WeakPolarHBondContact O-CA 3.42Å; L325-Y328 WeakPolarHBondContact O-CB 3.47Å; L325-Y328 PolarHBondContact O-N 3.49Å; V326-Y328 VanDerWaalsContact C-N 3.29Å; V326-Y328 PolarHBondContact O-N 2.93Å; Y328-F331 WeakPolarHBondContact O-CB 3.38Å; Y328-F331 PolarHBondContact O-N 3.15Å; Y328-D332 PolarHBondContact O-N 3.02Å; Y328-W446 AromaticContact CD1-CE3 3.57Å; Y328-W446 HydrophobicContact CD1-CE3 3.57Å; Y328-W446 AromaticContact CD1-CZ3 3.63Å; Y328-W446 HydrophobicContact CD1-CZ3 3.63Å; Y328-W446 HydrophobicContact CE1-CE3 4.42Å; Y328-W446 HydrophobicContact CE1-CZ3 4.05Å; Y328-W446 HydrophobicContact CG-CE3 4.41Å; Y328-W446 WeakPolarHBondContact O-CB 3.4Å
329	V	86.1	Confident	92.6	Very high	14 Å²	14	28.4 Å²	28.4	9%	0.085	14%	0.135	C	C	.	.	H	α-helix	trans	-65.4	-41.5	176.8	177.4	0	0	0	0	111	L325 V326 F331 D332 L447 W491	L325-V329 PolarHBondContact O-N 3.05Å; V326-V329 PolarHBondContact O-N 2.96Å; V329-F331 VanDerWaalsContact C-N 3.27Å; V329-F331 PolarHBondContact O-N 3.05Å; V329-D332 VanDerWaalsContact O-CB 3.25Å; V329-D332 WeakPolarHBondContact O-CB 3.46Å; V329-D332 PolarHBondContact O-N 3.11Å; V329-D332 VanDerWaalsContact O-N 3.16Å; V329-L447 HydrophobicContact CG1-CD1 4.14Å; V329-W491 HydrophobicContact CG1-CB 4.5Å; V329-W491 HydrophobicContact CG1-CD2 4.23Å; V329-W491 HydrophobicContact CG1-CE3 3.79Å; V329-W491 HydrophobicContact CG1-CZ3 4.22Å
330	V	87.9	Confident	92.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-59.6	-40.7	173	172.6	0	0	0	0	111.1	V326 D332 A493 L496 L497 I502	V326-V330 WeakPolarHBondContact O-CG2 3.33Å; V326-V330 PolarHBondContact O-N 3.29Å; V330-D332 VanDerWaalsContact C-N 3.35Å; V330-A493 HydrophobicContact CG1-CB 4.36Å; V330-L496 HydrophobicContact CG2-CB 3.59Å; V330-L496 HydrophobicContact CG2-CD1 3.84Å; V330-L496 HydrophobicContact CG2-CG 4.4Å; V330-L497 HydrophobicContact CG1-CB 4.1Å; V330-L497 HydrophobicContact CG1-CD1 3.99Å; V330-I502 HydrophobicContact CB-CD1 4.49Å; V330-I502 HydrophobicContact CG2-CD1 3.88Å
331	F	92.2	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.8	-34.3	176.3	-179.1	-102.4	0	0	0	113.1	V278 M282 S327 Y328 V329 R333 H334 W335 W446 V510 I513	V278-F331 HydrophobicContact CG1-CE2 3.55Å; V278-F331 HydrophobicContact CG1-CZ 3.42Å; V278-F331 VanDerWaalsContact CG1-CZ 3.42Å; M282-F331 HydrophobicContact CE-CB 3.87Å; M282-F331 HydrophobicContact CE-CD1 3.49Å; M282-F331 VanDerWaalsContact CE-CD1 3.49Å; M282-F331 HydrophobicContact CE-CD2 3.28Å; M282-F331 HydrophobicContact CE-CE1 3.74Å; M282-F331 HydrophobicContact CE-CE2 3.56Å; M282-F331 HydrophobicContact CE-CG 3.24Å; M282-F331 HydrophobicContact CE-CZ 3.79Å; S327-F331 PolarHBondContact O-N 2.79Å; Y328-F331 WeakPolarHBondContact O-CB 3.38Å; Y328-F331 PolarHBondContact O-N 3.15Å; V329-F331 VanDerWaalsContact C-N 3.27Å; V329-F331 PolarHBondContact O-N 3.05Å; F331-R333 VanDerWaalsContact C-N 3.3Å; F331-R333 PolarHBondContact O-N 2.74Å; F331-H334 PolarHBondContact O-N 2.73Å; F331-W335 HydrophobicContact CD1-CB 4.04Å; F331-W335 HydrophobicContact CE1-CB 3.73Å; F331-W335 HydrophobicContact CE1-CD2 4.08Å; F331-W335 AromaticContact CE1-CE3 3.85Å; F331-W335 HydrophobicContact CE1-CE3 3.85Å; F331-W335 HydrophobicContact CE1-CG 4.05Å; F331-W335 HydrophobicContact CZ-CB 4.25Å; F331-W335 HydrophobicContact CZ-CD2 4.45Å; F331-W335 AromaticContact CZ-CE3 3.79Å; F331-W335 HydrophobicContact CZ-CE3 3.79Å; F331-W335 PolarHBondContact O-N 3.35Å; F331-W446 AromaticContact CD1-CD1 3.92Å; F331-W446 HydrophobicContact CD1-CD2 4.29Å; F331-W446 AromaticContact CD1-CE2 3.85Å; F331-W446 HydrophobicContact CD1-CG 4.32Å; F331-W446 HydrophobicContact CD1-CZ2 4.37Å; F331-W446 AromaticContact CD1-NE1 3.6Å; F331-W446 AromaticContact CE1-CE2 3.87Å; F331-W446 HydrophobicContact CE1-CZ2 4.09Å; F331-W446 AromaticContact CE1-NE1 3.58Å; F331-V510 HydrophobicContact CD2-CG2 4.03Å; F331-I513 HydrophobicContact CE2-CG1 3.87Å; F331-I513 HydrophobicContact CZ-CG1 4.17Å
332	D	92.8	Very high	93.3	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.053	14%	0.142	C	C	.	.	H	α-helix	trans	-50.4	-46.8	-177.4	-163.3	76.9	0	0	0	112.9	Y328 V329 V330 H334 W335 N336 G444 W446 L447	Y328-D332 PolarHBondContact O-N 3.02Å; V329-D332 VanDerWaalsContact O-CB 3.25Å; V329-D332 WeakPolarHBondContact O-CB 3.46Å; V329-D332 PolarHBondContact O-N 3.11Å; V329-D332 VanDerWaalsContact O-N 3.16Å; V330-D332 VanDerWaalsContact C-N 3.35Å; D332-H334 VanDerWaalsContact C-N 3.32Å; D332-H334 PolarHBondContact O-N 3.41Å; D332-W335 WeakPolarHBondContact O-CB 3.42Å; D332-W335 PolarHBondContact O-N 2.66Å; D332-N336 VanDerWaalsContact O-CG 3.27Å; D332-N336 PolarHBondContact O-N 2.99Å; D332-N336 PolarHBondContact O-ND2 3.35Å; D332-N336 PolarHBondContact OD2-ND2 3.06Å; D332-G444 VanDerWaalsContact OD1-C 3.32Å; D332-G444 WeakPolarHBondContact OD1-CA 3.48Å; D332-W446 HydrophobicContact CB-CB 3.83Å; D332-W446 HydrophobicContact CB-CG 4.42Å; D332-W446 VanDerWaalsContact OD1-CB 3.3Å; D332-W446 WeakPolarHBondContact OD1-CB 3.46Å; D332-W446 PolarHBondContact OD1-N 3.41Å; D332-L447 PolarHBondContact OD1-N 2.04Å
333	R	91.4	Very high	93.5	Very high	146 Å²	146	31.9 Å²	31.9	55%	0.551	14%	0.144	S	C	*	.	H	α-helix	trans	-57.5	-45.8	179.5	-178.9	179.8	174.4	167.5	-1.5	111.9	F331 E337 A493	F331-R333 VanDerWaalsContact C-N 3.3Å; F331-R333 PolarHBondContact O-N 2.74Å; R333-E337 PolarHBondContact O-N 3.31Å; R333-A493 HydrophobicContact CB-CB 4.38Å
334	H	93.9	Very high	93.8	Very high	9 Å²	9	28.2 Å²	28.2	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-73.6	-33.3	-179.6	-64.9	-53.2	0	0	0	112.4	F331 D332 Y338 V510 I513 R514	F331-H334 PolarHBondContact O-N 2.73Å; D332-H334 VanDerWaalsContact C-N 3.32Å; D332-H334 PolarHBondContact O-N 3.41Å; H334-Y338 WeakPolarHBondContact O-CB 3.43Å; H334-Y338 PolarHBondContact O-N 2.7Å; H334-V510 WeakPolarHBondContact CD2-CG1 3.47Å; H334-I513 HydrophobicContact CB-CG2 4.27Å; H334-I513 WeakPolarHBondContact O-CG2 3.32Å; H334-R514 PolarHBondContact CE1-NE 2.95Å; H334-R514 VanDerWaalsContact CE1-NE 3.29Å; H334-R514 PolarHBondContact CE1-NH2 3.23Å; H334-R514 PolarHBondContact NE2-NH2 2.74Å
335	W	96.2	Very high	94	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-46	172.4	-179.6	-110.3	0	0	0	111.7	F136 I279 F331 D332 Y338 L339 T442 W446	F136-W335 HydrophobicContact CD1-CH2 4.24Å; F136-W335 AromaticContact CE1-CH2 3.64Å; F136-W335 HydrophobicContact CE1-CH2 3.64Å; F136-W335 HydrophobicContact CE1-CZ2 4.08Å; F136-W335 HydrophobicContact CE2-CH2 4.06Å; F136-W335 AromaticContact CE2-CZ2 3.8Å; F136-W335 HydrophobicContact CE2-CZ2 3.8Å; F136-W335 AromaticContact CZ-CH2 3.55Å; F136-W335 HydrophobicContact CZ-CH2 3.55Å; F136-W335 AromaticContact CZ-CZ2 3.48Å; F136-W335 HydrophobicContact CZ-CZ2 3.48Å; F136-W335 VanDerWaalsContact CZ-CZ2 3.48Å; I279-W335 HydrophobicContact CD1-CH2 3.19Å; I279-W335 HydrophobicContact CD1-CZ2 3.74Å; I279-W335 HydrophobicContact CD1-CZ3 3.84Å; I279-W335 HydrophobicContact CG1-CH2 3.74Å; I279-W335 HydrophobicContact CG1-CZ2 4.34Å; I279-W335 HydrophobicContact CG1-CZ3 3.87Å; F331-W335 HydrophobicContact CD1-CB 4.04Å; F331-W335 HydrophobicContact CE1-CB 3.73Å; F331-W335 HydrophobicContact CE1-CD2 4.08Å; F331-W335 AromaticContact CE1-CE3 3.85Å; F331-W335 HydrophobicContact CE1-CE3 3.85Å; F331-W335 HydrophobicContact CE1-CG 4.05Å; F331-W335 HydrophobicContact CZ-CB 4.25Å; F331-W335 HydrophobicContact CZ-CD2 4.45Å; F331-W335 AromaticContact CZ-CE3 3.79Å; F331-W335 HydrophobicContact CZ-CE3 3.79Å; F331-W335 PolarHBondContact O-N 3.35Å; D332-W335 WeakPolarHBondContact O-CB 3.42Å; D332-W335 PolarHBondContact O-N 2.66Å; W335-Y338 HydrophobicContact CD2-CD1 4.36Å; W335-Y338 AromaticContact CE3-CD1 3.72Å; W335-Y338 HydrophobicContact CE3-CD1 3.72Å; W335-Y338 HydrophobicContact CE3-CE1 4.14Å; W335-Y338 HydrophobicContact CH2-CD1 4.08Å; W335-Y338 AromaticContact CH2-CE1 3.7Å; W335-Y338 HydrophobicContact CH2-CE1 3.7Å; W335-Y338 AromaticContact CZ3-CD1 3.58Å; W335-Y338 HydrophobicContact CZ3-CD1 3.58Å; W335-Y338 AromaticContact CZ3-CE1 3.49Å; W335-Y338 HydrophobicContact CZ3-CE1 3.49Å; W335-Y338 VanDerWaalsContact CZ3-CE1 3.49Å; W335-Y338 WeakPolarHBondContact O-CB 3.41Å; W335-Y338 PolarHBondContact O-N 3.43Å; W335-L339 HydrophobicContact CD2-CG 4.41Å; W335-L339 HydrophobicContact CH2-CD2 4.28Å; W335-L339 HydrophobicContact CZ2-CD1 4.35Å; W335-L339 HydrophobicContact CZ2-CD2 3.75Å; W335-L339 HydrophobicContact CZ2-CG 4.18Å; W335-L339 WeakPolarHBondContact O-CG 3.49Å; W335-L339 PolarHBondContact O-N 3.04Å; W335-T442 PolarHBondContact NE1-O 3.11Å; W335-W446 AromaticContact CD1-CD1 3.85Å; W335-W446 AromaticContact CD1-NE1 3.54Å; W335-W446 AromaticContact CG-NE1 3.57Å; W335-W446 AromaticContact NE1-NE1 3.95Å
336	N	96	Very high	94.1	Very high	31 Å²	31	27.3 Å²	27.3	17%	0.166	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-44.2	178.5	-66.7	-40.4	0	0	0	112	D332 Y338 L339 E340 K443 G444	D332-N336 VanDerWaalsContact O-CG 3.27Å; D332-N336 PolarHBondContact O-N 2.99Å; D332-N336 PolarHBondContact O-ND2 3.35Å; D332-N336 PolarHBondContact OD2-ND2 3.06Å; N336-Y338 VanDerWaalsContact C-N 3.29Å; N336-Y338 PolarHBondContact O-N 2.92Å; N336-L339 PolarHBondContact O-N 3.4Å; N336-E340 WeakPolarHBondContact O-CG 3.37Å; N336-E340 PolarHBondContact O-N 3.32Å; N336-K443 VanDerWaalsContact OD1-CA 3.24Å; N336-K443 WeakPolarHBondContact OD1-CA 3.27Å; N336-G444 PolarHBondContact OD1-N 3.14Å
337	E	95.8	Very high	94.5	Very high	65 Å²	65	29.2 Å²	29.2	30%	0.304	14%	0.138	S	C	.	.	H	α-helix	trans	-61.4	-38.6	175.4	-175	-178.2	-175.4	0	0	112	R333 S341 V517 K521	R333-E337 PolarHBondContact O-N 3.31Å; E337-S341 WeakPolarHBondContact O-CB 3.25Å; E337-S341 PolarHBondContact O-N 3.05Å; E337-S341 PolarHBondContact O-OG 2.63Å; E337-V517 HydrophobicContact CG-CG1 4.12Å; E337-V517 HydrophobicContact CG-CG2 4.47Å; E337-K521 IonicContact OE1-NZ 2.99Å; E337-K521 PolarHBondContact OE1-NZ 2.75Å
338	Y	97.9	Very high	94.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-49.7	173.2	161.5	-97.4	0	0	0	112.7	F136 A271 H334 W335 N336 E340 S341 L342 I513 T516 L520	F136-Y338 HydrophobicContact CE1-CE1 4.34Å; A271-Y338 HydrophobicContact CB-CE2 4.26Å; A271-Y338 PolarHBondContact O-OH 2.89Å; H334-Y338 WeakPolarHBondContact O-CB 3.43Å; H334-Y338 PolarHBondContact O-N 2.7Å; W335-Y338 HydrophobicContact CD2-CD1 4.36Å; W335-Y338 AromaticContact CE3-CD1 3.72Å; W335-Y338 HydrophobicContact CE3-CD1 3.72Å; W335-Y338 HydrophobicContact CE3-CE1 4.14Å; W335-Y338 HydrophobicContact CH2-CD1 4.08Å; W335-Y338 AromaticContact CH2-CE1 3.7Å; W335-Y338 HydrophobicContact CH2-CE1 3.7Å; W335-Y338 AromaticContact CZ3-CD1 3.58Å; W335-Y338 HydrophobicContact CZ3-CD1 3.58Å; W335-Y338 AromaticContact CZ3-CE1 3.49Å; W335-Y338 HydrophobicContact CZ3-CE1 3.49Å; W335-Y338 VanDerWaalsContact CZ3-CE1 3.49Å; W335-Y338 WeakPolarHBondContact O-CB 3.41Å; W335-Y338 PolarHBondContact O-N 3.43Å; N336-Y338 VanDerWaalsContact C-N 3.29Å; N336-Y338 PolarHBondContact O-N 2.92Å; Y338-E340 VanDerWaalsContact C-N 3.28Å; Y338-E340 PolarHBondContact O-N 3.09Å; Y338-S341 PolarHBondContact O-N 3.17Å; Y338-L342 HydrophobicContact CE1-CD2 4.12Å; Y338-L342 WeakPolarHBondContact O-CB 3.43Å; Y338-L342 PolarHBondContact O-N 2.92Å; Y338-I513 HydrophobicContact CD1-CD1 4.45Å; Y338-I513 HydrophobicContact CD2-CD1 4.15Å; Y338-I513 HydrophobicContact CG-CD1 4.12Å; Y338-I513 HydrophobicContact CG-CG2 4.25Å; Y338-T516 HydrophobicContact CD2-CG2 4.11Å; Y338-T516 HydrophobicContact CE2-CG2 3.86Å; Y338-L520 HydrophobicContact CD2-CD1 4.38Å; Y338-L520 HydrophobicContact CE2-CD1 4.49Å
339	L	97.4	Very high	94.8	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-42.2	177.6	-71.6	-179.6	0	0	0	111.5	F136 W335 N336 L342 L343 A439 T442 K443	F136-L339 HydrophobicContact CE1-CD2 4.39Å; F136-L339 HydrophobicContact CZ-CD2 3.79Å; W335-L339 HydrophobicContact CD2-CG 4.41Å; W335-L339 HydrophobicContact CH2-CD2 4.28Å; W335-L339 HydrophobicContact CZ2-CD1 4.35Å; W335-L339 HydrophobicContact CZ2-CD2 3.75Å; W335-L339 HydrophobicContact CZ2-CG 4.18Å; W335-L339 WeakPolarHBondContact O-CG 3.49Å; W335-L339 PolarHBondContact O-N 3.04Å; N336-L339 PolarHBondContact O-N 3.4Å; L339-L342 PolarHBondContact O-N 3.16Å; L339-L343 WeakPolarHBondContact O-CB 3.41Å; L339-L343 WeakPolarHBondContact O-CG 3.4Å; L339-L343 PolarHBondContact O-N 3.16Å; L339-A439 HydrophobicContact CD2-CB 4.36Å; L339-T442 WeakPolarHBondContact CD1-OG1 3.43Å; L339-K443 HydrophobicContact CD1-CG 3.87Å
340	E	97.3	Very high	95	Very high	102 Å²	102	32.6 Å²	32.6	48%	0.477	15%	0.148	S	C	.	.	H	α-helix	trans	-62.5	-47.6	177.9	-74.9	172.5	-177.1	0	0	112.1	N336 Y338 L342 L343 Q344 K443	N336-E340 WeakPolarHBondContact O-CG 3.37Å; N336-E340 PolarHBondContact O-N 3.32Å; Y338-E340 VanDerWaalsContact C-N 3.28Å; Y338-E340 PolarHBondContact O-N 3.09Å; E340-L342 VanDerWaalsContact C-N 3.3Å; E340-L342 PolarHBondContact O-N 3.49Å; E340-L343 PolarHBondContact O-N 3.33Å; E340-Q344 VanDerWaalsContact O-CB 3.32Å; E340-Q344 WeakPolarHBondContact O-CB 3.22Å; E340-Q344 PolarHBondContact O-N 2.9Å; E340-K443 IonicContact OE1-NZ 3.15Å; E340-K443 PolarHBondContact OE1-NZ 3.2Å
341	S	97.9	Very high	95.1	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-36	178.1	-56.4	0	0	0	0	112	E337 Y338 L345	E337-S341 WeakPolarHBondContact O-CB 3.25Å; E337-S341 PolarHBondContact O-N 3.05Å; E337-S341 PolarHBondContact O-OG 2.63Å; Y338-S341 PolarHBondContact O-N 3.17Å; S341-L345 PolarHBondContact O-N 3.31Å
342	L	97.8	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-48.5	178.3	-179.8	75.1	0	0	0	111.2	F268 A271 L272 Y338 L339 E340 Q344 L345 L346 M435 L520	F268-L342 HydrophobicContact CD2-CD1 3.67Å; F268-L342 HydrophobicContact CD2-CG 4.39Å; F268-L342 HydrophobicContact CE2-CD1 3.61Å; F268-L342 HydrophobicContact CE2-CG 3.91Å; A271-L342 HydrophobicContact CB-CD1 3.77Å; L272-L342 HydrophobicContact CD2-CD1 4.23Å; L272-L342 HydrophobicContact CD2-CD2 3.79Å; L272-L342 HydrophobicContact CG-CD1 4.25Å; Y338-L342 HydrophobicContact CE1-CD2 4.12Å; Y338-L342 WeakPolarHBondContact O-CB 3.43Å; Y338-L342 PolarHBondContact O-N 2.92Å; L339-L342 PolarHBondContact O-N 3.16Å; E340-L342 VanDerWaalsContact C-N 3.3Å; E340-L342 PolarHBondContact O-N 3.49Å; L342-Q344 VanDerWaalsContact C-N 3.32Å; L342-Q344 PolarHBondContact O-N 3.35Å; L342-L345 PolarHBondContact O-N 3.21Å; L342-L346 PolarHBondContact O-N 3.12Å; L342-M435 HydrophobicContact CD2-CE 3.88Å; L342-L520 HydrophobicContact CB-CD1 4.28Å; L342-L520 HydrophobicContact CD1-CD2 4.49Å
343	L	97.5	Very high	94.8	Very high	18 Å²	18	40.1 Å²	40.1	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-36	178.9	-69.4	176.1	0	0	0	111.5	L339 E340 L345 L346 D347 K436 A439 I440	L339-L343 WeakPolarHBondContact O-CB 3.41Å; L339-L343 WeakPolarHBondContact O-CG 3.4Å; L339-L343 PolarHBondContact O-N 3.16Å; E340-L343 PolarHBondContact O-N 3.33Å; L343-L345 VanDerWaalsContact C-N 3.33Å; L343-L345 PolarHBondContact O-N 3.5Å; L343-L346 HydrophobicContact CD2-CD2 4.19Å; L343-L346 WeakPolarHBondContact O-CB 3.44Å; L343-L346 PolarHBondContact O-N 3.47Å; L343-L346 VanDerWaalsContact O-N 3.15Å; L343-D347 PolarHBondContact O-N 3.12Å; L343-K436 HydrophobicContact CD2-CG 3.91Å; L343-A439 HydrophobicContact CD2-CB 4.31Å; L343-I440 HydrophobicContact CD1-CG1 3.84Å
344	Q	96.7	Very high	94.8	Very high	100 Å²	100	34 Å²	34	47%	0.467	18%	0.179	S	C	.	.	H	α-helix	trans	-63.7	-37.6	174.2	-169	-178.9	33.6	0	0	112.4	E340 L342 R348 M524	E340-Q344 VanDerWaalsContact O-CB 3.32Å; E340-Q344 WeakPolarHBondContact O-CB 3.22Å; E340-Q344 PolarHBondContact O-N 2.9Å; L342-Q344 VanDerWaalsContact C-N 3.32Å; L342-Q344 PolarHBondContact O-N 3.35Å; Q344-R348 WeakPolarHBondContact O-CG 3.39Å; Q344-R348 PolarHBondContact O-N 3.3Å; Q344-M524 HydrophobicContact CB-CE 4.27Å; Q344-M524 HydrophobicContact CB-SD 3.74Å; Q344-M524 HydrophobicContact CG-CE 4.33Å; Q344-M524 HydrophobicContact CG-SD 3.51Å; Q344-M524 VanDerWaalsContact CG-SD 3.51Å; Q344-M524 PolarHBondContact OE1-SD 3.34Å; Q344-M524 VanDerWaalsContact OE1-SD 3.38Å
345	L	96.1	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-70.5	-35.7	173.4	-175.6	61.7	0	0	0	111.4	A264 T267 F268 S341 L342 L343 R348 L349 L520 V523 M524	A264-L345 HydrophobicContact CB-CD1 3.97Å; T267-L345 HydrophobicContact CG2-CD2 4.33Å; F268-L345 HydrophobicContact CB-CD2 3.94Å; S341-L345 PolarHBondContact O-N 3.31Å; L342-L345 PolarHBondContact O-N 3.21Å; L343-L345 VanDerWaalsContact C-N 3.33Å; L343-L345 PolarHBondContact O-N 3.5Å; L345-R348 WeakPolarHBondContact O-CB 3.45Å; L345-R348 PolarHBondContact O-N 3.3Å; L345-L349 PolarHBondContact O-N 2.9Å; L345-L520 HydrophobicContact CB-CD2 4.13Å; L345-L520 HydrophobicContact CD2-CD2 3.4Å; L345-L520 HydrophobicContact CG-CD2 4.41Å; L345-V523 HydrophobicContact CD1-CG1 4.3Å; L345-M524 HydrophobicContact CB-CG 4.42Å; L345-M524 HydrophobicContact CB-SD 4.15Å; L345-M524 HydrophobicContact CD1-CG 3.95Å
346	L	96.9	Very high	94.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-45.6	174.8	-175.3	55.4	0	0	0	111.7	F143 F268 L342 L343 R348 L349 E350 A432 M435 K436	F143-L346 HydrophobicContact CE1-CD1 4.17Å; F143-L346 HydrophobicContact CZ-CD1 3.97Å; F268-L346 HydrophobicContact CD2-CB 4.49Å; F268-L346 HydrophobicContact CE1-CD1 4.15Å; F268-L346 HydrophobicContact CE2-CB 3.77Å; F268-L346 HydrophobicContact CE2-CD1 4.01Å; F268-L346 HydrophobicContact CE2-CD2 4.43Å; F268-L346 HydrophobicContact CE2-CG 4.28Å; F268-L346 HydrophobicContact CZ-CB 4.23Å; F268-L346 HydrophobicContact CZ-CD1 3.64Å; F268-L346 HydrophobicContact CZ-CD2 4.2Å; F268-L346 HydrophobicContact CZ-CG 4.24Å; L342-L346 PolarHBondContact O-N 3.12Å; L343-L346 HydrophobicContact CD2-CD2 4.19Å; L343-L346 WeakPolarHBondContact O-CB 3.44Å; L343-L346 PolarHBondContact O-N 3.47Å; L343-L346 VanDerWaalsContact O-N 3.15Å; L346-R348 PolarHBondContact O-N 3.34Å; L346-L349 CarbonylContact O-C 3.57Å; L346-L349 WeakPolarHBondContact O-CA 3.44Å; L346-L349 WeakPolarHBondContact O-CB 3.3Å; L346-L349 PolarHBondContact O-N 3.18Å; L346-E350 PolarHBondContact O-N 3.14Å; L346-A432 HydrophobicContact CD1-CB 3.63Å; L346-A432 HydrophobicContact CD2-CB 4.14Å; L346-A432 HydrophobicContact CG-CB 3.93Å; L346-M435 HydrophobicContact CD2-CB 4.05Å; L346-M435 HydrophobicContact CD2-CG 4.02Å; L346-K436 HydrophobicContact CD2-CG 4.09Å
347	D	95.3	Very high	94.4	Very high	82 Å²	82	36 Å²	36	44%	0.439	20%	0.195	S	C	.	.	H	α-helix	trans	-57.7	-36.1	175.2	-67.7	-35.5	0	0	0	111.9	L343 E350 G351 K436	L343-D347 PolarHBondContact O-N 3.12Å; D347-E350 PolarHBondContact O-N 2.91Å; D347-G351 PolarHBondContact O-N 2.98Å; D347-G351 VanDerWaalsContact O-N 3.08Å; D347-K436 WeakPolarHBondContact OD1-CE 3.49Å; D347-K436 IonicContact OD1-NZ 3.78Å; D347-K436 PolarHBondContact OD1-NZ 3.5Å
348	R	93.5	Very high	94.3	Very high	67 Å²	67	33.2 Å²	33.2	25%	0.253	18%	0.183	S	C	.	.	H	α-helix	trans	-72.8	-33	175.8	-68.1	173	176.2	-133.7	11.8	112.8	Q344 L345 L346 G351 P352 Y353 M524	Q344-R348 WeakPolarHBondContact O-CG 3.39Å; Q344-R348 PolarHBondContact O-N 3.3Å; L345-R348 WeakPolarHBondContact O-CB 3.45Å; L345-R348 PolarHBondContact O-N 3.3Å; L346-R348 PolarHBondContact O-N 3.34Å; R348-G351 CarbonylContact O-C 3.49Å; R348-G351 VanDerWaalsContact O-C 3.32Å; R348-G351 PolarHBondContact O-N 2.85Å; R348-P352 WeakPolarHBondContact O-CD 3.45Å; R348-Y353 HydrophobicContact CB-CD2 3.7Å; R348-Y353 HydrophobicContact CB-CE2 4.06Å; R348-Y353 HydrophobicContact CB-CG 4.33Å; R348-Y353 HydrophobicContact CG-CE2 4.39Å; R348-Y353 PolarHBondContact NH1-OH 3.09Å; R348-Y353 WeakPolarHBondContact O-CA 3.2Å; R348-Y353 WeakPolarHBondContact O-CB 3.29Å; R348-Y353 PolarHBondContact O-N 3.35Å; R348-M524 VanDerWaalsContact CZ-O 3.28Å; R348-M524 VanDerWaalsContact NH1-CA 3.33Å; R348-M524 PolarHBondContact NH1-O 3.49Å; R348-M524 PolarHBondContact NH2-O 2.93Å
349	L	93.8	Very high	94.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-68.9	-34.1	172.9	-78.3	171.8	0	0	0	111.9	A264 A265 F268 L345 L346 G351 N354 M428	A264-L349 HydrophobicContact CB-CD2 3.65Å; A264-L349 HydrophobicContact CB-CG 4.22Å; A265-L349 HydrophobicContact CB-CD2 4.24Å; F268-L349 HydrophobicContact CB-CD1 3.59Å; F268-L349 HydrophobicContact CD1-CD1 3.91Å; F268-L349 HydrophobicContact CD2-CD1 4.12Å; F268-L349 HydrophobicContact CG-CD1 3.6Å; L345-L349 PolarHBondContact O-N 2.9Å; L346-L349 CarbonylContact O-C 3.57Å; L346-L349 WeakPolarHBondContact O-CA 3.44Å; L346-L349 WeakPolarHBondContact O-CB 3.3Å; L346-L349 PolarHBondContact O-N 3.18Å; L349-G351 VanDerWaalsContact C-N 3.32Å; L349-N354 WeakPolarHBondContact O-CA 3.49Å; L349-N354 VanDerWaalsContact O-CB 3.22Å; L349-N354 WeakPolarHBondContact O-CB 3.46Å; L349-N354 PolarHBondContact O-N 3.01Å; L349-M428 HydrophobicContact CB-SD 4.2Å; L349-M428 WeakPolarHBondContact O-CE 3.25Å
350	E	91.9	Very high	93.9	Very high	47 Å²	47	34.6 Å²	34.6	22%	0.22	19%	0.19	C	C	.	.	H	α-helix	trans	-68.5	-34.8	170.4	-73.2	162.8	101.1	0	0	111.4	L346 D347 N354 A432 K436	L346-E350 PolarHBondContact O-N 3.14Å; D347-E350 PolarHBondContact O-N 2.91Å; E350-N354 PolarHBondContact O-ND2 2.89Å; E350-A432 HydrophobicContact CG-CB 3.51Å; E350-A432 WeakPolarHBondContact OE1-CB 3.35Å; E350-K436 VanDerWaalsContact CD-NZ 3.3Å; E350-K436 IonicContact OE1-NZ 2.83Å; E350-K436 PolarHBondContact OE1-NZ 3.26Å; E350-K436 VanDerWaalsContact OE2-CE 3.31Å; E350-K436 WeakPolarHBondContact OE2-CE 3.16Å; E350-K436 IonicContact OE2-NZ 3.67Å; E350-K436 PolarHBondContact OE2-NZ 2.91Å
351	G	89.8	Confident	93.8	Very high	37 Å²	37	31.4 Å²	31.4	38%	0.381	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-115.5	-179.1	0	0	0	0	0	115.1	D347 R348 L349 Y353 N354	D347-G351 PolarHBondContact O-N 2.98Å; D347-G351 VanDerWaalsContact O-N 3.08Å; R348-G351 CarbonylContact O-C 3.49Å; R348-G351 VanDerWaalsContact O-C 3.32Å; R348-G351 PolarHBondContact O-N 2.85Å; L349-G351 VanDerWaalsContact C-N 3.32Å; G351-Y353 VanDerWaalsContact C-N 3.27Å; G351-Y353 PolarHBondContact O-N 2.78Å; G351-N354 WeakPolarHBondContact O-CB 3.43Å; G351-N354 PolarHBondContact O-N 3.16Å
