A0A087XWR0_POEFO Loading...

XK-related protein

AlphaFold DB , UniProt , Accession A0A087XWR0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 578 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	30.8	Very low	26	Very low	255 Å²	255	141.6 Å²	141.6	100%	1.256	85%	0.848	S	S	*	*				0	134.3	0	-66	-172	-151.8	0	0	107.9
2	A	25.3	Very low	25.9	Very low	105 Å²	105	141.1 Å²	141.1	87%	0.868	85%	0.846	S	S	*	*			trans	-99.5	152.8	-163.8	0	0	0	0	0	113.5
3	A	25.2	Very low	25.8	Very low	97 Å²	97	134.5 Å²	134.5	80%	0.802	83%	0.825	S	S	*	*			trans	175	110.6	140.1	0	0	0	0	0	106.4
4	K	25.3	Very low	25.7	Very low	199 Å²	199	140.1 Å²	140.1	87%	0.865	83%	0.833	S	S	*	*				69	95.6	57.9	-160	165.8	-172.2	-175.7	0	113.3
5	S	25.7	Very low	25.7	Very low	93 Å²	93	137.6 Å²	137.6	65%	0.65	83%	0.834	S	S	*	*				101.4	137.8	116.1	-150.1	0	0	0	0	110.6
6	D	24.7	Very low	25.6	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	84%	0.835	S	S	*	*			cis	-147.9	161.7	46.8	-77.8	-41.4	0	0	0	113
7	G	25.6	Very low	25.5	Very low	73 Å²	73	142.3 Å²	142.3	75%	0.753	84%	0.839	S	S	*	*			trans	-88.1	162.1	-175	0	0	0	0	0	116.3
8	R	23.7	Very low	25.4	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	84%	0.835	S	S	*	*			trans	-163.7	122.5	140.6	-120.2	178.9	-173.3	-163.6	2	108.5
9	G	27.6	Very low	25.4	Very low	79 Å²	79	144.2 Å²	144.2	81%	0.814	84%	0.835	S	S	*	*			trans	-71	129.3	170.1	0	0	0	0	0	110
10	V	25.1	Very low	25.5	Very low	120 Å²	120	144.8 Å²	144.8	73%	0.727	83%	0.834	S	S	*	*			trans	-144.9	123.1	157.3	178	0	0	0	0	107.7	T12	V10-T12 HydrophobicContact CG1-CG2 4.34Å; V10-T12 PolarHBondContact O-N 3.12Å
11	V	27.2	Very low	25.6	Very low	140 Å²	140	145.2 Å²	145.2	85%	0.848	83%	0.833	S	S	*	*			trans	-63.6	119.5	165.7	171.8	0	0	0	0	107.9
12	T	25	Very low	25.5	Very low	135 Å²	135	141.6 Å²	141.6	83%	0.828	81%	0.813	S	S	*	*			trans	-111.5	98.5	168.7	46.7	0	0	0	0	109.9	V10	V10-T12 HydrophobicContact CG1-CG2 4.34Å; V10-T12 PolarHBondContact O-N 3.12Å
13	G	23.8	Very low	25.6	Very low	56 Å²	56	143.7 Å²	143.7	58%	0.577	82%	0.815	S	S	*	*			trans	-89.9	152.6	158.7	0	0	0	0	0	110.6
14	F	24.9	Very low	25.6	Very low	213 Å²	213	146 Å²	146	93%	0.934	82%	0.818	S	S	*	*	S	Bend	trans	56.2	123.2	153	-76.2	-87.6	0	0	0	120.3
15	A	26.2	Very low	25.6	Very low	102 Å²	102	139.2 Å²	139.2	84%	0.843	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-53.9	130.1	174.7	0	0	0	0	0	113.3
16	Q	23.8	Very low	25.5	Very low	182 Å²	182	142 Å²	142	85%	0.85	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-76.8	129.9	164.7	-80.2	171.5	-83.5	0	0	110
17	L	23	Very low	25.5	Very low	173 Å²	173	138 Å²	138	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.3	126.8	160.6	-88.5	121.9	0	0	0	108.8
18	H	23.6	Very low	25.5	Very low	167 Å²	167	143.2 Å²	143.2	77%	0.773	82%	0.819	S	S	*	*			trans	-106.1	116.6	166.6	-130.6	-76.8	0	0	0	109.2
19	N	26.1	Very low	25.7	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	81%	0.812	S	S	*	*			trans	-73.8	145	159.5	-91.7	-59	0	0	0	108.4
20	L	27	Very low	25.6	Very low	155 Å²	155	142.8 Å²	142.8	81%	0.812	82%	0.816	S	S	*	*			trans	-141.2	104	170.9	-124.1	148.1	0	0	0	107.6
21	D	27	Very low	25.7	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	82%	0.819	S	S	*	*			trans	-107.7	147.3	164.1	-104.8	-29.2	0	0	0	108.2
22	E	29.5	Very low	25.7	Very low	179 Å²	179	146.8 Å²	146.8	84%	0.836	82%	0.823	S	S	*	*			trans	70.8	115.3	171.2	-60.9	-166	147.5	0	0	119.6
23	V	26.9	Very low	25.8	Very low	149 Å²	149	148.4 Å²	148.4	90%	0.903	83%	0.827	S	S	*	*				-161.1	135.1	115	167.6	0	0	0	0	110.2
24	V	27	Very low	25.8	Very low	145 Å²	145	149 Å²	149	88%	0.879	83%	0.833	S	S	*	*			trans	-75.1	143.6	174.5	168	0	0	0	0	112.1
25	G	24.7	Very low	25.8	Very low	58 Å²	58	144.1 Å²	144.1	60%	0.598	83%	0.825	S	S	*	*			trans	148.7	98.4	151.6	0	0	0	0	0	118.5
26	T	24.1	Very low	25.9	Very low	150 Å²	150	143.5 Å²	143.5	92%	0.92	82%	0.815	S	S	*	*			trans	58.5	121.6	138.3	59.2	0	0	0	0	122.1
27	G	24	Very low	26.2	Very low	71 Å²	71	143 Å²	143	73%	0.732	81%	0.81	S	S	*	*			trans	118.8	91.1	130.8	0	0	0	0	0	118.1
28	E	26.1	Very low	26.7	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	80%	0.801	S	S	*	*			trans	63.5	129.9	143.9	-68.1	173.6	141.2	0	0	122.2
29	D	27.6	Very low	27.4	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	79%	0.787	S	S	*	*			trans	62.4	98.4	157.1	-62.4	-22.2	0	0	0	119.8
30	D	25.9	Very low	28	Very low	169 Å²	169	133.2 Å²	133.2	90%	0.904	76%	0.761	S	S	*	*				-168.6	149	113	-104.6	-33.1	0	0	0	114.1
31	A	26.2	Very low	28.7	Very low	94 Å²	94	134.5 Å²	134.5	78%	0.777	76%	0.762	S	S	*	*			trans	-62.5	138.5	-169.5	0	0	0	0	0	114.1	D33	A31-D33 PolarHBondContact O-N 2.67Å
32	R	28.2	Very low	29.5	Very low	249 Å²	249	129.7 Å²	129.7	94%	0.94	74%	0.74	S	S	*	*			trans	-54.1	114.2	169	-70.9	171.9	168.3	173.3	-3.7	111.5
33	D	25.3	Very low	30.2	Very low	170 Å²	170	124 Å²	124	91%	0.909	72%	0.719	S	S	*	*			trans	-114.7	80.3	153.6	-108.8	-12.9	0	0	0	109.1	A31 S35	A31-D33 PolarHBondContact O-N 2.67Å; D33-S35 PolarHBondContact O-N 2.87Å
34	G	25.3	Very low	30.8	Very low	69 Å²	69	122.7 Å²	122.7	71%	0.711	71%	0.707	S	S	*	*			trans	-70	119.5	170.3	0	0	0	0	0	109.5	S36	G34-S36 PolarHBondContact O-N 3.27Å
35	S	25.2	Very low	31.5	Very low	109 Å²	109	118.7 Å²	118.7	76%	0.762	68%	0.683	S	S	*	*			trans	-58.1	105.1	171.8	50	0	0	0	0	110.4	D33 F37	D33-S35 PolarHBondContact O-N 2.87Å; S35-F37 PolarHBondContact O-N 3.34Å
36	S	26.5	Very low	32.1	Very low	90 Å²	90	120 Å²	120	63%	0.629	68%	0.683	S	S	*	*			trans	-70.7	113.4	175.3	54.3	0	0	0	0	109.6	G34 H38	G34-S36 PolarHBondContact O-N 3.27Å; S36-H38 PolarHBondContact O-N 3.18Å
37	F	31.9	Very low	32.8	Very low	172 Å²	172	117.3 Å²	117.3	75%	0.754	67%	0.67	S	S	*	*			trans	-65.3	100	169	-91.9	-92.9	0	0	0	109.6	S35 I39	S35-F37 PolarHBondContact O-N 3.34Å; F37-I39 PolarHBondContact O-N 3.12Å
38	H	33.5	Very low	33.3	Very low	155 Å²	155	115.5 Å²	115.5	72%	0.718	65%	0.646	S	S	*	*			trans	-79.1	109	172.3	-89.3	-84	0	0	0	111.1	S36	S36-H38 PolarHBondContact O-N 3.18Å
39	I	36.8	Very low	33.6	Very low	93 Å²	93	115.8 Å²	115.8	48%	0.477	64%	0.641	S	S	.	*			trans	-76.6	130.7	174.6	-61.3	167.6	0	0	0	109.2	F37 H41 N44	F37-I39 PolarHBondContact O-N 3.12Å; I39-H41 PolarHBondContact O-N 3.34Å; I39-N44 WeakPolarHBondContact CG2-OD1 3.39Å
40	C	39.3	Very low	33.8	Very low	40 Å²	40	118.2 Å²	118.2	27%	0.27	64%	0.639	S	S	.	*	B	Isolated β-bridge	trans	-74.1	111.5	174	-179.2	0	0	0	0	110.3	C42 C43 N44 C48	C40-C42 PolarHBondContact O-N 3.17Å; C40-C43 PolarHBondContact O-N 2.82Å; C40-C43 VanDerWaalsContact O-N 3.11Å; C40-N44 PolarHBondContact O-N 2.91Å; C40-C48 HydrophobicContact CB-CB 3.4Å; C40-C48 VanDerWaalsContact CB-SG 3.54Å
41	H	41.1	Very low	34.3	Very low	182 Å²	182	113.5 Å²	113.5	84%	0.843	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-11.7	180	-96.2	-73	0	0	0	115.4	I39	I39-H41 PolarHBondContact O-N 3.34Å
42	C	43.9	Very low	34.8	Very low	53 Å²	53	111.3 Å²	111.3	36%	0.358	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-25.6	174.1	-84.7	0	0	0	0	113.7	C40 C56	C40-C42 PolarHBondContact O-N 3.17Å; C42-C56 WeakPolarHBondContact CB-SG 3.44Å
43	C	45.6	Very low	35.1	Very low	58 Å²	58	110.5 Å²	110.5	39%	0.392	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.2	-10.6	-174.4	-50.8	0	0	0	0	113.4	C40 T45	C40-C43 PolarHBondContact O-N 2.82Å; C40-C43 VanDerWaalsContact O-N 3.11Å; C43-T45 HydrophobicContact CB-CG2 3.86Å; C43-T45 WeakPolarHBondContact O-CG2 3.22Å; C43-T45 PolarHBondContact O-N 3.23Å
44	N	37.6	Very low	36	Very low	122 Å²	122	106.5 Å²	106.5	65%	0.652	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.9	36.4	-176.8	-141.4	33.8	0	0	0	114.2	I39 C40	I39-N44 WeakPolarHBondContact CG2-OD1 3.39Å; C40-N44 PolarHBondContact O-N 2.91Å
45	T	42.6	Very low	36.6	Very low	62 Å²	62	105.9 Å²	105.9	38%	0.38	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-131.6	148.9	175.4	130.5	0	0	0	0	110.6	C43 S47	C43-T45 HydrophobicContact CB-CG2 3.86Å; C43-T45 WeakPolarHBondContact O-CG2 3.22Å; C43-T45 PolarHBondContact O-N 3.23Å; T45-S47 PolarHBondContact O-N 3.34Å; T45-S47 WeakPolarHBondContact OG1-CB 3.42Å; T45-S47 PolarHBondContact OG1-N 3.42Å
46	S	38.1	Very low	37.2	Very low	85 Å²	85	101.7 Å²	101.7	59%	0.594	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-75	-5.9	176.7	57	0	0	0	0	113.5	C48	S46-C48 PolarHBondContact O-N 3.04Å
47	S	37.6	Very low	38	Very low	93 Å²	93	102.3 Å²	102.3	65%	0.65	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-78.3	2.8	-176.3	-168.9	0	0	0	0	114.3	T45 Y49	T45-S47 PolarHBondContact O-N 3.34Å; T45-S47 WeakPolarHBondContact OG1-CB 3.42Å; T45-S47 PolarHBondContact OG1-N 3.42Å; S47-Y49 PolarHBondContact O-N 3.44Å
48	C	34.9	Very low	38.7	Very low	33 Å²	33	100.8 Å²	100.8	22%	0.223	54%	0.54	C	S	.	.	G	3₁₀ helix	trans	-82.4	-6.2	-168.4	-78.9	0	0	0	0	116	C40 S46 W50	C40-C48 HydrophobicContact CB-CB 3.4Å; C40-C48 VanDerWaalsContact CB-SG 3.54Å; S46-C48 PolarHBondContact O-N 3.04Å; C48-W50 PolarHBondContact O-N 2.93Å
49	Y	33.6	Very low	39	Very low	189 Å²	189	99.8 Å²	99.8	74%	0.741	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-81	-14.8	-164.8	-147.3	-87.2	0	0	0	115.4	S47	S47-Y49 PolarHBondContact O-N 3.44Å
50	W	30.8	Very low	39.3	Very low	196 Å²	196	99.9 Å²	99.9	74%	0.742	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-140.6	33.9	-170.1	-80	93.8	0	0	0	117.7	C48	C48-W50 PolarHBondContact O-N 2.93Å
51	G	36.8	Very low	39.4	Very low	69 Å²	69	106.9 Å²	106.9	71%	0.711	55%	0.553	S	S	*	*	S	Bend	trans	176.9	0.8	172.2	0	0	0	0	0	118.7
52	C	36.3	Very low	39.5	Very low	48 Å²	48	108.3 Å²	108.3	32%	0.324	55%	0.551	S	S	.	*			trans	-98.4	15.4	-166.6	-131	0	0	0	0	115.3	S54 A55 C56	C52-S54 PolarHBondContact O-N 3.24Å; C52-S54 VanDerWaalsContact O-N 3.13Å; C52-A55 PolarHBondContact O-N 2.9Å; C52-C56 VanDerWaalsContact O-CB 3.3Å; C52-C56 WeakPolarHBondContact O-CB 3.44Å; C52-C56 PolarHBondContact O-N 3.41Å
53	R	35.5	Very low	39.4	Very low	232 Å²	232	113.6 Å²	113.6	88%	0.875	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-24.8	-179.8	-94.8	-171.5	-179.7	-132.4	2.5	113.2	L57	R53-L57 WeakPolarHBondContact O-CB 3.27Å
54	S	42.2	Very low	38.9	Very low	86 Å²	86	114.1 Å²	114.1	60%	0.601	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-40.9	178.3	57.9	0	0	0	0	113.5	C52 H58	C52-S54 PolarHBondContact O-N 3.24Å; C52-S54 VanDerWaalsContact O-N 3.13Å; S54-H58 WeakPolarHBondContact O-CB 3.27Å; S54-H58 PolarHBondContact O-CD2 2.93Å; S54-H58 PolarHBondContact O-N 3.24Å
55	A	38.5	Very low	39	Very low	56 Å²	56	118.6 Å²	118.6	46%	0.463	59%	0.591	S	S	.	*	H	α-helix	trans	-78.9	-39.8	-176.2	0	0	0	0	0	113	C52 H58 Y59	C52-A55 PolarHBondContact O-N 2.9Å; A55-H58 PolarHBondContact O-N 3.04Å; A55-Y59 PolarHBondContact O-N 3.03Å
56	C	39.3	Very low	38.6	Very low	22 Å²	22	119 Å²	119	15%	0.149	61%	0.608	C	S	.	*	H	α-helix	trans	-68.3	-37.5	176.8	-157.9	0	0	0	0	111.4	C42 C52 Y59 L60	C42-C56 WeakPolarHBondContact CB-SG 3.44Å; C52-C56 VanDerWaalsContact O-CB 3.3Å; C52-C56 WeakPolarHBondContact O-CB 3.44Å; C52-C56 PolarHBondContact O-N 3.41Å; C56-Y59 PolarHBondContact O-N 3.02Å; C56-L60 WeakPolarHBondContact O-CG 3.48Å; C56-L60 PolarHBondContact O-N 2.95Å
57	L	41.5	Very low	38.8	Very low	103 Å²	103	125.9 Å²	125.9	54%	0.539	63%	0.627	S	S	.	*	H	α-helix	trans	-70.4	-32.8	175.2	-158.3	144.2	0	0	0	111.8	R53 R61	R53-L57 WeakPolarHBondContact O-CB 3.27Å; L57-R61 WeakPolarHBondContact O-CB 3.28Å; L57-R61 PolarHBondContact O-N 3.28Å
58	H	46.3	Very low	38.5	Very low	139 Å²	139	124.7 Å²	124.7	64%	0.644	63%	0.629	S	S	*	*	H	α-helix	trans	-65.4	-41	169.9	-106.7	-79.5	0	0	0	112.7	S54 A55 R61 R62	S54-H58 WeakPolarHBondContact O-CB 3.27Å; S54-H58 PolarHBondContact O-CD2 2.93Å; S54-H58 PolarHBondContact O-N 3.24Å; A55-H58 PolarHBondContact O-N 3.04Å; H58-R61 PolarHBondContact O-N 3.44Å; H58-R62 WeakPolarHBondContact O-CB 3.35Å; H58-R62 PolarHBondContact O-N 3.31Å
59	Y	40.7	Very low	38.6	Very low	135 Å²	135	134.7 Å²	134.7	53%	0.529	66%	0.662	S	S	.	*	H	α-helix	trans	-65.5	-46.3	178.1	-175.4	-106.7	0	0	0	111.9	A55 C56 R61 R62 K63	A55-Y59 PolarHBondContact O-N 3.03Å; C56-Y59 PolarHBondContact O-N 3.02Å; Y59-R61 PolarHBondContact O-N 3.32Å; Y59-R62 PolarHBondContact O-N 2.89Å; Y59-K63 PolarHBondContact O-N 3.18Å
60	L	42.6	Very low	38.4	Very low	94 Å²	94	133.2 Å²	133.2	49%	0.492	67%	0.667	S	S	.	*	H	α-helix	trans	-62.8	-39.7	175.6	-72.5	167.8	0	0	0	112.4	C56 R62 K63 G64	C56-L60 WeakPolarHBondContact O-CG 3.48Å; C56-L60 PolarHBondContact O-N 2.95Å; L60-R62 VanDerWaalsContact C-N 3.31Å; L60-R62 PolarHBondContact O-N 3.38Å; L60-K63 PolarHBondContact O-N 2.93Å; L60-G64 PolarHBondContact O-N 3.36Å
61	R	42.8	Very low	38.7	Very low	187 Å²	187	129.3 Å²	129.3	71%	0.706	68%	0.677	S	S	*	*	H	α-helix	trans	-71.1	-25.1	178.7	-155.4	174.9	-172.1	174.5	3.6	113.2	L57 H58 Y59	L57-R61 WeakPolarHBondContact O-CB 3.28Å; L57-R61 PolarHBondContact O-N 3.28Å; H58-R61 PolarHBondContact O-N 3.44Å; Y59-R61 PolarHBondContact O-N 3.32Å
62	R	42.3	Very low	38.4	Very low	212 Å²	212	129.1 Å²	129.1	80%	0.8	67%	0.674	S	S	*	*	H	α-helix	trans	-80.3	-35.2	174.9	-140.5	177	-174	174.1	0.1	111.9	H58 Y59 L60 G64	H58-R62 WeakPolarHBondContact O-CB 3.35Å; H58-R62 PolarHBondContact O-N 3.31Å; Y59-R62 PolarHBondContact O-N 2.89Å; L60-R62 VanDerWaalsContact C-N 3.31Å; L60-R62 PolarHBondContact O-N 3.38Å; R62-G64 VanDerWaalsContact C-N 3.32Å
63	K	41.8	Very low	38.2	Very low	165 Å²	165	135.6 Å²	135.6	72%	0.717	69%	0.692	S	S	*	*	H	α-helix	trans	-70.6	-27.4	176.9	-155.4	177.2	-176.9	-176.5	0	112.7	Y59 L60	Y59-K63 PolarHBondContact O-N 3.18Å; L60-K63 PolarHBondContact O-N 2.93Å
64	G	35.8	Very low	38.3	Very low	69 Å²	69	127.9 Å²	127.9	71%	0.711	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-6.8	177.3	0	0	0	0	0	116.3	L60 R62	L60-G64 PolarHBondContact O-N 3.36Å; R62-G64 VanDerWaalsContact C-N 3.32Å
65	R	39.6	Very low	38.8	Very low	216 Å²	216	129.2 Å²	129.2	82%	0.815	68%	0.679	S	S	*	*	S	Bend	trans	-105.6	99.7	173.7	-83.4	-176.8	169.9	173.7	-4.9	109.1
66	G	33.5	Very low	39.6	Very low	71 Å²	71	132.1 Å²	132.1	73%	0.732	68%	0.683	S	S	*	*			trans	-56.4	155.8	-178.9	0	0	0	0	0	114.5	G68	G66-G68 PolarHBondContact O-N 3.44Å
67	K	42.5	Very low	40.5	Very low	228 Å²	228	134 Å²	134	99%	0.991	69%	0.689	S	S	*	*	S	Bend	trans	-30.1	117.8	161.6	-102.4	170.8	167	175.8	0	112.2
68	G	32.3	Very low	41.7	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	69%	0.69	S	S	*	*			trans	163.8	97.4	167.3	0	0	0	0	0	115	G66	G66-G68 PolarHBondContact O-N 3.44Å
69	R	35.2	Very low	43	Very low	244 Å²	244	132 Å²	132	92%	0.921	67%	0.674	S	S	*	*	S	Bend	trans	68.6	141.8	154.5	-65.5	177.2	-176.6	163.2	1.2	119.3