352	P	87.4	Confident	93.7	Very high	104 Å²	104	31.1 Å²	31.1	68%	0.675	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.6	-165.3	27.8	-37.6	0	0	0	115.5	R348	R348-P352 WeakPolarHBondContact O-CD 3.45Å
353	Y	90.5	Very high	93.6	Very high	27 Å²	27	31.8 Å²	31.8	11%	0.106	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	18.2	-179.9	-53.3	-19.4	0	0	0	111.9	K260 A261 A264 R348 G351 I355	K260-Y353 HydrophobicContact CB-CD1 3.94Å; K260-Y353 HydrophobicContact CB-CE1 4.27Å; K260-Y353 HydrophobicContact CB-CG 4.49Å; K260-Y353 HydrophobicContact CD-CD1 4.24Å; K260-Y353 HydrophobicContact CD-CE1 3.92Å; K260-Y353 HydrophobicContact CG-CD1 4.5Å; K260-Y353 HydrophobicContact CG-CE1 4.35Å; A261-Y353 WeakPolarHBondContact CA-O 3.4Å; A264-Y353 HydrophobicContact CB-CD2 3.87Å; A264-Y353 HydrophobicContact CB-CG 4.32Å; R348-Y353 HydrophobicContact CB-CD2 3.7Å; R348-Y353 HydrophobicContact CB-CE2 4.06Å; R348-Y353 HydrophobicContact CB-CG 4.33Å; R348-Y353 HydrophobicContact CG-CE2 4.39Å; R348-Y353 PolarHBondContact NH1-OH 3.09Å; R348-Y353 WeakPolarHBondContact O-CA 3.2Å; R348-Y353 WeakPolarHBondContact O-CB 3.29Å; R348-Y353 PolarHBondContact O-N 3.35Å; G351-Y353 VanDerWaalsContact C-N 3.27Å; G351-Y353 PolarHBondContact O-N 2.78Å; Y353-I355 PolarHBondContact O-N 3.44Å
354	N	92.1	Very high	93.5	Very high	18 Å²	18	34 Å²	34	10%	0.096	19%	0.191	C	C	.	.			trans	-57.9	108.9	179.7	-179.3	-40.4	0	0	0	111.5	L349 E350 G351 E356 S357 V358 M428	L349-N354 WeakPolarHBondContact O-CA 3.49Å; L349-N354 VanDerWaalsContact O-CB 3.22Å; L349-N354 WeakPolarHBondContact O-CB 3.46Å; L349-N354 PolarHBondContact O-N 3.01Å; E350-N354 PolarHBondContact O-ND2 2.89Å; G351-N354 WeakPolarHBondContact O-CB 3.43Å; G351-N354 PolarHBondContact O-N 3.16Å; N354-E356 VanDerWaalsContact C-N 3.29Å; N354-E356 PolarHBondContact O-N 2.98Å; N354-E356 WeakPolarHBondContact OD1-CA 3.48Å; N354-E356 VanDerWaalsContact OD1-CB 3.31Å; N354-E356 WeakPolarHBondContact OD1-CB 3.35Å; N354-E356 PolarHBondContact OD1-N 3.26Å; N354-S357 PolarHBondContact O-N 3.39Å; N354-S357 PolarHBondContact O-OG 3.29Å; N354-S357 PolarHBondContact OD1-N 3.02Å; N354-V358 PolarHBondContact O-N 3.21Å; N354-M428 HydrophobicContact CB-CE 3.9Å; N354-M428 VanDerWaalsContact ND2-CE 3.25Å; N354-M428 WeakPolarHBondContact ND2-CE 3.31Å; N354-M428 WeakPolarHBondContact OD1-CE 3.5Å
355	I	93.2	Very high	93.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.8	-31	-177.4	-170.4	170.1	0	0	0	112.5	F147 L150 A261 F262 A265 Y353 S357 V358 I359 M428	F147-I355 HydrophobicContact CD1-CD1 4.38Å; F147-I355 HydrophobicContact CD1-CG2 3.68Å; F147-I355 HydrophobicContact CE1-CG2 3.44Å; F147-I355 VanDerWaalsContact CE1-CG2 3.44Å; L150-I355 HydrophobicContact CD2-CB 4.4Å; L150-I355 HydrophobicContact CD2-CG1 4.08Å; L150-I355 HydrophobicContact CD2-CG2 3.76Å; A261-I355 HydrophobicContact CB-CB 4.19Å; A261-I355 HydrophobicContact CB-CG1 4.37Å; F262-I355 HydrophobicContact CD2-CD1 4.35Å; F262-I355 HydrophobicContact CE2-CD1 4.29Å; F262-I355 HydrophobicContact CE2-CG1 4.43Å; A265-I355 HydrophobicContact CB-CD1 4.09Å; Y353-I355 PolarHBondContact O-N 3.44Å; I355-S357 VanDerWaalsContact C-N 3.33Å; I355-S357 PolarHBondContact O-N 3.22Å; I355-V358 PolarHBondContact O-N 2.88Å; I355-I359 HydrophobicContact CG1-CG1 3.93Å; I355-I359 WeakPolarHBondContact O-CB 3.33Å; I355-I359 PolarHBondContact O-N 3.07Å; I355-M428 HydrophobicContact CG2-CE 4.39Å; I355-M428 HydrophobicContact CG2-SD 4.43Å
356	E	92.7	Very high	93.6	Very high	14 Å²	14	30.8 Å²	30.8	7%	0.065	18%	0.176	C	C	.	.	H	α-helix	trans	-63.7	-42	174.4	-66.9	-176.8	89.5	0	0	111	F146 L150 N354 V358 N360 T426 S427 M428	F146-E356 HydrophobicContact CE2-CG 4.25Å; F146-E356 HydrophobicContact CZ-CG 3.54Å; F146-E356 VanDerWaalsContact CZ-OE2 3.3Å; F146-E356 WeakPolarHBondContact CZ-OE2 3.21Å; L150-E356 HydrophobicContact CD1-CG 3.96Å; L150-E356 HydrophobicContact CD2-CB 4.49Å; L150-E356 HydrophobicContact CD2-CG 3.76Å; N354-E356 VanDerWaalsContact C-N 3.29Å; N354-E356 PolarHBondContact O-N 2.98Å; N354-E356 WeakPolarHBondContact OD1-CA 3.48Å; N354-E356 VanDerWaalsContact OD1-CB 3.31Å; N354-E356 WeakPolarHBondContact OD1-CB 3.35Å; N354-E356 PolarHBondContact OD1-N 3.26Å; E356-V358 PolarHBondContact O-N 2.69Å; E356-N360 WeakPolarHBondContact O-CB 3.1Å; E356-N360 PolarHBondContact O-N 3.32Å; E356-N360 PolarHBondContact O-ND2 3.02Å; E356-T426 WeakPolarHBondContact OE2-CB 2.93Å; E356-T426 PolarHBondContact OE2-OG1 2.86Å; E356-S427 PolarHBondContact OE1-OG 2.8Å; E356-M428 HydrophobicContact CB-CE 4.32Å; E356-M428 HydrophobicContact CG-CE 4.11Å; E356-M428 WeakPolarHBondContact OE2-CB 3.27Å; E356-M428 PolarHBondContact OE2-N 3.41Å
357	S	92.1	Very high	93.5	Very high	68 Å²	68	31 Å²	31	48%	0.476	18%	0.177	S	C	.	.	H	α-helix	trans	-64.8	-21	177.9	78.9	0	0	0	0	113.6	N354 I355 P361	N354-S357 PolarHBondContact O-N 3.39Å; N354-S357 PolarHBondContact O-OG 3.29Å; N354-S357 PolarHBondContact OD1-N 3.02Å; I355-S357 VanDerWaalsContact C-N 3.33Å; I355-S357 PolarHBondContact O-N 3.22Å; S357-P361 WeakPolarHBondContact O-CD 3.35Å; S357-P361 WeakPolarHBondContact O-CG 3.49Å
358	V	93.3	Very high	93.6	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.036	18%	0.176	C	C	.	.	H	α-helix	trans	-96.4	-41.6	178.9	178.5	0	0	0	0	112	Q257 V258 A261 N354 I355 E356	Q257-V358 HydrophobicContact CB-CG1 4Å; Q257-V358 HydrophobicContact CB-CG2 3.94Å; V258-V358 HydrophobicContact CB-CG1 4.44Å; V258-V358 HydrophobicContact CG2-CG1 3.67Å; A261-V358 HydrophobicContact CB-CB 4.24Å; A261-V358 HydrophobicContact CB-CG2 3.93Å; N354-V358 PolarHBondContact O-N 3.21Å; I355-V358 PolarHBondContact O-N 2.88Å; E356-V358 PolarHBondContact O-N 2.69Å
359	I	94.4	Very high	93.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-89	-31.1	-173.5	-72.3	-53.3	0	0	0	113.5	L150 L151 S154 L184 F262 I355 I362	L150-I359 HydrophobicContact CD1-CG2 4.45Å; L150-I359 HydrophobicContact CD2-CB 4.43Å; L150-I359 HydrophobicContact CD2-CG2 4.46Å; L150-I359 HydrophobicContact CG-CB 4.45Å; L150-I359 HydrophobicContact CG-CG2 3.98Å; L151-I359 HydrophobicContact CD2-CD1 4.34Å; L151-I359 HydrophobicContact CD2-CG1 4.23Å; L151-I359 HydrophobicContact CD2-CG2 4.26Å; S154-I359 WeakPolarHBondContact OG-CG2 3.49Å; S154-I359 PolarHBondContact OG-O 3.2Å; L184-I359 HydrophobicContact CD1-CD1 4.41Å; F262-I359 HydrophobicContact CE2-CD1 3.52Å; F262-I359 HydrophobicContact CE2-CG1 3.69Å; F262-I359 HydrophobicContact CZ-CD1 3.66Å; F262-I359 HydrophobicContact CZ-CG1 3.92Å; I355-I359 HydrophobicContact CG1-CG1 3.93Å; I355-I359 WeakPolarHBondContact O-CB 3.33Å; I355-I359 PolarHBondContact O-N 3.07Å; I359-I362 HydrophobicContact CD1-CD1 4Å; I359-I362 WeakPolarHBondContact O-CB 3.27Å; I359-I362 WeakPolarHBondContact O-CG2 3.49Å; I359-I362 PolarHBondContact O-N 3.45Å
360	N	92.6	Very high	93.8	Very high	29 Å²	29	28.8 Å²	28.8	16%	0.155	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-37.1	177.2	-73.9	-32.6	0	0	0	114.8	L150 E356 R419	L150-N360 VanDerWaalsContact CD1-OD1 3.29Å; L150-N360 WeakPolarHBondContact CD1-OD1 3.41Å; E356-N360 WeakPolarHBondContact O-CB 3.1Å; E356-N360 PolarHBondContact O-N 3.32Å; E356-N360 PolarHBondContact O-ND2 3.02Å; N360-R419 PolarHBondContact O-NH1 3.28Å; N360-R419 PolarHBondContact OD1-NH1 3.24Å; N360-R419 PolarHBondContact OD1-NH2 3.28Å
361	P	94.3	Very high	93.9	Very high	36 Å²	36	29 Å²	29	23%	0.234	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	11.2	178.4	36.3	-36.6	0	0	0	113.9	S357 D363 I364 Q365	S357-P361 WeakPolarHBondContact O-CD 3.35Å; S357-P361 WeakPolarHBondContact O-CG 3.49Å; P361-D363 VanDerWaalsContact C-N 3.26Å; P361-D363 PolarHBondContact O-N 3.35Å; P361-I364 PolarHBondContact O-N 3.18Å; P361-I364 VanDerWaalsContact O-N 3.15Å; P361-Q365 WeakPolarHBondContact O-CG 3.35Å; P361-Q365 PolarHBondContact O-N 3.01Å
362	I	95.5	Very high	94.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.8	-36.9	-174.2	-171.4	154.4	0	0	0	113	S154 F181 L184 M254 I359 Q365 I366	S154-I362 WeakPolarHBondContact OG-CG2 3.48Å; F181-I362 HydrophobicContact CE1-CG2 4.44Å; F181-I362 HydrophobicContact CZ-CG2 3.74Å; L184-I362 HydrophobicContact CD1-CD1 4.2Å; M254-I362 HydrophobicContact CE-CB 4.4Å; M254-I362 HydrophobicContact CE-CD1 3.2Å; M254-I362 HydrophobicContact CE-CG1 3.26Å; I359-I362 HydrophobicContact CD1-CD1 4Å; I359-I362 WeakPolarHBondContact O-CB 3.27Å; I359-I362 WeakPolarHBondContact O-CG2 3.49Å; I359-I362 PolarHBondContact O-N 3.45Å; I362-Q365 PolarHBondContact O-N 3.36Å; I362-I366 HydrophobicContact CG1-CD1 3.74Å; I362-I366 HydrophobicContact CG1-CG1 4.35Å; I362-I366 WeakPolarHBondContact O-CB 3.23Å; I362-I366 WeakPolarHBondContact O-CD1 3.4Å; I362-I366 WeakPolarHBondContact O-CG1 3.38Å; I362-I366 PolarHBondContact O-N 3.49Å
363	D	95.5	Very high	94.6	Very high	13 Å²	13	24.4 Å²	24.4	7%	0.07	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-47.2	175.4	55.1	-13.6	0	0	0	111.3	L158 M161 F162 P361 I366 S367	L158-D363 HydrophobicContact CB-CB 3.85Å; L158-D363 HydrophobicContact CD1-CB 4.23Å; L158-D363 HydrophobicContact CG-CB 4.02Å; M161-D363 HydrophobicContact CE-CB 3.79Å; M161-D363 VanDerWaalsContact CE-CG 3.43Å; M161-D363 VanDerWaalsContact CE-OD2 3.26Å; M161-D363 WeakPolarHBondContact CE-OD2 3.35Å; M161-D363 HydrophobicContact SD-CB 4.15Å; F162-D363 HydrophobicContact CE2-CB 4.32Å; F162-D363 WeakPolarHBondContact CE2-O 3.35Å; P361-D363 VanDerWaalsContact C-N 3.26Å; P361-D363 PolarHBondContact O-N 3.35Å; D363-I366 PolarHBondContact O-N 3.42Å; D363-S367 VanDerWaalsContact O-CB 3.32Å; D363-S367 WeakPolarHBondContact O-CB 3.38Å; D363-S367 PolarHBondContact O-N 3.36Å
364	I	95.8	Very high	94.7	Very high	64 Å²	64	25.4 Å²	25.4	33%	0.328	14%	0.135	S	C	.	.	H	α-helix	trans	-63.8	-46	177	-59.9	172.6	0	0	0	110.1	M161 P361 I366 S367 E368 I416	M161-I364 HydrophobicContact CE-CB 4.32Å; M161-I364 HydrophobicContact CE-CG1 3.41Å; M161-I364 VanDerWaalsContact CE-CG1 3.41Å; P361-I364 PolarHBondContact O-N 3.18Å; P361-I364 VanDerWaalsContact O-N 3.15Å; I364-I366 PolarHBondContact O-N 3.09Å; I364-S367 WeakPolarHBondContact O-CB 3.43Å; I364-S367 PolarHBondContact O-N 2.96Å; I364-E368 WeakPolarHBondContact O-CB 3.14Å; I364-E368 PolarHBondContact O-N 3.41Å; I364-I416 HydrophobicContact CD1-CG2 4.16Å; I364-I416 HydrophobicContact CG1-CG2 4.32Å
365	Q	96.8	Very high	94.7	Very high	34 Å²	34	31.3 Å²	31.3	16%	0.159	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-42.9	-179.8	-70.8	-177.3	10.1	0	0	112.3	V250 P361 I362 S367 E368 A369	V250-Q365 HydrophobicContact CG1-CB 4.36Å; V250-Q365 WeakPolarHBondContact CG1-O 3.31Å; P361-Q365 WeakPolarHBondContact O-CG 3.35Å; P361-Q365 PolarHBondContact O-N 3.01Å; I362-Q365 PolarHBondContact O-N 3.36Å; Q365-S367 VanDerWaalsContact C-N 3.33Å; Q365-E368 PolarHBondContact O-N 3.49Å; Q365-A369 PolarHBondContact O-N 3.46Å
366	I	97.4	Very high	94.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66	-39.8	176.1	-68.8	169	0	0	0	110.3	L158 F162 F177 L180 F211 M254 I362 D363 I364 A369 I370	L158-I366 HydrophobicContact CD1-CD1 3.88Å; F162-I366 HydrophobicContact CE1-CG2 4.04Å; F162-I366 HydrophobicContact CZ-CB 4.13Å; F162-I366 HydrophobicContact CZ-CG2 3.73Å; F177-I366 HydrophobicContact CD1-CG2 4.35Å; F177-I366 HydrophobicContact CE1-CG2 3.71Å; L180-I366 HydrophobicContact CD2-CD1 3.84Å; F211-I366 HydrophobicContact CE1-CD1 4.1Å; F211-I366 HydrophobicContact CE1-CG1 4.12Å; F211-I366 HydrophobicContact CE1-CG2 4.48Å; F211-I366 HydrophobicContact CZ-CD1 3.8Å; F211-I366 HydrophobicContact CZ-CG1 4.14Å; F211-I366 HydrophobicContact CZ-CG2 4Å; M254-I366 HydrophobicContact SD-CG1 4.43Å; I362-I366 HydrophobicContact CG1-CD1 3.74Å; I362-I366 HydrophobicContact CG1-CG1 4.35Å; I362-I366 WeakPolarHBondContact O-CB 3.23Å; I362-I366 WeakPolarHBondContact O-CD1 3.4Å; I362-I366 WeakPolarHBondContact O-CG1 3.38Å; I362-I366 PolarHBondContact O-N 3.49Å; D363-I366 PolarHBondContact O-N 3.42Å; I364-I366 PolarHBondContact O-N 3.09Å; I366-A369 WeakPolarHBondContact O-CB 3.44Å; I366-A369 PolarHBondContact O-N 2.98Å; I366-I370 HydrophobicContact CG2-CD1 4.13Å; I366-I370 WeakPolarHBondContact O-CG1 3.38Å; I366-I370 PolarHBondContact O-N 3.13Å
367	S	96	Very high	94.7	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-43.2	174.8	-164.2	0	0	0	0	111.6	Y166 D363 I364 Q365 A369 I370 M371	Y166-S367 PolarHBondContact OH-OG 3.31Å; D363-S367 VanDerWaalsContact O-CB 3.32Å; D363-S367 WeakPolarHBondContact O-CB 3.38Å; D363-S367 PolarHBondContact O-N 3.36Å; I364-S367 WeakPolarHBondContact O-CB 3.43Å; I364-S367 PolarHBondContact O-N 2.96Å; Q365-S367 VanDerWaalsContact C-N 3.33Å; S367-A369 PolarHBondContact O-N 3.44Å; S367-I370 WeakPolarHBondContact O-CB 3.24Å; S367-I370 PolarHBondContact O-N 3.18Å; S367-I370 VanDerWaalsContact O-N 3.12Å; S367-M371 WeakPolarHBondContact O-CG 3.29Å; S367-M371 PolarHBondContact O-N 3.01Å
368	E	96	Very high	94.7	Very high	91 Å²	91	38.4 Å²	38.4	43%	0.425	19%	0.187	S	C	.	.	H	α-helix	trans	-57.7	-45.4	173.8	-174.7	-173.6	173	0	0	112.2	V250 I364 Q365 I370 M371 I372	V250-E368 HydrophobicContact CG2-CG 4.4Å; I364-E368 WeakPolarHBondContact O-CB 3.14Å; I364-E368 PolarHBondContact O-N 3.41Å; Q365-E368 PolarHBondContact O-N 3.49Å; E368-I370 VanDerWaalsContact C-N 3.32Å; E368-I370 PolarHBondContact O-N 3.08Å; E368-M371 HydrophobicContact CB-CE 4.24Å; E368-M371 HydrophobicContact CG-CE 4.49Å; E368-M371 PolarHBondContact O-N 2.95Å; E368-I372 HydrophobicContact CG-CD1 4.18Å; E368-I372 WeakPolarHBondContact O-CG1 3.34Å; E368-I372 PolarHBondContact O-N 2.82Å
369	A	97.2	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-46.4	173.9	0	0	0	0	0	111.6	Y212 F247 V250 Q365 I366 S367 M371 I372 F373	Y212-A369 HydrophobicContact CE1-CB 4Å; F247-A369 HydrophobicContact CB-CB 3.97Å; F247-A369 HydrophobicContact CD1-CB 4.05Å; F247-A369 WeakPolarHBondContact CD1-O 3.24Å; F247-A369 HydrophobicContact CG-CB 4.26Å; V250-A369 HydrophobicContact CB-CB 4.12Å; V250-A369 HydrophobicContact CG1-CB 4.06Å; V250-A369 HydrophobicContact CG2-CB 4.46Å; Q365-A369 PolarHBondContact O-N 3.46Å; I366-A369 WeakPolarHBondContact O-CB 3.44Å; I366-A369 PolarHBondContact O-N 2.98Å; S367-A369 PolarHBondContact O-N 3.44Å; A369-M371 VanDerWaalsContact C-N 3.34Å; A369-M371 PolarHBondContact O-N 2.78Å; A369-I372 PolarHBondContact O-N 3.43Å; A369-F373 PolarHBondContact O-N 3.31Å; A369-F373 VanDerWaalsContact O-N 3.08Å
370	I	95.8	Very high	94.6	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-44	177.4	-70.8	169.1	0	0	0	110.8	F162 Y166 F177 L215 M219 I366 S367 E368 F373 Q374	F162-I370 HydrophobicContact CE1-CD1 3.82Å; F162-I370 HydrophobicContact CZ-CD1 4.31Å; Y166-I370 HydrophobicContact CE1-CG2 3.94Å; Y166-I370 HydrophobicContact CE2-CD1 4.44Å; Y166-I370 WeakPolarHBondContact OH-CG2 3.44Å; F177-I370 HydrophobicContact CZ-CD1 4.47Å; L215-I370 HydrophobicContact CD1-CD1 4.39Å; L215-I370 HydrophobicContact CD1-CG1 4.35Å; L215-I370 HydrophobicContact CD2-CG1 4.17Å; M219-I370 HydrophobicContact CE-CB 4.15Å; M219-I370 HydrophobicContact CE-CG1 4.31Å; M219-I370 HydrophobicContact CE-CG2 3.65Å; M219-I370 HydrophobicContact SD-CB 4.4Å; M219-I370 HydrophobicContact SD-CG1 3.94Å; M219-I370 HydrophobicContact SD-CG2 4.39Å; I366-I370 HydrophobicContact CG2-CD1 4.13Å; I366-I370 WeakPolarHBondContact O-CG1 3.38Å; I366-I370 PolarHBondContact O-N 3.13Å; S367-I370 WeakPolarHBondContact O-CB 3.24Å; S367-I370 PolarHBondContact O-N 3.18Å; S367-I370 VanDerWaalsContact O-N 3.12Å; E368-I370 VanDerWaalsContact C-N 3.32Å; E368-I370 PolarHBondContact O-N 3.08Å; I370-F373 WeakPolarHBondContact O-CB 3.48Å; I370-F373 PolarHBondContact O-N 2.86Å; I370-Q374 WeakPolarHBondContact O-CG 3.45Å; I370-Q374 PolarHBondContact O-N 2.9Å
371	M	94.3	Very high	94.6	Very high	53 Å²	53	40.5 Å²	40.5	26%	0.261	20%	0.196	S	C	.	.	H	α-helix	trans	-59.7	-48	176.6	-68	-169.5	-61.4	0	0	111.8	S367 E368 A369 F373 Q374 D375 F413	S367-M371 WeakPolarHBondContact O-CG 3.29Å; S367-M371 PolarHBondContact O-N 3.01Å; E368-M371 HydrophobicContact CB-CE 4.24Å; E368-M371 HydrophobicContact CG-CE 4.49Å; E368-M371 PolarHBondContact O-N 2.95Å; A369-M371 VanDerWaalsContact C-N 3.34Å; A369-M371 PolarHBondContact O-N 2.78Å; M371-F373 VanDerWaalsContact C-N 3.26Å; M371-F373 PolarHBondContact O-N 2.97Å; M371-Q374 PolarHBondContact O-N 3.35Å; M371-D375 PolarHBondContact O-N 3.49Å; M371-F413 HydrophobicContact CG-CE1 4.07Å; M371-F413 HydrophobicContact CG-CE2 4.07Å; M371-F413 HydrophobicContact CG-CZ 3.5Å; M371-F413 VanDerWaalsContact CG-CZ 3.5Å; M371-F413 HydrophobicContact SD-CD1 4.34Å; M371-F413 HydrophobicContact SD-CD2 4.23Å; M371-F413 HydrophobicContact SD-CE1 3.84Å; M371-F413 HydrophobicContact SD-CE2 3.72Å; M371-F413 HydrophobicContact SD-CZ 3.52Å; M371-F413 VanDerWaalsContact SD-CZ 3.52Å
372	I	96.2	Very high	94.6	Very high	41 Å²	41	42.8 Å²	42.8	21%	0.21	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-41.5	177.6	-67.2	164.2	0	0	0	111.2	V250 E368 A369 R376	V250-I372 HydrophobicContact CG2-CD1 3.87Å; E368-I372 HydrophobicContact CG-CD1 4.18Å; E368-I372 WeakPolarHBondContact O-CG1 3.34Å; E368-I372 PolarHBondContact O-N 2.82Å; A369-I372 PolarHBondContact O-N 3.43Å; I372-R376 WeakPolarHBondContact O-CB 3.46Å; I372-R376 PolarHBondContact O-N 3.09Å; I372-R376 VanDerWaalsContact O-N 3.13Å
373	F	95.7	Very high	94.5	Very high	3 Å²	3	47.6 Å²	47.6	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-63.5	-44	176.8	-174.5	-82.4	0	0	0	111.9	Y216 M219 F220 L223 P246 F247 A369 I370 M371 R376 G377 I380	Y216-F373 HydrophobicContact CD2-CD2 4.41Å; Y216-F373 AromaticContact CD2-CE2 3.49Å; Y216-F373 HydrophobicContact CD2-CE2 3.49Å; Y216-F373 VanDerWaalsContact CD2-CE2 3.49Å; Y216-F373 HydrophobicContact CD2-CZ 4.13Å; Y216-F373 AromaticContact CE2-CE2 3.66Å; Y216-F373 HydrophobicContact CE2-CE2 3.66Å; Y216-F373 HydrophobicContact CE2-CZ 4.17Å; M219-F373 HydrophobicContact CB-CD1 3.9Å; M219-F373 HydrophobicContact CB-CE1 3.67Å; M219-F373 HydrophobicContact CB-CG 4.4Å; M219-F373 HydrophobicContact CB-CZ 4.03Å; M219-F373 HydrophobicContact CE-CB 3.69Å; M219-F373 HydrophobicContact CE-CD1 3.45Å; M219-F373 VanDerWaalsContact CE-CD1 3.45Å; M219-F373 HydrophobicContact CE-CE1 4.34Å; M219-F373 HydrophobicContact CE-CG 3.72Å; M219-F373 HydrophobicContact SD-CB 4.11Å; M219-F373 HydrophobicContact SD-CD1 4.13Å; M219-F373 HydrophobicContact SD-CG 4.01Å; F220-F373 HydrophobicContact CB-CZ 4.35Å; L223-F373 HydrophobicContact CD2-CE1 4.27Å; P246-F373 HydrophobicContact CB-CD2 3.67Å; P246-F373 HydrophobicContact CB-CE2 3.78Å; P246-F373 WeakPolarHBondContact O-CA 3.5Å; F247-F373 HydrophobicContact CD1-CB 3.96Å; F247-F373 HydrophobicContact CD1-CD2 4.29Å; F247-F373 HydrophobicContact CE1-CB 3.87Å; F247-F373 AromaticContact CE1-CD2 3.82Å; F247-F373 HydrophobicContact CE1-CD2 3.82Å; F247-F373 HydrophobicContact CE1-CG 4.1Å; F247-F373 HydrophobicContact CZ-CD2 4.25Å; A369-F373 PolarHBondContact O-N 3.31Å; A369-F373 VanDerWaalsContact O-N 3.08Å; I370-F373 WeakPolarHBondContact O-CB 3.48Å; I370-F373 PolarHBondContact O-N 2.86Å; M371-F373 VanDerWaalsContact C-N 3.26Å; M371-F373 PolarHBondContact O-N 2.97Å; F373-R376 CarbonylContact O-C 3.32Å; F373-R376 PolarHBondContact O-N 3.46Å; F373-G377 WeakPolarHBondContact O-CA 3.39Å; F373-G377 PolarHBondContact O-N 3.41Å; F373-I380 HydrophobicContact CD2-CD1 3.83Å; F373-I380 HydrophobicContact CE2-CD1 3.84Å; F373-I380 HydrophobicContact CE2-CG2 4.24Å; F373-I380 HydrophobicContact CG-CD1 4.39Å; F373-I380 HydrophobicContact CZ-CD1 4.46Å; F373-I380 HydrophobicContact CZ-CG2 4.42Å
374	Q	92.1	Very high	94.4	Very high	47 Å²	47	47 Å²	47	22%	0.22	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-44.8	-178.6	-72.9	170.5	-37.7	0	0	111.1	M219 I370 M371 R376 G377	M219-Q374 HydrophobicContact CE-CG 4.01Å; I370-Q374 WeakPolarHBondContact O-CG 3.45Å; I370-Q374 PolarHBondContact O-N 2.9Å; M371-Q374 PolarHBondContact O-N 3.35Å; Q374-R376 VanDerWaalsContact C-N 3.33Å; Q374-R376 PolarHBondContact O-N 3.14Å; Q374-G377 PolarHBondContact O-N 2.91Å
375	D	92.7	Very high	94.3	Very high	142 Å²	142	45 Å²	45	76%	0.759	21%	0.213	S	C	*	.	H	α-helix	trans	-61.3	-42	177.8	-71.6	-18.5	0	0	0	111.9	M371 G377	M371-D375 PolarHBondContact O-N 3.49Å; D375-G377 VanDerWaalsContact C-N 3.33Å
376	R	93.6	Very high	94.1	Very high	67 Å²	67	47.5 Å²	47.5	25%	0.253	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	5.8	179.4	-63.6	177.7	64.1	-149.7	-5.3	113.5	L244 Q245 I372 F373 Q374 K378 E379 I380	L244-R376 PolarHBondContact O-NH1 3.45Å; L244-R376 PolarHBondContact O-NH2 2.87Å; Q245-R376 PolarHBondContact O-NH1 3.39Å; I372-R376 WeakPolarHBondContact O-CB 3.46Å; I372-R376 PolarHBondContact O-N 3.09Å; I372-R376 VanDerWaalsContact O-N 3.13Å; F373-R376 CarbonylContact O-C 3.32Å; F373-R376 PolarHBondContact O-N 3.46Å; Q374-R376 VanDerWaalsContact C-N 3.33Å; Q374-R376 PolarHBondContact O-N 3.14Å; R376-K378 VanDerWaalsContact C-N 3.31Å; R376-K378 PolarHBondContact O-N 2.94Å; R376-E379 IonicContact NE-OE2 3.61Å; R376-E379 PolarHBondContact NE-OE2 2.74Å; R376-E379 IonicContact NH2-OE1 3.91Å; R376-E379 IonicContact NH2-OE2 3.11Å; R376-E379 WeakPolarHBondContact O-CB 3.2Å; R376-E379 PolarHBondContact O-N 3.49Å; R376-I380 HydrophobicContact CB-CD1 3.9Å; R376-I380 HydrophobicContact CB-CG1 4.24Å; R376-I380 WeakPolarHBondContact O-CG1 3.28Å; R376-I380 PolarHBondContact O-N 3.16Å