70	D	30.3	Very low	44.6	Very low	158 Å²	158	127.3 Å²	127.3	85%	0.845	66%	0.658	S	S	*	*			trans	75.5	92.6	174.6	-55.6	-19.9	0	0	0	118.4	G72	D70-G72 PolarHBondContact O-N 3.19Å
71	A	36.1	Very low	46.4	Very low	114 Å²	114	131.6 Å²	131.6	94%	0.942	67%	0.668	S	S	*	*			trans	-68.1	74.8	159.1	0	0	0	0	0	110.2
72	G	31.8	Very low	48.3	Very low	64 Å²	64	126.4 Å²	126.4	66%	0.66	65%	0.654	S	S	*	*			trans	-72.6	138.6	161.9	0	0	0	0	0	110.3	D70	D70-G72 PolarHBondContact O-N 3.19Å
73	R	32.5	Very low	50.3	Low	185 Å²	185	118.6 Å²	118.6	70%	0.698	63%	0.628	S	S	*	*			trans	-43.6	147.4	175.2	-80.2	179.5	-173.3	164.6	1.1	112.2
74	P	37.3	Very low	52.3	Low	70 Å²	70	112 Å²	112	46%	0.455	60%	0.602	S	S	.	*			trans	-63.5	139.7	177.4	26.9	-32.4	0	0	0	110.3	Q76 E77	P74-Q76 PolarHBondContact O-N 2.9Å; P74-E77 HydrophobicContact CG-CG 4.2Å; P74-E77 PolarHBondContact O-N 3.35Å; P74-E77 VanDerWaalsContact O-N 3.08Å
75	P	51.2	Low	54.8	Low	114 Å²	114	113.1 Å²	113.1	74%	0.74	59%	0.591	S	S	*	*	H	α-helix	trans	-60.4	-2.3	178.7	22	-32.5	0	0	0	114.8
76	Q	55.5	Low	57.2	Low	117 Å²	117	103.4 Å²	103.4	55%	0.547	55%	0.554	S	S	.	*	H	α-helix	trans	-86.2	-31.2	177.9	-161.4	166.3	14.5	0	0	112.7	P74 L80 Q208	P74-Q76 PolarHBondContact O-N 2.9Å; Q76-L80 PolarHBondContact O-N 3.45Å; Q76-Q208 VanDerWaalsContact NE2-NE2 3.19Å
77	E	58.2	Low	59.8	Low	60 Å²	60	100.6 Å²	100.6	28%	0.28	52%	0.523	S	S	.	.	H	α-helix	trans	-70.9	-44.6	176.5	-83.9	-176.9	174.5	0	0	111.4	P74 R79 L80 W81 H202	P74-E77 HydrophobicContact CG-CG 4.2Å; P74-E77 PolarHBondContact O-N 3.35Å; P74-E77 VanDerWaalsContact O-N 3.08Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.45Å; E77-L80 PolarHBondContact O-N 3.35Å; E77-W81 PolarHBondContact O-N 3.39Å; E77-H202 VanDerWaalsContact CG-NE2 3.33Å; E77-H202 WeakPolarHBondContact CG-NE2 3.22Å; E77-H202 IonicContact OE1-CE1 3.4Å; E77-H202 PolarHBondContact OE1-CE1 3.19Å; E77-H202 IonicContact OE1-NE2 2.78Å
78	E	67.4	Low	62	Low	121 Å²	121	92.6 Å²	92.6	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-61.4	-37.5	177.5	-66.9	-176.9	167.6	0	0	112	W81 L82	E78-W81 PolarHBondContact O-N 3.08Å; E78-L82 VanDerWaalsContact O-CG 3.29Å; E78-L82 WeakPolarHBondContact O-CG 3.48Å; E78-L82 PolarHBondContact O-N 3.27Å; E78-L82 VanDerWaalsContact O-N 3.15Å
79	R	73.8	Confident	64.8	Low	79 Å²	79	92.6 Å²	92.6	30%	0.298	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-39.3	177	-169.8	174.6	-179.5	-144.7	-2.5	112	E77 L82 D83 D279 S286 Y289	E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.45Å; R79-L82 PolarHBondContact O-N 2.95Å; R79-D83 PolarHBondContact O-N 3.01Å; R79-D279 IonicContact NH2-OD1 3.44Å; R79-D279 IonicContact NH2-OD2 2.61Å; R79-D279 PolarHBondContact NH2-OD2 2.97Å; R79-S286 VanDerWaalsContact NH2-CB 3.33Å; R79-Y289 PolarHBondContact O-OH 3.31Å
80	L	74.4	Confident	67.3	Low	38 Å²	38	81.4 Å²	81.4	20%	0.199	44%	0.436	C	S	.	.	H	α-helix	trans	-62.9	-46	177.6	-170	95.4	0	0	0	111.5	Q76 E77 L82 D83 C84 H202	Q76-L80 PolarHBondContact O-N 3.45Å; E77-L80 PolarHBondContact O-N 3.35Å; L80-L82 VanDerWaalsContact C-N 3.29Å; L80-L82 PolarHBondContact O-N 3.41Å; L80-D83 PolarHBondContact O-N 3.3Å; L80-D83 VanDerWaalsContact O-N 3.17Å; L80-C84 PolarHBondContact O-N 3.46Å; L80-C84 PolarHBondContact O-SG 3.48Å; L80-H202 HydrophobicContact CD2-CB 4.17Å
81	W	79.6	Confident	70.2	Confident	184 Å²	184	75 Å²	75	70%	0.697	40%	0.402	S	S	*	.	H	α-helix	trans	-61.6	-39.3	177.7	-76.8	107	0	0	0	112	E77 E78 C84 L85	E77-W81 PolarHBondContact O-N 3.39Å; E78-W81 PolarHBondContact O-N 3.08Å; W81-C84 PolarHBondContact O-N 2.92Å; W81-L85 VanDerWaalsContact O-CB 3.27Å; W81-L85 WeakPolarHBondContact O-CB 3.34Å; W81-L85 PolarHBondContact O-N 3.09Å
82	L	84.1	Confident	72.8	Confident	78 Å²	78	74.6 Å²	74.6	41%	0.408	38%	0.383	S	S	.	.	H	α-helix	trans	-68.2	-35.9	174.7	-67.7	169.3	0	0	0	112.5	E78 R79 L80 W86 Y289	E78-L82 VanDerWaalsContact O-CG 3.29Å; E78-L82 WeakPolarHBondContact O-CG 3.48Å; E78-L82 PolarHBondContact O-N 3.27Å; E78-L82 VanDerWaalsContact O-N 3.15Å; R79-L82 PolarHBondContact O-N 2.95Å; L80-L82 VanDerWaalsContact C-N 3.29Å; L80-L82 PolarHBondContact O-N 3.41Å; L82-W86 VanDerWaalsContact O-CB 3.29Å; L82-W86 WeakPolarHBondContact O-CB 3.35Å; L82-W86 PolarHBondContact O-N 3.19Å; L82-Y289 HydrophobicContact CB-CD2 4.11Å; L82-Y289 HydrophobicContact CB-CE1 4.05Å; L82-Y289 HydrophobicContact CB-CE2 3.42Å; L82-Y289 VanDerWaalsContact CB-CE2 3.42Å; L82-Y289 WeakPolarHBondContact CB-OH 3.46Å; L82-Y289 HydrophobicContact CD1-CD2 3.85Å; L82-Y289 HydrophobicContact CD1-CE2 3.69Å; L82-Y289 HydrophobicContact CG-CE2 4.18Å
83	D	83.4	Confident	75.6	Confident	48 Å²	48	72.9 Å²	72.9	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-67.3	-43.9	174.1	-78.3	-34.2	0	0	0	111.2	R79 L80 W86 I87 Y289	R79-D83 PolarHBondContact O-N 3.01Å; L80-D83 PolarHBondContact O-N 3.3Å; L80-D83 VanDerWaalsContact O-N 3.17Å; D83-W86 PolarHBondContact O-N 2.94Å; D83-I87 VanDerWaalsContact O-CG1 3.31Å; D83-I87 WeakPolarHBondContact O-CG1 3.31Å; D83-I87 PolarHBondContact O-N 2.84Å; D83-Y289 WeakPolarHBondContact CA-OH 3.38Å; D83-Y289 PolarHBondContact N-OH 3.36Å; D83-Y289 PolarHBondContact OD1-OH 2.97Å
84	C	84.4	Confident	78.3	Confident	25 Å²	25	65.2 Å²	65.2	17%	0.169	33%	0.331	C	S	.	.	H	α-helix	trans	-61	-46.9	173.1	-73.1	0	0	0	0	111.4	L80 W81 W86 I87 V88	L80-C84 PolarHBondContact O-N 3.46Å; L80-C84 PolarHBondContact O-SG 3.48Å; W81-C84 PolarHBondContact O-N 2.92Å; C84-W86 VanDerWaalsContact C-N 3.32Å; C84-W86 PolarHBondContact O-N 3.36Å; C84-I87 PolarHBondContact O-N 2.85Å; C84-V88 VanDerWaalsContact O-CG2 3.31Å; C84-V88 WeakPolarHBondContact O-CG2 3.44Å; C84-V88 PolarHBondContact O-N 3.42Å
85	L	88.8	Confident	80.8	Confident	94 Å²	94	66.4 Å²	66.4	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-59.3	-44.3	176.6	179.3	65.4	0	0	0	111.2	W81 I87 V88 L89	W81-L85 VanDerWaalsContact O-CB 3.27Å; W81-L85 WeakPolarHBondContact O-CB 3.34Å; W81-L85 PolarHBondContact O-N 3.09Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.22Å; L85-V88 PolarHBondContact O-N 3.42Å; L85-L89 HydrophobicContact CD1-CD1 4.19Å; L85-L89 HydrophobicContact CD1-CG 4.22Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.42Å; L85-L89 WeakPolarHBondContact O-CB 3.33Å; L85-L89 VanDerWaalsContact O-CG 3.28Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 2.71Å
86	W	88.9	Confident	82.8	Confident	11 Å²	11	67.9 Å²	67.9	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-42.7	177.5	-172.8	-86.2	0	0	0	112.2	L82 D83 C84 A90 W268 A271 S272 Y289 A292 L293	L82-W86 VanDerWaalsContact O-CB 3.29Å; L82-W86 WeakPolarHBondContact O-CB 3.35Å; L82-W86 PolarHBondContact O-N 3.19Å; D83-W86 PolarHBondContact O-N 2.94Å; C84-W86 VanDerWaalsContact C-N 3.32Å; C84-W86 PolarHBondContact O-N 3.36Å; W86-A90 WeakPolarHBondContact O-CB 3.28Å; W86-A90 PolarHBondContact O-N 3.42Å; W86-W268 AromaticContact CD2-CZ2 3.82Å; W86-W268 HydrophobicContact CD2-CZ2 3.82Å; W86-W268 AromaticContact CE2-CE2 3.98Å; W86-W268 AromaticContact CE2-CZ2 3.9Å; W86-W268 AromaticContact CE2-NE1 3.91Å; W86-W268 HydrophobicContact CE3-CH2 4.3Å; W86-W268 AromaticContact CE3-CZ2 3.96Å; W86-W268 HydrophobicContact CE3-CZ2 3.96Å; W86-W268 HydrophobicContact CG-CZ2 4.31Å; W86-W268 HydrophobicContact CH2-CH2 4.48Å; W86-W268 HydrophobicContact CH2-CZ2 4.27Å; W86-W268 HydrophobicContact CZ2-CZ2 4.14Å; W86-W268 HydrophobicContact CZ3-CH2 4.24Å; W86-W268 HydrophobicContact CZ3-CZ2 4.19Å; W86-W268 AromaticContact NE1-NE1 3.69Å; W86-A271 HydrophobicContact CZ2-CB 4.48Å; W86-S272 PolarHBondContact NE1-OG 2.72Å; W86-Y289 HydrophobicContact CB-CE1 4.29Å; W86-Y289 AromaticContact CE3-CD1 3.93Å; W86-Y289 HydrophobicContact CE3-CD1 3.93Å; W86-Y289 HydrophobicContact CE3-CE1 4.4Å; W86-Y289 HydrophobicContact CZ3-CD1 4.47Å; W86-A292 HydrophobicContact CH2-CB 3.83Å; W86-A292 HydrophobicContact CZ2-CB 4.38Å; W86-A292 HydrophobicContact CZ3-CB 4.22Å; W86-L293 HydrophobicContact CZ3-CD2 4.12Å