377	G	90.8	Very high	93.8	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-40.4	-167.2	0	0	0	0	0	113.5	L223 F373 Q374 D375 S381	L223-G377 WeakPolarHBondContact CD2-O 3.44Å; F373-G377 WeakPolarHBondContact O-CA 3.39Å; F373-G377 PolarHBondContact O-N 3.41Å; Q374-G377 PolarHBondContact O-N 2.91Å; D375-G377 VanDerWaalsContact C-N 3.33Å; G377-S381 WeakPolarHBondContact O-CB 3.34Å; G377-S381 PolarHBondContact O-N 3.36Å; G377-S381 PolarHBondContact O-OG 3.09Å; G377-S381 VanDerWaalsContact O-OG 3.14Å
378	K	91.9	Very high	93.6	Very high	164 Å²	164	50.9 Å²	50.9	71%	0.713	27%	0.27	S	S	*	.	H	α-helix	trans	-65	-47	176.9	-175	-177.7	175.5	-170.3	0	111.8	R376 I380 S381 D382	R376-K378 VanDerWaalsContact C-N 3.31Å; R376-K378 PolarHBondContact O-N 2.94Å; K378-I380 VanDerWaalsContact C-N 3.33Å; K378-I380 PolarHBondContact O-N 3.05Å; K378-S381 PolarHBondContact O-N 3.14Å; K378-D382 WeakPolarHBondContact O-CB 3.22Å; K378-D382 VanDerWaalsContact O-CG 3.3Å; K378-D382 PolarHBondContact O-N 3.28Å
379	E	93.7	Very high	93.3	Very high	74 Å²	74	48.2 Å²	48.2	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-59.6	-44.5	178.1	-173.5	-153.4	150.1	0	0	111.2	R376 D382 K383	R376-E379 IonicContact NE-OE2 3.61Å; R376-E379 PolarHBondContact NE-OE2 2.74Å; R376-E379 IonicContact NH2-OE1 3.91Å; R376-E379 IonicContact NH2-OE2 3.11Å; R376-E379 WeakPolarHBondContact O-CB 3.2Å; R376-E379 PolarHBondContact O-N 3.49Å; E379-D382 PolarHBondContact O-N 3.22Å; E379-K383 HydrophobicContact CG-CD 4.36Å; E379-K383 WeakPolarHBondContact O-CB 3.28Å; E379-K383 WeakPolarHBondContact O-CG 3.39Å; E379-K383 PolarHBondContact O-N 3.28Å; E379-K383 WeakPolarHBondContact OE1-CE 3.49Å; E379-K383 IonicContact OE1-NZ 2.64Å; E379-K383 PolarHBondContact OE1-NZ 2.86Å
380	I	93.7	Very high	92.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-49.8	177.9	-66.4	165.3	0	0	0	110	Y216 F220 L244 P246 F373 R376 K378 D382 K383 V384	Y216-I380 HydrophobicContact CE2-CG2 4.1Å; F220-I380 HydrophobicContact CD2-CG2 4.4Å; L244-I380 HydrophobicContact CD1-CG2 4.46Å; P246-I380 HydrophobicContact CB-CD1 3.92Å; F373-I380 HydrophobicContact CD2-CD1 3.83Å; F373-I380 HydrophobicContact CE2-CD1 3.84Å; F373-I380 HydrophobicContact CE2-CG2 4.24Å; F373-I380 HydrophobicContact CG-CD1 4.39Å; F373-I380 HydrophobicContact CZ-CD1 4.46Å; F373-I380 HydrophobicContact CZ-CG2 4.42Å; R376-I380 HydrophobicContact CB-CD1 3.9Å; R376-I380 HydrophobicContact CB-CG1 4.24Å; R376-I380 WeakPolarHBondContact O-CG1 3.28Å; R376-I380 PolarHBondContact O-N 3.16Å; K378-I380 VanDerWaalsContact C-N 3.33Å; K378-I380 PolarHBondContact O-N 3.05Å; I380-D382 PolarHBondContact O-N 3.39Å; I380-K383 PolarHBondContact O-N 3.19Å; I380-V384 HydrophobicContact CG2-CG2 4.35Å; I380-V384 WeakPolarHBondContact O-CB 3.45Å; I380-V384 VanDerWaalsContact O-CG2 3.24Å; I380-V384 WeakPolarHBondContact O-CG2 3.32Å; I380-V384 PolarHBondContact O-N 3.23Å
381	S	92.6	Very high	92.2	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.035	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-46.8	177.4	-69.2	0	0	0	0	112.4	N224 G377 K378 K383 V384 F385	N224-S381 PolarHBondContact ND2-OG 3.09Å; N224-S381 PolarHBondContact OD1-OG 3.39Å; G377-S381 WeakPolarHBondContact O-CB 3.34Å; G377-S381 PolarHBondContact O-N 3.36Å; G377-S381 PolarHBondContact O-OG 3.09Å; G377-S381 VanDerWaalsContact O-OG 3.14Å; K378-S381 PolarHBondContact O-N 3.14Å; S381-K383 PolarHBondContact O-N 2.89Å; S381-V384 PolarHBondContact O-N 2.94Å; S381-F385 WeakPolarHBondContact O-CB 3.21Å; S381-F385 WeakPolarHBondContact O-CD2 3.39Å; S381-F385 WeakPolarHBondContact O-CG 3.33Å; S381-F385 PolarHBondContact O-N 3.37Å
382	D	94	Very high	91.7	Very high	83 Å²	83	63 Å²	63	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-62.7	-42.2	-179.2	-71.7	-23.4	0	0	0	111.8	K378 E379 I380 F385 A386	K378-D382 WeakPolarHBondContact O-CB 3.22Å; K378-D382 VanDerWaalsContact O-CG 3.3Å; K378-D382 PolarHBondContact O-N 3.28Å; E379-D382 PolarHBondContact O-N 3.22Å; I380-D382 PolarHBondContact O-N 3.39Å; D382-F385 PolarHBondContact O-N 3.2Å; D382-A386 WeakPolarHBondContact O-CB 3.45Å; D382-A386 PolarHBondContact O-N 3.15Å
383	K	93.6	Very high	90.8	Very high	102 Å²	102	66.1 Å²	66.1	44%	0.443	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-41	176.7	-72.6	178.7	176.7	175.8	0	112.6	L244 E379 I380 S381 A386 G387	L244-K383 HydrophobicContact CD2-CB 3.69Å; L244-K383 HydrophobicContact CD2-CD 3.32Å; L244-K383 HydrophobicContact CD2-CG 4.14Å; E379-K383 HydrophobicContact CG-CD 4.36Å; E379-K383 WeakPolarHBondContact O-CB 3.28Å; E379-K383 WeakPolarHBondContact O-CG 3.39Å; E379-K383 PolarHBondContact O-N 3.28Å; E379-K383 WeakPolarHBondContact OE1-CE 3.49Å; E379-K383 IonicContact OE1-NZ 2.64Å; E379-K383 PolarHBondContact OE1-NZ 2.86Å; I380-K383 PolarHBondContact O-N 3.19Å; S381-K383 PolarHBondContact O-N 2.89Å; K383-A386 PolarHBondContact O-N 3.47Å; K383-G387 PolarHBondContact O-N 3.46Å
384	V	92.9	Very high	89.4	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-65.8	-41.7	176.2	175.2	0	0	0	0	110.5	Y216 F220 Y233 M237 L244 I380 S381 A386 G387 C388	Y216-V384 WeakPolarHBondContact OH-CG2 3.41Å; F220-V384 HydrophobicContact CE2-CB 4Å; F220-V384 HydrophobicContact CE2-CG1 4.1Å; F220-V384 HydrophobicContact CE2-CG2 4.04Å; F220-V384 HydrophobicContact CZ-CB 4.06Å; F220-V384 HydrophobicContact CZ-CG1 3.78Å; Y233-V384 HydrophobicContact CE1-CG1 3.99Å; Y233-V384 WeakPolarHBondContact OH-CG1 3.41Å; M237-V384 HydrophobicContact CB-CG1 4.3Å; M237-V384 HydrophobicContact CG-CG1 3.87Å; M237-V384 HydrophobicContact CG-CG2 4.11Å; L244-V384 HydrophobicContact CD1-CG2 3.64Å; I380-V384 HydrophobicContact CG2-CG2 4.35Å; I380-V384 WeakPolarHBondContact O-CB 3.45Å; I380-V384 VanDerWaalsContact O-CG2 3.24Å; I380-V384 WeakPolarHBondContact O-CG2 3.32Å; I380-V384 PolarHBondContact O-N 3.23Å; S381-V384 PolarHBondContact O-N 2.94Å; V384-A386 VanDerWaalsContact C-N 3.31Å; V384-A386 PolarHBondContact O-N 3.3Å; V384-G387 PolarHBondContact O-N 3.16Å; V384-C388 WeakPolarHBondContact O-CB 3.37Å; V384-C388 PolarHBondContact O-N 2.76Å
385	F	93.5	Very high	87.8	Confident	21 Å²	21	77.7 Å²	77.7	9%	0.092	39%	0.388	C	S	.	.	H	α-helix	trans	-65.7	-33.4	175.6	-64.8	-33.3	0	0	0	112.8	F220 N224 Y227 Y233 S381 D382 G389 R390 P391	F220-F385 HydrophobicContact CZ-CE1 4.15Å; F220-F385 HydrophobicContact CZ-CZ 4.46Å; N224-F385 WeakPolarHBondContact OD1-CZ 3.4Å; Y227-F385 HydrophobicContact CD2-CZ 4.33Å; Y227-F385 AromaticContact CE2-CZ 4Å; Y227-F385 HydrophobicContact CE2-CZ 4Å; Y233-F385 WeakPolarHBondContact OH-CD1 3.28Å; S381-F385 WeakPolarHBondContact O-CB 3.21Å; S381-F385 WeakPolarHBondContact O-CD2 3.39Å; S381-F385 WeakPolarHBondContact O-CG 3.33Å; S381-F385 PolarHBondContact O-N 3.37Å; D382-F385 PolarHBondContact O-N 3.2Å; F385-G389 CarbonylContact O-C 3.57Å; F385-G389 VanDerWaalsContact O-C 3.27Å; F385-G389 WeakPolarHBondContact O-CA 3.31Å; F385-G389 PolarHBondContact O-N 3.4Å; F385-R390 HydrophobicContact CB-CG 4.09Å; F385-R390 HydrophobicContact CG-CG 4.24Å; F385-P391 VanDerWaalsContact CD1-CD 3.47Å; F385-P391 HydrophobicContact CD1-CG 4.3Å; F385-P391 HydrophobicContact CE1-CG 3.72Å
386	A	92.5	Very high	85.9	Confident	88 Å²	88	76.2 Å²	76.2	73%	0.727	38%	0.384	S	S	*	.	H	α-helix	trans	-68.6	-38.4	174.4	0	0	0	0	0	112.2	D382 K383 V384	D382-A386 WeakPolarHBondContact O-CB 3.45Å; D382-A386 PolarHBondContact O-N 3.15Å; K383-A386 PolarHBondContact O-N 3.47Å; V384-A386 VanDerWaalsContact C-N 3.31Å; V384-A386 PolarHBondContact O-N 3.3Å
387	G	91.2	Very high	83.7	Confident	44 Å²	44	82.2 Å²	82.2	45%	0.454	41%	0.412	S	S	.	.	H	α-helix	trans	-81.6	-41.6	-179.3	0	0	0	0	0	114.6	K383 V384	K383-G387 PolarHBondContact O-N 3.46Å; V384-G387 PolarHBondContact O-N 3.16Å
388	C	91.6	Very high	81.6	Confident	30 Å²	30	94.3 Å²	94.3	20%	0.203	46%	0.457	C	S	.	.	H	α-helix	trans	-103.7	-6	-173.5	-59.9	0	0	0	0	114.1	Y233 C236 V384	Y233-C388 HydrophobicContact CD2-CB 4.18Å; Y233-C388 HydrophobicContact CE2-CB 3.62Å; C236-C388 HydrophobicContact CB-CB 3.89Å; C236-C388 WeakPolarHBondContact CB-SG 3.37Å; C236-C388 WeakPolarHBondContact SG-CA 3.34Å; C236-C388 WeakPolarHBondContact SG-CB 3.48Å; C236-C388 CovalentContact SG-SG 2.04Å; C236-C388 PolarHBondContact SG-SG 3.03Å; V384-C388 WeakPolarHBondContact O-CB 3.37Å; V384-C388 PolarHBondContact O-N 2.76Å
389	G	90.1	Very high	79.6	Confident	35 Å²	35	95 Å²	95	36%	0.361	46%	0.463	S	S	.	.			trans	83.3	167	-171	0	0	0	0	0	112.6	Y233 F385 P391	Y233-G389 WeakPolarHBondContact CE2-O 3.4Å; Y233-G389 PolarHBondContact OH-O 3.15Å; F385-G389 CarbonylContact O-C 3.57Å; F385-G389 VanDerWaalsContact O-C 3.27Å; F385-G389 WeakPolarHBondContact O-CA 3.31Å; F385-G389 PolarHBondContact O-N 3.4Å; G389-P391 WeakPolarHBondContact O-CD 3.49Å
390	R	87.2	Confident	77.5	Confident	198 Å²	198	94.8 Å²	94.8	75%	0.747	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-80.7	124	175.8	-74.8	-174.5	175.6	178.5	-0.3	110.2	F385	F385-R390 HydrophobicContact CB-CG 4.09Å; F385-R390 HydrophobicContact CG-CG 4.24Å
391	P	82.6	Confident	75.2	Confident	15 Å²	15	105.3 Å²	105.3	10%	0.097	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-67.5	163.2	179.1	21	-25.6	0	0	0	112	Y227 L229 Y233 F385 G389 I393	Y227-P391 HydrophobicContact CD1-CB 4.19Å; Y227-P391 HydrophobicContact CD1-CG 3.66Å; Y227-P391 VanDerWaalsContact CD1-O 3.27Å; Y227-P391 WeakPolarHBondContact CD1-O 3.47Å; Y227-P391 HydrophobicContact CE1-CG 4.39Å; Y227-P391 HydrophobicContact CG-CB 4.42Å; Y227-P391 HydrophobicContact CG-CG 3.72Å; L229-P391 HydrophobicContact CD2-CB 3.82Å; L229-P391 HydrophobicContact CD2-CG 3.67Å; Y233-P391 HydrophobicContact CD2-CB 4.39Å; Y233-P391 HydrophobicContact CE2-CB 4.14Å; Y233-P391 HydrophobicContact CE2-CG 4.16Å; F385-P391 VanDerWaalsContact CD1-CD 3.47Å; F385-P391 HydrophobicContact CD1-CG 4.3Å; F385-P391 HydrophobicContact CE1-CG 3.72Å; G389-P391 WeakPolarHBondContact O-CD 3.49Å; P391-I393 PolarHBondContact O-N 3.2Å
392	K	82.5	Confident	73.2	Confident	162 Å²	162	108.1 Å²	108.1	70%	0.704	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-69.3	130	179.7	-65.6	174.8	-176.1	168.5	0	109.5	Y227 Q228	Y227-K392 WeakPolarHBondContact CA-O 3.3Å; Q228-K392 PolarHBondContact N-O 3.19Å
393	I	78.6	Confident	71.1	Confident	107 Å²	107	111.6 Å²	111.6	55%	0.549	54%	0.54	S	S	.	.	B	Isolated β-bridge	trans	-77.3	127	172.5	-63.1	171.4	0	0	0	107.7	P226 Y227 P391 R395	P226-I393 HydrophobicContact CB-CG2 4.48Å; P226-I393 WeakPolarHBondContact O-CA 2.99Å; Y227-I393 HydrophobicContact CD1-CG1 3.67Å; Y227-I393 HydrophobicContact CE1-CD1 4.04Å; Y227-I393 HydrophobicContact CE1-CG1 3.39Å; P391-I393 PolarHBondContact O-N 3.2Å; I393-R395 PolarHBondContact O-N 3.31Å
394	T	67	Low	68.8	Low	43 Å²	43	110.1 Å²	110.1	26%	0.264	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-71.3	122.2	168	-36.2	0	0	0	0	108.3	P226 Q228 T396	P226-T394 PolarHBondContact O-N 3.05Å; Q228-T394 VanDerWaalsContact CG-OG1 3.25Å; Q228-T394 WeakPolarHBondContact CG-OG1 3.37Å; Q228-T394 PolarHBondContact NE2-OG1 2.84Å; Q228-T394 VanDerWaalsContact NE2-OG1 3.12Å; T394-T396 WeakPolarHBondContact CG2-OG1 3.37Å; T394-T396 PolarHBondContact O-N 3.4Å
395	R	57.6	Low	66.8	Low	251 Å²	251	112.5 Å²	112.5	95%	0.947	55%	0.55	S	S	*	*			trans	-75.3	46.8	167.6	-66.6	-176.6	81	141.5	0.6	110.7	I393	I393-R395 PolarHBondContact O-N 3.31Å
396	T	52	Low	64.7	Low	110 Å²	110	115.1 Å²	115.1	68%	0.675	57%	0.565	S	S	*	*			trans	-85.1	137.8	168.7	-33.6	0	0	0	0	108.1	T394 R398	T394-T396 WeakPolarHBondContact CG2-OG1 3.37Å; T394-T396 PolarHBondContact O-N 3.4Å; T396-R398 PolarHBondContact O-N 3.14Å
397	K	48.4	Very low	62.7	Low	194 Å²	194	116.1 Å²	116.1	84%	0.843	56%	0.555	S	S	*	*			trans	-34.7	129.2	-176.6	-79.5	174.9	175.4	172.4	0	111.8	Q399	K397-Q399 VanDerWaalsContact C-N 3.28Å; K397-Q399 PolarHBondContact O-N 3.04Å
398	R	47.4	Very low	60.7	Low	254 Å²	254	116 Å²	116	96%	0.958	54%	0.544	S	S	*	.			trans	-41.3	86.3	172.8	-69.9	175.3	177.2	162.4	-2.4	111	T396	T396-R398 PolarHBondContact O-N 3.14Å
399	Q	48.4	Very low	58.8	Low	180 Å²	180	122.2 Å²	122.2	84%	0.841	57%	0.567	S	S	*	*			trans	-76.7	129.3	155	-76.6	-172.1	-17	0	0	105.6	K397 R401	K397-Q399 VanDerWaalsContact C-N 3.28Å; K397-Q399 PolarHBondContact O-N 3.04Å; Q399-R401 PolarHBondContact O-N 3.29Å
400	S	49.2	Very low	56.8	Low	69 Å²	69	126.2 Å²	126.2	48%	0.483	58%	0.58	S	S	.	*			trans	-46.1	109.8	-169.4	177.5	0	0	0	0	111.8	S402 K403	S400-S402 PolarHBondContact O-N 3.48Å; S400-S402 VanDerWaalsContact OG-CB 3.32Å; S400-S402 WeakPolarHBondContact OG-CB 3.05Å; S400-S402 PolarHBondContact OG-N 3.1Å; S400-K403 PolarHBondContact O-N 3.38Å; S400-K403 PolarHBondContact OG-N 3.45Å
401	R	46.4	Very low	54.9	Low	220 Å²	220	119.3 Å²	119.3	83%	0.83	56%	0.558	S	S	*	*	H	α-helix	trans	-53.5	-23.2	168.2	-162.2	178.3	89.2	161.3	5.1	111.7	Q399 V405	Q399-R401 PolarHBondContact O-N 3.29Å; R401-V405 WeakPolarHBondContact O-CB 3.45Å; R401-V405 WeakPolarHBondContact O-CG2 3.42Å
402	S	51.4	Low	53.1	Low	64 Å²	64	128.8 Å²	128.8	45%	0.448	59%	0.592	S	S	.	*	H	α-helix	trans	-72.6	-57.9	179.6	-141.6	0	0	0	0	110.7	S400 M404 V405 D406	S400-S402 PolarHBondContact O-N 3.48Å; S400-S402 VanDerWaalsContact OG-CB 3.32Å; S400-S402 WeakPolarHBondContact OG-CB 3.05Å; S400-S402 PolarHBondContact OG-N 3.1Å; S402-M404 PolarHBondContact O-N 3.19Å; S402-M404 VanDerWaalsContact O-N 3.13Å; S402-V405 PolarHBondContact O-N 3.09Å; S402-D406 WeakPolarHBondContact CA-OD2 3.39Å; S402-D406 WeakPolarHBondContact CB-OD2 3.5Å; S402-D406 WeakPolarHBondContact O-CA 3.32Å; S402-D406 WeakPolarHBondContact O-CB 3.28Å; S402-D406 PolarHBondContact O-N 2.84Å; S402-D406 PolarHBondContact OG-OD2 2.66Å
403	K	49.2	Very low	51.4	Low	157 Å²	157	125.7 Å²	125.7	68%	0.683	58%	0.579	S	S	*	*	H	α-helix	trans	-60.9	-37	-165	-83.2	-172.4	175.3	-178.9	0	115.4	S400 Q407	S400-K403 PolarHBondContact O-N 3.38Å; S400-K403 PolarHBondContact OG-N 3.45Å; K403-Q407 WeakPolarHBondContact O-CB 3.32Å; K403-Q407 WeakPolarHBondContact O-CG 3.34Å; K403-Q407 PolarHBondContact O-N 3.3Å
404	M	46.1	Very low	49.8	Very low	70 Å²	70	123.2 Å²	123.2	35%	0.345	58%	0.58	S	S	.	*	H	α-helix	trans	-90.5	-34.6	-176.9	-159.6	-178.4	-56.3	0	0	113.8	Q225 S402 D406 Q407 L408	Q225-M404 VanDerWaalsContact CD-SD 3.51Å; Q225-M404 PolarHBondContact NE2-SD 2.85Å; Q225-M404 PolarHBondContact OE1-SD 2.84Å; Q225-M404 VanDerWaalsContact OE1-SD 3.37Å; S402-M404 PolarHBondContact O-N 3.19Å; S402-M404 VanDerWaalsContact O-N 3.13Å; M404-D406 VanDerWaalsContact C-N 3.34Å; M404-Q407 WeakPolarHBondContact O-CB 3.47Å; M404-Q407 PolarHBondContact O-N 2.92Å; M404-L408 PolarHBondContact O-N 3.22Å
405	V	49.1	Very low	48.5	Very low	51 Å²	51	127.5 Å²	127.5	31%	0.309	61%	0.608	S	S	.	*	H	α-helix	trans	-70.8	-36.5	172.5	178.3	0	0	0	0	110.1	R401 S402 L408 K409	R401-V405 WeakPolarHBondContact O-CB 3.45Å; R401-V405 WeakPolarHBondContact O-CG2 3.42Å; S402-V405 PolarHBondContact O-N 3.09Å; V405-L408 PolarHBondContact O-N 3.45Å; V405-K409 HydrophobicContact CG1-CD 4.29Å; V405-K409 WeakPolarHBondContact O-CB 3.37Å; V405-K409 WeakPolarHBondContact O-CG 2.95Å; V405-K409 PolarHBondContact O-N 2.96Å
406	D	50.5	Low	47.9	Very low	75 Å²	75	119.7 Å²	119.7	40%	0.401	58%	0.584	S	S	.	*	H	α-helix	trans	-65.4	-41.8	170.3	-63.8	-28	0	0	0	109.7	S402 M404 L408 K409 D410	S402-D406 WeakPolarHBondContact CA-OD2 3.39Å; S402-D406 WeakPolarHBondContact CB-OD2 3.5Å; S402-D406 WeakPolarHBondContact O-CA 3.32Å; S402-D406 WeakPolarHBondContact O-CB 3.28Å; S402-D406 PolarHBondContact O-N 2.84Å; S402-D406 PolarHBondContact OG-OD2 2.66Å; M404-D406 VanDerWaalsContact C-N 3.34Å; D406-L408 VanDerWaalsContact C-N 3.34Å; D406-L408 PolarHBondContact O-N 3.2Å; D406-K409 PolarHBondContact O-N 3.11Å; D406-D410 WeakPolarHBondContact O-CA 3.33Å; D406-D410 WeakPolarHBondContact O-CB 3.24Å; D406-D410 PolarHBondContact O-N 3.29Å
407	Q	49.8	Very low	47.5	Very low	110 Å²	110	119.6 Å²	119.6	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-57.1	-43.9	170.3	-80.6	166.2	5.8	0	0	112.3	K403 M404 K409 L411	K403-Q407 WeakPolarHBondContact O-CB 3.32Å; K403-Q407 WeakPolarHBondContact O-CG 3.34Å; K403-Q407 PolarHBondContact O-N 3.3Å; M404-Q407 WeakPolarHBondContact O-CB 3.47Å; M404-Q407 PolarHBondContact O-N 2.92Å; Q407-K409 VanDerWaalsContact C-N 3.32Å; Q407-K409 PolarHBondContact O-N 3.22Å; Q407-L411 WeakPolarHBondContact O-CD1 3.45Å; Q407-L411 WeakPolarHBondContact O-CG 3.28Å; Q407-L411 PolarHBondContact O-N 3.21Å
408	L	50.2	Low	47.2	Very low	42 Å²	42	114.7 Å²	114.7	22%	0.22	58%	0.583	C	S	.	*	H	α-helix	trans	-68.8	-30.6	179.6	-157.8	76.3	0	0	0	113	L169 L223 M404 V405 D406	L169-L408 HydrophobicContact CD1-CD1 3.64Å; L223-L408 HydrophobicContact CD1-CD2 4.47Å; M404-L408 PolarHBondContact O-N 3.22Å; V405-L408 PolarHBondContact O-N 3.45Å; D406-L408 VanDerWaalsContact C-N 3.34Å; D406-L408 PolarHBondContact O-N 3.2Å
409	K	50.3	Low	47.4	Very low	160 Å²	160	106.8 Å²	106.8	70%	0.696	55%	0.554	S	S	*	*	H	α-helix	trans	-85.6	-27.7	178.2	-74.6	-177.4	175.6	-172.6	0	114	V405 D406 Q407	V405-K409 HydrophobicContact CG1-CD 4.29Å; V405-K409 WeakPolarHBondContact O-CB 3.37Å; V405-K409 WeakPolarHBondContact O-CG 2.95Å; V405-K409 PolarHBondContact O-N 2.96Å; D406-K409 PolarHBondContact O-N 3.11Å; Q407-K409 VanDerWaalsContact C-N 3.32Å; Q407-K409 PolarHBondContact O-N 3.22Å
410	D	48.4	Very low	47.1	Very low	119 Å²	119	103.8 Å²	103.8	64%	0.636	55%	0.55	S	S	*	.	H	α-helix	trans	-97.3	2.3	-173.7	-151	29.6	0	0	0	112.4	D406 R412	D406-D410 WeakPolarHBondContact O-CA 3.33Å; D406-D410 WeakPolarHBondContact O-CB 3.24Å; D406-D410 PolarHBondContact O-N 3.29Å; D410-R412 PolarHBondContact O-N 3.04Å
411	L	47.5	Very low	46.9	Very low	53 Å²	53	105.5 Å²	105.5	28%	0.277	56%	0.562	S	S	.	*			trans	-70	63.4	158.9	-67.1	163.5	0	0	0	109.1	T165 Y166 L169 Q407 F413	T165-L411 WeakPolarHBondContact O-CD2 3.29Å; Y166-L411 HydrophobicContact CD1-CD1 4.24Å; L169-L411 HydrophobicContact CD1-CD1 3.96Å; Q407-L411 WeakPolarHBondContact O-CD1 3.45Å; Q407-L411 WeakPolarHBondContact O-CG 3.28Å; Q407-L411 PolarHBondContact O-N 3.21Å; L411-F413 PolarHBondContact O-N 2.97Å
412	R	44.4	Very low	47.1	Very low	214 Å²	214	98.3 Å²	98.3	81%	0.808	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-75	121.6	168.6	-77.3	-152.6	-103.6	-142.9	-1.8	109.1	D410	D410-R412 PolarHBondContact O-N 3.04Å
413	F	47.3	Very low	46.6	Very low	97 Å²	97	102.4 Å²	102.4	43%	0.425	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-61.6	132.1	-172.1	-56.3	-85.1	0	0	0	112.5	T165 M371 L411	T165-F413 HydrophobicContact CG2-CD1 3.84Å; T165-F413 HydrophobicContact CG2-CE1 3.82Å; M371-F413 HydrophobicContact CG-CE1 4.07Å; M371-F413 HydrophobicContact CG-CE2 4.07Å; M371-F413 HydrophobicContact CG-CZ 3.5Å; M371-F413 VanDerWaalsContact CG-CZ 3.5Å; M371-F413 HydrophobicContact SD-CD1 4.34Å; M371-F413 HydrophobicContact SD-CD2 4.23Å; M371-F413 HydrophobicContact SD-CE1 3.84Å; M371-F413 HydrophobicContact SD-CE2 3.72Å; M371-F413 HydrophobicContact SD-CZ 3.52Å; M371-F413 VanDerWaalsContact SD-CZ 3.52Å; L411-F413 PolarHBondContact O-N 2.97Å
414	G	45.1	Very low	46.5	Very low	55 Å²	55	102.5 Å²	102.5	57%	0.567	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-74.5	155.9	155.5	0	0	0	0	0	110	I416	G414-I416 PolarHBondContact O-N 3.18Å
415	P	39.4	Very low	47	Very low	132 Å²	132	100.7 Å²	100.7	86%	0.857	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-56.3	124.8	-179.9	22.2	-31.4	0	0	0	110.2	S417	P415-S417 PolarHBondContact O-N 3.37Å; P415-S417 VanDerWaalsContact O-N 3.07Å
416	I	46.6	Very low	48	Very low	87 Å²	87	99.8 Å²	99.8	45%	0.446	57%	0.568	S	S	.	*			trans	-61.5	112	170.3	-61.9	173	0	0	0	105.5	I364 G414 A418	I364-I416 HydrophobicContact CD1-CG2 4.16Å; I364-I416 HydrophobicContact CG1-CG2 4.32Å; G414-I416 PolarHBondContact O-N 3.18Å; I416-A418 PolarHBondContact O-N 3.45Å
417	S	43.5	Very low	49.4	Very low	108 Å²	108	98.9 Å²	98.9	76%	0.755	57%	0.567	S	S	*	*			trans	-56.4	114.9	174.9	-171.9	0	0	0	0	107.8	P415 R419	P415-S417 PolarHBondContact O-N 3.37Å; P415-S417 VanDerWaalsContact O-N 3.07Å; S417-R419 PolarHBondContact O-N 2.78Å
418	A	41	Very low	51.2	Low	91 Å²	91	93.6 Å²	93.6	75%	0.752	54%	0.543	S	S	*	.			trans	-57	116.1	174	0	0	0	0	0	107.8	I416	I416-A418 PolarHBondContact O-N 3.45Å
419	R	52.7	Low	53.1	Low	89 Å²	89	94.1 Å²	94.1	34%	0.336	55%	0.546	S	S	.	.			trans	-59.2	136.1	178.2	-171.8	170.8	175.4	159.8	-0.7	108.2	K153 D157 N360 S417 S421	K153-R419 VanDerWaalsContact NZ-NH2 3.16Å; D157-R419 IonicContact OD2-CZ 2.82Å; D157-R419 IonicContact OD2-NH1 3.38Å; D157-R419 PolarHBondContact OD2-NH1 3.48Å; D157-R419 IonicContact OD2-NH2 3.85Å; D157-R419 PolarHBondContact OD2-NH2 3.04Å; N360-R419 PolarHBondContact O-NH1 3.28Å; N360-R419 PolarHBondContact OD1-NH1 3.24Å; N360-R419 PolarHBondContact OD1-NH2 3.28Å; S417-R419 PolarHBondContact O-N 2.78Å; R419-S421 PolarHBondContact O-N 2.96Å
420	P	40.5	Very low	55.1	Low	117 Å²	117	92 Å²	92	76%	0.76	54%	0.541	S	S	*	.			trans	-63.2	103.2	172.6	23.3	-29.8	0	0	0	108.3	S422	P420-S422 PolarHBondContact O-N 3.44Å; P420-S422 VanDerWaalsContact O-N 3.12Å
421	S	46	Very low	57.2	Low	104 Å²	104	88 Å²	88	73%	0.727	52%	0.52	S	S	*	.			trans	-60.4	106.9	157	43	0	0	0	0	105.7	R419 V423	R419-S421 PolarHBondContact O-N 2.96Å; S421-V423 PolarHBondContact O-N 2.8Å
422	S	49.4	Very low	59.5	Low	70 Å²	70	85.5 Å²	85.5	49%	0.49	51%	0.507	S	S	.	.			trans	-57.2	112.2	-177.5	48.2	0	0	0	0	109.2	P420 L424 G425	P420-S422 PolarHBondContact O-N 3.44Å; P420-S422 VanDerWaalsContact O-N 3.12Å; S422-L424 PolarHBondContact O-N 2.83Å; S422-L424 VanDerWaalsContact O-N 3.11Å; S422-G425 WeakPolarHBondContact CB-O 3.05Å; S422-G425 PolarHBondContact OG-O 3.46Å
423	V	42.3	Very low	61.8	Low	149 Å²	149	81.2 Å²	81.2	90%	0.903	49%	0.494	S	S	*	.	S	Bend	trans	-63.2	-12.7	175.7	178.1	0	0	0	0	111.3	S421	S421-V423 PolarHBondContact O-N 2.8Å
424	L	46.2	Very low	64	Low	160 Å²	160	78.8 Å²	78.8	84%	0.838	49%	0.485	S	S	*	.	S	Bend	trans	-106.1	48.6	-179.3	-155	82	0	0	0	112.3	S422	S422-L424 PolarHBondContact O-N 2.83Å; S422-L424 VanDerWaalsContact O-N 3.11Å
425	G	56.5	Low	66.4	Low	31 Å²	31	76.3 Å²	76.3	32%	0.32	46%	0.459	S	S	.	.			trans	65.4	160.6	-176.8	0	0	0	0	0	113.3	S422	S422-G425 WeakPolarHBondContact CB-O 3.05Å; S422-G425 PolarHBondContact OG-O 3.46Å
426	T	69.6	Low	69.1	Low	32 Å²	32	72.2 Å²	72.2	20%	0.196	43%	0.428	C	S	.	.			trans	-83.3	163.1	168.6	61.7	0	0	0	0	110.3	E356 M428 D429 L430	E356-T426 WeakPolarHBondContact OE2-CB 2.93Å; E356-T426 PolarHBondContact OE2-OG1 2.86Å; T426-M428 PolarHBondContact O-N 3.13Å; T426-D429 PolarHBondContact N-OD2 3.25Å; T426-D429 PolarHBondContact O-N 3.42Å; T426-D429 VanDerWaalsContact O-N 3.12Å; T426-D429 PolarHBondContact OG1-N 3.1Å; T426-D429 PolarHBondContact OG1-OD2 3Å; T426-L430 PolarHBondContact O-N 3.09Å
427	S	81.3	Confident	71.3	Confident	56 Å²	56	73.2 Å²	73.2	39%	0.392	43%	0.431	S	S	.	.	H	α-helix	trans	-55.5	-32.2	171.4	18.2	0	0	0	0	112.2	F146 E356 L431	F146-S427 WeakPolarHBondContact CE2-OG 3.34Å; E356-S427 PolarHBondContact OE1-OG 2.8Å; S427-L431 WeakPolarHBondContact O-CG 3.34Å; S427-L431 PolarHBondContact O-N 3.48Å
428	M	88	Confident	73.7	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-69.2	-40	175.1	179.6	161.1	40	0	0	113.4	F146 L349 N354 I355 E356 T426 L430 L431 A432	F146-M428 HydrophobicContact CE1-CB 3.89Å; F146-M428 HydrophobicContact CE1-CG 4.5Å; F146-M428 HydrophobicContact CZ-CB 3.99Å; L349-M428 HydrophobicContact CB-SD 4.2Å; L349-M428 WeakPolarHBondContact O-CE 3.25Å; N354-M428 HydrophobicContact CB-CE 3.9Å; N354-M428 VanDerWaalsContact ND2-CE 3.25Å; N354-M428 WeakPolarHBondContact ND2-CE 3.31Å; N354-M428 WeakPolarHBondContact OD1-CE 3.5Å; I355-M428 HydrophobicContact CG2-CE 4.39Å; I355-M428 HydrophobicContact CG2-SD 4.43Å; E356-M428 HydrophobicContact CB-CE 4.32Å; E356-M428 HydrophobicContact CG-CE 4.11Å; E356-M428 WeakPolarHBondContact OE2-CB 3.27Å; E356-M428 PolarHBondContact OE2-N 3.41Å; T426-M428 PolarHBondContact O-N 3.13Å; M428-L430 VanDerWaalsContact C-N 3.27Å; M428-L430 PolarHBondContact O-N 3.49Å; M428-L431 PolarHBondContact O-N 3.45Å; M428-A432 VanDerWaalsContact O-CB 3.24Å; M428-A432 WeakPolarHBondContact O-CB 3.34Å; M428-A432 PolarHBondContact O-N 3.11Å
429	D	89.8	Confident	76.2	Confident	53 Å²	53	68.5 Å²	68.5	28%	0.283	38%	0.38	S	S	.	.	H	α-helix	trans	-60.8	-40	179.3	-60.5	-41.6	0	0	0	111.1	T426 K433	T426-D429 PolarHBondContact N-OD2 3.25Å; T426-D429 PolarHBondContact O-N 3.42Å; T426-D429 VanDerWaalsContact O-N 3.12Å; T426-D429 PolarHBondContact OG1-N 3.1Å; T426-D429 PolarHBondContact OG1-OD2 3Å; D429-K433 VanDerWaalsContact O-CB 3.25Å; D429-K433 WeakPolarHBondContact O-CB 3.32Å; D429-K433 PolarHBondContact O-N 3.19Å
430	L	91.4	Very high	78.2	Confident	114 Å²	114	68.6 Å²	68.6	60%	0.597	39%	0.386	S	S	*	.	H	α-helix	trans	-65.8	-45	176.3	-65.6	176.2	0	0	0	111.9	T426 M428 D434	T426-L430 PolarHBondContact O-N 3.09Å; M428-L430 VanDerWaalsContact C-N 3.27Å; M428-L430 PolarHBondContact O-N 3.49Å; L430-D434 WeakPolarHBondContact O-CB 3.22Å; L430-D434 PolarHBondContact O-N 2.68Å
431	L	93.2	Very high	80.6	Confident	37 Å²	37	67.7 Å²	67.7	19%	0.194	38%	0.38	C	S	.	.	H	α-helix	trans	-65.1	-39.7	177	-72.5	170.4	0	0	0	112.1	F143 F146 S427 M428 M435	F143-L431 HydrophobicContact CD1-CB 4.12Å; F143-L431 HydrophobicContact CD1-CD1 4.18Å; F143-L431 HydrophobicContact CE1-CB 3.62Å; F143-L431 HydrophobicContact CE1-CD1 4.47Å; F143-L431 HydrophobicContact CE2-CB 4.3Å; F143-L431 HydrophobicContact CZ-CB 3.72Å; F143-L431 WeakPolarHBondContact CZ-O 3.32Å; F146-L431 HydrophobicContact CB-CD1 3.54Å; F146-L431 HydrophobicContact CD1-CD1 3.7Å; F146-L431 HydrophobicContact CD2-CD1 4.33Å; F146-L431 HydrophobicContact CG-CD1 3.56Å; S427-L431 WeakPolarHBondContact O-CG 3.34Å; S427-L431 PolarHBondContact O-N 3.48Å; M428-L431 PolarHBondContact O-N 3.45Å; L431-M435 WeakPolarHBondContact O-CB 3.14Å; L431-M435 PolarHBondContact O-N 3.25Å
432	A	94.7	Very high	82.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-67.6	-45.4	178.9	0	0	0	0	0	111.6	L346 E350 M428 M435 K436	L346-A432 HydrophobicContact CD1-CB 3.63Å; L346-A432 HydrophobicContact CD2-CB 4.14Å; L346-A432 HydrophobicContact CG-CB 3.93Å; E350-A432 HydrophobicContact CG-CB 3.51Å; E350-A432 WeakPolarHBondContact OE1-CB 3.35Å; M428-A432 VanDerWaalsContact O-CB 3.24Å; M428-A432 WeakPolarHBondContact O-CB 3.34Å; M428-A432 PolarHBondContact O-N 3.11Å; A432-M435 PolarHBondContact O-N 3.27Å; A432-K436 WeakPolarHBondContact O-CB 3.35Å; A432-K436 WeakPolarHBondContact O-CG 3.36Å; A432-K436 PolarHBondContact O-N 3.29Å
433	K	94.1	Very high	84.9	Confident	123 Å²	123	64 Å²	64	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-57.7	-49.5	173.4	-177.4	-179.5	174.4	-175.6	0	111.5	D429 M435 K436 E437	D429-K433 VanDerWaalsContact O-CB 3.25Å; D429-K433 WeakPolarHBondContact O-CB 3.32Å; D429-K433 PolarHBondContact O-N 3.19Å; K433-M435 VanDerWaalsContact C-N 3.32Å; K433-M435 PolarHBondContact O-N 2.99Å; K433-K436 PolarHBondContact O-N 3.2Å; K433-E437 WeakPolarHBondContact CE-OE1 3.49Å; K433-E437 WeakPolarHBondContact O-CG 3.43Å; K433-E437 PolarHBondContact O-N 3.28Å
434	D	92.8	Very high	87.3	Confident	46 Å²	46	57.4 Å²	57.4	25%	0.246	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-40.1	178.6	176.3	63	0	0	0	112	R139 L430 E437 K438	R139-D434 IonicContact CZ-OD1 2.83Å; R139-D434 IonicContact CZ-OD2 3.64Å; R139-D434 IonicContact NE-OD1 3.71Å; R139-D434 IonicContact NE-OD2 3.71Å; R139-D434 PolarHBondContact NE-OD2 3.26Å; R139-D434 VanDerWaalsContact NH2-CG 3.27Å; R139-D434 IonicContact NH2-OD1 3.86Å; R139-D434 PolarHBondContact NH2-OD1 2.72Å; R139-D434 IonicContact NH2-OD2 2.73Å; R139-D434 PolarHBondContact NH2-OD2 3.09Å; L430-D434 WeakPolarHBondContact O-CB 3.22Å; L430-D434 PolarHBondContact O-N 2.68Å; D434-E437 PolarHBondContact O-N 2.9Å; D434-K438 WeakPolarHBondContact O-CG 3.08Å; D434-K438 PolarHBondContact O-N 3.46Å; D434-K438 VanDerWaalsContact O-N 3.11Å
435	M	94.6	Very high	89.5	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-44.2	174.2	-177.4	57.9	-161.9	0	0	112.2	F136 R139 F143 L272 L342 L346 L431 A432 K433 K438 A439	F136-M435 HydrophobicContact CD1-CE 4.36Å; F136-M435 HydrophobicContact CE1-CE 3.72Å; F136-M435 HydrophobicContact CZ-CE 3.86Å; R139-M435 HydrophobicContact CB-SD 3.9Å; R139-M435 HydrophobicContact CG-SD 4.03Å; F143-M435 HydrophobicContact CE2-CB 3.88Å; F143-M435 HydrophobicContact CE2-CG 4.23Å; F143-M435 HydrophobicContact CZ-CB 4.16Å; L272-M435 HydrophobicContact CD2-CE 3.56Å; L272-M435 HydrophobicContact CD2-SD 4.08Å; L342-M435 HydrophobicContact CD2-CE 3.88Å; L346-M435 HydrophobicContact CD2-CB 4.05Å; L346-M435 HydrophobicContact CD2-CG 4.02Å; L431-M435 WeakPolarHBondContact O-CB 3.14Å; L431-M435 PolarHBondContact O-N 3.25Å; A432-M435 PolarHBondContact O-N 3.27Å; K433-M435 VanDerWaalsContact C-N 3.32Å; K433-M435 PolarHBondContact O-N 2.99Å; M435-K438 PolarHBondContact O-N 3.41Å; M435-A439 HydrophobicContact CE-CB 3.6Å; M435-A439 WeakPolarHBondContact O-CB 3.05Å; M435-A439 PolarHBondContact O-N 2.94Å; M435-A439 HydrophobicContact SD-CB 4.47Å
436	K	96.1	Very high	91.3	Very high	47 Å²	47	50.2 Å²	50.2	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-46.8	176.6	-76.7	166.1	173	175.2	0	111.5	L343 L346 D347 E350 A432 K433 K438 A439 I440	L343-K436 HydrophobicContact CD2-CG 3.91Å; L346-K436 HydrophobicContact CD2-CG 4.09Å; D347-K436 WeakPolarHBondContact OD1-CE 3.49Å; D347-K436 IonicContact OD1-NZ 3.78Å; D347-K436 PolarHBondContact OD1-NZ 3.5Å; E350-K436 VanDerWaalsContact CD-NZ 3.3Å; E350-K436 IonicContact OE1-NZ 2.83Å; E350-K436 PolarHBondContact OE1-NZ 3.26Å; E350-K436 VanDerWaalsContact OE2-CE 3.31Å; E350-K436 WeakPolarHBondContact OE2-CE 3.16Å; E350-K436 IonicContact OE2-NZ 3.67Å; E350-K436 PolarHBondContact OE2-NZ 2.91Å; A432-K436 WeakPolarHBondContact O-CB 3.35Å; A432-K436 WeakPolarHBondContact O-CG 3.36Å; A432-K436 PolarHBondContact O-N 3.29Å; K433-K436 PolarHBondContact O-N 3.2Å; K436-K438 PolarHBondContact O-N 3.02Å; K436-A439 PolarHBondContact O-N 3.23Å; K436-I440 HydrophobicContact CB-CD1 4.12Å; K436-I440 WeakPolarHBondContact O-CB 3.43Å; K436-I440 WeakPolarHBondContact O-CD1 3.42Å; K436-I440 VanDerWaalsContact O-CG1 3.26Å; K436-I440 WeakPolarHBondContact O-CG1 3.47Å; K436-I440 PolarHBondContact O-N 3.36Å
437	E	94.7	Very high	92.3	Very high	108 Å²	108	50.9 Å²	50.9	51%	0.505	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-33.9	177.4	-75.4	179.6	-173.2	0	0	112.6	K433 D434 P441	K433-E437 WeakPolarHBondContact CE-OE1 3.49Å; K433-E437 WeakPolarHBondContact O-CG 3.43Å; K433-E437 PolarHBondContact O-N 3.28Å; D434-E437 PolarHBondContact O-N 2.9Å; E437-P441 WeakPolarHBondContact O-CD 3.32Å; E437-P441 WeakPolarHBondContact O-CG 3.33Å
438	K	92.4	Very high	92.9	Very high	99 Å²	99	53.8 Å²	53.8	43%	0.43	27%	0.268	S	S	.	.	H	α-helix	trans	-88.6	-31	178.1	-64	-55.7	179.7	-170.4	0	114.5	D434 M435 K436 T442	D434-K438 WeakPolarHBondContact O-CG 3.08Å; D434-K438 PolarHBondContact O-N 3.46Å; D434-K438 VanDerWaalsContact O-N 3.11Å; M435-K438 PolarHBondContact O-N 3.41Å; K436-K438 PolarHBondContact O-N 3.02Å; K438-T442 WeakPolarHBondContact O-CG2 3.46Å
439	A	94	Very high	93.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-85.4	-41.4	-174.3	0	0	0	0	0	112.9	L339 L343 M435 K436 T442	L339-A439 HydrophobicContact CD2-CB 4.36Å; L343-A439 HydrophobicContact CD2-CB 4.31Å; M435-A439 HydrophobicContact CE-CB 3.6Å; M435-A439 WeakPolarHBondContact O-CB 3.05Å; M435-A439 PolarHBondContact O-N 2.94Å; M435-A439 HydrophobicContact SD-CB 4.47Å; K436-A439 PolarHBondContact O-N 3.23Å; A439-T442 WeakPolarHBondContact O-CB 3.47Å; A439-T442 PolarHBondContact O-N 3.4Å; A439-T442 PolarHBondContact O-OG1 2.93Å
440	I	94	Very high	93.4	Very high	91 Å²	91	51.5 Å²	51.5	47%	0.467	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-58.6	-44.8	-176	-66.6	167.5	0	0	0	112.2	L343 K436 T442 K443	L343-I440 HydrophobicContact CD1-CG1 3.84Å; K436-I440 HydrophobicContact CB-CD1 4.12Å; K436-I440 WeakPolarHBondContact O-CB 3.43Å; K436-I440 WeakPolarHBondContact O-CD1 3.42Å; K436-I440 VanDerWaalsContact O-CG1 3.26Å; K436-I440 WeakPolarHBondContact O-CG1 3.47Å; K436-I440 PolarHBondContact O-N 3.36Å; I440-T442 PolarHBondContact O-N 3.35Å; I440-K443 WeakPolarHBondContact O-CB 3.32Å; I440-K443 PolarHBondContact O-N 2.89Å; I440-K443 VanDerWaalsContact O-N 3.15Å
441	P	91.4	Very high	93.5	Very high	98 Å²	98	52.7 Å²	52.7	64%	0.636	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-65.4	-10	178.2	-22.5	35.3	0	0	0	114.6	E437 K443	E437-P441 WeakPolarHBondContact O-CD 3.32Å; E437-P441 WeakPolarHBondContact O-CG 3.33Å; P441-K443 VanDerWaalsContact C-N 3.33Å
442	T	92.5	Very high	93.6	Very high	13 Å²	13	55 Å²	55	8%	0.08	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-89.6	-4.7	-179.6	75.4	0	0	0	0	112.2	L132 W335 L339 K438 A439 I440 G444 F445	L132-T442 HydrophobicContact CD1-CG2 3.27Å; W335-T442 PolarHBondContact NE1-O 3.11Å; L339-T442 WeakPolarHBondContact CD1-OG1 3.43Å; K438-T442 WeakPolarHBondContact O-CG2 3.46Å; A439-T442 WeakPolarHBondContact O-CB 3.47Å; A439-T442 PolarHBondContact O-N 3.4Å; A439-T442 PolarHBondContact O-OG1 2.93Å; I440-T442 PolarHBondContact O-N 3.35Å; T442-G444 PolarHBondContact O-N 3.12Å; T442-F445 WeakPolarHBondContact O-CB 3.46Å; T442-F445 PolarHBondContact O-N 3.35Å
443	K	93.4	Very high	93.6	Very high	84 Å²	84	55 Å²	55	37%	0.365	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	133.3	169	-72.5	-166.2	174.3	-161.3	0	110.1	N336 L339 E340 I440 P441 F445	N336-K443 VanDerWaalsContact OD1-CA 3.24Å; N336-K443 WeakPolarHBondContact OD1-CA 3.27Å; L339-K443 HydrophobicContact CD1-CG 3.87Å; E340-K443 IonicContact OE1-NZ 3.15Å; E340-K443 PolarHBondContact OE1-NZ 3.2Å; I440-K443 WeakPolarHBondContact O-CB 3.32Å; I440-K443 PolarHBondContact O-N 2.89Å; I440-K443 VanDerWaalsContact O-N 3.15Å; P441-K443 VanDerWaalsContact C-N 3.33Å; K443-F445 PolarHBondContact O-N 2.97Å
444	G	91.7	Very high	93.7	Very high	10 Å²	10	49.2 Å²	49.2	10%	0.103	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	12.3	-177.5	0	0	0	0	0	114.4	D332 N336 T442 W446 L447 H448	D332-G444 VanDerWaalsContact OD1-C 3.32Å; D332-G444 WeakPolarHBondContact OD1-CA 3.48Å; N336-G444 PolarHBondContact OD1-N 3.14Å; T442-G444 PolarHBondContact O-N 3.12Å; G444-W446 VanDerWaalsContact C-N 3.28Å; G444-W446 PolarHBondContact O-N 3.38Å; G444-L447 PolarHBondContact O-N 3.45Å; G444-H448 PolarHBondContact O-N 2.71Å; G444-H448 VanDerWaalsContact O-N 3.13Å; G444-H448 PolarHBondContact O-ND1 3.48Å
445	F	93.8	Very high	93.7	Very high	41 Å²	41	51.3 Å²	51.3	18%	0.18	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-43.7	-179.1	169.1	-92	0	0	0	111.7	S128 I129 L132 T442 K443 H448 L449	S128-F445 VanDerWaalsContact O-CZ 3.28Å; S128-F445 WeakPolarHBondContact O-CZ 3.46Å; I129-F445 HydrophobicContact CG1-CE1 4.06Å; I129-F445 HydrophobicContact CG1-CZ 4.22Å; L132-F445 HydrophobicContact CD2-CD1 4.29Å; L132-F445 HydrophobicContact CD2-CE1 4.43Å; T442-F445 WeakPolarHBondContact O-CB 3.46Å; T442-F445 PolarHBondContact O-N 3.35Å; K443-F445 PolarHBondContact O-N 2.97Å; F445-H448 PolarHBondContact O-N 3.37Å; F445-L449 PolarHBondContact O-N 3.44Å
446	W	93.5	Very high	93.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-75.2	-34.2	-176	-48.4	99.6	0	0	0	111.4	I129 L132 I279 M282 Y328 F331 D332 W335 G444 H448 L449	I129-W446 HydrophobicContact CD1-CH2 4.04Å; I129-W446 HydrophobicContact CD1-CZ3 3.56Å; I129-W446 HydrophobicContact CG1-CH2 3.91Å; I129-W446 HydrophobicContact CG1-CZ3 3.62Å; I129-W446 HydrophobicContact CG2-CH2 4.02Å; L132-W446 HydrophobicContact CD2-CH2 4.42Å; L132-W446 HydrophobicContact CD2-CZ2 3.89Å; I279-W446 HydrophobicContact CG2-CH2 4.34Å; I279-W446 HydrophobicContact CG2-CZ2 4.39Å; M282-W446 HydrophobicContact CB-CH2 4.24Å; M282-W446 HydrophobicContact CG-CH2 4.18Å; Y328-W446 AromaticContact CD1-CE3 3.57Å; Y328-W446 HydrophobicContact CD1-CE3 3.57Å; Y328-W446 AromaticContact CD1-CZ3 3.63Å; Y328-W446 HydrophobicContact CD1-CZ3 3.63Å; Y328-W446 HydrophobicContact CE1-CE3 4.42Å; Y328-W446 HydrophobicContact CE1-CZ3 4.05Å; Y328-W446 HydrophobicContact CG-CE3 4.41Å; Y328-W446 WeakPolarHBondContact O-CB 3.4Å; F331-W446 AromaticContact CD1-CD1 3.92Å; F331-W446 HydrophobicContact CD1-CD2 4.29Å; F331-W446 AromaticContact CD1-CE2 3.85Å; F331-W446 HydrophobicContact CD1-CG 4.32Å; F331-W446 HydrophobicContact CD1-CZ2 4.37Å; F331-W446 AromaticContact CD1-NE1 3.6Å; F331-W446 AromaticContact CE1-CE2 3.87Å; F331-W446 HydrophobicContact CE1-CZ2 4.09Å; F331-W446 AromaticContact CE1-NE1 3.58Å; D332-W446 HydrophobicContact CB-CB 3.83Å; D332-W446 HydrophobicContact CB-CG 4.42Å; D332-W446 VanDerWaalsContact OD1-CB 3.3Å; D332-W446 WeakPolarHBondContact OD1-CB 3.46Å; D332-W446 PolarHBondContact OD1-N 3.41Å; W335-W446 AromaticContact CD1-CD1 3.85Å; W335-W446 AromaticContact CD1-NE1 3.54Å; W335-W446 AromaticContact CG-NE1 3.57Å; W335-W446 AromaticContact NE1-NE1 3.95Å; G444-W446 VanDerWaalsContact C-N 3.28Å; G444-W446 PolarHBondContact O-N 3.38Å; W446-H448 VanDerWaalsContact C-N 3.32Å; W446-H448 PolarHBondContact O-N 2.93Å; W446-L449 HydrophobicContact CE3-CD2 4.42Å; W446-L449 WeakPolarHBondContact O-CB 3.4Å; W446-L449 PolarHBondContact O-N 3.48Å
447	L	91.2	Very high	93.5	Very high	45 Å²	45	53.2 Å²	53.2	24%	0.236	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-37.6	173.5	-176.7	65.7	0	0	0	112.4	V329 D332 G444 P450 V486 W491	V329-L447 HydrophobicContact CG1-CD1 4.14Å; D332-L447 PolarHBondContact OD1-N 2.04Å; G444-L447 PolarHBondContact O-N 3.45Å; L447-P450 WeakPolarHBondContact O-CD 3.41Å; L447-V486 HydrophobicContact CD1-CG1 4.48Å; L447-W491 HydrophobicContact CD1-CZ3 4.31Å
448	H	92.8	Very high	93.4	Very high	118 Å²	118	50.2 Å²	50.2	55%	0.546	25%	0.249	S	C	.	.	H	α-helix	trans	-89.1	-7.7	-178.8	-66.5	91	0	0	0	114.1	G444 F445 W446 P450 K451 K452	G444-H448 PolarHBondContact O-N 2.71Å; G444-H448 VanDerWaalsContact O-N 3.13Å; G444-H448 PolarHBondContact O-ND1 3.48Å; F445-H448 PolarHBondContact O-N 3.37Å; W446-H448 VanDerWaalsContact C-N 3.32Å; W446-H448 PolarHBondContact O-N 2.93Å; H448-P450 VanDerWaalsContact C-CD 3.49Å; H448-K451 PolarHBondContact O-N 3.27Å; H448-K452 PolarHBondContact O-N 2.86Å
449	L	94.1	Very high	93.2	Very high	2 Å²	2	49 Å²	49	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-42.4	-178.2	-173.7	61.2	0	0	0	113.7	L325 F445 W446 K451 K452 L453	L325-L449 HydrophobicContact CD1-CB 4.09Å; L325-L449 HydrophobicContact CD1-CD2 3.96Å; L325-L449 HydrophobicContact CD1-CG 3.79Å; L325-L449 HydrophobicContact CD2-CD2 4.05Å; F445-L449 PolarHBondContact O-N 3.44Å; W446-L449 HydrophobicContact CE3-CD2 4.42Å; W446-L449 WeakPolarHBondContact O-CB 3.4Å; W446-L449 PolarHBondContact O-N 3.48Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.13Å; L449-K452 WeakPolarHBondContact O-CB 3.43Å; L449-K452 PolarHBondContact O-N 3.03Å; L449-K452 VanDerWaalsContact O-N 3.11Å; L449-L453 HydrophobicContact CD1-CG 4.49Å; L449-L453 HydrophobicContact CG-CG 4.46Å; L449-L453 WeakPolarHBondContact O-CG 3.49Å; L449-L453 PolarHBondContact O-N 3.47Å
450	P	94.4	Very high	92.8	Very high	3 Å²	3	52 Å²	52	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-54.4	-43.7	175.9	-25.3	33.2	0	0	0	113.2	L325 L447 H448 K452 L453 C454	L325-P450 HydrophobicContact CB-CG 4.38Å; L325-P450 HydrophobicContact CD1-CB 4.3Å; L325-P450 HydrophobicContact CD1-CG 3.75Å; L447-P450 WeakPolarHBondContact O-CD 3.41Å; H448-P450 VanDerWaalsContact C-CD 3.49Å; P450-K452 PolarHBondContact O-N 3.29Å; P450-L453 PolarHBondContact O-N 2.83Å; P450-C454 PolarHBondContact O-N 2.95Å
451	K	94	Very high	92.2	Very high	138 Å²	138	48.8 Å²	48.8	60%	0.6	27%	0.269	S	S	*	.	H	α-helix	trans	-63.9	-41.8	178.1	-174.3	176	-179.2	176	0	111.6	L318 H448 L449 C454 V455	L318-K451 HydrophobicContact CD2-CB 4.08Å; H448-K451 PolarHBondContact O-N 3.27Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.13Å; K451-C454 PolarHBondContact O-N 3.15Å; K451-V455 WeakPolarHBondContact O-CG2 3.44Å; K451-V455 PolarHBondContact O-N 3.11Å
452	K	94.5	Very high	91.1	Very high	85 Å²	85	46.1 Å²	46.1	37%	0.37	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-44.4	176.1	-169.1	-175.4	178.7	-159.2	0	111.4	S128 H448 L449 P450 C454 V455 E456	S128-K452 PolarHBondContact OG-NZ 3.46Å; H448-K452 PolarHBondContact O-N 2.86Å; L449-K452 WeakPolarHBondContact O-CB 3.43Å; L449-K452 PolarHBondContact O-N 3.03Å; L449-K452 VanDerWaalsContact O-N 3.11Å; P450-K452 PolarHBondContact O-N 3.29Å; K452-C454 PolarHBondContact O-N 2.93Å; K452-V455 PolarHBondContact O-N 3.43Å; K452-E456 PolarHBondContact O-N 3.45Å
453	L	96	Very high	89.4	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-42	177.1	-66.2	-174.3	0	0	0	112.3	F121 L124 V125 T321 L325 L449 P450 V455 E456 F457	F121-L453 HydrophobicContact CD2-CD1 3.99Å; F121-L453 HydrophobicContact CE2-CD1 3.56Å; F121-L453 HydrophobicContact CZ-CD1 4.42Å; L124-L453 HydrophobicContact CB-CD2 3.45Å; L124-L453 VanDerWaalsContact CB-CD2 3.45Å; L124-L453 HydrophobicContact CD1-CD2 4.42Å; V125-L453 HydrophobicContact CG2-CD1 3.9Å; V125-L453 HydrophobicContact CG2-CD2 4.26Å; T321-L453 HydrophobicContact CG2-CB 4.31Å; L325-L453 HydrophobicContact CD1-CD1 3.67Å; L325-L453 HydrophobicContact CG-CD1 4.45Å; L449-L453 HydrophobicContact CD1-CG 4.49Å; L449-L453 HydrophobicContact CG-CG 4.46Å; L449-L453 WeakPolarHBondContact O-CG 3.49Å; L449-L453 PolarHBondContact O-N 3.47Å; P450-L453 PolarHBondContact O-N 2.83Å; L453-V455 VanDerWaalsContact C-N 3.31Å; L453-V455 PolarHBondContact O-N 3.48Å; L453-E456 PolarHBondContact O-N 3.35Å; L453-F457 HydrophobicContact CB-CD2 4.34Å; L453-F457 HydrophobicContact CB-CE2 3.99Å; L453-F457 WeakPolarHBondContact O-CD2 3.39Å; L453-F457 WeakPolarHBondContact O-CG 3.44Å; L453-F457 PolarHBondContact O-N 2.86Å
454	C	94.7	Very high	87.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-36	177.7	-72.3	0	0	0	0	113.3	C317 L318 T321 P450 K451 K452 E456 F457 H458	C317-C454 HydrophobicContact CB-CB 4Å; C317-C454 WeakPolarHBondContact CB-SG 3.14Å; C317-C454 PolarHBondContact O-SG 3.15Å; C317-C454 WeakPolarHBondContact SG-CA 3.1Å; C317-C454 WeakPolarHBondContact SG-CB 3.43Å; C317-C454 CovalentContact SG-SG 2.04Å; C317-C454 PolarHBondContact SG-SG 2.83Å; L318-C454 PolarHBondContact N-SG 2.84Å; T321-C454 PolarHBondContact OG1-SG 2.95Å; P450-C454 PolarHBondContact O-N 2.95Å; K451-C454 PolarHBondContact O-N 3.15Å; K452-C454 PolarHBondContact O-N 2.93Å; C454-E456 VanDerWaalsContact C-N 3.34Å; C454-F457 PolarHBondContact O-N 2.82Å; C454-H458 WeakPolarHBondContact O-CB 3.16Å; C454-H458 PolarHBondContact O-CD2 3.41Å; C454-H458 PolarHBondContact O-N 3.32Å; C454-H458 PolarHBondContact O-ND1 3.27Å
455	V	93.6	Very high	85.4	Confident	91 Å²	91	62.2 Å²	62.2	55%	0.552	34%	0.339	S	S	*	.	H	α-helix	trans	-60.6	-45.2	172.8	172.9	0	0	0	0	110.8	K451 K452 L453 H458 A459	K451-V455 WeakPolarHBondContact O-CG2 3.44Å; K451-V455 PolarHBondContact O-N 3.11Å; K452-V455 PolarHBondContact O-N 3.43Å; L453-V455 VanDerWaalsContact C-N 3.31Å; L453-V455 PolarHBondContact O-N 3.48Å; V455-H458 PolarHBondContact O-N 3.21Å; V455-A459 PolarHBondContact O-N 3.3Å
456	E	94	Very high	83.5	Confident	88 Å²	88	63.4 Å²	63.4	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-66.2	-41.7	177.8	-64.3	-64.2	160.9	0	0	112.5	L124 K452 L453 C454 H458 A459 A460	L124-E456 HydrophobicContact CD1-CB 3.95Å; L124-E456 HydrophobicContact CD2-CB 3.8Å; L124-E456 HydrophobicContact CD2-CG 4.07Å; L124-E456 HydrophobicContact CG-CB 4.49Å; K452-E456 PolarHBondContact O-N 3.45Å; L453-E456 PolarHBondContact O-N 3.35Å; C454-E456 VanDerWaalsContact C-N 3.34Å; E456-H458 VanDerWaalsContact C-N 3.34Å; E456-H458 PolarHBondContact O-N 2.98Å; E456-A459 PolarHBondContact O-N 2.88Å; E456-A460 WeakPolarHBondContact O-CB 3.41Å; E456-A460 PolarHBondContact O-N 3.17Å