87	I	87.1	Confident	84.6	Confident	13 Å²	13	62.4 Å²	62.4	7%	0.067	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-43.2	177.1	-68.9	167.3	0	0	0	111.4	D83 C84 L85 A90 L91 Y191 T194 Y219	D83-I87 VanDerWaalsContact O-CG1 3.31Å; D83-I87 WeakPolarHBondContact O-CG1 3.31Å; D83-I87 PolarHBondContact O-N 2.84Å; C84-I87 PolarHBondContact O-N 2.85Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.22Å; I87-A90 WeakPolarHBondContact O-CB 3.4Å; I87-A90 PolarHBondContact O-N 3.03Å; I87-L91 PolarHBondContact O-N 3.11Å; I87-Y191 HydrophobicContact CG2-CD1 3.77Å; I87-Y191 HydrophobicContact CG2-CE1 4.34Å; I87-T194 HydrophobicContact CD1-CG2 4.23Å; I87-Y219 HydrophobicContact CD1-CD2 4.44Å; I87-Y219 HydrophobicContact CD1-CE2 4.22Å; I87-Y219 HydrophobicContact CG1-CE2 3.92Å
88	V	89.9	Confident	86.1	Confident	60 Å²	60	61.2 Å²	61.2	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-44.4	178.1	170.7	0	0	0	0	110.8	C84 L85 A90 L91 L92 M195	C84-V88 VanDerWaalsContact O-CG2 3.31Å; C84-V88 WeakPolarHBondContact O-CG2 3.44Å; C84-V88 PolarHBondContact O-N 3.42Å; L85-V88 PolarHBondContact O-N 3.42Å; V88-A90 VanDerWaalsContact C-N 3.33Å; V88-A90 PolarHBondContact O-N 2.99Å; V88-L91 WeakPolarHBondContact O-CB 3.42Å; V88-L91 PolarHBondContact O-N 3.28Å; V88-L92 HydrophobicContact CG1-CD1 4.19Å; V88-L92 HydrophobicContact CG1-CG 4.47Å; V88-L92 WeakPolarHBondContact O-CG 3.49Å; V88-L92 PolarHBondContact O-N 3.35Å; V88-M195 HydrophobicContact CG2-SD 4.49Å
89	L	90.9	Very high	87.3	Confident	67 Å²	67	57.2 Å²	57.2	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-41.3	174.8	-70.5	172.3	0	0	0	111.5	L85 L91 L92 V93 W268	L85-L89 HydrophobicContact CD1-CD1 4.19Å; L85-L89 HydrophobicContact CD1-CG 4.22Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.42Å; L85-L89 WeakPolarHBondContact O-CB 3.33Å; L85-L89 VanDerWaalsContact O-CG 3.28Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 2.71Å; L89-L91 VanDerWaalsContact C-N 3.31Å; L89-L91 PolarHBondContact O-N 2.87Å; L89-L92 PolarHBondContact O-N 2.86Å; L89-V93 WeakPolarHBondContact O-CG2 3.37Å; L89-V93 PolarHBondContact O-N 2.95Å; L89-W268 HydrophobicContact CB-CH2 3.7Å; L89-W268 HydrophobicContact CB-CZ2 3.61Å; L89-W268 HydrophobicContact CD1-CH2 3.91Å; L89-W268 HydrophobicContact CD1-CZ2 4.4Å; L89-W268 HydrophobicContact CG-CH2 4.44Å
90	A	88.4	Confident	88.2	Confident	9 Å²	9	54.3 Å²	54.3	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-42.7	174.6	0	0	0	0	0	112.3	W86 I87 V88 F94 W268	W86-A90 WeakPolarHBondContact O-CB 3.28Å; W86-A90 PolarHBondContact O-N 3.42Å; I87-A90 WeakPolarHBondContact O-CB 3.4Å; I87-A90 PolarHBondContact O-N 3.03Å; V88-A90 VanDerWaalsContact C-N 3.33Å; V88-A90 PolarHBondContact O-N 2.99Å; A90-F94 WeakPolarHBondContact O-CB 3.22Å; A90-F94 PolarHBondContact O-N 2.95Å; A90-W268 VanDerWaalsContact CB-NE1 3.25Å
91	L	89.6	Confident	89.1	Confident	25 Å²	25	52.5 Å²	52.5	13%	0.131	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-43.1	176.6	-82.7	174.8	0	0	0	112.3	I87 V88 L89 F94 F95 Y191	I87-L91 PolarHBondContact O-N 3.11Å; V88-L91 WeakPolarHBondContact O-CB 3.42Å; V88-L91 PolarHBondContact O-N 3.28Å; L89-L91 VanDerWaalsContact C-N 3.31Å; L89-L91 PolarHBondContact O-N 2.87Å; L91-F94 WeakPolarHBondContact O-CB 3.48Å; L91-F94 PolarHBondContact O-N 2.87Å; L91-F95 HydrophobicContact CD2-CE2 4.49Å; L91-F95 WeakPolarHBondContact O-CD2 3.3Å; L91-F95 PolarHBondContact O-N 3.47Å; L91-Y191 HydrophobicContact CD1-CG 4.3Å; L91-Y191 HydrophobicContact CD2-CD1 4.11Å; L91-Y191 HydrophobicContact CD2-CD2 3.44Å; L91-Y191 VanDerWaalsContact CD2-CD2 3.44Å; L91-Y191 HydrophobicContact CD2-CE2 4.01Å; L91-Y191 HydrophobicContact CD2-CG 3.51Å; L91-Y191 HydrophobicContact CG-CD1 4.08Å; L91-Y191 HydrophobicContact CG-CD2 4.3Å; L91-Y191 HydrophobicContact CG-CG 3.93Å
92	L	91.8	Very high	89.7	Confident	104 Å²	104	47.6 Å²	47.6	55%	0.545	25%	0.251	S	S	.	.	H	α-helix	trans	-63	-44.7	178.3	-70.8	173.7	0	0	0	111.4	V88 L89 F94 F95 W96	V88-L92 HydrophobicContact CG1-CD1 4.19Å; V88-L92 HydrophobicContact CG1-CG 4.47Å; V88-L92 WeakPolarHBondContact O-CG 3.49Å; V88-L92 PolarHBondContact O-N 3.35Å; L89-L92 PolarHBondContact O-N 2.86Å; L92-F94 VanDerWaalsContact C-N 3.29Å; L92-F94 PolarHBondContact O-N 3.34Å; L92-F95 PolarHBondContact O-N 2.99Å; L92-W96 VanDerWaalsContact O-CB 3.3Å; L92-W96 WeakPolarHBondContact O-CB 3.37Å; L92-W96 PolarHBondContact O-N 3.21Å
93	V	91.1	Very high	90.3	Very high	29 Å²	29	52 Å²	52	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-40.6	175.4	173.1	0	0	0	0	110.7	L89 W96 D97 T264 S265	L89-V93 WeakPolarHBondContact O-CG2 3.37Å; L89-V93 PolarHBondContact O-N 2.95Å; V93-W96 PolarHBondContact O-N 3.38Å; V93-D97 WeakPolarHBondContact O-CB 3.46Å; V93-D97 PolarHBondContact O-N 3.48Å; V93-T264 HydrophobicContact CG1-CG2 4.43Å; V93-S265 VanDerWaalsContact CG1-CA 3.46Å
94	F	88.4	Confident	90.7	Very high	23 Å²	23	49.8 Å²	49.8	10%	0.101	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-49.4	175.3	165.4	-113.4	0	0	0	113.3	A90 L91 L92 W96 D97 V98 V188 R226	A90-F94 WeakPolarHBondContact O-CB 3.22Å; A90-F94 PolarHBondContact O-N 2.95Å; L91-F94 WeakPolarHBondContact O-CB 3.48Å; L91-F94 PolarHBondContact O-N 2.87Å; L92-F94 VanDerWaalsContact C-N 3.29Å; L92-F94 PolarHBondContact O-N 3.34Å; F94-W96 VanDerWaalsContact C-N 3.26Å; F94-W96 PolarHBondContact O-N 2.9Å; F94-D97 PolarHBondContact O-N 3.32Å; F94-V98 HydrophobicContact CD2-CG2 3.88Å; F94-V98 HydrophobicContact CE2-CG2 3.37Å; F94-V98 HydrophobicContact CZ-CG2 3.89Å; F94-V98 PolarHBondContact O-N 3.24Å; F94-V98 VanDerWaalsContact O-N 3.11Å; F94-V188 HydrophobicContact CE1-CG2 4.18Å; F94-R226 VanDerWaalsContact CD2-NH2 3.31Å
95	F	90.9	Very high	91.1	Very high	96 Å²	96	49 Å²	49	42%	0.421	25%	0.246	S	C	.	.	H	α-helix	trans	-63.8	-36.1	178.4	-77.4	-62.9	0	0	0	112.1	L91 L92 G99 V188	L91-F95 HydrophobicContact CD2-CE2 4.49Å; L91-F95 WeakPolarHBondContact O-CD2 3.3Å; L91-F95 PolarHBondContact O-N 3.47Å; L92-F95 PolarHBondContact O-N 2.99Å; F95-G99 PolarHBondContact O-N 3.44Å; F95-V188 HydrophobicContact CE1-CG2 4.01Å; F95-V188 HydrophobicContact CZ-CB 4.5Å; F95-V188 HydrophobicContact CZ-CG1 4.05Å; F95-V188 HydrophobicContact CZ-CG2 3.58Å
96	W	92.3	Very high	91.4	Very high	144 Å²	144	47.2 Å²	47.2	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-46.5	175.4	-173	-99	0	0	0	111	L92 V93 F94 G99 T100 L257	L92-W96 VanDerWaalsContact O-CB 3.3Å; L92-W96 WeakPolarHBondContact O-CB 3.37Å; L92-W96 PolarHBondContact O-N 3.21Å; V93-W96 PolarHBondContact O-N 3.38Å; F94-W96 VanDerWaalsContact C-N 3.26Å; F94-W96 PolarHBondContact O-N 2.9Å; W96-G99 PolarHBondContact O-N 2.81Å; W96-T100 HydrophobicContact CD2-CG2 4.46Å; W96-T100 HydrophobicContact CZ2-CG2 4.44Å; W96-T100 WeakPolarHBondContact O-CG2 3.26Å; W96-T100 PolarHBondContact O-N 3.46Å; W96-T100 PolarHBondContact O-OG1 2.95Å; W96-L257 HydrophobicContact CZ2-CD1 4.07Å; W96-L257 HydrophobicContact CZ2-CD2 3.93Å; W96-L257 HydrophobicContact CZ2-CG 4.16Å