457	F	93.7	Very high	82.1	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.009	38%	0.379	C	S	.	.	H	α-helix	trans	-63.2	-39.4	175.4	-69.8	-48.8	0	0	0	112.3	E120 F121 L124 L295 M298 L299 T321 L453 C454 A460 A461	E120-F457 HydrophobicContact CG-CE1 4.1Å; F121-F457 HydrophobicContact CD2-CZ 4.36Å; L124-F457 HydrophobicContact CD1-CD1 3.83Å; L124-F457 HydrophobicContact CD1-CE1 3.47Å; L124-F457 VanDerWaalsContact CD1-CE1 3.47Å; L124-F457 HydrophobicContact CD1-CG 4.49Å; L124-F457 HydrophobicContact CD1-CZ 3.85Å; L295-F457 HydrophobicContact CD2-CE2 4.39Å; L295-F457 HydrophobicContact CD2-CZ 4.32Å; M298-F457 HydrophobicContact CE-CD2 4.07Å; M298-F457 HydrophobicContact CE-CE2 4.21Å; L299-F457 HydrophobicContact CD1-CD1 4.02Å; L299-F457 HydrophobicContact CD1-CE1 3.73Å; L299-F457 HydrophobicContact CD1-CZ 4.25Å; L299-F457 HydrophobicContact CD2-CB 4.11Å; L299-F457 HydrophobicContact CD2-CD1 3.75Å; L299-F457 HydrophobicContact CD2-CE1 4.3Å; L299-F457 HydrophobicContact CD2-CG 3.94Å; T321-F457 HydrophobicContact CG2-CD2 4.29Å; T321-F457 HydrophobicContact CG2-CE2 3.86Å; L453-F457 HydrophobicContact CB-CD2 4.34Å; L453-F457 HydrophobicContact CB-CE2 3.99Å; L453-F457 WeakPolarHBondContact O-CD2 3.39Å; L453-F457 WeakPolarHBondContact O-CG 3.44Å; L453-F457 PolarHBondContact O-N 2.86Å; C454-F457 PolarHBondContact O-N 2.82Å; F457-A460 PolarHBondContact O-N 3.23Å; F457-A461 PolarHBondContact O-N 3.13Å
458	H	91.3	Very high	81.5	Confident	45 Å²	45	71.9 Å²	71.9	21%	0.208	40%	0.395	C	S	.	.	H	α-helix	trans	-66.8	-38.1	174.6	-65	161.9	0	0	0	112	P312 C454 V455 E456 A460 A461	P312-H458 PolarHBondContact O-NE2 3.41Å; C454-H458 WeakPolarHBondContact O-CB 3.16Å; C454-H458 PolarHBondContact O-CD2 3.41Å; C454-H458 PolarHBondContact O-N 3.32Å; C454-H458 PolarHBondContact O-ND1 3.27Å; V455-H458 PolarHBondContact O-N 3.21Å; E456-H458 VanDerWaalsContact C-N 3.34Å; E456-H458 PolarHBondContact O-N 2.98Å; H458-A460 VanDerWaalsContact C-N 3.33Å; H458-A461 PolarHBondContact O-N 3.34Å
459	A	88.7	Confident	81.2	Confident	74 Å²	74	69.9 Å²	69.9	61%	0.612	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-38.5	175.1	0	0	0	0	0	111.8	V455 E456	V455-A459 PolarHBondContact O-N 3.3Å; E456-A459 PolarHBondContact O-N 2.88Å
460	A	85.8	Confident	81	Confident	63 Å²	63	69.8 Å²	69.8	52%	0.521	38%	0.382	S	S	.	.	H	α-helix	trans	-72	-29	177.9	0	0	0	0	0	113.9	E456 F457 H458 G462	E456-A460 WeakPolarHBondContact O-CB 3.41Å; E456-A460 PolarHBondContact O-N 3.17Å; F457-A460 PolarHBondContact O-N 3.23Å; H458-A460 VanDerWaalsContact C-N 3.33Å; A460-G462 PolarHBondContact O-N 3.28Å; A460-G462 VanDerWaalsContact O-N 3.12Å
461	A	81.5	Confident	80.9	Confident	22 Å²	22	69.7 Å²	69.7	18%	0.182	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-14.8	-176.4	0	0	0	0	0	114.3	G309 K311 F457 H458	G309-A461 CarbonylContact C-O 3.57Å; G309-A461 WeakPolarHBondContact CA-O 3.4Å; K311-A461 HydrophobicContact CB-CB 3.81Å; F457-A461 PolarHBondContact O-N 3.13Å; H458-A461 PolarHBondContact O-N 3.34Å
462	G	67.9	Low	80.8	Confident	43 Å²	43	65 Å²	65	44%	0.443	36%	0.363	S	S	.	.			trans	78.8	137.7	-179	0	0	0	0	0	112.4	A460 N464	A460-G462 PolarHBondContact O-N 3.28Å; A460-G462 VanDerWaalsContact O-N 3.12Å; G462-N464 VanDerWaalsContact C-N 3.3Å; G462-N464 PolarHBondContact O-N 2.94Å
463	S	57.3	Low	80.6	Confident	109 Å²	109	61.3 Å²	61.3	76%	0.762	35%	0.349	S	S	*	.	S	Bend	trans	-77	77.7	176.3	177.5	0	0	0	0	109.9
464	N	49	Very low	80.2	Confident	116 Å²	116	65.8 Å²	65.8	62%	0.62	38%	0.376	S	S	*	.			trans	-116.7	150.1	177.5	-112.3	-13.9	0	0	0	113.7	G462 S466	G462-N464 VanDerWaalsContact C-N 3.3Å; G462-N464 PolarHBondContact O-N 2.94Å; N464-S466 PolarHBondContact O-N 2.95Å
465	R	51.3	Low	79.9	Confident	219 Å²	219	68.6 Å²	68.6	83%	0.826	40%	0.396	S	S	*	.	S	Bend	trans	9	97.7	178.3	-71.8	179.8	172.1	173.9	-3.3	115.8
466	S	53.9	Low	79.6	Confident	67 Å²	67	67.5 Å²	67.5	47%	0.469	39%	0.387	S	S	.	.			trans	71.5	91.4	171.4	65.4	0	0	0	0	115.4	N464 Q468 Y469	N464-S466 PolarHBondContact O-N 2.95Å; S466-Q468 PolarHBondContact O-N 3.04Å; S466-Y469 PolarHBondContact O-N 3.4Å; S466-Y469 VanDerWaalsContact O-N 3.11Å
467	D	64.7	Low	79.2	Confident	104 Å²	104	67.7 Å²	67.7	56%	0.556	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-11.8	166.5	-84.5	-49.7	0	0	0	115.1	K311	K311-D467 PolarHBondContact NZ-O 3.28Å; K311-D467 IonicContact NZ-OD1 2.82Å; K311-D467 PolarHBondContact NZ-OD1 3.43Å
468	Q	77.7	Confident	78.6	Confident	119 Å²	119	73.4 Å²	73.4	56%	0.556	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-32.7	177	-80.6	-179.4	-16.8	0	0	114.2	S466 Q478 Q479	S466-Q468 PolarHBondContact O-N 3.04Å; Q468-Q478 CarbonylContact O-C 3.32Å; Q468-Q478 WeakPolarHBondContact O-CA 3.45Å; Q468-Q479 PolarHBondContact O-N 3.36Å
469	Y	87	Confident	77.7	Confident	76 Å²	76	74.2 Å²	74.2	30%	0.298	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.9	-176.6	-64.8	-83	0	0	0	111	Q310 S466 Q477 Q478	Q310-Y469 PolarHBondContact NE2-O 3.49Å; S466-Y469 PolarHBondContact O-N 3.4Å; S466-Y469 VanDerWaalsContact O-N 3.11Å; Y469-Q477 CarbonylContact C-O 3.52Å; Y469-Q477 VanDerWaalsContact CA-O 3.32Å; Y469-Q477 WeakPolarHBondContact CA-O 3.27Å; Y469-Q478 HydrophobicContact CE1-CB 4.46Å
470	C	91.1	Very high	76.7	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.1	-179.4	65.5	0	0	0	0	110.7	K311 C313 L476 Q477 Q479	K311-C470 WeakPolarHBondContact O-CA 3.27Å; C313-C470 WeakPolarHBondContact CA-SG 3.24Å; C313-C470 HydrophobicContact CB-CB 3.86Å; C313-C470 WeakPolarHBondContact CB-SG 3.46Å; C313-C470 WeakPolarHBondContact SG-CB 3.16Å; C313-C470 PolarHBondContact SG-O 3.33Å; C313-C470 CovalentContact SG-SG 2.03Å; C313-C470 PolarHBondContact SG-SG 3.22Å; C470-L476 WeakPolarHBondContact O-CA 3.35Å; C470-Q477 PolarHBondContact N-O 3.04Å; C470-Q477 PolarHBondContact O-N 2.72Å; C470-Q479 PolarHBondContact SG-OE1 3.4Å
471	W	92	Very high	75.5	Confident	1 Å²	1	79.2 Å²	79.2	0%	0.004	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.3	178.4	173.1	-111.2	0	0	0	112.1	Q297 M298 P302 L307 Q310 K311 P312 C313 G473 T474	Q297-W471 PolarHBondContact O-NE1 3.23Å; M298-W471 VanDerWaalsContact O-CD1 3.31Å; P302-W471 HydrophobicContact CB-CD2 4.33Å; P302-W471 HydrophobicContact CB-CE3 4.46Å; P302-W471 HydrophobicContact CG-CB 4.19Å; P302-W471 HydrophobicContact CG-CD2 3.6Å; P302-W471 HydrophobicContact CG-CE3 4.2Å; P302-W471 HydrophobicContact CG-CG 3.57Å; P302-W471 HydrophobicContact CG-CZ2 4.32Å; L307-W471 HydrophobicContact CD1-CE3 4.47Å; L307-W471 HydrophobicContact CD1-CZ3 4.36Å; Q310-W471 HydrophobicContact CG-CB 3.87Å; K311-W471 PolarHBondContact O-N 3.17Å; P312-W471 CarbonylContact C-O 3.52Å; P312-W471 WeakPolarHBondContact CA-O 3.34Å; C313-W471 PolarHBondContact N-O 3.22Å; C313-W471 VanDerWaalsContact SG-C 3.5Å; C313-W471 PolarHBondContact SG-O 3.18Å; W471-G473 VanDerWaalsContact CE2-CA 3.44Å; W471-G473 VanDerWaalsContact CZ2-O 3.27Å; W471-G473 WeakPolarHBondContact CZ2-O 3.36Å; W471-G473 VanDerWaalsContact NE1-CA 3.35Å; W471-T474 VanDerWaalsContact CH2-O 3.25Å; W471-T474 WeakPolarHBondContact CH2-O 3.22Å; W471-T474 VanDerWaalsContact CZ3-C 3.42Å; W471-T474 WeakPolarHBondContact CZ3-O 3.48Å
472	N	90.8	Very high	74.4	Confident	39 Å²	39	85.6 Å²	85.6	21%	0.209	45%	0.449	C	S	.	.			trans	-100.4	5.6	-179.2	73.4	8.9	0	0	0	114.7	T474 S475 Q477	N472-T474 PolarHBondContact OD1-N 3.2Å; N472-T474 PolarHBondContact OD1-OG1 3.2Å; N472-S475 PolarHBondContact N-O 3.24Å; N472-S475 PolarHBondContact OD1-N 3.12Å; N472-S475 PolarHBondContact OD1-O 2.03Å; N472-Q477 HydrophobicContact CB-CB 4.48Å; N472-Q477 PolarHBondContact ND2-OE1 3.5Å
473	G	90.5	Very high	73.9	Confident	7 Å²	7	89 Å²	89	7%	0.072	46%	0.463	C	S	.	.	S	Bend	trans	101.9	-15.1	-175.7	0	0	0	0	0	114.9	Q297 F316 W471	Q297-G473 PolarHBondContact NE2-O 3.04Å; Q297-G473 VanDerWaalsContact NE2-O 3.1Å; F316-G473 VanDerWaalsContact CZ-CA 3.44Å; W471-G473 VanDerWaalsContact CE2-CA 3.44Å; W471-G473 VanDerWaalsContact CZ2-O 3.27Å; W471-G473 WeakPolarHBondContact CZ2-O 3.36Å; W471-G473 VanDerWaalsContact NE1-CA 3.35Å
474	T	88.2	Confident	73.9	Confident	96 Å²	96	87 Å²	87	59%	0.589	45%	0.446	S	S	*	.	S	Bend	trans	-133.1	-41.6	179.8	57.6	0	0	0	0	113.6	W471 N472	W471-T474 VanDerWaalsContact CH2-O 3.25Å; W471-T474 WeakPolarHBondContact CH2-O 3.22Å; W471-T474 VanDerWaalsContact CZ3-C 3.42Å; W471-T474 WeakPolarHBondContact CZ3-O 3.48Å; N472-T474 PolarHBondContact OD1-N 3.2Å; N472-T474 PolarHBondContact OD1-OG1 3.2Å
475	S	87.2	Confident	74.1	Confident	59 Å²	59	89.6 Å²	89.6	41%	0.413	46%	0.455	S	S	.	.	S	Bend	trans	-146.4	172.8	-179.9	70.9	0	0	0	0	111.4	N472	N472-S475 PolarHBondContact N-O 3.24Å; N472-S475 PolarHBondContact OD1-N 3.12Å; N472-S475 PolarHBondContact OD1-O 2.03Å
476	L	87.9	Confident	74.3	Confident	69 Å²	69	81.3 Å²	81.3	36%	0.361	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	139.2	165.3	-64.4	177.2	0	0	0	109.7	L307 Q310 C470	L307-L476 HydrophobicContact CD1-CD1 4.21Å; L307-L476 HydrophobicContact CD1-CD2 4Å; L307-L476 HydrophobicContact CD1-CG 3.9Å; L307-L476 HydrophobicContact CD2-CD1 4.1Å; Q310-L476 HydrophobicContact CG-CD2 3.59Å; C470-L476 WeakPolarHBondContact O-CA 3.35Å
477	Q	85	Confident	74.3	Confident	91 Å²	91	80.5 Å²	80.5	43%	0.425	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.4	175	-173.7	179.4	-23	0	0	109	Y469 C470 N472 Q479	Y469-Q477 CarbonylContact C-O 3.52Å; Y469-Q477 VanDerWaalsContact CA-O 3.32Å; Y469-Q477 WeakPolarHBondContact CA-O 3.27Å; C470-Q477 PolarHBondContact N-O 3.04Å; C470-Q477 PolarHBondContact O-N 2.72Å; N472-Q477 HydrophobicContact CB-CB 4.48Å; N472-Q477 PolarHBondContact ND2-OE1 3.5Å; Q477-Q479 PolarHBondContact O-N 3.33Å
478	Q	82.3	Confident	73.7	Confident	122 Å²	122	79.3 Å²	79.3	57%	0.57	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	134.5	169.8	-169	172.7	6.2	0	0	109.9	Q468 Y469 S480	Q468-Q478 CarbonylContact O-C 3.32Å; Q468-Q478 WeakPolarHBondContact O-CA 3.45Å; Y469-Q478 HydrophobicContact CE1-CB 4.46Å; Q478-S480 PolarHBondContact O-N 3Å; Q478-S480 VanDerWaalsContact O-N 3.13Å
479	Q	71.8	Confident	72.6	Confident	62 Å²	62	80.9 Å²	80.9	29%	0.29	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-54.5	118.8	178.8	-175.8	77.4	13.7	0	0	109.9	Q468 C470 Q477	Q468-Q479 PolarHBondContact O-N 3.36Å; C470-Q479 PolarHBondContact SG-OE1 3.4Å; Q477-Q479 PolarHBondContact O-N 3.33Å
480	S	68.4	Low	71.1	Confident	45 Å²	45	84.5 Å²	84.5	32%	0.315	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-73.1	130.7	172	56.9	0	0	0	0	110	Q478 E482	Q478-S480 PolarHBondContact O-N 3Å; Q478-S480 VanDerWaalsContact O-N 3.13Å; S480-E482 PolarHBondContact O-N 3.46Å
481	E	61.1	Low	69.8	Low	197 Å²	197	86.9 Å²	86.9	92%	0.921	46%	0.461	S	S	*	.			trans	-78	-5.2	175.1	-67.9	-175.3	169.6	0	0	113.5	P483	E481-P483 WeakPolarHBondContact O-CD 3.28Å
482	E	58.4	Low	68.6	Low	157 Å²	157	90.6 Å²	90.6	73%	0.734	48%	0.481	S	S	*	.			trans	-65.6	125.4	-177.9	-72.9	-176.4	176.6	0	0	111.6	S480 V484	S480-E482 PolarHBondContact O-N 3.46Å; E482-V484 PolarHBondContact O-N 3.01Å
483	P	56.2	Low	67.8	Low	114 Å²	114	89 Å²	89	74%	0.74	47%	0.474	S	S	*	.			trans	-67.5	106.1	170.6	25.5	-29.1	0	0	0	108.6	E481 E485	E481-P483 WeakPolarHBondContact O-CD 3.28Å; P483-E485 VanDerWaalsContact C-N 3.29Å; P483-E485 PolarHBondContact O-N 2.88Å
484	V	57.3	Low	67.2	Low	67 Å²	67	91.8 Å²	91.8	41%	0.406	49%	0.485	S	S	.	.			trans	-72	94.1	163.7	179.1	0	0	0	0	106.9	S315 L318 E482 V486	S315-V484 VanDerWaalsContact CB-CG2 3.45Å; L318-V484 HydrophobicContact CD1-CB 4.34Å; E482-V484 PolarHBondContact O-N 3.01Å; V484-V486 PolarHBondContact O-N 3.35Å
485	E	52.9	Low	66.7	Low	171 Å²	171	91.4 Å²	91.4	80%	0.799	48%	0.483	S	S	*	.			trans	-72.6	121.9	164.1	-76.6	-171.8	170.1	0	0	108.6	P483 S487	P483-E485 VanDerWaalsContact C-N 3.29Å; P483-E485 PolarHBondContact O-N 2.88Å; E485-S487 PolarHBondContact O-N 3.04Å; E485-S487 VanDerWaalsContact O-N 3.07Å
486	V	55.2	Low	66	Low	45 Å²	45	90.4 Å²	90.4	27%	0.273	47%	0.472	S	S	.	.			trans	-67.5	99.7	163.3	161.7	0	0	0	0	106.7	L447 V484 P488 W491	L447-V486 HydrophobicContact CD1-CG1 4.48Å; V484-V486 PolarHBondContact O-N 3.35Å; V486-P488 WeakPolarHBondContact O-CD 3.43Å; V486-W491 HydrophobicContact CB-CH2 4.25Å; V486-W491 HydrophobicContact CB-CZ3 4.41Å; V486-W491 HydrophobicContact CG1-CE3 4.25Å; V486-W491 HydrophobicContact CG1-CH2 3.13Å; V486-W491 HydrophobicContact CG1-CZ2 4.45Å; V486-W491 HydrophobicContact CG1-CZ3 3.01Å; V486-W491 HydrophobicContact CG2-CH2 4.28Å
487	S	53.7	Low	65.5	Low	50 Å²	50	88 Å²	88	35%	0.35	46%	0.46	S	S	.	.			trans	-71.7	121.5	176.5	-178.1	0	0	0	0	109.7	E485 D489 Q490	E485-S487 PolarHBondContact O-N 3.04Å; E485-S487 VanDerWaalsContact O-N 3.07Å; S487-D489 PolarHBondContact O-N 2.81Å; S487-D489 PolarHBondContact OG-N 3.49Å; S487-Q490 WeakPolarHBondContact O-CB 3.1Å; S487-Q490 PolarHBondContact O-N 2.03Å; S487-Q490 VanDerWaalsContact O-N 3.09Å
488	P	53.2	Low	65.1	Low	79 Å²	79	91 Å²	91	51%	0.513	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-56.8	-29.5	174.7	-22.9	33.5	0	0	0	112.8	V486 Q490 W491	V486-P488 WeakPolarHBondContact O-CD 3.43Å; P488-Q490 PolarHBondContact O-N 3.23Å; P488-W491 PolarHBondContact O-N 3.43Å
489	D	55	Low	64.7	Low	151 Å²	151	88.3 Å²	88.3	81%	0.807	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-67.8	-15.2	-179.4	-64.8	-30.4	0	0	0	112.9	S487 W491	S487-D489 PolarHBondContact O-N 2.81Å; S487-D489 PolarHBondContact OG-N 3.49Å; D489-W491 PolarHBondContact O-N 2.89Å
490	Q	55.3	Low	64.5	Low	152 Å²	152	89.9 Å²	89.9	71%	0.71	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-73.3	-15.1	177.3	-167.9	153.3	23.8	0	0	113	S487 P488	S487-Q490 WeakPolarHBondContact O-CB 3.1Å; S487-Q490 PolarHBondContact O-N 2.03Å; S487-Q490 VanDerWaalsContact O-N 3.09Å; P488-Q490 PolarHBondContact O-N 3.23Å
491	W	63.3	Low	64.7	Low	50 Å²	50	95.7 Å²	95.7	19%	0.189	51%	0.507	C	S	.	.			trans	-125.4	88.1	-179.4	-59.6	-61.2	0	0	0	111.1	V329 L447 V486 P488 D489 A493 L496	V329-W491 HydrophobicContact CG1-CB 4.5Å; V329-W491 HydrophobicContact CG1-CD2 4.23Å; V329-W491 HydrophobicContact CG1-CE3 3.79Å; V329-W491 HydrophobicContact CG1-CZ3 4.22Å; L447-W491 HydrophobicContact CD1-CZ3 4.31Å; V486-W491 HydrophobicContact CB-CH2 4.25Å; V486-W491 HydrophobicContact CB-CZ3 4.41Å; V486-W491 HydrophobicContact CG1-CE3 4.25Å; V486-W491 HydrophobicContact CG1-CH2 3.13Å; V486-W491 HydrophobicContact CG1-CZ2 4.45Å; V486-W491 HydrophobicContact CG1-CZ3 3.01Å; V486-W491 HydrophobicContact CG2-CH2 4.28Å; P488-W491 PolarHBondContact O-N 3.43Å; D489-W491 PolarHBondContact O-N 2.89Å; W491-A493 VanDerWaalsContact C-N 3.35Å; W491-A493 PolarHBondContact O-N 3.06Å; W491-L496 HydrophobicContact CB-CD1 3.56Å; W491-L496 HydrophobicContact CG-CD1 4.01Å
492	D	68	Low	65.5	Low	79 Å²	79	86.7 Å²	86.7	42%	0.422	47%	0.465	S	S	.	.			trans	-65.7	99.2	164.2	177.5	14.3	0	0	0	109.5	E494 T495 L496	D492-E494 PolarHBondContact O-N 3.24Å; D492-E494 VanDerWaalsContact O-N 3.14Å; D492-E494 PolarHBondContact OD1-N 3.39Å; D492-E494 VanDerWaalsContact OD1-N 3.17Å; D492-T495 PolarHBondContact O-N 2.93Å; D492-T495 VanDerWaalsContact O-N 3.12Å; D492-T495 VanDerWaalsContact OD2-CB 3.3Å; D492-T495 WeakPolarHBondContact OD2-CB 3.44Å; D492-T495 PolarHBondContact OD2-OG1 3.46Å; D492-L496 WeakPolarHBondContact O-CG 3.46Å; D492-L496 PolarHBondContact O-N 2.8Å
493	A	73.5	Confident	66.5	Low	7 Å²	7	81.9 Å²	81.9	6%	0.058	44%	0.442	C	S	.	.	H	α-helix	trans	-54	-33.6	-177.6	0	0	0	0	0	113.3	V330 R333 W491 L497	V330-A493 HydrophobicContact CG1-CB 4.36Å; R333-A493 HydrophobicContact CB-CB 4.38Å; W491-A493 VanDerWaalsContact C-N 3.35Å; W491-A493 PolarHBondContact O-N 3.06Å; A493-L497 WeakPolarHBondContact O-CB 3.43Å; A493-L497 PolarHBondContact O-N 2.74Å
494	E	77.2	Confident	67.9	Low	65 Å²	65	80.6 Å²	80.6	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-77.5	-36.1	-178.9	-172.8	63	-155.5	0	0	111.9	D492 K498 R514	D492-E494 PolarHBondContact O-N 3.24Å; D492-E494 VanDerWaalsContact O-N 3.14Å; D492-E494 PolarHBondContact OD1-N 3.39Å; D492-E494 VanDerWaalsContact OD1-N 3.17Å; E494-K498 WeakPolarHBondContact O-CG 3.25Å; E494-K498 PolarHBondContact O-N 3.41Å; E494-K498 WeakPolarHBondContact OE1-CE 3.41Å; E494-K498 IonicContact OE1-NZ 2.89Å; E494-R514 IonicContact OE2-CZ 2.83Å; E494-R514 IonicContact OE2-NH1 2.66Å; E494-R514 IonicContact OE2-NH2 3.16Å; E494-R514 PolarHBondContact OE2-NH2 3.38Å
495	T	77	Confident	69.4	Low	88 Å²	88	79.7 Å²	79.7	54%	0.54	43%	0.429	S	S	.	.	H	α-helix	trans	-68	-44.7	172.9	-65.6	0	0	0	0	110.7	D492 L497 K498 D499	D492-T495 PolarHBondContact O-N 2.93Å; D492-T495 VanDerWaalsContact O-N 3.12Å; D492-T495 VanDerWaalsContact OD2-CB 3.3Å; D492-T495 WeakPolarHBondContact OD2-CB 3.44Å; D492-T495 PolarHBondContact OD2-OG1 3.46Å; T495-L497 PolarHBondContact O-N 3.23Å; T495-K498 PolarHBondContact O-N 3.49Å; T495-D499 PolarHBondContact O-N 2.81Å
496	L	74.3	Confident	71.2	Confident	37 Å²	37	71.6 Å²	71.6	19%	0.194	39%	0.391	C	S	.	.	H	α-helix	trans	-62.8	-42.4	176.3	-70.8	173.2	0	0	0	111.9	V326 V330 W491 D492 K498 D499 I502	V326-L496 HydrophobicContact CG2-CD1 4.13Å; V326-L496 HydrophobicContact CG2-CD2 4.43Å; V330-L496 HydrophobicContact CG2-CB 3.59Å; V330-L496 HydrophobicContact CG2-CD1 3.84Å; V330-L496 HydrophobicContact CG2-CG 4.4Å; W491-L496 HydrophobicContact CB-CD1 3.56Å; W491-L496 HydrophobicContact CG-CD1 4.01Å; D492-L496 WeakPolarHBondContact O-CG 3.46Å; D492-L496 PolarHBondContact O-N 2.8Å; L496-K498 PolarHBondContact O-N 3.11Å; L496-K498 VanDerWaalsContact O-N 3.12Å; L496-D499 WeakPolarHBondContact O-CB 3.28Å; L496-D499 PolarHBondContact O-N 2.82Å; L496-I502 HydrophobicContact CB-CD1 4.02Å; L496-I502 WeakPolarHBondContact O-CD1 3.38Å; L496-I502 WeakPolarHBondContact O-CG1 3.11Å
497	L	76.4	Confident	72.9	Confident	19 Å²	19	73.7 Å²	73.7	10%	0.099	39%	0.394	C	S	.	.	H	α-helix	trans	-58.6	-27.8	177.7	-169.3	67.4	0	0	0	113.3	V330 A493 T495 I506 R507 V510	V330-L497 HydrophobicContact CG1-CB 4.1Å; V330-L497 HydrophobicContact CG1-CD1 3.99Å; A493-L497 WeakPolarHBondContact O-CB 3.43Å; A493-L497 PolarHBondContact O-N 2.74Å; T495-L497 PolarHBondContact O-N 3.23Å; L497-I506 HydrophobicContact CD1-CG2 4.41Å; L497-R507 HydrophobicContact CD1-CG 3.94Å; L497-V510 HydrophobicContact CD1-CB 4.4Å; L497-V510 HydrophobicContact CD1-CG1 4.48Å; L497-V510 HydrophobicContact CD1-CG2 4.22Å; L497-V510 HydrophobicContact CD2-CG1 3.84Å
498	K	76.5	Confident	74.7	Confident	155 Å²	155	76.3 Å²	76.3	67%	0.674	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.1	176.3	-68.4	170.8	-175	170	0	113.3	E494 T495 L496	E494-K498 WeakPolarHBondContact O-CG 3.25Å; E494-K498 PolarHBondContact O-N 3.41Å; E494-K498 WeakPolarHBondContact OE1-CE 3.41Å; E494-K498 IonicContact OE1-NZ 2.89Å; T495-K498 PolarHBondContact O-N 3.49Å; L496-K498 PolarHBondContact O-N 3.11Å; L496-K498 VanDerWaalsContact O-N 3.12Å
499	D	73.8	Confident	76.7	Confident	65 Å²	65	73.1 Å²	73.1	35%	0.348	38%	0.379	S	S	.	.	S	Bend	trans	-63.9	135.2	176.7	-159.3	-30.8	0	0	0	110.3	T495 L496 E501 I502 R507	T495-D499 PolarHBondContact O-N 2.81Å; L496-D499 WeakPolarHBondContact O-CB 3.28Å; L496-D499 PolarHBondContact O-N 2.82Å; D499-E501 PolarHBondContact O-N 3.35Å; D499-E501 PolarHBondContact OD1-N 3.25Å; D499-E501 VanDerWaalsContact OD1-N 3.09Å; D499-I502 HydrophobicContact CB-CG1 4.35Å; D499-I502 PolarHBondContact O-N 2.82Å; D499-R507 PolarHBondContact O-NH1 3.03Å
500	A	68.9	Low	78.5	Confident	94 Å²	94	66 Å²	66	78%	0.777	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.9	177.9	0	0	0	0	0	111.6	I502	A500-I502 VanDerWaalsContact C-N 3.31Å; A500-I502 PolarHBondContact O-N 3.43Å
501	E	71.6	Confident	80.3	Confident	167 Å²	167	60.6 Å²	60.6	78%	0.78	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-17	179.7	-64.2	-173.1	176.2	0	0	113.8	D499	D499-E501 PolarHBondContact O-N 3.35Å; D499-E501 PolarHBondContact OD1-N 3.25Å; D499-E501 VanDerWaalsContact OD1-N 3.09Å
502	I	77.1	Confident	81.8	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.046	33%	0.325	C	S	.	.	S	Bend	trans	-71	137.4	177.6	-66.3	-151.5	0	0	0	111.4	V330 L496 D499 A500 I506 R507	V330-I502 HydrophobicContact CB-CD1 4.49Å; V330-I502 HydrophobicContact CG2-CD1 3.88Å; L496-I502 HydrophobicContact CB-CD1 4.02Å; L496-I502 WeakPolarHBondContact O-CD1 3.38Å; L496-I502 WeakPolarHBondContact O-CG1 3.11Å; D499-I502 HydrophobicContact CB-CG1 4.35Å; D499-I502 PolarHBondContact O-N 2.82Å; A500-I502 VanDerWaalsContact C-N 3.31Å; A500-I502 PolarHBondContact O-N 3.43Å; I502-I506 HydrophobicContact CG2-CB 4.12Å; I502-I506 HydrophobicContact CG2-CG2 3.96Å; I502-R507 VanDerWaalsContact O-CZ 3.22Å; I502-R507 PolarHBondContact O-NH1 2.98Å; I502-R507 PolarHBondContact O-NH2 3Å
503	E	81	Confident	83.2	Confident	56 Å²	56	57.6 Å²	57.6	26%	0.262	31%	0.305	S	S	.	.			trans	-57.9	131.7	179.7	-159.6	-174.3	153.9	0	0	111	T505 I506 R507	E503-T505 HydrophobicContact CG-CG2 4.42Å; E503-T505 WeakPolarHBondContact CG-OG1 3.48Å; E503-T505 PolarHBondContact O-N 3.2Å; E503-T505 WeakPolarHBondContact OE1-CG2 3.46Å; E503-T505 PolarHBondContact OE1-OG1 2.95Å; E503-I506 HydrophobicContact CB-CG1 4.28Å; E503-I506 WeakPolarHBondContact O-CB 3.37Å; E503-I506 PolarHBondContact O-N 3.49Å; E503-I506 VanDerWaalsContact O-N 3.16Å; E503-R507 PolarHBondContact O-N 3.39Å
504	P	85.9	Confident	84.2	Confident	86 Å²	86	60.9 Å²	60.9	56%	0.558	32%	0.316	S	S	*	.	H	α-helix	trans	-61	-28.2	-179.6	23.7	-34.3	0	0	0	113.3	R507 E508	P504-R507 PolarHBondContact O-N 2.99Å; P504-E508 PolarHBondContact O-N 3.35Å; P504-E508 VanDerWaalsContact O-N 3.15Å
505	T	88.5	Confident	85.1	Confident	49 Å²	49	64.2 Å²	64.2	30%	0.301	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-41.8	177	57.9	0	0	0	0	111.4	E503 R507 E508 M509	E503-T505 HydrophobicContact CG-CG2 4.42Å; E503-T505 WeakPolarHBondContact CG-OG1 3.48Å; E503-T505 PolarHBondContact O-N 3.2Å; E503-T505 WeakPolarHBondContact OE1-CG2 3.46Å; E503-T505 PolarHBondContact OE1-OG1 2.95Å; T505-R507 PolarHBondContact O-N 3.37Å; T505-E508 WeakPolarHBondContact O-CB 2.99Å; T505-E508 PolarHBondContact O-N 3.21Å; T505-M509 WeakPolarHBondContact O-CG 3.33Å; T505-M509 PolarHBondContact O-N 3.44Å
506	I	90.4	Very high	85.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-43.5	175.4	-70.6	-75.5	0	0	0	111.1	M282 M285 L497 I502 E503 E508 M509 V510	M282-I506 HydrophobicContact CE-CD1 3.72Å; M282-I506 HydrophobicContact SD-CD1 3.72Å; M285-I506 HydrophobicContact CE-CD1 3.8Å; M285-I506 HydrophobicContact SD-CD1 3.27Å; M285-I506 WeakPolarHBondContact SD-CD1 3.39Å; M285-I506 HydrophobicContact SD-CG1 3.62Å; L497-I506 HydrophobicContact CD1-CG2 4.41Å; I502-I506 HydrophobicContact CG2-CB 4.12Å; I502-I506 HydrophobicContact CG2-CG2 3.96Å; E503-I506 HydrophobicContact CB-CG1 4.28Å; E503-I506 WeakPolarHBondContact O-CB 3.37Å; E503-I506 PolarHBondContact O-N 3.49Å; E503-I506 VanDerWaalsContact O-N 3.16Å; I506-E508 VanDerWaalsContact C-N 3.28Å; I506-E508 PolarHBondContact O-N 2.92Å; I506-M509 PolarHBondContact O-N 2.99Å; I506-V510 HydrophobicContact CG2-CG2 4.25Å; I506-V510 WeakPolarHBondContact O-CB 3.05Å; I506-V510 WeakPolarHBondContact O-CG2 3.19Å; I506-V510 PolarHBondContact O-N 3.38Å
507	R	90.3	Very high	86.9	Confident	90 Å²	90	58.7 Å²	58.7	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-41.7	176.5	-73.1	-170.4	-76.6	-92.6	-7.1	111.4	L497 D499 I502 E503 P504 T505 A511	L497-R507 HydrophobicContact CD1-CG 3.94Å; D499-R507 PolarHBondContact O-NH1 3.03Å; I502-R507 VanDerWaalsContact O-CZ 3.22Å; I502-R507 PolarHBondContact O-NH1 2.98Å; I502-R507 PolarHBondContact O-NH2 3Å; E503-R507 PolarHBondContact O-N 3.39Å; P504-R507 PolarHBondContact O-N 2.99Å; T505-R507 PolarHBondContact O-N 3.37Å; R507-A511 WeakPolarHBondContact O-CB 3.41Å; R507-A511 PolarHBondContact O-N 3.17Å
508	E	92.2	Very high	87.8	Confident	105 Å²	105	62.5 Å²	62.5	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-45	176.1	-164.1	-165.8	147.4	0	0	112.2	P504 T505 I506 A511 R512	P504-E508 PolarHBondContact O-N 3.35Å; P504-E508 VanDerWaalsContact O-N 3.15Å; T505-E508 WeakPolarHBondContact O-CB 2.99Å; T505-E508 PolarHBondContact O-N 3.21Å; I506-E508 VanDerWaalsContact C-N 3.28Å; I506-E508 PolarHBondContact O-N 2.92Å; E508-A511 PolarHBondContact O-N 3.1Å; E508-R512 WeakPolarHBondContact O-CB 3.46Å; E508-R512 PolarHBondContact O-N 2.92Å; E508-R512 IonicContact OE1-CZ 2.76Å; E508-R512 IonicContact OE1-NH2 2.72Å; E508-R512 PolarHBondContact OE1-NH2 3.2Å
509	M	93.9	Very high	88.5	Confident	12 Å²	12	57.6 Å²	57.6	6%	0.059	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-46.2	177.9	-70.7	-176.2	-140.5	0	0	111.7	V278 D281 M282 M285 T505 I506 A511 R512 I513	V278-M509 HydrophobicContact CG1-CB 3.91Å; V278-M509 HydrophobicContact CG1-CG 4.13Å; V278-M509 HydrophobicContact CG1-SD 4.18Å; D281-M509 HydrophobicContact CB-CE 3.61Å; D281-M509 HydrophobicContact CB-SD 3.96Å; M282-M509 HydrophobicContact CE-CB 4.33Å; M282-M509 HydrophobicContact CE-SD 3.51Å; M282-M509 VanDerWaalsContact CE-SD 3.51Å; M282-M509 HydrophobicContact CG-SD 3.98Å; M282-M509 HydrophobicContact SD-SD 3.77Å; M285-M509 HydrophobicContact CG-CE 4.3Å; M285-M509 HydrophobicContact SD-CE 4.14Å; T505-M509 WeakPolarHBondContact O-CG 3.33Å; T505-M509 PolarHBondContact O-N 3.44Å; I506-M509 PolarHBondContact O-N 2.99Å; M509-A511 PolarHBondContact O-N 3.21Å; M509-R512 WeakPolarHBondContact O-CB 3.41Å; M509-R512 PolarHBondContact O-N 3.41Å; M509-I513 WeakPolarHBondContact O-CG1 3.42Å; M509-I513 PolarHBondContact O-N 2.9Å
510	V	93.7	Very high	89.5	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-44.9	175.1	169.7	0	0	0	0	110.9	F331 H334 L497 I506 R512 I513 R514	F331-V510 HydrophobicContact CD2-CG2 4.03Å; H334-V510 WeakPolarHBondContact CD2-CG1 3.47Å; L497-V510 HydrophobicContact CD1-CB 4.4Å; L497-V510 HydrophobicContact CD1-CG1 4.48Å; L497-V510 HydrophobicContact CD1-CG2 4.22Å; L497-V510 HydrophobicContact CD2-CG1 3.84Å; I506-V510 HydrophobicContact CG2-CG2 4.25Å; I506-V510 WeakPolarHBondContact O-CB 3.05Å; I506-V510 WeakPolarHBondContact O-CG2 3.19Å; I506-V510 PolarHBondContact O-N 3.38Å; V510-R512 VanDerWaalsContact C-N 3.26Å; V510-R512 PolarHBondContact O-N 3.49Å; V510-I513 PolarHBondContact O-N 2.98Å; V510-R514 HydrophobicContact CG1-CG 4.26Å; V510-R514 WeakPolarHBondContact O-CB 3.5Å; V510-R514 WeakPolarHBondContact O-CG 2.99Å; V510-R514 PolarHBondContact O-N 3.47Å
511	A	93.5	Very high	90.7	Very high	38 Å²	38	54.1 Å²	54.1	31%	0.314	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-36.9	176.5	0	0	0	0	0	112.1	R507 E508 M509 R515	R507-A511 WeakPolarHBondContact O-CB 3.41Å; R507-A511 PolarHBondContact O-N 3.17Å; E508-A511 PolarHBondContact O-N 3.1Å; M509-A511 PolarHBondContact O-N 3.21Å; A511-R515 WeakPolarHBondContact O-CB 3.21Å; A511-R515 WeakPolarHBondContact O-CG 3.18Å; A511-R515 PolarHBondContact O-N 2.88Å; A511-R515 VanDerWaalsContact O-N 3.07Å; A511-R515 PolarHBondContact O-NE 3.05Å; A511-R515 VanDerWaalsContact O-NE 3.16Å
512	R	95.2	Very high	91.6	Very high	66 Å²	66	52.4 Å²	52.4	25%	0.249	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-45.4	177	-162.5	-179.3	-66	-156.6	1	111.6	V274 V278 E508 M509 V510 R515 T516	V274-R512 HydrophobicContact CG1-CG 3.72Å; V278-R512 HydrophobicContact CG2-CB 4.46Å; V278-R512 HydrophobicContact CG2-CG 4.5Å; E508-R512 WeakPolarHBondContact O-CB 3.46Å; E508-R512 PolarHBondContact O-N 2.92Å; E508-R512 IonicContact OE1-CZ 2.76Å; E508-R512 IonicContact OE1-NH2 2.72Å; E508-R512 PolarHBondContact OE1-NH2 3.2Å; M509-R512 WeakPolarHBondContact O-CB 3.41Å; M509-R512 PolarHBondContact O-N 3.41Å; V510-R512 VanDerWaalsContact C-N 3.26Å; V510-R512 PolarHBondContact O-N 3.49Å; R512-R515 PolarHBondContact O-N 3.37Å; R512-T516 PolarHBondContact O-N 3.15Å; R512-T516 VanDerWaalsContact O-N 3.09Å; R512-T516 PolarHBondContact O-OG1 3.21Å
513	I	96	Very high	92.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-47.4	175.3	-71.9	-63.9	0	0	0	111.7	V274 V278 F331 H334 Y338 M509 V510 R515 T516 V517	V274-I513 HydrophobicContact CG1-CD1 4.44Å; V278-I513 HydrophobicContact CB-CD1 4.36Å; V278-I513 HydrophobicContact CG1-CD1 4.38Å; V278-I513 HydrophobicContact CG1-CG1 4.15Å; V278-I513 HydrophobicContact CG2-CD1 4.21Å; V278-I513 HydrophobicContact CG2-CG1 4.23Å; F331-I513 HydrophobicContact CE2-CG1 3.87Å; F331-I513 HydrophobicContact CZ-CG1 4.17Å; H334-I513 HydrophobicContact CB-CG2 4.27Å; H334-I513 WeakPolarHBondContact O-CG2 3.32Å; Y338-I513 HydrophobicContact CD1-CD1 4.45Å; Y338-I513 HydrophobicContact CD2-CD1 4.15Å; Y338-I513 HydrophobicContact CG-CD1 4.12Å; Y338-I513 HydrophobicContact CG-CG2 4.25Å; M509-I513 WeakPolarHBondContact O-CG1 3.42Å; M509-I513 PolarHBondContact O-N 2.9Å; V510-I513 PolarHBondContact O-N 2.98Å; I513-R515 VanDerWaalsContact C-N 3.31Å; I513-R515 PolarHBondContact O-N 2.86Å; I513-T516 WeakPolarHBondContact O-CB 3.41Å; I513-T516 PolarHBondContact O-N 3.5Å; I513-V517 HydrophobicContact CG2-CG2 4.35Å; I513-V517 WeakPolarHBondContact O-CG2 3.37Å; I513-V517 PolarHBondContact O-N 3.37Å
514	R	95.5	Very high	92.5	Very high	76 Å²	76	50.9 Å²	50.9	29%	0.287	24%	0.241	S	C	.	.	H	α-helix	trans	-58.2	-42.3	177.5	-73.1	-179.6	-174.4	-170	0.5	111.9	H334 E494 V510 T516 V517 N518	H334-R514 PolarHBondContact CE1-NE 2.95Å; H334-R514 VanDerWaalsContact CE1-NE 3.29Å; H334-R514 PolarHBondContact CE1-NH2 3.23Å; H334-R514 PolarHBondContact NE2-NH2 2.74Å; E494-R514 IonicContact OE2-CZ 2.83Å; E494-R514 IonicContact OE2-NH1 2.66Å; E494-R514 IonicContact OE2-NH2 3.16Å; E494-R514 PolarHBondContact OE2-NH2 3.38Å; V510-R514 HydrophobicContact CG1-CG 4.26Å; V510-R514 WeakPolarHBondContact O-CB 3.5Å; V510-R514 WeakPolarHBondContact O-CG 2.99Å; V510-R514 PolarHBondContact O-N 3.47Å; R514-T516 VanDerWaalsContact C-N 3.35Å; R514-T516 PolarHBondContact O-N 3.17Å; R514-V517 PolarHBondContact O-N 2.84Å; R514-N518 VanDerWaalsContact O-CG 3.29Å; R514-N518 PolarHBondContact O-N 3.03Å; R514-N518 PolarHBondContact O-ND2 2.97Å
515	R	94.9	Very high	92.5	Very high	135 Å²	135	51 Å²	51	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-45.5	173.8	-81.3	179.3	-88.4	119.2	-8	111.6	A511 R512 I513 N518 E519	A511-R515 WeakPolarHBondContact O-CB 3.21Å; A511-R515 WeakPolarHBondContact O-CG 3.18Å; A511-R515 PolarHBondContact O-N 2.88Å; A511-R515 VanDerWaalsContact O-N 3.07Å; A511-R515 PolarHBondContact O-NE 3.05Å; A511-R515 VanDerWaalsContact O-NE 3.16Å; R512-R515 PolarHBondContact O-N 3.37Å; I513-R515 VanDerWaalsContact C-N 3.31Å; I513-R515 PolarHBondContact O-N 2.86Å; R515-N518 PolarHBondContact O-N 2.94Å; R515-E519 WeakPolarHBondContact O-CG 3Å; R515-E519 PolarHBondContact O-N 2.99Å; R515-E519 VanDerWaalsContact O-N 3.08Å
516	T	94.5	Very high	91.8	Very high	7 Å²	7	52 Å²	52	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-42.9	176.9	-61.9	0	0	0	0	112.5	A271 V274 Y338 R512 I513 R514 N518 E519 L520	A271-T516 HydrophobicContact CB-CG2 3.46Å; A271-T516 VanDerWaalsContact CB-CG2 3.46Å; V274-T516 WeakPolarHBondContact CG1-OG1 3.27Å; Y338-T516 HydrophobicContact CD2-CG2 4.11Å; Y338-T516 HydrophobicContact CE2-CG2 3.86Å; R512-T516 PolarHBondContact O-N 3.15Å; R512-T516 VanDerWaalsContact O-N 3.09Å; R512-T516 PolarHBondContact O-OG1 3.21Å; I513-T516 WeakPolarHBondContact O-CB 3.41Å; I513-T516 PolarHBondContact O-N 3.5Å; R514-T516 VanDerWaalsContact C-N 3.35Å; R514-T516 PolarHBondContact O-N 3.17Å; T516-N518 VanDerWaalsContact C-N 3.31Å; T516-N518 PolarHBondContact O-N 2.96Å; T516-E519 PolarHBondContact O-N 2.89Å; T516-L520 HydrophobicContact CG2-CD1 4.15Å; T516-L520 HydrophobicContact CG2-CG 4.45Å; T516-L520 WeakPolarHBondContact O-CG 2.97Å; T516-L520 PolarHBondContact O-N 3.36Å
517	V	96	Very high	90.4	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-56.6	-45.8	174.3	167.7	0	0	0	0	111.1	E337 I513 R514 E519 L520 K521	E337-V517 HydrophobicContact CG-CG1 4.12Å; E337-V517 HydrophobicContact CG-CG2 4.47Å; I513-V517 HydrophobicContact CG2-CG2 4.35Å; I513-V517 WeakPolarHBondContact O-CG2 3.37Å; I513-V517 PolarHBondContact O-N 3.37Å; R514-V517 PolarHBondContact O-N 2.84Å; V517-E519 VanDerWaalsContact C-N 3.34Å; V517-E519 PolarHBondContact O-N 3.29Å; V517-L520 PolarHBondContact O-N 2.6Å; V517-K521 HydrophobicContact CG1-CD 3.95Å; V517-K521 VanDerWaalsContact CG1-CE 3.47Å; V517-K521 HydrophobicContact CG1-CG 4.46Å; V517-K521 WeakPolarHBondContact O-CB 3.34Å; V517-K521 WeakPolarHBondContact O-CG 3.43Å; V517-K521 PolarHBondContact O-N 2.84Å
518	N	94.8	Very high	88.8	Confident	98 Å²	98	52 Å²	52	52%	0.524	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-39.5	178.5	-69.4	-18.5	0	0	0	112.1	R514 R515 T516 K521 K522	R514-N518 VanDerWaalsContact O-CG 3.29Å; R514-N518 PolarHBondContact O-N 3.03Å; R514-N518 PolarHBondContact O-ND2 2.97Å; R515-N518 PolarHBondContact O-N 2.94Å; T516-N518 VanDerWaalsContact C-N 3.31Å; T516-N518 PolarHBondContact O-N 2.96Å; N518-K521 PolarHBondContact O-N 3.03Å; N518-K522 VanDerWaalsContact O-CB 3.3Å; N518-K522 WeakPolarHBondContact O-CB 3.22Å; N518-K522 PolarHBondContact O-N 3.49Å
519	E	91.3	Very high	87	Confident	53 Å²	53	55.4 Å²	55.4	25%	0.248	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-41.9	176	-69.1	-71.5	112.9	0	0	112.1	R192 T267 R515 T516 V517 K522 V523	R192-E519 IonicContact CZ-OE2 2.69Å; R192-E519 IonicContact NH1-OE2 3.56Å; R192-E519 IonicContact NH2-OE2 3.05Å; R192-E519 PolarHBondContact NH2-OE2 2.74Å; T267-E519 HydrophobicContact CG2-CB 4.43Å; R515-E519 WeakPolarHBondContact O-CG 3Å; R515-E519 PolarHBondContact O-N 2.99Å; R515-E519 VanDerWaalsContact O-N 3.08Å; T516-E519 PolarHBondContact O-N 2.89Å; V517-E519 VanDerWaalsContact C-N 3.34Å; V517-E519 PolarHBondContact O-N 3.29Å; E519-K522 PolarHBondContact O-N 2.95Å; E519-V523 PolarHBondContact O-N 2.63Å; E519-V523 VanDerWaalsContact O-N 3.12Å
520	L	94.3	Very high	85	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.7	-51.5	173	-71.8	166.7	0	0	0	110.5	T267 A271 Y338 L342 L345 T516 V517 K522 V523 M524	T267-L520 HydrophobicContact CG2-CD2 4.16Å; A271-L520 HydrophobicContact CB-CD1 4.05Å; A271-L520 HydrophobicContact CB-CD2 3.77Å; A271-L520 HydrophobicContact CB-CG 4.09Å; Y338-L520 HydrophobicContact CD2-CD1 4.38Å; Y338-L520 HydrophobicContact CE2-CD1 4.49Å; L342-L520 HydrophobicContact CB-CD1 4.28Å; L342-L520 HydrophobicContact CD1-CD2 4.49Å; L345-L520 HydrophobicContact CB-CD2 4.13Å; L345-L520 HydrophobicContact CD2-CD2 3.4Å; L345-L520 HydrophobicContact CG-CD2 4.41Å; T516-L520 HydrophobicContact CG2-CD1 4.15Å; T516-L520 HydrophobicContact CG2-CG 4.45Å; T516-L520 WeakPolarHBondContact O-CG 2.97Å; T516-L520 PolarHBondContact O-N 3.36Å; V517-L520 PolarHBondContact O-N 2.6Å; L520-K522 VanDerWaalsContact C-N 3.32Å; L520-K522 PolarHBondContact O-N 2.77Å; L520-V523 PolarHBondContact O-N 3.17Å; L520-M524 HydrophobicContact CB-CE 4.45Å; L520-M524 WeakPolarHBondContact O-CG 3.32Å; L520-M524 PolarHBondContact O-N 2.75Å; L520-M524 VanDerWaalsContact O-N 3.09Å
521	K	93.9	Very high	82.9	Confident	86 Å²	86	71.3 Å²	71.3	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-41.8	178.1	-72.4	175.9	-177.4	171.8	0	111.9	E337 V517 N518 V523 M524 S525	E337-K521 IonicContact OE1-NZ 2.99Å; E337-K521 PolarHBondContact OE1-NZ 2.75Å; V517-K521 HydrophobicContact CG1-CD 3.95Å; V517-K521 VanDerWaalsContact CG1-CE 3.47Å; V517-K521 HydrophobicContact CG1-CG 4.46Å; V517-K521 WeakPolarHBondContact O-CB 3.34Å; V517-K521 WeakPolarHBondContact O-CG 3.43Å; V517-K521 PolarHBondContact O-N 2.84Å; N518-K521 PolarHBondContact O-N 3.03Å; K521-V523 PolarHBondContact O-N 2.94Å; K521-M524 HydrophobicContact CG-CE 4.35Å; K521-M524 CarbonylContact O-C 3.27Å; K521-M524 PolarHBondContact O-N 3.12Å; K521-S525 PolarHBondContact O-N 3.3Å; K521-S525 PolarHBondContact O-OG 3.14Å; K521-S525 VanDerWaalsContact O-OG 3.13Å
522	K	89.8	Confident	80.2	Confident	131 Å²	131	72.8 Å²	72.8	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-59.8	-45.5	178.6	-179	-178.8	178.4	-178.9	0	112.7	N518 E519 L520 M524 S525 F526	N518-K522 VanDerWaalsContact O-CB 3.3Å; N518-K522 WeakPolarHBondContact O-CB 3.22Å; N518-K522 PolarHBondContact O-N 3.49Å; E519-K522 PolarHBondContact O-N 2.95Å; L520-K522 VanDerWaalsContact C-N 3.32Å; L520-K522 PolarHBondContact O-N 2.77Å; K522-M524 VanDerWaalsContact C-N 3.31Å; K522-S525 WeakPolarHBondContact CA-OG 3.4Å; K522-S525 PolarHBondContact O-N 3.48Å; K522-S525 PolarHBondContact O-OG 3.41Å; K522-F526 PolarHBondContact O-N 3.2Å; K522-F526 VanDerWaalsContact O-N 3.14Å
523	V	89.3	Confident	77.3	Confident	19 Å²	19	80.1 Å²	80.1	12%	0.115	38%	0.379	C	S	.	.	H	α-helix	trans	-68.6	-34.1	178.2	174.7	0	0	0	0	111.3	A264 T267 L345 E519 L520 K521 F526	A264-V523 HydrophobicContact CB-CG1 4.3Å; T267-V523 HydrophobicContact CG2-CG2 4.01Å; T267-V523 WeakPolarHBondContact OG1-CG2 3.39Å; L345-V523 HydrophobicContact CD1-CG1 4.3Å; E519-V523 PolarHBondContact O-N 2.63Å; E519-V523 VanDerWaalsContact O-N 3.12Å; L520-V523 PolarHBondContact O-N 3.17Å; K521-V523 PolarHBondContact O-N 2.94Å; V523-F526 WeakPolarHBondContact O-CB 3.43Å; V523-F526 PolarHBondContact O-N 2.83Å
524	M	88.9	Confident	74.6	Confident	13 Å²	13	84.8 Å²	84.8	6%	0.064	41%	0.409	C	S	.	.	H	α-helix	trans	-71.1	-30	174.1	-69.8	-168.5	-67.5	0	0	113.5	Q344 L345 R348 L520 K521 K522 F526	Q344-M524 HydrophobicContact CB-CE 4.27Å; Q344-M524 HydrophobicContact CB-SD 3.74Å; Q344-M524 HydrophobicContact CG-CE 4.33Å; Q344-M524 HydrophobicContact CG-SD 3.51Å; Q344-M524 VanDerWaalsContact CG-SD 3.51Å; Q344-M524 PolarHBondContact OE1-SD 3.34Å; Q344-M524 VanDerWaalsContact OE1-SD 3.38Å; L345-M524 HydrophobicContact CB-CG 4.42Å; L345-M524 HydrophobicContact CB-SD 4.15Å; L345-M524 HydrophobicContact CD1-CG 3.95Å; R348-M524 VanDerWaalsContact CZ-O 3.28Å; R348-M524 VanDerWaalsContact NH1-CA 3.33Å; R348-M524 PolarHBondContact NH1-O 3.49Å; R348-M524 PolarHBondContact NH2-O 2.93Å; L520-M524 HydrophobicContact CB-CE 4.45Å; L520-M524 WeakPolarHBondContact O-CG 3.32Å; L520-M524 PolarHBondContact O-N 2.75Å; L520-M524 VanDerWaalsContact O-N 3.09Å; K521-M524 HydrophobicContact CG-CE 4.35Å; K521-M524 CarbonylContact O-C 3.27Å; K521-M524 PolarHBondContact O-N 3.12Å; K522-M524 VanDerWaalsContact C-N 3.31Å; M524-F526 VanDerWaalsContact C-N 3.33Å
525	S	85.5	Confident	71.7	Confident	89 Å²	89	87.3 Å²	87.3	62%	0.622	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.2	174.2	57.2	0	0	0	0	113.8	K521 K522 D527	K521-S525 PolarHBondContact O-N 3.3Å; K521-S525 PolarHBondContact O-OG 3.14Å; K521-S525 VanDerWaalsContact O-OG 3.13Å; K522-S525 WeakPolarHBondContact CA-OG 3.4Å; K522-S525 PolarHBondContact O-N 3.48Å; K522-S525 PolarHBondContact O-OG 3.41Å; S525-D527 PolarHBondContact O-N 2.84Å; S525-D527 VanDerWaalsContact O-N 3.15Å
526	F	73.3	Confident	68.7	Low	70 Å²	70	84.2 Å²	84.2	31%	0.307	44%	0.436	S	S	.	.			trans	-69.3	111	-174	-179.4	-106.4	0	0	0	111.8	K522 V523 M524 P528	K522-F526 PolarHBondContact O-N 3.2Å; K522-F526 VanDerWaalsContact O-N 3.14Å; V523-F526 WeakPolarHBondContact O-CB 3.43Å; V523-F526 PolarHBondContact O-N 2.83Å; M524-F526 VanDerWaalsContact C-N 3.33Å; F526-P528 HydrophobicContact CE1-CB 3.67Å; F526-P528 HydrophobicContact CE1-CG 3.97Å; F526-P528 HydrophobicContact CZ-CB 3.83Å
527	D	61.5	Low	66.3	Low	75 Å²	75	86.1 Å²	86.1	40%	0.401	45%	0.45	S	S	.	.			trans	-104	110.5	163.3	-165.1	-19.3	0	0	0	109.6	S525 K529 E530	S525-D527 PolarHBondContact O-N 2.84Å; S525-D527 VanDerWaalsContact O-N 3.15Å; D527-K529 PolarHBondContact O-N 2.03Å; D527-K529 VanDerWaalsContact O-N 3.08Å; D527-K529 PolarHBondContact OD1-N 2.88Å; D527-K529 VanDerWaalsContact OD1-N 3.12Å; D527-E530 PolarHBondContact O-N 3.37Å
528	P	56.8	Low	63.4	Low	15 Å²	15	91.3 Å²	91.3	10%	0.097	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-63.6	-15.1	-179.1	18.1	-25.7	0	0	0	114.3	L256 K260 F526 E530 R531	L256-P528 HydrophobicContact CD2-CB 3.49Å; L256-P528 VanDerWaalsContact CD2-CB 3.49Å; L256-P528 HydrophobicContact CD2-CG 3.71Å; K260-P528 HydrophobicContact CD-CG 4.43Å; K260-P528 HydrophobicContact CG-CG 4.43Å; F526-P528 HydrophobicContact CE1-CB 3.67Å; F526-P528 HydrophobicContact CE1-CG 3.97Å; F526-P528 HydrophobicContact CZ-CB 3.83Å; P528-E530 PolarHBondContact O-N 3.39Å; P528-R531 PolarHBondContact O-N 3.39Å
529	K	55	Low	60.4	Low	176 Å²	176	90.5 Å²	90.5	77%	0.765	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-61.1	-24.5	175	-69.8	-176.1	178	-179	0	113	D527 R531 G532	D527-K529 PolarHBondContact O-N 2.03Å; D527-K529 VanDerWaalsContact O-N 3.08Å; D527-K529 PolarHBondContact OD1-N 2.88Å; D527-K529 VanDerWaalsContact OD1-N 3.12Å; K529-R531 VanDerWaalsContact C-N 3.3Å; K529-R531 PolarHBondContact O-N 2.88Å; K529-G532 PolarHBondContact O-N 2.94Å
530	E	51.2	Low	58	Low	175 Å²	175	93.1 Å²	93.1	82%	0.818	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-73.2	-18	-179.5	-67.8	-170.8	160.1	0	0	114	D527 P528 G532	D527-E530 PolarHBondContact O-N 3.37Å; P528-E530 PolarHBondContact O-N 3.39Å; E530-G532 PolarHBondContact O-N 3.42Å
531	R	49	Very low	54.8	Low	173 Å²	173	102.5 Å²	102.5	65%	0.653	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-84.5	7.7	178.9	-137.5	178.7	-135.3	173.9	2.6	113.8	D203 P528 K529 R533	D203-R531 IonicContact OD2-NH1 2.7Å; P528-R531 PolarHBondContact O-N 3.39Å; K529-R531 VanDerWaalsContact C-N 3.3Å; K529-R531 PolarHBondContact O-N 2.88Å; R531-R533 VanDerWaalsContact C-N 3.32Å; R531-R533 PolarHBondContact O-N 3.06Å
532	G	38.8	Very low	51.7	Low	69 Å²	69	104 Å²	104	71%	0.711	56%	0.56	S	S	*	*			trans	-62	80.8	-178.5	0	0	0	0	0	114	K529 E530	K529-G532 PolarHBondContact O-N 2.94Å; E530-G532 PolarHBondContact O-N 3.42Å
533	R	32.5	Very low	48.8	Very low	219 Å²	219	103.4 Å²	103.4	83%	0.826	57%	0.573	S	S	*	*			trans	-143	115.6	145.5	-150	-177.6	-71.9	-157.6	0.9	107.8	R531 V535	R531-R533 VanDerWaalsContact C-N 3.32Å; R531-R533 PolarHBondContact O-N 3.06Å; R533-V535 PolarHBondContact O-N 3.41Å; R533-V535 VanDerWaalsContact O-N 3.14Å
534	P	39	Very low	45.9	Very low	99 Å²	99	107 Å²	107	64%	0.643	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-55.7	122.7	174.4	-20.4	30.2	0	0	0	108.8	A536	P534-A536 PolarHBondContact O-N 3.41Å; P534-A536 VanDerWaalsContact O-N 3.16Å
535	V	35.7	Very low	43.1	Very low	130 Å²	130	116.1 Å²	116.1	79%	0.788	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-62.5	118.2	167.3	175.1	0	0	0	0	106.2	R533 S537	R533-V535 PolarHBondContact O-N 3.41Å; R533-V535 VanDerWaalsContact O-N 3.14Å; V535-S537 PolarHBondContact O-N 3.28Å
536	A	32.5	Very low	40.4	Very low	69 Å²	69	120.1 Å²	120.1	57%	0.57	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-56.6	138.1	176.5	0	0	0	0	0	109.5	P534 S538	P534-A536 PolarHBondContact O-N 3.41Å; P534-A536 VanDerWaalsContact O-N 3.16Å; A536-S538 PolarHBondContact O-N 3.04Å
537	S	42.3	Very low	38	Very low	48 Å²	48	120 Å²	120	34%	0.336	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	27.9	-177.6	78.5	0	0	0	0	114.5	V535	V535-S537 PolarHBondContact O-N 3.28Å
538	S	35.6	Very low	36.4	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-1.6	178.5	73.1	0	0	0	0	113.5	A536 W540	A536-S538 PolarHBondContact O-N 3.04Å; S538-W540 VanDerWaalsContact C-N 3.29Å; S538-W540 PolarHBondContact O-N 3.1Å
539	A	31.3	Very low	34.7	Very low	82 Å²	82	131.7 Å²	131.7	68%	0.678	74%	0.735	S	S	*	*			trans	-82.3	-0.8	179.4	0	0	0	0	0	114.4	K541	A539-K541 PolarHBondContact O-N 2.99Å
540	W	40.9	Very low	33.3	Very low	108 Å²	108	127.7 Å²	127.7	41%	0.409	74%	0.735	S	S	.	*			trans	-77.5	88.1	-179.5	-51.2	107.4	0	0	0	111.4	F206 E213 S538	F206-W540 AromaticContact CE2-CH2 4Å; F206-W540 HydrophobicContact CE2-CH2 4Å; F206-W540 HydrophobicContact CE2-CZ3 4.03Å; F206-W540 HydrophobicContact CZ-CZ3 4.39Å; E213-W540 WeakPolarHBondContact OE2-CH2 3.13Å; S538-W540 VanDerWaalsContact C-N 3.29Å; S538-W540 PolarHBondContact O-N 3.1Å