97	D	92.6	Very high	91.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-58.3	-58.9	178.7	-161.1	31.2	0	0	0	112.8	V93 F94 G99 T100 D101 S261 S262 S265	V93-D97 WeakPolarHBondContact O-CB 3.46Å; V93-D97 PolarHBondContact O-N 3.48Å; F94-D97 PolarHBondContact O-N 3.32Å; D97-G99 PolarHBondContact O-N 3.33Å; D97-T100 PolarHBondContact O-N 3.46Å; D97-T100 VanDerWaalsContact O-N 3.16Å; D97-T100 PolarHBondContact O-OG1 3.07Å; D97-D101 WeakPolarHBondContact O-CB 3.46Å; D97-D101 PolarHBondContact O-N 3.03Å; D97-S261 WeakPolarHBondContact CA-OG 3.35Å; D97-S261 PolarHBondContact N-OG 3.49Å; D97-S261 PolarHBondContact OD1-OG 3.37Å; D97-S262 WeakPolarHBondContact OD1-CA 3.37Å; D97-S262 VanDerWaalsContact OD1-CB 3.31Å; D97-S262 WeakPolarHBondContact OD1-CB 3.4Å; D97-S262 PolarHBondContact OD1-N 3.49Å; D97-S262 VanDerWaalsContact OD1-N 3.14Å; D97-S262 PolarHBondContact OD1-OG 3.42Å; D97-S265 WeakPolarHBondContact OD2-CB 3.47Å; D97-S265 PolarHBondContact OD2-OG 3.16Å
98	V	90.2	Very high	91.8	Very high	35 Å²	35	47.8 Å²	47.8	21%	0.212	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-40.3	177.9	177	0	0	0	0	111	F94 D101 L102	F94-V98 HydrophobicContact CD2-CG2 3.88Å; F94-V98 HydrophobicContact CE2-CG2 3.37Å; F94-V98 HydrophobicContact CZ-CG2 3.89Å; F94-V98 PolarHBondContact O-N 3.24Å; F94-V98 VanDerWaalsContact O-N 3.11Å; V98-D101 PolarHBondContact O-N 3.3Å; V98-L102 HydrophobicContact CG1-CD1 3.99Å; V98-L102 HydrophobicContact CG1-CG 4.37Å; V98-L102 WeakPolarHBondContact O-CB 3.5Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.36Å; V98-L102 PolarHBondContact O-N 3.45Å
99	G	92.4	Very high	92	Very high	36 Å²	36	52 Å²	52	37%	0.371	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-46.6	178	0	0	0	0	0	112.7	F95 W96 D97 D101 W103	F95-G99 PolarHBondContact O-N 3.44Å; W96-G99 PolarHBondContact O-N 2.81Å; D97-G99 PolarHBondContact O-N 3.33Å; G99-D101 VanDerWaalsContact C-N 3.33Å; G99-W103 WeakPolarHBondContact O-CB 3.28Å; G99-W103 PolarHBondContact O-N 3.08Å
100	T	93.4	Very high	92.1	Very high	18 Å²	18	56.6 Å²	56.6	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-38.3	178.1	48.5	0	0	0	0	112.1	W96 D97 W103 L104 L257 S258	W96-T100 HydrophobicContact CD2-CG2 4.46Å; W96-T100 HydrophobicContact CZ2-CG2 4.44Å; W96-T100 WeakPolarHBondContact O-CG2 3.26Å; W96-T100 PolarHBondContact O-N 3.46Å; W96-T100 PolarHBondContact O-OG1 2.95Å; D97-T100 PolarHBondContact O-N 3.46Å; D97-T100 VanDerWaalsContact O-N 3.16Å; D97-T100 PolarHBondContact O-OG1 3.07Å; T100-W103 PolarHBondContact O-N 3.42Å; T100-L104 WeakPolarHBondContact O-CB 3.44Å; T100-L104 PolarHBondContact O-N 3.25Å; T100-L257 HydrophobicContact CG2-CD2 4.45Å; T100-L257 HydrophobicContact CG2-CG 4.35Å; T100-S258 PolarHBondContact O-OG 3.21Å
101	D	92.5	Very high	92.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.7	-41.4	179.8	-74.1	-28.4	0	0	0	112.6	D97 V98 G99 L104 A105 V124 Q237 Q241 S258	D97-D101 WeakPolarHBondContact O-CB 3.46Å; D97-D101 PolarHBondContact O-N 3.03Å; V98-D101 PolarHBondContact O-N 3.3Å; G99-D101 VanDerWaalsContact C-N 3.33Å; D101-L104 PolarHBondContact O-N 3.46Å; D101-A105 WeakPolarHBondContact O-CB 3.46Å; D101-A105 PolarHBondContact O-N 2.9Å; D101-V124 HydrophobicContact CB-CG2 3.9Å; D101-Q237 PolarHBondContact OD1-NE2 3.45Å; D101-Q237 PolarHBondContact OD2-NE2 3.47Å; D101-Q241 PolarHBondContact OD1-NE2 3.24Å; D101-S258 PolarHBondContact OD1-OG 3.34Å
102	L	93.2	Very high	92.3	Very high	81 Å²	81	69 Å²	69	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-40.1	173.7	-70	176.8	0	0	0	112	V98 L104 A105 A106 L121 V124	V98-L102 HydrophobicContact CG1-CD1 3.99Å; V98-L102 HydrophobicContact CG1-CG 4.37Å; V98-L102 WeakPolarHBondContact O-CB 3.5Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.36Å; V98-L102 PolarHBondContact O-N 3.45Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-A105 PolarHBondContact O-N 2.89Å; L102-A106 WeakPolarHBondContact O-CB 3.29Å; L102-A106 PolarHBondContact O-N 3Å; L102-L121 HydrophobicContact CD2-CD1 4.35Å; L102-V124 HydrophobicContact CD2-CG1 4.12Å
103	W	95.2	Very high	92.1	Very high	171 Å²	171	67.5 Å²	67.5	65%	0.648	32%	0.317	S	S	*	.	H	α-helix	trans	-60.4	-48.2	173.8	-168.3	-40	0	0	0	110	G99 T100 A105 A106 D107	G99-W103 WeakPolarHBondContact O-CB 3.28Å; G99-W103 PolarHBondContact O-N 3.08Å; T100-W103 PolarHBondContact O-N 3.42Å; W103-A105 VanDerWaalsContact C-N 3.33Å; W103-A105 PolarHBondContact O-N 3.17Å; W103-A106 WeakPolarHBondContact O-CB 2.98Å; W103-A106 PolarHBondContact O-N 3.28Å; W103-A106 VanDerWaalsContact O-N 3.11Å; W103-D107 PolarHBondContact O-N 3.21Å
104	L	92.9	Very high	92.2	Very high	2 Å²	2	71.2 Å²	71.2	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-42.3	179.9	-175.4	64.9	0	0	0	111.9	T100 D101 L102 A106 D107 Y108 Q241 L254 Q255	T100-L104 WeakPolarHBondContact O-CB 3.44Å; T100-L104 PolarHBondContact O-N 3.25Å; D101-L104 PolarHBondContact O-N 3.46Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L104-A106 VanDerWaalsContact C-N 3.31Å; L104-A106 PolarHBondContact O-N 2.92Å; L104-D107 PolarHBondContact O-N 2.95Å; L104-Y108 HydrophobicContact CD1-CE1 4.31Å; L104-Y108 HydrophobicContact CD1-CE2 4.01Å; L104-Y108 HydrophobicContact CD2-CE2 4.04Å; L104-Y108 HydrophobicContact CG-CD2 4.22Å; L104-Y108 HydrophobicContact CG-CE2 3.68Å; L104-Y108 WeakPolarHBondContact O-CD2 3.17Å; L104-Y108 PolarHBondContact O-N 2.94Å; L104-Q241 HydrophobicContact CD2-CG 3.96Å; L104-L254 HydrophobicContact CD1-CB 4.36Å; L104-Q255 HydrophobicContact CD1-CG 3.66Å; L104-Q255 HydrophobicContact CD2-CG 4.49Å
105	A	93	Very high	92.3	Very high	7 Å²	7	76.8 Å²	76.8	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-61.1	-39.1	175.1	0	0	0	0	0	112.3	D101 L102 W103 Y109 S117 T120	D101-A105 WeakPolarHBondContact O-CB 3.46Å; D101-A105 PolarHBondContact O-N 2.9Å; L102-A105 PolarHBondContact O-N 2.89Å; W103-A105 VanDerWaalsContact C-N 3.33Å; W103-A105 PolarHBondContact O-N 3.17Å; A105-Y109 PolarHBondContact O-N 3.34Å; A105-S117 PolarHBondContact O-OG 2.9Å; A105-T120 HydrophobicContact CB-CG2 4.07Å
106	A	93.9	Very high	92.3	Very high	58 Å²	58	75.8 Å²	75.8	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-69.3	-38.5	175.9	0	0	0	0	0	112.6	L102 W103 L104 Y109 H110	L102-A106 WeakPolarHBondContact O-CB 3.29Å; L102-A106 PolarHBondContact O-N 3Å; W103-A106 WeakPolarHBondContact O-CB 2.98Å; W103-A106 PolarHBondContact O-N 3.28Å; W103-A106 VanDerWaalsContact O-N 3.11Å; L104-A106 VanDerWaalsContact C-N 3.31Å; L104-A106 PolarHBondContact O-N 2.92Å; A106-Y109 WeakPolarHBondContact O-CB 3.33Å; A106-Y109 PolarHBondContact O-N 3.02Å; A106-H110 PolarHBondContact O-N 3.47Å
107	D	93.1	Very high	92.3	Very high	32 Å²	32	69.5 Å²	69.5	17%	0.171	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-44.7	173.9	-179.5	67.1	0	0	0	111.1	W103 L104 Y109 H110 K111 L254	W103-D107 PolarHBondContact O-N 3.21Å; L104-D107 PolarHBondContact O-N 2.95Å; D107-Y109 VanDerWaalsContact C-N 3.31Å; D107-Y109 PolarHBondContact O-N 2.92Å; D107-H110 PolarHBondContact O-N 3.38Å; D107-K111 WeakPolarHBondContact O-CB 3.22Å; D107-K111 WeakPolarHBondContact O-CG 3.15Å; D107-K111 PolarHBondContact O-N 3.38Å; D107-K111 VanDerWaalsContact OD1-CE 3.3Å; D107-K111 WeakPolarHBondContact OD1-CE 3.47Å; D107-K111 IonicContact OD1-NZ 2.64Å; D107-K111 PolarHBondContact OD1-NZ 3.47Å; D107-K111 WeakPolarHBondContact OD2-CD 3.21Å; D107-K111 WeakPolarHBondContact OD2-CE 3.34Å; D107-K111 IonicContact OD2-NZ 3.63Å; D107-K111 PolarHBondContact OD2-NZ 2.84Å; D107-L254 HydrophobicContact CB-CD1 4.29Å