541	K	27.6	Very low	32.2	Very low	196 Å²	196	123.8 Å²	123.8	85%	0.852	73%	0.733	S	S	*	*			trans	-90.9	122.8	148.9	-80.5	-172.6	177.8	-178.1	0	107.3	A539 S543	A539-K541 PolarHBondContact O-N 2.99Å; K541-S543 PolarHBondContact O-N 3.08Å
542	P	29	Very low	31.1	Very low	118 Å²	118	121.3 Å²	121.3	77%	0.766	74%	0.742	S	S	*	*			trans	-55.4	130.2	172.4	-19	29.6	0	0	0	108.5	A544	P542-A544 PolarHBondContact O-N 2.99Å
543	S	29.3	Very low	30.8	Very low	119 Å²	119	123.2 Å²	123.2	83%	0.832	74%	0.742	S	S	*	*			trans	-45.5	119.1	168.1	-68.4	0	0	0	0	108.2	K541 K545	K541-S543 PolarHBondContact O-N 3.08Å; S543-K545 PolarHBondContact O-N 3.42Å; S543-K545 VanDerWaalsContact O-N 3.12Å
544	A	28.2	Very low	30.2	Very low	93 Å²	93	119.9 Å²	119.9	77%	0.769	74%	0.739	S	S	*	*			trans	-49.2	122.4	-178.4	0	0	0	0	0	109.1	P542 L546	P542-A544 PolarHBondContact O-N 2.99Å; A544-L546 PolarHBondContact O-N 2.97Å
545	K	30.5	Very low	29.5	Very low	205 Å²	205	126 Å²	126	89%	0.891	75%	0.751	S	S	*	*			trans	-51.7	107.4	169.4	-70.5	176.8	176.2	178.9	0	107.6	S543 G547	S543-K545 PolarHBondContact O-N 3.42Å; S543-K545 VanDerWaalsContact O-N 3.12Å; K545-G547 PolarHBondContact O-N 2.93Å
546	L	28	Very low	28.8	Very low	174 Å²	174	128.2 Å²	128.2	91%	0.911	75%	0.753	S	S	*	*			trans	-58.9	117.2	154.8	-115.3	84.5	0	0	0	105.7	A544	A544-L546 PolarHBondContact O-N 2.97Å
547	G	22.3	Very low	28.4	Very low	66 Å²	66	130 Å²	130	68%	0.68	76%	0.758	S	S	*	*			trans	-64.6	136.1	-169.7	0	0	0	0	0	113	K545	K545-G547 PolarHBondContact O-N 2.93Å
548	V	27.9	Very low	27.3	Very low	143 Å²	143	132.2 Å²	132.2	87%	0.867	78%	0.779	S	S	*	*			trans	-128.6	92.1	147.8	-178.7	0	0	0	0	106
549	Q	21.8	Very low	26.9	Very low	193 Å²	193	134.9 Å²	134.9	90%	0.902	78%	0.783	S	S	*	*			trans	-80.9	118.7	160.2	-74.4	171	-19.4	0	0	107
550	A	26.1	Very low	26.3	Very low	93 Å²	93	138.5 Å²	138.5	77%	0.769	79%	0.786	S	S	*	*			trans	-173.7	128.8	145.6	0	0	0	0	0	111.4
551	A	28.6	Very low	25.4	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	80%	0.803	S	S	*	*			trans	79.5	85.5	155.1	0	0	0	0	0	120.2
552	S	24.2	Very low	25.1	Very low	121 Å²	121	137.4 Å²	137.4	85%	0.846	80%	0.801	S	S	*	*				59.9	155.3	102.8	-67.9	0	0	0	0	122.4
553	P	33.3	Very low	24.8	Very low	108 Å²	108	135 Å²	135	70%	0.701	80%	0.797	S	S	*	*				-113.9	162.6	-127.4	41.7	-36.3	0	0	0	116.6
554	I	20.8	Very low	24.4	Very low	150 Å²	150	140.7 Å²	140.7	77%	0.769	80%	0.803	S	S	*	*			trans	31.2	109	136.4	-50.8	171.3	0	0	0	116.4
555	Y	23.3	Very low	24.1	Very low	227 Å²	227	139.3 Å²	139.3	89%	0.89	80%	0.797	S	S	*	*			trans	-138.2	108.3	145.3	-133.9	-93.6	0	0	0	108.8
556	E	20.8	Very low	23.9	Very low	177 Å²	177	135 Å²	135	83%	0.827	79%	0.793	S	S	*	*			trans	-114.3	114.3	174.8	-167.5	163.5	-160.9	0	0	106.8
557	P	24.9	Very low	23.6	Very low	107 Å²	107	133.3 Å²	133.3	70%	0.695	79%	0.785	S	S	*	*			trans	-89.8	123	176.8	27.6	-21.4	0	0	0	110.9
558	A	19.8	Very low	23.6	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	79%	0.788	S	S	*	*			trans	-70	131.5	165.7	0	0	0	0	0	110.5
559	I	25.9	Very low	23.4	Very low	167 Å²	167	136.7 Å²	136.7	86%	0.856	78%	0.782	S	S	*	*			trans	-125.9	110.9	159.7	-63.5	-179.3	0	0	0	107.1
560	E	19	Very low	23.8	Very low	157 Å²	157	136.5 Å²	136.5	73%	0.734	78%	0.778	S	S	*	*			trans	-82.1	173.5	167.5	-64.3	-174.3	143.7	0	0	111.4
561	Q	22.8	Very low	23.6	Very low	166 Å²	166	135.1 Å²	135.1	78%	0.776	77%	0.774	S	S	*	*			trans	87.2	104.9	160	-64	179.9	13.2	0	0	115.3
562	S	21.4	Very low	23.3	Very low	115 Å²	115	137 Å²	137	80%	0.804	78%	0.781	S	S	*	*				99.7	130.3	66.7	69.3	0	0	0	0	109.8
563	G	21.7	Very low	23.1	Very low	67 Å²	67	135.2 Å²	135.2	69%	0.691	78%	0.782	S	S	*	*			trans	150.2	87.5	164.6	0	0	0	0	0	116
564	Y	21.1	Very low	22.7	Very low	240 Å²	240	133.8 Å²	133.8	94%	0.941	79%	0.787	S	S	*	*			trans	44.9	120.9	133.8	-79.9	-95.4	0	0	0	121.1
565	G	21.3	Very low	22.7	Very low	64 Å²	64	135.6 Å²	135.6	66%	0.66	79%	0.791	S	S	*	*				120.2	131.8	106.8	0	0	0	0	0	118
566	S	26.2	Very low	22.5	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	79%	0.787	S	S	*	*			trans	92.3	94.4	162	-42.9	0	0	0	0	114.6
567	N	22.3	Very low	22.8	Very low	139 Å²	139	130.3 Å²	130.3	74%	0.743	79%	0.786	S	S	*	*				73.9	117.7	73.2	-71.1	9.6	0	0	0	113.7
568	D	23.2	Very low	22.5	Very low	139 Å²	139	129 Å²	129	74%	0.743	78%	0.784	S	S	*	*			trans	56.2	119.4	139.5	-51	-31.1	0	0	0	119.4
569	L	23	Very low	22.8	Very low	141 Å²	141	129.2 Å²	129.2	74%	0.738	79%	0.785	S	S	*	*				179.8	144.6	103.9	-142.8	57.1	0	0	0	111.9
570	F	30.2	Very low	23.3	Very low	188 Å²	188	126.6 Å²	126.6	83%	0.825	78%	0.78	S	S	*	*			trans	77.8	107.9	175.1	-53.5	-77.4	0	0	0	116.2
571	G	20.9	Very low	23.5	Very low	65 Å²	65	129 Å²	129	67%	0.67	79%	0.788	S	S	*	*			cis	99	102.1	13.9	0	0	0	0	0	111.9
572	S	23.7	Very low	23.6	Very low	131 Å²	131	128.5 Å²	128.5	92%	0.916	79%	0.791	S	S	*	*			trans	66.4	122.1	159.9	-53.5	0	0	0	0	116.5
573	G	20.3	Very low	23.7	Very low	84 Å²	84	131.7 Å²	131.7	87%	0.866	79%	0.792	S	S	*	*				105.4	109.9	54	0	0	0	0	0	107
574	G	23.5	Very low	24.1	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	80%	0.799	S	S	*	*			trans	-176.6	97.3	-174.8	0	0	0	0	0	111.9
575	H	22	Very low	24.3	Very low	187 Å²	187	131.9 Å²	131.9	87%	0.866	79%	0.793	S	S	*	*			trans	-37.5	133.1	179.2	-88.4	-82.5	0	0	0	117.4
576	E	19.3	Very low	24.5	Very low	170 Å²	170	134.7 Å²	134.7	79%	0.794	80%	0.798	S	S	*	*			trans	-46	131.3	145.1	-173.7	172.8	167	0	0	112.7
577	P	25.4	Very low	24.7	Very low	124 Å²	124	137.2 Å²	137.2	81%	0.805	80%	0.802	S	S	*	*			trans	-106.3	117.1	146.8	23.1	-7.3	0	0	0	109.2
578	A	20.5	Very low	25	Very low	80 Å²	80	137.8 Å²	137.8	66%	0.661	81%	0.805	S	S	*	*			trans	-79.9	154.6	165.3	0	0	0	0	0	111
579	A	25.9	Very low	25.4	Very low	96 Å²	96	139 Å²	139	79%	0.793	81%	0.806	S	S	*	*			trans	97.9	150.5	161.2	0	0	0	0	0	118.1
580	P	36.2	Very low	25.6	Very low	113 Å²	113	140.2 Å²	140.2	73%	0.734	81%	0.814	S	S	*	*			cis	-131	163.6	-31.2	27.5	-7.1	0	0	0	113.7	D582	P580-D582 PolarHBondContact O-N 3.31Å
581	F	21.6	Very low	25.7	Very low	208 Å²	208	139.5 Å²	139.5	91%	0.912	82%	0.817	S	S	*	*			trans	-58.7	125.5	167.6	-75	-98.2	0	0	0	110.8
582	D	26.2	Very low	25.9	Very low	155 Å²	155	143.4 Å²	143.4	83%	0.829	82%	0.822	S	S	*	*			trans	-122.3	124.6	156.3	-105.1	-31.1	0	0	0	109.7	P580	P580-D582 PolarHBondContact O-N 3.31Å
583	H	22.7	Very low	26.1	Very low	182 Å²	182	146.7 Å²	146.7	84%	0.843	82%	0.819	S	S	*	*			trans	-65.8	123.3	172.3	-87.2	-81.8	0	0	0	109.5
584	V	30.1	Very low	26.4	Very low	138 Å²	138	151.8 Å²	151.8	84%	0.836	82%	0.82	S	S	*	*			trans	-124.8	114.7	160	-179.9	0	0	0	0	107.8
585	Q	24.9	Very low	26.7	Very low	173 Å²	173	155.2 Å²	155.2	81%	0.808	83%	0.825	S	S	*	*			trans	-69.2	152.1	176.9	-79.2	168.7	-53.9	0	0	111.2
586	T	25.9	Very low	26.7	Very low	123 Å²	123	149.2 Å²	149.2	76%	0.755	81%	0.814	S	S	*	*			trans	-64.1	125.2	171.5	47.1	0	0	0	0	111.8
587	D	30.7	Very low	27	Very low	167 Å²	167	150.1 Å²	150.1	89%	0.893	82%	0.818	S	S	*	*			trans	-118.2	107.2	157	-73.8	-35.7	0	0	0	107.9
588	D	28.5	Very low	27.1	Very low	151 Å²	151	154.5 Å²	154.5	81%	0.807	82%	0.824	S	S	*	*			trans	-76.3	161	161.4	-81.1	-53.2	0	0	0	109.6
589	E	30.9	Very low	27.3	Very low	164 Å²	164	154 Å²	154	77%	0.766	83%	0.826	S	S	*	*			trans	87.5	69.7	171.9	-64	-88.8	119.8	0	0	117.3
590	D	28.7	Very low	27.1	Very low	167 Å²	167	155.3 Å²	155.3	89%	0.893	82%	0.824	S	S	*	*			trans	-153	69.2	150.9	-103.3	-25.2	0	0	0	111.3
591	L	31.4	Very low	26.5	Very low	172 Å²	172	158 Å²	158	90%	0.901	83%	0.833	S	S	*	*			trans	-154.2	52.2	166.1	-104.6	143	0	0	0	111.7
592	I	26.4	Very low	26.5	Very low	148 Å²	148	157 Å²	157	76%	0.759	83%	0.831	S	S	*	*			trans	-128.6	81.7	160.3	-52.9	177.3	0	0	0	108
593	K	25.9	Very low	26.4	Very low	199 Å²	199	152.9 Å²	152.9	87%	0.865	83%	0.826	S	S	*	*			trans	-169.1	135.9	162.1	-101.8	155.4	-164.9	177.6	0	108.4
594	Q	28	Very low	26.3	Very low	191 Å²	191	150.5 Å²	150.5	89%	0.893	83%	0.829	S	S	*	*			trans	82.5	95.5	-166.6	-53.5	172.7	14.2	0	0	110.5
595	V	30.4	Very low	25.9	Very low	152 Å²	152	147.2 Å²	147.2	92%	0.921	82%	0.823	S	S	*	*				-144.8	114	60.1	175.4	0	0	0	0	109.9
596	G	22.1	Very low	25.8	Very low	60 Å²	60	145.1 Å²	145.1	62%	0.619	83%	0.828	S	S	*	*			trans	-119.8	144.6	164.5	0	0	0	0	0	109.5
597	H	24.8	Very low	25.6	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.875	83%	0.826	S	S	*	*			trans	85.5	99.6	164.7	-60.7	-44.9	0	0	0	119.8
598	K	28.1	Very low	25.2	Very low	216 Å²	216	144 Å²	144	94%	0.939	83%	0.83	S	S	*	*				-160.4	106.7	114.4	-96.3	167.6	-175.7	-176.6	0	106.5
599	G	24.2	Very low	24.8	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	82%	0.821	S	S	*	*				86.2	82.6	90.9	0	0	0	0	0	108.6
600	V	20.9	Very low	24.5	Very low	124 Å²	124	142.8 Å²	142.8	75%	0.752	83%	0.827	S	S	*	*				50.8	99	98.9	-174.3	0	0	0	0	112.3
601	D	24.8	Very low	24.2	Very low	170 Å²	170	139.8 Å²	139.8	91%	0.909	82%	0.817	S	S	*	*			trans	-143.8	131.7	141.7	-97.1	-31.8	0	0	0	109.5
602	Q	21.3	Very low	23.8	Very low	186 Å²	186	136.3 Å²	136.3	87%	0.869	81%	0.807	S	S	*	*			trans	-97.3	142.4	-173.2	-69	172.8	-8.5	0	0	110.6
603	G	23.3	Very low	23.6	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	81%	0.809	S	S	*	*			trans	157.5	89	167.9	0	0	0	0	0	108.9
604	S	21.1	Very low	23.3	Very low	131 Å²	131	132.7 Å²	132.7	92%	0.916	80%	0.8	S	S	*	*				54.9	105.6	64.9	-66.1	0	0	0	0	114
605	G	22.7	Very low	23.1	Very low	69 Å²	69	131.4 Å²	131.4	71%	0.711	80%	0.799	S	S	*	*			trans	147.4	77	179.9	0	0	0	0	0	108.9
606	S	21.9	Very low	22.7	Very low	129 Å²	129	130.2 Å²	130.2	90%	0.902	79%	0.792	S	S	*	*				60	116.6	74.8	-60	0	0	0	0	113.9
607	G	21.9	Very low	22.8	Very low	70 Å²	70	132.7 Å²	132.7	72%	0.722	80%	0.795	S	S	*	*			trans	114.2	107.8	144.9	0	0	0	0	0	116.2
608	M	21.6	Very low	22.8	Very low	198 Å²	198	131.9 Å²	131.9	98%	0.975	79%	0.791	S	S	*	*				32	129.8	128.7	-61.6	175	-171.7	0	0	117.1
609	G	20.8	Very low	22.4	Very low	60 Å²	60	127.1 Å²	127.1	62%	0.619	79%	0.785	S	S	*	*			cis	144.2	151.6	22.1	0	0	0	0	0	108
610	Y	23.9	Very low	22.5	Very low	229 Å²	229	129.3 Å²	129.3	90%	0.898	79%	0.787	S	S	*	*			trans	63.7	170.4	163.1	-60.7	-82.8	0	0	0	117.1
611	P	23.8	Very low	22.7	Very low	104 Å²	104	134.2 Å²	134.2	68%	0.675	79%	0.792	S	S	*	*			cis	-126.2	174.3	-24.2	17.1	7.4	0	0	0	111.8
612	S	21.2	Very low	22.7	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	79%	0.787	S	S	*	*				28	136.6	129.8	-42.9	0	0	0	0	120.8
613	E	22.8	Very low	23.1	Very low	173 Å²	173	130.3 Å²	130.3	81%	0.808	78%	0.783	S	S	*	*				168.6	103.8	107.9	-90.6	169.2	172.7	0	0	107.9
614	S	20.8	Very low	23.2	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	79%	0.785	S	S	*	*				46.1	72.6	86.3	72	0	0	0	0	112.8	V616	S614-V616 PolarHBondContact O-N 3.06Å
615	L	23.9	Very low	23.4	Very low	164 Å²	164	136 Å²	136	86%	0.859	78%	0.784	S	S	*	*			trans	-77.7	105	152.2	-129.7	80.3	0	0	0	108.2
616	V	20.6	Very low	23.7	Very low	128 Å²	128	138.3 Å²	138.3	78%	0.776	78%	0.784	S	S	*	*			trans	-72.6	113.1	166	171.9	0	0	0	0	107.7	S614	S614-V616 PolarHBondContact O-N 3.06Å
617	T	23.7	Very low	23.9	Very low	112 Å²	112	139.2 Å²	139.2	69%	0.687	78%	0.778	S	S	*	*			trans	-137.8	108.2	155.3	36.2	0	0	0	0	109.8
618	H	25	Very low	24	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.796	79%	0.785	S	S	*	*			trans	46.2	109.8	150.3	-65.7	-73.4	0	0	0	120.1	P620	H618-P620 WeakPolarHBondContact O-CD 3.13Å
619	S	20.1	Very low	24.2	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	78%	0.781	S	S	*	*			trans	-41.7	135.2	150.4	-179.1	0	0	0	0	112.8
620	P	26.3	Very low	24.4	Very low	115 Å²	115	148.9 Å²	148.9	75%	0.747	79%	0.794	S	S	*	*			trans	-131.9	123.1	130.3	21.2	-1.3	0	0	0	112.6	H618	H618-P620 WeakPolarHBondContact O-CD 3.13Å
621	R	25.8	Very low	24.5	Very low	228 Å²	228	146.8 Å²	146.8	86%	0.86	79%	0.794	S	S	*	*			trans	68.3	112.8	146.5	-71.7	179.6	170.2	160.9	-3.3	118.8	P623	R621-P623 WeakPolarHBondContact O-CD 3.35Å
622	D	24	Very low	24.5	Very low	152 Å²	152	147.9 Å²	147.9	81%	0.813	80%	0.799	S	S	*	*			trans	-45.6	119.2	159.3	-64	-64.6	0	0	0	112.6
623	P	30.5	Very low	24.8	Very low	121 Å²	121	147.2 Å²	147.2	79%	0.786	80%	0.8	S	S	*	*			trans	-101.8	42.8	168	34.5	-23.6	0	0	0	110.9	R621	R621-P623 WeakPolarHBondContact O-CD 3.35Å
624	M	24.5	Very low	24.9	Very low	154 Å²	154	145.5 Å²	145.5	76%	0.759	80%	0.796	S	S	*	*			trans	-120.4	34.3	175.3	-60.4	-66.1	-75.4	0	0	111.5	V626	M624-V626 PolarHBondContact O-N 3.15Å
625	D	24.7	Very low	25.3	Very low	167 Å²	167	148 Å²	148	89%	0.893	80%	0.799	S	S	*	*			trans	-72.2	103.1	156.3	-99.9	-30.9	0	0	0	107.7	D627	D625-D627 PolarHBondContact O-N 2.62Å
626	V	29.5	Very low	25.5	Very low	117 Å²	117	145.1 Å²	145.1	71%	0.709	79%	0.792	S	S	*	*			trans	-79.5	88.1	176.7	179.3	0	0	0	0	106.8	M624	M624-V626 PolarHBondContact O-N 3.15Å
627	D	26.6	Very low	25.8	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	79%	0.789	S	S	*	*			trans	-176.9	83.9	157.7	-89	-29	0	0	0	109.5	D625	D625-D627 PolarHBondContact O-N 2.62Å
628	D	24.6	Very low	26	Very low	160 Å²	160	142.3 Å²	142.3	86%	0.856	79%	0.789	S	S	*	*			trans	169.9	62.1	148	-94.2	-23.4	0	0	0	113.1
629	L	25.3	Very low	26.2	Very low	170 Å²	170	142.5 Å²	142.5	89%	0.89	79%	0.79	S	S	*	*			trans	-125	56.6	166.3	-125.7	93.9	0	0	0	112.2
630	F	24.5	Very low	26.4	Very low	202 Å²	202	145.2 Å²	145.2	89%	0.886	80%	0.795	S	S	*	*			trans	-117.7	59.5	157.5	-76.8	-78.9	0	0	0	109.9	T632	F630-T632 PolarHBondContact O-N 2.57Å
631	M	25.6	Very low	26.7	Very low	184 Å²	184	145.5 Å²	145.5	91%	0.906	79%	0.794	S	S	*	*			trans	-81.6	92.2	161.6	-83.2	-88.2	172.9	0	0	108.1	A633	M631-A633 PolarHBondContact O-N 2.9Å
632	T	24.3	Very low	26.7	Very low	128 Å²	128	142.3 Å²	142.3	79%	0.785	79%	0.793	S	S	*	*			trans	-64	107.2	163.2	48.8	0	0	0	0	108.4	F630 D634	F630-T632 PolarHBondContact O-N 2.57Å; T632-D634 PolarHBondContact O-N 2.88Å
633	A	27.2	Very low	27.1	Very low	84 Å²	84	140.3 Å²	140.3	69%	0.694	80%	0.798	S	S	*	*			trans	-72.4	108.6	169.7	0	0	0	0	0	109	M631 M635	M631-A633 PolarHBondContact O-N 2.9Å; A633-M635 PolarHBondContact O-N 3.22Å
634	D	25.2	Very low	27.3	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	80%	0.796	S	S	*	*			trans	-65.6	115.4	166.6	-176.6	-2.4	0	0	0	109	T632 S636	T632-D634 PolarHBondContact O-N 2.88Å; D634-S636 VanDerWaalsContact C-N 3.34Å; D634-S636 VanDerWaalsContact OD1-CB 3.32Å; D634-S636 WeakPolarHBondContact OD1-CB 3.33Å; D634-S636 PolarHBondContact OD1-N 3.49Å; D634-S636 PolarHBondContact OD1-OG 2.77Å; D634-S636 PolarHBondContact OD2-OG 3.35Å
635	M	29.3	Very low	28	Very low	151 Å²	151	140.4 Å²	140.4	74%	0.744	79%	0.789	S	S	*	*			trans	-94.5	24.4	-175.3	-79.5	-76.1	-152.4	0	0	112.7	A633 G637 V638	A633-M635 PolarHBondContact O-N 3.22Å; M635-G637 PolarHBondContact O-N 3.38Å; M635-V638 HydrophobicContact SD-CG2 4.24Å
636	S	28.7	Very low	29	Very low	103 Å²	103	143.4 Å²	143.4	72%	0.72	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	5.2	-177.6	50.7	0	0	0	0	115.5	D634	D634-S636 VanDerWaalsContact C-N 3.34Å; D634-S636 VanDerWaalsContact OD1-CB 3.32Å; D634-S636 WeakPolarHBondContact OD1-CB 3.33Å; D634-S636 PolarHBondContact OD1-N 3.49Å; D634-S636 PolarHBondContact OD1-OG 2.77Å; D634-S636 PolarHBondContact OD2-OG 3.35Å
637	G	26.2	Very low	29.8	Very low	69 Å²	69	140.1 Å²	140.1	71%	0.711	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.1	-2.6	-174.3	0	0	0	0	0	118.4	M635 Q639	M635-G637 PolarHBondContact O-N 3.38Å; G637-Q639 PolarHBondContact O-N 3.26Å; G637-Q639 VanDerWaalsContact O-N 3.09Å
638	V	29.2	Very low	31.4	Very low	112 Å²	112	133.6 Å²	133.6	68%	0.679	74%	0.735	S	S	*	*			trans	-86.9	90.9	-172.1	-172	0	0	0	0	111.1	M635 L640	M635-V638 HydrophobicContact SD-CG2 4.24Å; V638-L640 PolarHBondContact O-N 3.06Å
639	Q	27.6	Very low	33	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	73%	0.726	S	S	*	*			trans	-71.2	117.6	168.8	-147	163.5	-1.2	0	0	108.8	G637 T641	G637-Q639 PolarHBondContact O-N 3.26Å; G637-Q639 VanDerWaalsContact O-N 3.09Å; Q639-T641 PolarHBondContact O-N 3.4Å
640	L	26.1	Very low	35.1	Very low	172 Å²	172	125 Å²	125	90%	0.901	69%	0.692	S	S	*	*			trans	-62.5	94.5	179.4	-73.9	157.1	0	0	0	110.4	V638	V638-L640 PolarHBondContact O-N 3.06Å
641	T	30.8	Very low	37	Very low	120 Å²	120	117 Å²	117	74%	0.736	66%	0.659	S	S	*	*			trans	-78.6	133.8	165.2	48.7	0	0	0	0	109.2	Q639	Q639-T641 PolarHBondContact O-N 3.4Å
642	L	27.5	Very low	39	Very low	161 Å²	161	110.7 Å²	110.7	84%	0.843	63%	0.629	S	S	*	*			trans	-50.9	145.8	-179.1	-82.9	109.8	0	0	0	111.8	T644	L642-T644 PolarHBondContact O-N 2.93Å
643	A	31.1	Very low	40.7	Very low	111 Å²	111	110.1 Å²	110.1	92%	0.917	63%	0.63	S	S	*	*			trans	-40.5	89.7	-179.6	0	0	0	0	0	113.4
644	T	34.4	Very low	42.4	Very low	121 Å²	121	111.9 Å²	111.9	74%	0.742	63%	0.628	S	S	*	*			trans	-80.8	137.5	165.5	46.8	0	0	0	0	107.8	L642 R646	L642-T644 PolarHBondContact O-N 2.93Å; T644-R646 PolarHBondContact O-N 3.1Å
645	Y	39.9	Very low	43.6	Very low	156 Å²	156	108 Å²	108	61%	0.612	62%	0.621	S	S	*	*			trans	-35.8	111.7	170.1	-175.9	-99.3	0	0	0	110.3	P647	Y645-P647 WeakPolarHBondContact O-CD 3.43Å
646	R	44.9	Very low	44.9	Very low	230 Å²	230	108.6 Å²	108.6	87%	0.868	62%	0.615	S	S	*	*			trans	-79.6	111	174.9	-164.2	179.3	-162	174.6	5.4	106.5	T644	T644-R646 PolarHBondContact O-N 3.1Å
647	P	47.6	Very low	46	Very low	48 Å²	48	108.7 Å²	108.7	31%	0.312	61%	0.613	S	S	.	*			trans	-60.6	149.6	177.5	23.8	-31.1	0	0	0	109.9	Y645 V651	Y645-P647 WeakPolarHBondContact O-CD 3.43Å; P647-V651 HydrophobicContact CB-CB 4.13Å; P647-V651 HydrophobicContact CB-CG1 4.08Å
648	P	58.8	Low	47.7	Very low	11 Å²	11	108.8 Å²	108.8	7%	0.071	60%	0.6	C	S	.	*			trans	-55.2	153.9	175.4	-22.2	30.9	0	0	0	111.8	W650 V651	P648-W650 HydrophobicContact CB-CD2 3.96Å; P648-W650 HydrophobicContact CB-CE3 4.21Å; P648-W650 HydrophobicContact CB-CH2 3.66Å; P648-W650 HydrophobicContact CB-CZ2 3.43Å; P648-W650 VanDerWaalsContact CB-CZ2 3.43Å; P648-W650 HydrophobicContact CB-CZ3 4.08Å; P648-W650 HydrophobicContact CG-CZ2 4.06Å; P648-W650 PolarHBondContact O-N 3.05Å; P648-V651 HydrophobicContact CB-CG2 4.23Å; P648-V651 HydrophobicContact CG-CG2 4.22Å; P648-V651 WeakPolarHBondContact O-CA 3.41Å; P648-V651 WeakPolarHBondContact O-CB 3.31Å; P648-V651 PolarHBondContact O-N 3.37Å; P648-V651 VanDerWaalsContact O-O 3.09Å
649	P	59.8	Low	48.4	Very low	103 Å²	103	108.6 Å²	108.6	67%	0.669	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-23.5	-173.9	-24.9	32.6	0	0	0	116.2	V651	P649-V651 VanDerWaalsContact C-N 3.35Å
650	W	68.4	Low	49	Very low	47 Å²	47	105.6 Å²	105.6	18%	0.178	59%	0.59	C	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	9.3	176.9	60.4	84	0	0	0	112.8	Q155 R156 H159 P648 P657 V658	Q155-W650 HydrophobicContact CB-CH2 4.15Å; Q155-W650 HydrophobicContact CB-CZ3 4.3Å; Q155-W650 VanDerWaalsContact CD-CH2 3.42Å; Q155-W650 HydrophobicContact CG-CH2 3.54Å; Q155-W650 HydrophobicContact CG-CZ3 4Å; R156-W650 HydrophobicContact CG-CD2 3.62Å; R156-W650 HydrophobicContact CG-CE3 3.79Å; R156-W650 HydrophobicContact CG-CG 4.12Å; R156-W650 HydrophobicContact CG-CH2 4.3Å; R156-W650 HydrophobicContact CG-CZ2 4.11Å; R156-W650 HydrophobicContact CG-CZ3 4.12Å; H159-W650 HydrophobicContact CB-CZ2 4.42Å; P648-W650 HydrophobicContact CB-CD2 3.96Å; P648-W650 HydrophobicContact CB-CE3 4.21Å; P648-W650 HydrophobicContact CB-CH2 3.66Å; P648-W650 HydrophobicContact CB-CZ2 3.43Å; P648-W650 VanDerWaalsContact CB-CZ2 3.43Å; P648-W650 HydrophobicContact CB-CZ3 4.08Å; P648-W650 HydrophobicContact CG-CZ2 4.06Å; P648-W650 PolarHBondContact O-N 3.05Å; W650-P657 CarbonylContact O-C 3.52Å; W650-P657 WeakPolarHBondContact O-CA 3.08Å; W650-V658 PolarHBondContact O-N 2.99Å
651	V	64.5	Low	49.3	Very low	32 Å²	32	107.6 Å²	107.6	19%	0.194	59%	0.592	C	S	.	*	B	Isolated β-bridge	trans	-118.4	118.9	175.9	-177.9	0	0	0	0	106.7	P647 P648 P649 G655 R656	P647-V651 HydrophobicContact CB-CB 4.13Å; P647-V651 HydrophobicContact CB-CG1 4.08Å; P648-V651 HydrophobicContact CB-CG2 4.23Å; P648-V651 HydrophobicContact CG-CG2 4.22Å; P648-V651 WeakPolarHBondContact O-CA 3.41Å; P648-V651 WeakPolarHBondContact O-CB 3.31Å; P648-V651 PolarHBondContact O-N 3.37Å; P648-V651 VanDerWaalsContact O-O 3.09Å; P649-V651 VanDerWaalsContact C-N 3.35Å; V651-G655 VanDerWaalsContact CG1-C 3.5Å; V651-G655 VanDerWaalsContact CG1-CA 3.46Å; V651-R656 CarbonylContact C-O 3.57Å; V651-R656 WeakPolarHBondContact CA-O 3.43Å
652	D	67.1	Low	49.1	Very low	52 Å²	52	110 Å²	110	28%	0.278	60%	0.595	S	S	.	*			trans	-67.8	173.3	176.3	68.8	17.2	0	0	0	111.5	D654 G655 R656 V658	D652-D654 PolarHBondContact O-N 2.99Å; D652-D654 VanDerWaalsContact O-N 3.09Å; D652-D654 VanDerWaalsContact OD1-C 3.3Å; D652-D654 WeakPolarHBondContact OD1-CA 3.12Å; D652-D654 WeakPolarHBondContact OD1-CB 3.25Å; D652-D654 PolarHBondContact OD1-N 3.47Å; D652-G655 PolarHBondContact O-N 3.27Å; D652-G655 PolarHBondContact OD1-N 3.11Å; D652-R656 PolarHBondContact N-O 2.04Å; D652-R656 PolarHBondContact OD1-N 3.27Å; D652-R656 WeakPolarHBondContact OD2-CB 3.32Å; D652-V658 HydrophobicContact CB-CG2 4.45Å
653	S	60	Low	49.1	Very low	116 Å²	116	110.7 Å²	110.7	81%	0.811	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-15.7	177.6	31.6	0	0	0	0	114
654	D	63.3	Low	48.9	Very low	122 Å²	122	108.5 Å²	108.5	65%	0.652	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	4.4	176.3	-63.5	-31.9	0	0	0	112.6	D652 R656	D652-D654 PolarHBondContact O-N 2.99Å; D652-D654 VanDerWaalsContact O-N 3.09Å; D652-D654 VanDerWaalsContact OD1-C 3.3Å; D652-D654 WeakPolarHBondContact OD1-CA 3.12Å; D652-D654 WeakPolarHBondContact OD1-CB 3.25Å; D652-D654 PolarHBondContact OD1-N 3.47Å; D654-R656 VanDerWaalsContact C-N 3.34Å; D654-R656 HydrophobicContact CB-CG 4.38Å