108	Y	92.7	Very high	92.3	Very high	4 Å²	4	72.8 Å²	72.8	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-37.5	173.8	-69.5	-34.6	0	0	0	113	L104 K111 R112 N113 W116 I244 Q255	L104-Y108 HydrophobicContact CD1-CE1 4.31Å; L104-Y108 HydrophobicContact CD1-CE2 4.01Å; L104-Y108 HydrophobicContact CD2-CE2 4.04Å; L104-Y108 HydrophobicContact CG-CD2 4.22Å; L104-Y108 HydrophobicContact CG-CE2 3.68Å; L104-Y108 WeakPolarHBondContact O-CD2 3.17Å; L104-Y108 PolarHBondContact O-N 2.94Å; Y108-K111 PolarHBondContact O-N 2.84Å; Y108-R112 PolarHBondContact O-N 3.22Å; Y108-N113 PolarHBondContact O-N 3.29Å; Y108-W116 HydrophobicContact CD2-CB 3.95Å; Y108-W116 HydrophobicContact CE2-CB 4.25Å; Y108-W116 HydrophobicContact CG-CB 4.11Å; Y108-I244 HydrophobicContact CE2-CD1 4.43Å; Y108-Q255 PolarHBondContact OH-NE2 3.21Å
109	Y	93.3	Very high	92.4	Very high	148 Å²	148	74.6 Å²	74.6	58%	0.58	36%	0.363	S	S	*	.	H	α-helix	trans	-63.4	-45.6	174.8	-173.2	-94.3	0	0	0	111.3	A105 A106 D107 K111 R112 F114	A105-Y109 PolarHBondContact O-N 3.34Å; A106-Y109 WeakPolarHBondContact O-CB 3.33Å; A106-Y109 PolarHBondContact O-N 3.02Å; D107-Y109 VanDerWaalsContact C-N 3.31Å; D107-Y109 PolarHBondContact O-N 2.92Å; Y109-K111 VanDerWaalsContact C-N 3.31Å; Y109-K111 PolarHBondContact O-N 2.95Å; Y109-R112 PolarHBondContact O-N 3.14Å; Y109-F114 AromaticContact CD2-CD1 3.85Å; Y109-F114 HydrophobicContact CD2-CD1 3.85Å; Y109-F114 AromaticContact CD2-CE1 3.83Å; Y109-F114 HydrophobicContact CD2-CE1 3.83Å; Y109-F114 AromaticContact CE2-CD1 3.86Å; Y109-F114 HydrophobicContact CE2-CD1 3.86Å; Y109-F114 AromaticContact CE2-CE1 3.57Å; Y109-F114 HydrophobicContact CE2-CE1 3.57Å
110	H	93.6	Very high	92.3	Very high	164 Å²	164	72.9 Å²	72.9	76%	0.759	35%	0.346	S	S	*	.	H	α-helix	trans	-64.3	-37.2	178.5	-165.1	71	0	0	0	112.2	A106 D107 R112	A106-H110 PolarHBondContact O-N 3.47Å; D107-H110 PolarHBondContact O-N 3.38Å; H110-R112 PolarHBondContact O-N 3.49Å
111	K	90.4	Very high	92.3	Very high	88 Å²	88	75.2 Å²	75.2	38%	0.383	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	5.5	173.8	-69.5	173.1	178.7	168.6	0	114	D107 Y108 Y109 N113 E252	D107-K111 WeakPolarHBondContact O-CB 3.22Å; D107-K111 WeakPolarHBondContact O-CG 3.15Å; D107-K111 PolarHBondContact O-N 3.38Å; D107-K111 VanDerWaalsContact OD1-CE 3.3Å; D107-K111 WeakPolarHBondContact OD1-CE 3.47Å; D107-K111 IonicContact OD1-NZ 2.64Å; D107-K111 PolarHBondContact OD1-NZ 3.47Å; D107-K111 WeakPolarHBondContact OD2-CD 3.21Å; D107-K111 WeakPolarHBondContact OD2-CE 3.34Å; D107-K111 IonicContact OD2-NZ 3.63Å; D107-K111 PolarHBondContact OD2-NZ 2.84Å; Y108-K111 PolarHBondContact O-N 2.84Å; Y109-K111 VanDerWaalsContact C-N 3.31Å; Y109-K111 PolarHBondContact O-N 2.95Å; K111-N113 PolarHBondContact O-N 3.36Å; K111-E252 IonicContact NZ-OE2 2.71Å
112	R	90.6	Very high	92.4	Very high	205 Å²	205	80.7 Å²	80.7	77%	0.774	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	19.1	-177.2	-57.7	-171.5	176.8	-175.1	-0.4	114.9	Y108 Y109 H110 F114	Y108-R112 PolarHBondContact O-N 3.22Å; Y109-R112 PolarHBondContact O-N 3.14Å; H110-R112 PolarHBondContact O-N 3.49Å; R112-F114 VanDerWaalsContact C-N 3.3Å; R112-F114 HydrophobicContact CB-CE2 4.2Å; R112-F114 HydrophobicContact CB-CZ 4.42Å; R112-F114 WeakPolarHBondContact O-CD2 3.38Å; R112-F114 PolarHBondContact O-N 3.09Å; R112-F114 VanDerWaalsContact O-N 3.12Å
113	N	89.3	Confident	92.3	Very high	74 Å²	74	79.2 Å²	79.2	40%	0.396	37%	0.372	S	S	.	.			trans	-88.5	68.3	175.3	-73.5	-23.2	0	0	0	110.1	Y108 K111 L115 W116 S117	Y108-N113 PolarHBondContact O-N 3.29Å; K111-N113 PolarHBondContact O-N 3.36Å; N113-L115 VanDerWaalsContact C-N 3.28Å; N113-L115 PolarHBondContact O-N 2.72Å; N113-W116 HydrophobicContact CB-CB 4.49Å; N113-W116 PolarHBondContact O-N 3.47Å; N113-S117 PolarHBondContact O-N 3.24Å
114	F	91.5	Very high	92.1	Very high	107 Å²	107	71.5 Å²	71.5	47%	0.469	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-32.2	-172.8	-60.3	-67.6	0	0	0	113.7	Y109 R112 S118	Y109-F114 AromaticContact CD2-CD1 3.85Å; Y109-F114 HydrophobicContact CD2-CD1 3.85Å; Y109-F114 AromaticContact CD2-CE1 3.83Å; Y109-F114 HydrophobicContact CD2-CE1 3.83Å; Y109-F114 AromaticContact CE2-CD1 3.86Å; Y109-F114 HydrophobicContact CE2-CD1 3.86Å; Y109-F114 AromaticContact CE2-CE1 3.57Å; Y109-F114 HydrophobicContact CE2-CE1 3.57Å; R112-F114 VanDerWaalsContact C-N 3.3Å; R112-F114 HydrophobicContact CB-CE2 4.2Å; R112-F114 HydrophobicContact CB-CZ 4.42Å; R112-F114 WeakPolarHBondContact O-CD2 3.38Å; R112-F114 PolarHBondContact O-N 3.09Å; R112-F114 VanDerWaalsContact O-N 3.12Å; F114-S118 WeakPolarHBondContact O-CB 3.49Å; F114-S118 PolarHBondContact O-N 3.41Å; F114-S118 PolarHBondContact O-OG 3.5Å
115	L	91.5	Very high	92.1	Very high	139 Å²	139	75.4 Å²	75.4	73%	0.728	36%	0.364	S	S	*	.	H	α-helix	trans	-64.4	-49.6	177.2	-69.8	174.8	0	0	0	111.6	N113 S118 L119	N113-L115 VanDerWaalsContact C-N 3.28Å; N113-L115 PolarHBondContact O-N 2.72Å; L115-S118 PolarHBondContact O-N 3.32Å; L115-L119 WeakPolarHBondContact O-CB 3.47Å; L115-L119 WeakPolarHBondContact O-CG 3.24Å; L115-L119 PolarHBondContact O-N 3.05Å
116	W	90.4	Very high	92.1	Very high	75 Å²	75	77.9 Å²	77.9	28%	0.284	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-42.5	178.8	-58.3	133.2	0	0	0	111.8	Y108 N113 S118 L119 T120 L240 I244	Y108-W116 HydrophobicContact CD2-CB 3.95Å; Y108-W116 HydrophobicContact CE2-CB 4.25Å; Y108-W116 HydrophobicContact CG-CB 4.11Å; N113-W116 HydrophobicContact CB-CB 4.49Å; N113-W116 PolarHBondContact O-N 3.47Å; W116-S118 VanDerWaalsContact C-N 3.34Å; W116-S118 PolarHBondContact O-N 3.44Å; W116-L119 HydrophobicContact CE3-CD1 3.84Å; W116-L119 HydrophobicContact CZ3-CD1 3.86Å; W116-L119 PolarHBondContact O-N 3.26Å; W116-T120 WeakPolarHBondContact O-CB 3.48Å; W116-T120 PolarHBondContact O-N 3.07Å; W116-T120 PolarHBondContact O-OG1 2.92Å; W116-L240 HydrophobicContact CZ3-CD1 4.24Å; W116-I244 HydrophobicContact CB-CD1 4.32Å; W116-I244 HydrophobicContact CD2-CD1 3.9Å; W116-I244 HydrophobicContact CD2-CG1 4.01Å; W116-I244 HydrophobicContact CE3-CD1 3.58Å; W116-I244 HydrophobicContact CE3-CG1 3.76Å; W116-I244 HydrophobicContact CG-CD1 4.22Å; W116-I244 HydrophobicContact CH2-CG1 4.36Å; W116-I244 HydrophobicContact CZ3-CD1 4.19Å; W116-I244 HydrophobicContact CZ3-CG1 3.96Å
117	S	92.6	Very high	92	Very high	12 Å²	12	75.5 Å²	75.5	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-46	173.4	-174.5	0	0	0	0	111.8	A105 N113 L121	A105-S117 PolarHBondContact O-OG 2.9Å; N113-S117 PolarHBondContact O-N 3.24Å; S117-L121 VanDerWaalsContact O-CB 3.27Å; S117-L121 WeakPolarHBondContact O-CB 3.14Å; S117-L121 PolarHBondContact O-N 3.34Å
118	S	92.6	Very high	91.9	Very high	73 Å²	73	75 Å²	75	51%	0.51	36%	0.356	S	S	.	.	H	α-helix	trans	-67.1	-39.9	-179.8	-58.5	0	0	0	0	112.4	F114 L115 W116 F122	F114-S118 WeakPolarHBondContact O-CB 3.49Å; F114-S118 PolarHBondContact O-N 3.41Å; F114-S118 PolarHBondContact O-OG 3.5Å; L115-S118 PolarHBondContact O-N 3.32Å; W116-S118 VanDerWaalsContact C-N 3.34Å; W116-S118 PolarHBondContact O-N 3.44Å; S118-F122 VanDerWaalsContact O-CB 3.27Å; S118-F122 WeakPolarHBondContact O-CB 3.49Å; S118-F122 PolarHBondContact O-N 3.42Å
119	L	91.6	Very high	91.8	Very high	72 Å²	72	77.8 Å²	77.8	38%	0.377	37%	0.374	S	S	.	.	H	α-helix	trans	-67	-45.5	177.2	-73.6	171.2	0	0	0	111.8	L115 W116 F122 F123 L240	L115-L119 WeakPolarHBondContact O-CB 3.47Å; L115-L119 WeakPolarHBondContact O-CG 3.24Å; L115-L119 PolarHBondContact O-N 3.05Å; W116-L119 HydrophobicContact CE3-CD1 3.84Å; W116-L119 HydrophobicContact CZ3-CD1 3.86Å; W116-L119 PolarHBondContact O-N 3.26Å; L119-F122 PolarHBondContact O-N 3.44Å; L119-F123 VanDerWaalsContact O-CD2 3.28Å; L119-F123 WeakPolarHBondContact O-CD2 3.43Å; L119-F123 PolarHBondContact O-N 3.19Å; L119-L240 HydrophobicContact CB-CD2 3.93Å
120	T	91.8	Very high	91.7	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-46.7	174.8	-57.3	0	0	0	0	110.6	A105 W116 F122 F123 V124	A105-T120 HydrophobicContact CB-CG2 4.07Å; W116-T120 WeakPolarHBondContact O-CB 3.48Å; W116-T120 PolarHBondContact O-N 3.07Å; W116-T120 PolarHBondContact O-OG1 2.92Å; T120-F122 VanDerWaalsContact C-N 3.31Å; T120-F122 PolarHBondContact O-N 3.02Å; T120-F123 PolarHBondContact O-N 3.49Å; T120-V124 WeakPolarHBondContact O-CG2 3.5Å; T120-V124 PolarHBondContact O-N 3.04Å; T120-V124 VanDerWaalsContact O-N 3.16Å
121	L	93.1	Very high	91.6	Very high	67 Å²	67	66.7 Å²	66.7	35%	0.351	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-34.8	179.3	-170.8	67.2	0	0	0	112.6	L102 S117 V124 L125	L102-L121 HydrophobicContact CD2-CD1 4.35Å; S117-L121 VanDerWaalsContact O-CB 3.27Å; S117-L121 WeakPolarHBondContact O-CB 3.14Å; S117-L121 PolarHBondContact O-N 3.34Å; L121-V124 PolarHBondContact O-N 3.38Å; L121-L125 HydrophobicContact CD1-CD1 3.85Å; L121-L125 HydrophobicContact CD1-CD2 4.43Å; L121-L125 HydrophobicContact CD1-CG 3.87Å; L121-L125 HydrophobicContact CD2-CD1 3.99Å; L121-L125 HydrophobicContact CG-CD1 3.6Å; L121-L125 HydrophobicContact CG-CG 3.97Å; L121-L125 WeakPolarHBondContact O-CB 3.3Å; L121-L125 WeakPolarHBondContact O-CG 3.22Å; L121-L125 PolarHBondContact O-N 3.22Å
122	F	93.8	Very high	91.7	Very high	116 Å²	116	63 Å²	63	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-46.7	175.7	173.9	-92.7	0	0	0	111.9	S118 L119 T120 V124 L125 V126	S118-F122 VanDerWaalsContact O-CB 3.27Å; S118-F122 WeakPolarHBondContact O-CB 3.49Å; S118-F122 PolarHBondContact O-N 3.42Å; L119-F122 PolarHBondContact O-N 3.44Å; T120-F122 VanDerWaalsContact C-N 3.31Å; T120-F122 PolarHBondContact O-N 3.02Å; F122-V124 VanDerWaalsContact C-N 3.28Å; F122-V124 PolarHBondContact O-N 3.27Å; F122-L125 PolarHBondContact O-N 3.41Å; F122-V126 HydrophobicContact CD2-CG2 3.69Å; F122-V126 HydrophobicContact CE2-CB 4.47Å; F122-V126 HydrophobicContact CE2-CG2 3.56Å; F122-V126 HydrophobicContact CG-CG2 4.34Å; F122-V126 HydrophobicContact CZ-CG2 4.08Å; F122-V126 WeakPolarHBondContact O-CB 3.27Å; F122-V126 PolarHBondContact O-N 3.45Å
123	F	91.5	Very high	91.7	Very high	50 Å²	50	58.1 Å²	58.1	22%	0.219	30%	0.302	C	S	.	.	H	α-helix	trans	-67.4	-27.3	178.2	-79.1	-66.7	0	0	0	113.1	L119 T120 P127 E233 P236 Q237 L240	L119-F123 VanDerWaalsContact O-CD2 3.28Å; L119-F123 WeakPolarHBondContact O-CD2 3.43Å; L119-F123 PolarHBondContact O-N 3.19Å; T120-F123 PolarHBondContact O-N 3.49Å; F123-P127 WeakPolarHBondContact O-CD 3.49Å; F123-P127 WeakPolarHBondContact O-CG 3.22Å; F123-E233 WeakPolarHBondContact O-CB 3.27Å; F123-E233 WeakPolarHBondContact O-CG 3.38Å; F123-P236 HydrophobicContact CD1-CB 4Å; F123-P236 HydrophobicContact CE1-CB 3.6Å; F123-P236 HydrophobicContact CE1-CG 4.35Å; F123-P236 HydrophobicContact CZ-CB 4.1Å; F123-Q237 HydrophobicContact CB-CB 4.25Å; F123-L240 HydrophobicContact CD2-CD2 3.93Å; F123-L240 HydrophobicContact CE2-CD2 4.03Å
124	V	91.4	Very high	91.7	Very high	8 Å²	8	56.7 Å²	56.7	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-77	-50.2	172.9	175.2	0	0	0	0	111.7	D101 L102 T120 L121 F122 S128 E233	D101-V124 HydrophobicContact CB-CG2 3.9Å; L102-V124 HydrophobicContact CD2-CG1 4.12Å; T120-V124 WeakPolarHBondContact O-CG2 3.5Å; T120-V124 PolarHBondContact O-N 3.04Å; T120-V124 VanDerWaalsContact O-N 3.16Å; L121-V124 PolarHBondContact O-N 3.38Å; F122-V124 VanDerWaalsContact C-N 3.28Å; F122-V124 PolarHBondContact O-N 3.27Å; V124-S128 WeakPolarHBondContact O-CB 3.3Å; V124-S128 PolarHBondContact O-N 2.96Å; V124-E233 WeakPolarHBondContact CA-OE1 3.5Å
125	L	91.9	Very high	91.7	Very high	85 Å²	85	51.6 Å²	51.6	45%	0.445	27%	0.272	S	S	.	.	H	α-helix	trans	-76.2	-42.5	-169.8	-68.9	-178.7	0	0	0	113.7	L121 F122 S128 V129	L121-L125 HydrophobicContact CD1-CD1 3.85Å; L121-L125 HydrophobicContact CD1-CD2 4.43Å; L121-L125 HydrophobicContact CD1-CG 3.87Å; L121-L125 HydrophobicContact CD2-CD1 3.99Å; L121-L125 HydrophobicContact CG-CD1 3.6Å; L121-L125 HydrophobicContact CG-CG 3.97Å; L121-L125 WeakPolarHBondContact O-CB 3.3Å; L121-L125 WeakPolarHBondContact O-CG 3.22Å; L121-L125 PolarHBondContact O-N 3.22Å; F122-L125 PolarHBondContact O-N 3.41Å; L125-S128 PolarHBondContact O-N 3.3Å; L125-V129 WeakPolarHBondContact O-CB 3.26Å; L125-V129 VanDerWaalsContact O-CG2 3.26Å; L125-V129 WeakPolarHBondContact O-CG2 3.4Å; L125-V129 PolarHBondContact O-N 3.27Å
126	V	92.8	Very high	91.5	Very high	59 Å²	59	47.9 Å²	47.9	36%	0.358	25%	0.25	S	C	.	.	H	α-helix	trans	-66.4	-51.4	-172.5	171.2	0	0	0	0	111.8	F122 S128 V129 L130	F122-V126 HydrophobicContact CD2-CG2 3.69Å; F122-V126 HydrophobicContact CE2-CB 4.47Å; F122-V126 HydrophobicContact CE2-CG2 3.56Å; F122-V126 HydrophobicContact CG-CG2 4.34Å; F122-V126 HydrophobicContact CZ-CG2 4.08Å; F122-V126 WeakPolarHBondContact O-CB 3.27Å; F122-V126 PolarHBondContact O-N 3.45Å; V126-S128 PolarHBondContact O-N 2.8Å; V126-V129 PolarHBondContact O-N 3.4Å; V126-L130 HydrophobicContact CG1-CD1 4.01Å; V126-L130 HydrophobicContact CG1-CG 4.49Å; V126-L130 VanDerWaalsContact O-CG 3.29Å; V126-L130 WeakPolarHBondContact O-CG 3.22Å; V126-L130 PolarHBondContact O-N 2.88Å
127	P	91.8	Very high	91.4	Very high	7 Å²	7	51.5 Å²	51.5	5%	0.045	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-41.1	175.8	-26.5	41.2	0	0	0	112.6	F123 V129 L130 V131 L232 E233	F123-P127 WeakPolarHBondContact O-CD 3.49Å; F123-P127 WeakPolarHBondContact O-CG 3.22Å; P127-V129 PolarHBondContact O-N 2.93Å; P127-L130 PolarHBondContact O-N 2.88Å; P127-V131 WeakPolarHBondContact O-CB 3.48Å; P127-V131 WeakPolarHBondContact O-CG2 3.33Å; P127-V131 PolarHBondContact O-N 3.38Å; P127-L232 HydrophobicContact CB-CB 3.72Å; P127-L232 HydrophobicContact CG-CB 3.77Å; P127-L232 WeakPolarHBondContact CG-O 3.47Å; P127-E233 HydrophobicContact CB-CB 3.8Å; P127-E233 HydrophobicContact CG-CB 3.8Å
128	S	91.4	Very high	91	Very high	21 Å²	21	52 Å²	52	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-55.9	-50.7	175.6	-178.5	0	0	0	0	111.5	V124 L125 V126 L130 V131 Q132 Q184	V124-S128 WeakPolarHBondContact O-CB 3.3Å; V124-S128 PolarHBondContact O-N 2.96Å; L125-S128 PolarHBondContact O-N 3.3Å; V126-S128 PolarHBondContact O-N 2.8Å; S128-L130 PolarHBondContact O-N 3.3Å; S128-V131 PolarHBondContact O-N 2.88Å; S128-Q132 VanDerWaalsContact O-CB 3.3Å; S128-Q132 WeakPolarHBondContact O-CB 3.26Å; S128-Q132 PolarHBondContact O-N 2.93Å; S128-Q184 PolarHBondContact OG-OE1 2.95Å