655	G	51.4	Low	48.4	Very low	56 Å²	56	111 Å²	111	58%	0.577	59%	0.591	S	S	*	*	S	Bend	trans	80.1	11	179.7	0	0	0	0	0	114.4	V651 D652	V651-G655 VanDerWaalsContact CG1-C 3.5Å; V651-G655 VanDerWaalsContact CG1-CA 3.46Å; D652-G655 PolarHBondContact O-N 3.27Å; D652-G655 PolarHBondContact OD1-N 3.11Å
656	R	55	Low	48	Very low	162 Å²	162	112.8 Å²	112.8	61%	0.611	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-92.6	146.5	-178.7	-53.8	176.8	180	-177.2	2.5	110.8	V651 D652 D654 V658	V651-R656 CarbonylContact C-O 3.57Å; V651-R656 WeakPolarHBondContact CA-O 3.43Å; D652-R656 PolarHBondContact N-O 2.04Å; D652-R656 PolarHBondContact OD1-N 3.27Å; D652-R656 WeakPolarHBondContact OD2-CB 3.32Å; D654-R656 VanDerWaalsContact C-N 3.34Å; D654-R656 HydrophobicContact CB-CG 4.38Å; R656-V658 PolarHBondContact O-N 2.8Å
657	P	52.5	Low	47	Very low	105 Å²	105	108 Å²	108	68%	0.682	60%	0.601	S	S	*	*	B	Isolated β-bridge	trans	-58.9	127.1	170.1	-17.4	29.3	0	0	0	110.1	W650 P659	W650-P657 CarbonylContact O-C 3.52Å; W650-P657 WeakPolarHBondContact O-CA 3.08Å; P657-P659 WeakPolarHBondContact O-CD 3.38Å
658	V	61.1	Low	46	Very low	72 Å²	72	112.3 Å²	112.3	44%	0.436	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-62.8	121.5	165.1	179.2	0	0	0	0	106.6	W650 D652 R656 D660	W650-V658 PolarHBondContact O-N 2.99Å; D652-V658 HydrophobicContact CB-CG2 4.45Å; R656-V658 PolarHBondContact O-N 2.8Å; V658-D660 PolarHBondContact O-N 2.99Å
659	P	43.9	Very low	45.2	Very low	108 Å²	108	117 Å²	117	70%	0.701	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.3	-179.5	-21.8	31.6	0	0	0	110.8	P657 F661	P657-P659 WeakPolarHBondContact O-CD 3.38Å; P659-F661 PolarHBondContact O-N 3.44Å
660	D	40.9	Very low	43.8	Very low	113 Å²	113	117.7 Å²	117.7	60%	0.604	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-58.6	129.8	164.2	-74.5	-48	0	0	0	107	R156 V658 E662	R156-D660 IonicContact NH1-OD1 3.34Å; R156-D660 PolarHBondContact NH1-OD1 2.9Å; R156-D660 VanDerWaalsContact NH1-OD1 3.11Å; R156-D660 IonicContact NH1-OD2 3.31Å; V658-D660 PolarHBondContact O-N 2.99Å; D660-E662 PolarHBondContact O-N 3.41Å
661	F	32.1	Very low	41.7	Very low	214 Å²	214	124 Å²	124	94%	0.939	69%	0.691	S	S	*	*			trans	-67.1	76.9	168.5	-93.9	-89.6	0	0	0	108.4	P659 I663	P659-F661 PolarHBondContact O-N 3.44Å; F661-I663 PolarHBondContact O-N 2.97Å
662	E	27	Very low	39.9	Very low	171 Å²	171	129.2 Å²	129.2	80%	0.799	72%	0.716	S	S	*	*			trans	-76.5	112.5	161.7	-77	-169	156.4	0	0	107.6	D660 G664	D660-E662 PolarHBondContact O-N 3.41Å; E662-G664 PolarHBondContact O-N 3.19Å
663	I	26.9	Very low	38	Very low	174 Å²	174	133.9 Å²	133.9	89%	0.892	74%	0.74	S	S	*	*			trans	-67.8	83.4	170.1	-58.7	170.6	0	0	0	106.9	F661	F661-I663 PolarHBondContact O-N 2.97Å
664	G	26.4	Very low	36.4	Very low	66 Å²	66	139.8 Å²	139.8	68%	0.68	75%	0.745	S	S	*	*			trans	-117.8	100.6	178	0	0	0	0	0	110.3	E662 H666	E662-G664 PolarHBondContact O-N 3.19Å; G664-H666 PolarHBondContact O-N 3.3Å
665	M	23.9	Very low	35.5	Very low	172 Å²	172	138.8 Å²	138.8	85%	0.847	75%	0.745	S	S	*	*			trans	-54.4	123.1	162.4	-64.8	175	-177.1	0	0	108.4
666	H	31.8	Very low	34.4	Very low	194 Å²	194	146 Å²	146	90%	0.898	76%	0.761	S	S	*	*			trans	-175.7	106	139.6	-86.2	-55	0	0	0	109.1	G664	G664-H666 PolarHBondContact O-N 3.3Å
667	T	24.7	Very low	33	Very low	130 Å²	130	143.2 Å²	143.2	80%	0.798	77%	0.766	S	S	*	*			trans	-77.9	120.4	168.2	47.5	0	0	0	0	110.2
668	T	26.2	Very low	31.8	Very low	139 Å²	139	149.4 Å²	149.4	85%	0.853	78%	0.776	S	S	*	*			trans	172.1	142.4	130.1	33.8	0	0	0	0	111.8
669	P	41.9	Very low	30.3	Very low	110 Å²	110	152.2 Å²	152.2	71%	0.714	80%	0.796	S	S	*	*			trans	-100.5	160.3	-174.6	39.7	-32.9	0	0	0	112.7
670	P	30	Very low	29.5	Very low	116 Å²	116	158.6 Å²	158.6	75%	0.753	81%	0.806	S	S	*	*				-156.6	154.7	99.2	34.6	-12.8	0	0	0	118.7
671	F	25.2	Very low	28.9	Very low	181 Å²	181	160.2 Å²	160.2	79%	0.794	81%	0.814	S	S	*	*			trans	14.7	123.3	146.5	-55.6	-83	0	0	0	125.2
672	I	25.8	Very low	28.8	Very low	141 Å²	141	161 Å²	161	72%	0.723	81%	0.813	S	S	*	*				34	117.5	123.9	-40.6	-177.8	0	0	0	120.5
673	L	28.1	Very low	29	Very low	149 Å²	149	159.9 Å²	159.9	78%	0.78	81%	0.812	S	S	*	*				165.4	114.9	116.5	-87.7	175.2	0	0	0	114.3
674	R	26.4	Very low	29.1	Very low	240 Å²	240	157.9 Å²	157.9	91%	0.906	81%	0.808	S	S	*	*			trans	63	161.4	134.9	-86.6	-157.8	-178.7	178.9	2.6	123.1
675	P	43.9	Very low	29.5	Very low	102 Å²	102	164.5 Å²	164.5	66%	0.662	82%	0.818	S	S	*	*			trans	-110.7	153.3	-139.8	40.4	-32	0	0	0	114.4
676	F	29.3	Very low	29.7	Very low	207 Å²	207	164.9 Å²	164.9	91%	0.908	82%	0.818	S	S	*	*			trans	-155.4	132.8	146.1	-103.5	-76.5	0	0	0	111.3
677	S	24.5	Very low	29.8	Very low	103 Å²	103	159.8 Å²	159.8	72%	0.72	81%	0.81	S	S	*	*			trans	-64	128.8	171.5	48.2	0	0	0	0	113.4
678	R	28.4	Very low	30.1	Very low	236 Å²	236	160 Å²	160	89%	0.891	81%	0.811	S	S	*	*			trans	-172.1	145.8	136.4	-103.3	177.6	-167	-167.3	4.3	109.9
679	P	28	Very low	30.7	Very low	130 Å²	130	158.8 Å²	158.8	84%	0.844	81%	0.806	S	S	*	*			trans	-76.3	128.2	-172.9	31.5	-30.6	0	0	0	109.5
680	R	28.2	Very low	30.5	Very low	242 Å²	242	158.3 Å²	158.3	91%	0.913	80%	0.802	S	S	*	*			trans	-115	133.5	167.8	-99.9	-173.2	176	177.2	-1.3	108.8
681	D	27.5	Very low	31	Very low	147 Å²	147	156.2 Å²	156.2	79%	0.786	79%	0.788	S	S	*	*			trans	-42.8	141.8	175.9	-63.5	-61.4	0	0	0	111.9	D683	D681-D683 PolarHBondContact O-N 3.45Å
682	Y	30.1	Very low	32	Very low	231 Å²	231	150.5 Å²	150.5	91%	0.906	77%	0.771	S	S	*	*			trans	-52.4	109.1	174	-77.4	-92.6	0	0	0	109.2	V684	Y682-V684 PolarHBondContact O-N 3.35Å
683	D	31.6	Very low	33.5	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	77%	0.768	S	S	*	*			trans	-54.9	109.1	166	-74.3	-45	0	0	0	107.3	D681 F685	D681-D683 PolarHBondContact O-N 3.45Å; D683-F685 PolarHBondContact O-N 3.33Å
684	V	29.7	Very low	35.1	Very low	131 Å²	131	144.7 Å²	144.7	79%	0.794	76%	0.755	S	S	*	*			trans	-54.3	111.9	161.3	173.6	0	0	0	0	105	Y682 E686	Y682-V684 PolarHBondContact O-N 3.35Å; V684-E686 PolarHBondContact O-N 2.86Å
685	F	33.4	Very low	36.8	Very low	205 Å²	205	139 Å²	139	90%	0.899	74%	0.739	S	S	*	*			trans	-60.6	91.3	169.8	-87.4	-89	0	0	0	107.6	D683 A687	D683-F685 PolarHBondContact O-N 3.33Å; F685-A687 PolarHBondContact O-N 2.6Å; F685-A687 VanDerWaalsContact O-N 3.07Å
686	E	28.8	Very low	37.5	Very low	180 Å²	180	140.5 Å²	140.5	84%	0.841	73%	0.732	S	S	*	*			trans	-67.1	104.5	167.8	-148.7	160.1	-154.1	0	0	105.5	V684 T688	V684-E686 PolarHBondContact O-N 2.86Å; E686-T688 PolarHBondContact O-N 3.14Å; E686-T688 VanDerWaalsContact O-N 3.14Å
687	A	33.1	Very low	39.4	Very low	88 Å²	88	136.5 Å²	136.5	73%	0.727	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-49.6	122.9	178.5	0	0	0	0	0	108.7	F685 P689	F685-A687 PolarHBondContact O-N 2.6Å; F685-A687 VanDerWaalsContact O-N 3.07Å; A687-P689 VanDerWaalsContact O-CD 3.31Å; A687-P689 WeakPolarHBondContact O-CD 3.15Å
688	T	33	Very low	41.5	Very low	135 Å²	135	134.5 Å²	134.5	83%	0.828	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-52.2	117.1	175.7	31.9	0	0	0	0	108.8	E686	E686-T688 PolarHBondContact O-N 3.14Å; E686-T688 VanDerWaalsContact O-N 3.14Å
689	P	37.3	Very low	43.5	Very low	113 Å²	113	126.3 Å²	126.3	73%	0.734	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-66.5	146.6	-178.8	24.7	-31.3	0	0	0	109.4	A687	A687-P689 VanDerWaalsContact O-CD 3.31Å; A687-P689 WeakPolarHBondContact O-CD 3.15Å
690	P	38.6	Very low	45.4	Very low	99 Å²	99	128.1 Å²	128.1	64%	0.643	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-63.1	148.8	-172	26.4	-34.4	0	0	0	111.1	S692	P690-S692 PolarHBondContact O-N 2.98Å
691	P	39.2	Very low	47.6	Very low	72 Å²	72	119.3 Å²	119.3	47%	0.468	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-57.2	137.1	-177.1	22.1	-32.5	0	0	0	111.1	Q695 R696	P691-Q695 HydrophobicContact CB-CB 4.37Å; P691-Q695 VanDerWaalsContact CB-OE1 3.23Å; P691-R696 PolarHBondContact O-NE 3.35Å; P691-R696 PolarHBondContact O-NH2 3.02Å; P691-R696 VanDerWaalsContact O-NH2 3.09Å
692	S	47.7	Very low	50	Low	61 Å²	61	120.4 Å²	120.4	43%	0.427	66%	0.656	S	S	.	*	P	Polyproline II helix	trans	-63.5	155.8	-176.2	59.1	0	0	0	0	111.7	P690 S694 Q695 R696	P690-S692 PolarHBondContact O-N 2.98Å; S692-S694 PolarHBondContact O-N 2.82Å; S692-S694 VanDerWaalsContact O-N 3.09Å; S692-S694 PolarHBondContact OG-OG 2.82Å; S692-Q695 PolarHBondContact O-N 3.45Å; S692-R696 PolarHBondContact O-N 3.21Å
693	S	57.7	Low	52.2	Low	93 Å²	93	112.4 Å²	112.4	65%	0.65	63%	0.634	S	S	*	*	H	α-helix	trans	-53	-32	-176.6	50.1	0	0	0	0	113.9	R696 L697	S693-R696 PolarHBondContact O-N 2.95Å; S693-L697 WeakPolarHBondContact O-CG 3.47Å; S693-L697 PolarHBondContact O-N 2.82Å
694	S	61.5	Low	54.5	Low	75 Å²	75	109.3 Å²	109.3	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-68.7	-37.9	177.8	55.6	0	0	0	0	113.2	S692 R696 L697 A698	S692-S694 PolarHBondContact O-N 2.82Å; S692-S694 VanDerWaalsContact O-N 3.09Å; S692-S694 PolarHBondContact OG-OG 2.82Å; S694-R696 VanDerWaalsContact C-N 3.31Å; S694-R696 PolarHBondContact O-N 2.96Å; S694-L697 PolarHBondContact O-N 2.82Å; S694-A698 PolarHBondContact O-N 3.23Å; S694-A698 VanDerWaalsContact O-N 3.12Å
695	Q	61.9	Low	56.9	Low	122 Å²	122	110.5 Å²	110.5	57%	0.57	62%	0.615	S	S	*	*	H	α-helix	trans	-68.2	-34.1	175.9	-70.6	179.2	-21.6	0	0	111.4	P691 S692 A699	P691-Q695 HydrophobicContact CB-CB 4.37Å; P691-Q695 VanDerWaalsContact CB-OE1 3.23Å; S692-Q695 PolarHBondContact O-N 3.45Å; Q695-A699 PolarHBondContact O-N 3.26Å
696	R	57.9	Low	59.4	Low	132 Å²	132	105.5 Å²	105.5	50%	0.498	60%	0.597	S	S	.	*	H	α-helix	trans	-67.6	-42.4	174.5	-58.7	-175.1	-159.7	-169.2	3	111.7	P691 S692 S693 S694 A698 A699 Y700	P691-R696 PolarHBondContact O-NE 3.35Å; P691-R696 PolarHBondContact O-NH2 3.02Å; P691-R696 VanDerWaalsContact O-NH2 3.09Å; S692-R696 PolarHBondContact O-N 3.21Å; S693-R696 PolarHBondContact O-N 2.95Å; S694-R696 VanDerWaalsContact C-N 3.31Å; S694-R696 PolarHBondContact O-N 2.96Å; R696-A698 PolarHBondContact O-N 3.08Å; R696-A699 PolarHBondContact O-N 3.04Å; R696-Y700 WeakPolarHBondContact O-CD2 3.32Å; R696-Y700 PolarHBondContact O-N 2.84Å
697	L	69.8	Low	61.7	Low	123 Å²	123	100.1 Å²	100.1	64%	0.644	58%	0.579	S	S	*	*	H	α-helix	trans	-63	-40.2	177.4	-77.8	164.4	0	0	0	112.5	S693 S694 Y700 A701	S693-L697 WeakPolarHBondContact O-CG 3.47Å; S693-L697 PolarHBondContact O-N 2.82Å; S694-L697 PolarHBondContact O-N 2.82Å; L697-Y700 PolarHBondContact O-N 3.33Å; L697-A701 WeakPolarHBondContact O-CB 3.39Å; L697-A701 PolarHBondContact O-N 3.1Å
698	A	68.1	Low	64.1	Low	61 Å²	61	99.4 Å²	99.4	50%	0.504	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-41.6	176.3	0	0	0	0	0	112	S694 R696 A701 Y702	S694-A698 PolarHBondContact O-N 3.23Å; S694-A698 VanDerWaalsContact O-N 3.12Å; R696-A698 PolarHBondContact O-N 3.08Å; A698-A701 PolarHBondContact O-N 2.98Å; A698-Y702 PolarHBondContact O-N 3.33Å; A698-Y702 VanDerWaalsContact O-N 3.09Å
699	A	71.1	Confident	66.7	Low	65 Å²	65	98.2 Å²	98.2	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-64.5	-41.4	175.8	0	0	0	0	0	112.1	Q695 R696 Y702 S703	Q695-A699 PolarHBondContact O-N 3.26Å; R696-A699 PolarHBondContact O-N 3.04Å; A699-Y702 PolarHBondContact O-N 3.27Å; A699-S703 PolarHBondContact O-N 3.42Å
700	Y	67.7	Low	69	Low	168 Å²	168	98.3 Å²	98.3	66%	0.659	55%	0.548	S	S	*	.	H	α-helix	trans	-62.5	-47.2	174.6	-93.5	-75.7	0	0	0	111.9	R696 L697 Y702 S703 V704	R696-Y700 WeakPolarHBondContact O-CD2 3.32Å; R696-Y700 PolarHBondContact O-N 2.84Å; L697-Y700 PolarHBondContact O-N 3.33Å; Y700-Y702 VanDerWaalsContact C-N 3.28Å; Y700-Y702 PolarHBondContact O-N 2.91Å; Y700-S703 PolarHBondContact O-N 2.74Å; Y700-S703 VanDerWaalsContact O-N 3.14Å; Y700-S703 PolarHBondContact O-OG 2.04Å; Y700-V704 WeakPolarHBondContact O-CG2 3.24Å; Y700-V704 PolarHBondContact O-N 2.69Å
701	A	74.6	Confident	71.1	Confident	56 Å²	56	99.5 Å²	99.5	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-58.7	-40.2	178.3	0	0	0	0	0	112.3	L697 A698 F705	L697-A701 WeakPolarHBondContact O-CB 3.39Å; L697-A701 PolarHBondContact O-N 3.1Å; A698-A701 PolarHBondContact O-N 2.98Å; A701-F705 PolarHBondContact O-N 2.92Å; A701-F705 VanDerWaalsContact O-N 3.14Å
702	Y	78.2	Confident	73.2	Confident	171 Å²	171	102 Å²	102	67%	0.671	56%	0.556	S	S	*	*	H	α-helix	trans	-64.4	-42.2	175.9	-120.6	-88.8	0	0	0	112.5	A698 A699 Y700 F705 L706	A698-Y702 PolarHBondContact O-N 3.33Å; A698-Y702 VanDerWaalsContact O-N 3.09Å; A699-Y702 PolarHBondContact O-N 3.27Å; Y700-Y702 VanDerWaalsContact C-N 3.28Å; Y700-Y702 PolarHBondContact O-N 2.91Å; Y702-F705 PolarHBondContact O-N 3.44Å; Y702-L706 HydrophobicContact CD1-CD1 4.14Å; Y702-L706 PolarHBondContact O-N 2.66Å; Y702-L706 VanDerWaalsContact O-N 3.09Å
703	S	76.1	Confident	75.1	Confident	63 Å²	63	104.7 Å²	104.7	44%	0.441	56%	0.564	S	S	.	*	H	α-helix	trans	-66.1	-38.5	-179.9	69.5	0	0	0	0	112.6	A699 Y700 L706 S707	A699-S703 PolarHBondContact O-N 3.42Å; Y700-S703 PolarHBondContact O-N 2.74Å; Y700-S703 VanDerWaalsContact O-N 3.14Å; Y700-S703 PolarHBondContact O-OG 2.04Å; S703-L706 PolarHBondContact O-N 2.97Å; S703-S707 PolarHBondContact O-N 3.31Å; S703-S707 VanDerWaalsContact O-N 3.09Å; S703-S707 PolarHBondContact O-OG 3.33Å
704	V	79.7	Confident	76.1	Confident	82 Å²	82	102.8 Å²	102.8	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-46.1	175.7	175.2	0	0	0	0	110	Y700 L706 S707 T708	Y700-V704 WeakPolarHBondContact O-CG2 3.24Å; Y700-V704 PolarHBondContact O-N 2.69Å; V704-L706 VanDerWaalsContact C-N 3.35Å; V704-L706 PolarHBondContact O-N 3.27Å; V704-S707 PolarHBondContact O-N 3.47Å; V704-S707 PolarHBondContact O-OG 2.82Å; V704-T708 PolarHBondContact O-N 3.45Å; V704-T708 PolarHBondContact O-OG1 3.23Å
705	F	80.3	Confident	77	Confident	156 Å²	156	103.3 Å²	103.3	68%	0.684	55%	0.553	S	S	*	*	H	α-helix	trans	-58.4	-45.4	179	-117.3	-85.3	0	0	0	112.2	A701 Y702 T708 L709	A701-F705 PolarHBondContact O-N 2.92Å; A701-F705 VanDerWaalsContact O-N 3.14Å; Y702-F705 PolarHBondContact O-N 3.44Å; F705-T708 PolarHBondContact O-N 2.8Å; F705-T708 PolarHBondContact O-OG1 2.81Å; F705-L709 PolarHBondContact O-N 3.31Å; F705-L709 VanDerWaalsContact O-N 3.1Å
706	L	86.1	Confident	77.9	Confident	101 Å²	101	105.7 Å²	105.7	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-64	-41.9	178.6	-110.7	117.9	0	0	0	112.3	Y702 S703 V704 L709 L710	Y702-L706 HydrophobicContact CD1-CD1 4.14Å; Y702-L706 PolarHBondContact O-N 2.66Å; Y702-L706 VanDerWaalsContact O-N 3.09Å; S703-L706 PolarHBondContact O-N 2.97Å; V704-L706 VanDerWaalsContact C-N 3.35Å; V704-L706 PolarHBondContact O-N 3.27Å; L706-L709 PolarHBondContact O-N 3.12Å; L706-L710 PolarHBondContact O-N 3.42Å
707	S	76.6	Confident	78.8	Confident	67 Å²	67	105.3 Å²	105.3	47%	0.469	56%	0.561	S	S	.	*	H	α-helix	trans	-64.4	-41.6	179.4	70.5	0	0	0	0	112.3	S703 V704 L709 L710 L711	S703-S707 PolarHBondContact O-N 3.31Å; S703-S707 VanDerWaalsContact O-N 3.09Å; S703-S707 PolarHBondContact O-OG 3.33Å; V704-S707 PolarHBondContact O-N 3.47Å; V704-S707 PolarHBondContact O-OG 2.82Å; S707-L709 VanDerWaalsContact C-N 3.33Å; S707-L709 PolarHBondContact O-N 2.99Å; S707-L710 PolarHBondContact O-N 3.44Å; S707-L711 PolarHBondContact O-N 3.33Å; S707-L711 VanDerWaalsContact O-N 3.11Å
708	T	82.2	Confident	79	Confident	72 Å²	72	105.3 Å²	105.3	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-65.1	-36.5	175.6	48.8	0	0	0	0	112.5	V704 F705 L711 L712	V704-T708 PolarHBondContact O-N 3.45Å; V704-T708 PolarHBondContact O-OG1 3.23Å; F705-T708 PolarHBondContact O-N 2.8Å; F705-T708 PolarHBondContact O-OG1 2.81Å; T708-L711 PolarHBondContact O-N 3.15Å; T708-L712 WeakPolarHBondContact O-CG 3.17Å; T708-L712 PolarHBondContact O-N 3.36Å; T708-L712 VanDerWaalsContact O-N 3.13Å
709	L	88.1	Confident	79.4	Confident	110 Å²	110	111.7 Å²	111.7	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-67.4	-43.2	178.3	-155.3	103.9	0	0	0	111.5	F705 L706 S707 L711 L712 M713	F705-L709 PolarHBondContact O-N 3.31Å; F705-L709 VanDerWaalsContact O-N 3.1Å; L706-L709 PolarHBondContact O-N 3.12Å; S707-L709 VanDerWaalsContact C-N 3.33Å; S707-L709 PolarHBondContact O-N 2.99Å; L709-L711 VanDerWaalsContact C-N 3.35Å; L709-L711 PolarHBondContact O-N 3.06Å; L709-L712 PolarHBondContact O-N 2.88Å; L709-M713 VanDerWaalsContact O-CG 3.24Å; L709-M713 WeakPolarHBondContact O-CG 3.34Å; L709-M713 PolarHBondContact O-N 3.44Å
710	L	86.3	Confident	79.6	Confident	116 Å²	116	114.5 Å²	114.5	61%	0.607	58%	0.578	S	S	*	*	H	α-helix	trans	-62.9	-40.3	177.2	-82.7	163.2	0	0	0	112.1	L706 S707 M713 A714	L706-L710 PolarHBondContact O-N 3.42Å; S707-L710 PolarHBondContact O-N 3.44Å; L710-M713 PolarHBondContact O-N 3.48Å; L710-A714 PolarHBondContact O-N 3.06Å
711	L	81.7	Confident	79.6	Confident	124 Å²	124	113.6 Å²	113.6	65%	0.649	58%	0.58	S	S	*	*	H	α-helix	trans	-66.3	-42.1	178.6	-149.7	113.9	0	0	0	111.7	S707 T708 L709 M713 A714 V715	S707-L711 PolarHBondContact O-N 3.33Å; S707-L711 VanDerWaalsContact O-N 3.11Å; T708-L711 PolarHBondContact O-N 3.15Å; L709-L711 VanDerWaalsContact C-N 3.35Å; L709-L711 PolarHBondContact O-N 3.06Å; L711-M713 VanDerWaalsContact C-N 3.3Å; L711-M713 PolarHBondContact O-N 3.24Å; L711-A714 PolarHBondContact O-N 3.07Å; L711-V715 WeakPolarHBondContact O-CG2 3.24Å; L711-V715 PolarHBondContact O-N 3.36Å
712	L	84.4	Confident	79	Confident	123 Å²	123	116.5 Å²	116.5	64%	0.644	62%	0.615	S	S	*	*	H	α-helix	trans	-62.3	-37.9	174.3	-74.2	169.1	0	0	0	112	T708 L709 R716	T708-L712 WeakPolarHBondContact O-CG 3.17Å; T708-L712 PolarHBondContact O-N 3.36Å; T708-L712 VanDerWaalsContact O-N 3.13Å; L709-L712 PolarHBondContact O-N 2.88Å; L712-R716 WeakPolarHBondContact O-CB 3.42Å; L712-R716 PolarHBondContact O-N 3.02Å
713	M	86.8	Confident	79	Confident	118 Å²	118	113.8 Å²	113.8	58%	0.581	61%	0.612	S	S	*	*	H	α-helix	trans	-66.6	-41.7	175.6	-69.3	-72.6	-78.8	0	0	111.7	L709 L710 L711 R716 H717	L709-M713 VanDerWaalsContact O-CG 3.24Å; L709-M713 WeakPolarHBondContact O-CG 3.34Å; L709-M713 PolarHBondContact O-N 3.44Å; L710-M713 PolarHBondContact O-N 3.48Å; L711-M713 VanDerWaalsContact C-N 3.3Å; L711-M713 PolarHBondContact O-N 3.24Å; M713-R716 PolarHBondContact O-N 3.4Å; M713-H717 WeakPolarHBondContact O-CB 3Å; M713-H717 PolarHBondContact O-N 3.31Å
714	A	79	Confident	79.2	Confident	53 Å²	53	116.4 Å²	116.4	44%	0.438	62%	0.621	S	S	.	*	H	α-helix	trans	-65.4	-43.3	177.1	0	0	0	0	0	112.5	L710 L711 R716 H717 L718	L710-A714 PolarHBondContact O-N 3.06Å; L711-A714 PolarHBondContact O-N 3.07Å; A714-R716 VanDerWaalsContact C-N 3.34Å; A714-R716 PolarHBondContact O-N 3.34Å; A714-H717 PolarHBondContact O-N 2.8Å; A714-L718 PolarHBondContact O-N 2.8Å
715	V	79.9	Confident	79.1	Confident	86 Å²	86	118.3 Å²	118.3	52%	0.521	63%	0.628	S	S	.	*	H	α-helix	trans	-63	-41.9	175.3	173.4	0	0	0	0	110.9	L711 H717 L718 Y719	L711-V715 WeakPolarHBondContact O-CG2 3.24Å; L711-V715 PolarHBondContact O-N 3.36Å; V715-H717 VanDerWaalsContact C-N 3.3Å; V715-H717 PolarHBondContact O-N 2.87Å; V715-L718 PolarHBondContact O-N 3.33Å; V715-Y719 WeakPolarHBondContact O-CB 2.82Å; V715-Y719 PolarHBondContact O-N 2.85Å
716	R	82.3	Confident	79.1	Confident	172 Å²	172	116.1 Å²	116.1	65%	0.649	63%	0.625	S	S	*	*	H	α-helix	trans	-62.4	-38.3	175.1	-170.5	178.7	-178.1	-177	1	111.9	L712 M713 A714 Y719 I720	L712-R716 WeakPolarHBondContact O-CB 3.42Å; L712-R716 PolarHBondContact O-N 3.02Å; M713-R716 PolarHBondContact O-N 3.4Å; A714-R716 VanDerWaalsContact C-N 3.34Å; A714-R716 PolarHBondContact O-N 3.34Å; R716-Y719 PolarHBondContact O-N 3.43Å; R716-I720 HydrophobicContact CG-CD1 4.08Å; R716-I720 WeakPolarHBondContact O-CD1 3.42Å; R716-I720 VanDerWaalsContact O-CG1 3.27Å; R716-I720 WeakPolarHBondContact O-CG1 3.2Å; R716-I720 PolarHBondContact O-N 3.33Å
717	H	75.2	Confident	78.6	Confident	125 Å²	125	117.1 Å²	117.1	58%	0.579	63%	0.631	S	S	*	*	H	α-helix	trans	-70.2	-36.6	179.5	-150	-59.1	0	0	0	112.6	M713 A714 V715 I720 Q721	M713-H717 WeakPolarHBondContact O-CB 3Å; M713-H717 PolarHBondContact O-N 3.31Å; A714-H717 PolarHBondContact O-N 2.8Å; V715-H717 VanDerWaalsContact C-N 3.3Å; V715-H717 PolarHBondContact O-N 2.87Å; H717-I720 PolarHBondContact O-N 3.05Å; H717-Q721 PolarHBondContact O-N 2.8Å
718	L	74.4	Confident	78.8	Confident	122 Å²	122	120.4 Å²	120.4	64%	0.639	64%	0.641	S	S	*	*	H	α-helix	trans	-69.6	-37.8	174.2	-75.9	163.4	0	0	0	112.2	A714 V715 I720 Q721 G722	A714-L718 PolarHBondContact O-N 2.8Å; V715-L718 PolarHBondContact O-N 3.33Å; L718-I720 VanDerWaalsContact C-N 3.28Å; L718-I720 PolarHBondContact O-N 2.91Å; L718-Q721 PolarHBondContact O-N 3.38Å; L718-G722 PolarHBondContact O-N 3.4Å; L718-G722 VanDerWaalsContact O-N 3.14Å
719	Y	76.1	Confident	78.5	Confident	196 Å²	196	123.9 Å²	123.9	77%	0.769	66%	0.656	S	S	*	*	H	α-helix	trans	-71.1	-20.3	177	-162.7	-90.2	0	0	0	113.6	V715 R716	V715-Y719 WeakPolarHBondContact O-CB 2.82Å; V715-Y719 PolarHBondContact O-N 2.85Å; R716-Y719 PolarHBondContact O-N 3.43Å
720	I	76	Confident	77.8	Confident	124 Å²	124	124.9 Å²	124.9	64%	0.636	66%	0.662	S	S	*	*	H	α-helix	trans	-86.1	-23.3	174.7	-67.5	166.6	0	0	0	111.5	R716 H717 L718	R716-I720 HydrophobicContact CG-CD1 4.08Å; R716-I720 WeakPolarHBondContact O-CD1 3.42Å; R716-I720 VanDerWaalsContact O-CG1 3.27Å; R716-I720 WeakPolarHBondContact O-CG1 3.2Å; R716-I720 PolarHBondContact O-N 3.33Å; H717-I720 PolarHBondContact O-N 3.05Å; L718-I720 VanDerWaalsContact C-N 3.28Å; L718-I720 PolarHBondContact O-N 2.91Å
721	Q	67	Low	77.1	Confident	149 Å²	149	125.7 Å²	125.7	70%	0.696	67%	0.666	S	S	*	*	H	α-helix	trans	-89.6	-25.4	179.3	-79.7	-168.4	-22.6	0	0	114.3	H717 L718	H717-Q721 PolarHBondContact O-N 2.8Å; L718-Q721 PolarHBondContact O-N 3.38Å
722	G	62.5	Low	76.7	Confident	116 Å²	116	125.8 Å²	125.8	100%	1.196	67%	0.668	S	S	*	*			trans	-85.2	0	166.3	0	0	0	0	0	111	L718	L718-G722 PolarHBondContact O-N 3.4Å; L718-G722 VanDerWaalsContact O-N 3.14Å

Retrieved 722 of 722 residues in 997.6 ms (Link to these results)

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