129	V	91.9	Very high	90.6	Very high	63 Å²	63	49.9 Å²	49.9	38%	0.382	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-44.2	176	170.7	0	0	0	0	111.9	L125 V126 P127 V131 Q132 I133	L125-V129 WeakPolarHBondContact O-CB 3.26Å; L125-V129 VanDerWaalsContact O-CG2 3.26Å; L125-V129 WeakPolarHBondContact O-CG2 3.4Å; L125-V129 PolarHBondContact O-N 3.27Å; V126-V129 PolarHBondContact O-N 3.4Å; P127-V129 PolarHBondContact O-N 2.93Å; V129-V131 PolarHBondContact O-N 3.34Å; V129-Q132 WeakPolarHBondContact O-CB 3.26Å; V129-Q132 PolarHBondContact O-N 3.39Å; V129-I133 HydrophobicContact CG1-CD1 3.79Å; V129-I133 HydrophobicContact CG1-CG1 4.39Å; V129-I133 VanDerWaalsContact O-CG1 3.28Å; V129-I133 WeakPolarHBondContact O-CG1 2.96Å; V129-I133 PolarHBondContact O-N 3.25Å
130	L	91.4	Very high	90.2	Very high	80 Å²	80	48.3 Å²	48.3	42%	0.419	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-46	178.6	-73.1	171.7	0	0	0	111.7	V126 P127 S128 Q132 I133 L134 L232	V126-L130 HydrophobicContact CG1-CD1 4.01Å; V126-L130 HydrophobicContact CG1-CG 4.49Å; V126-L130 VanDerWaalsContact O-CG 3.29Å; V126-L130 WeakPolarHBondContact O-CG 3.22Å; V126-L130 PolarHBondContact O-N 2.88Å; P127-L130 PolarHBondContact O-N 2.88Å; S128-L130 PolarHBondContact O-N 3.3Å; L130-Q132 VanDerWaalsContact C-N 3.29Å; L130-Q132 PolarHBondContact O-N 2.95Å; L130-I133 PolarHBondContact O-N 3.02Å; L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 2.85Å; L130-L232 HydrophobicContact CD1-CD1 4.31Å
131	V	91.3	Very high	89.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-37	178.5	175.2	0	0	0	0	110.4	P127 S128 V129 L134 S135 Q187 L225 L228 E229	P127-V131 WeakPolarHBondContact O-CB 3.48Å; P127-V131 WeakPolarHBondContact O-CG2 3.33Å; P127-V131 PolarHBondContact O-N 3.38Å; S128-V131 PolarHBondContact O-N 2.88Å; V129-V131 PolarHBondContact O-N 3.34Å; V131-L134 PolarHBondContact O-N 2.96Å; V131-S135 WeakPolarHBondContact O-CB 3.01Å; V131-S135 PolarHBondContact O-N 3.49Å; V131-Q187 HydrophobicContact CG1-CG 4.24Å; V131-L225 HydrophobicContact CG1-CB 3.82Å; V131-L225 HydrophobicContact CG1-CD2 3.87Å; V131-L225 HydrophobicContact CG1-CG 4.28Å; V131-L228 HydrophobicContact CG2-CD2 4.5Å; V131-E229 HydrophobicContact CG2-CB 3.73Å; V131-E229 HydrophobicContact CG2-CG 4.19Å
132	Q	92	Very high	88.8	Confident	11 Å²	11	51.2 Å²	51.2	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-42.1	176.2	-159.5	58.3	34.7	0	0	112.3	S128 V129 L130 S135 F136 H181	S128-Q132 VanDerWaalsContact O-CB 3.3Å; S128-Q132 WeakPolarHBondContact O-CB 3.26Å; S128-Q132 PolarHBondContact O-N 2.93Å; V129-Q132 WeakPolarHBondContact O-CB 3.26Å; V129-Q132 PolarHBondContact O-N 3.39Å; L130-Q132 VanDerWaalsContact C-N 3.29Å; L130-Q132 PolarHBondContact O-N 2.95Å; Q132-S135 PolarHBondContact O-N 3.35Å; Q132-F136 WeakPolarHBondContact O-CB 3.09Å; Q132-F136 PolarHBondContact O-N 2.87Å; Q132-H181 HydrophobicContact CG-CB 4.12Å; Q132-H181 VanDerWaalsContact CG-O 3.25Å; Q132-H181 WeakPolarHBondContact CG-O 3.3Å; Q132-H181 PolarHBondContact NE2-CD2 2.88Å; Q132-H181 PolarHBondContact O-CD2 3.05Å
133	I	90.1	Very high	87.8	Confident	102 Å²	102	49.5 Å²	49.5	52%	0.523	24%	0.243	S	C	.	.	H	α-helix	trans	-62.1	-45.1	174	-69	164.9	0	0	0	110.5	V129 L130 F136 R137	V129-I133 HydrophobicContact CG1-CD1 3.79Å; V129-I133 HydrophobicContact CG1-CG1 4.39Å; V129-I133 VanDerWaalsContact O-CG1 3.28Å; V129-I133 WeakPolarHBondContact O-CG1 2.96Å; V129-I133 PolarHBondContact O-N 3.25Å; L130-I133 PolarHBondContact O-N 3.02Å; I133-F136 PolarHBondContact O-N 2.86Å; I133-R137 WeakPolarHBondContact O-CB 3.48Å; I133-R137 PolarHBondContact O-N 3.43Å
134	L	89.8	Confident	86.8	Confident	43 Å²	43	51.2 Å²	51.2	23%	0.225	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-43.7	177.7	-70.6	174.1	0	0	0	111.9	L130 V131 F136 R137 W138 L225 L228	L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 2.85Å; V131-L134 PolarHBondContact O-N 2.96Å; L134-F136 VanDerWaalsContact C-N 3.33Å; L134-F136 PolarHBondContact O-N 3.29Å; L134-R137 PolarHBondContact O-N 3.31Å; L134-W138 VanDerWaalsContact O-CG 3.25Å; L134-W138 PolarHBondContact O-N 3.27Å; L134-L225 HydrophobicContact CB-CD2 3.93Å; L134-L228 HydrophobicContact CD1-CD2 3.3Å
135	S	90.3	Very high	85.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-44.5	174.6	174.4	0	0	0	0	111.6	V131 Q132 W138 F139 H181 R190	V131-S135 WeakPolarHBondContact O-CB 3.01Å; V131-S135 PolarHBondContact O-N 3.49Å; Q132-S135 PolarHBondContact O-N 3.35Å; S135-W138 PolarHBondContact O-N 3.19Å; S135-F139 PolarHBondContact O-N 3.43Å; S135-H181 PolarHBondContact OG-NE2 3.29Å; S135-R190 PolarHBondContact O-NH2 3.38Å; S135-R190 PolarHBondContact OG-NE 3.47Å
136	F	88.9	Confident	83.1	Confident	62 Å²	62	50.9 Å²	50.9	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-65.9	-44.7	178.2	-172.3	-109.4	0	0	0	111.1	Q132 I133 L134 W138 F139 V140 W174 H181	Q132-F136 WeakPolarHBondContact O-CB 3.09Å; Q132-F136 PolarHBondContact O-N 2.87Å; I133-F136 PolarHBondContact O-N 2.86Å; L134-F136 VanDerWaalsContact C-N 3.33Å; L134-F136 PolarHBondContact O-N 3.29Å; F136-W138 VanDerWaalsContact C-N 3.26Å; F136-W138 PolarHBondContact O-N 2.94Å; F136-F139 HydrophobicContact CD2-CD1 4.42Å; F136-F139 HydrophobicContact CE2-CD1 4.25Å; F136-F139 WeakPolarHBondContact O-CA 3.22Å; F136-F139 WeakPolarHBondContact O-CB 3.33Å; F136-F139 PolarHBondContact O-N 2.84Å; F136-F139 VanDerWaalsContact O-N 3.08Å; F136-V140 HydrophobicContact CD1-CG2 3.88Å; F136-V140 HydrophobicContact CE1-CG2 3.52Å; F136-V140 HydrophobicContact CE2-CG2 4.38Å; F136-V140 HydrophobicContact CG-CG2 4.45Å; F136-V140 HydrophobicContact CZ-CG2 3.8Å; F136-V140 WeakPolarHBondContact O-CG2 3.35Å; F136-V140 PolarHBondContact O-N 3.26Å; F136-W174 HydrophobicContact CZ-CZ3 4.27Å; F136-H181 VanDerWaalsContact CB-CD2 3.45Å; F136-H181 WeakPolarHBondContact CB-CD2 3.43Å; F136-H181 HydrophobicContact CD2-CB 4.41Å; F136-H181 AromaticContact CD2-CD2 3.94Å; F136-H181 AromaticContact CD2-CG 3.92Å; F136-H181 PolarHBondContact N-NE2 3.03Å
137	R	88.3	Confident	80.7	Confident	150 Å²	150	50.7 Å²	50.7	57%	0.566	29%	0.286	S	S	*	.	H	α-helix	trans	-57.5	-40.8	177.2	-173.1	176.8	70.7	154.2	0.9	111.6	I133 L134 V140 Q141	I133-R137 WeakPolarHBondContact O-CB 3.48Å; I133-R137 PolarHBondContact O-N 3.43Å; L134-R137 PolarHBondContact O-N 3.31Å; R137-V140 PolarHBondContact O-N 2.89Å; R137-Q141 WeakPolarHBondContact O-CB 3.4Å; R137-Q141 PolarHBondContact O-N 2.89Å
138	W	84.3	Confident	78.5	Confident	24 Å²	24	55 Å²	55	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-66.6	-42	175	-66.7	-14.7	0	0	0	112.6	L134 S135 F136 Q141 D142 D221 M224 L225 R541	L134-W138 VanDerWaalsContact O-CG 3.25Å; L134-W138 PolarHBondContact O-N 3.27Å; S135-W138 PolarHBondContact O-N 3.19Å; F136-W138 VanDerWaalsContact C-N 3.26Å; F136-W138 PolarHBondContact O-N 2.94Å; W138-Q141 PolarHBondContact O-N 2.87Å; W138-D142 WeakPolarHBondContact O-CB 3.22Å; W138-D142 VanDerWaalsContact O-CG 3.29Å; W138-D142 PolarHBondContact O-N 2.96Å; W138-D221 HydrophobicContact CE3-CB 4.27Å; W138-D221 HydrophobicContact CZ3-CB 3.93Å; W138-M224 HydrophobicContact CH2-CE 3.12Å; W138-M224 HydrophobicContact CZ2-CE 3.25Å; W138-M224 HydrophobicContact CZ3-CE 4.15Å; W138-L225 HydrophobicContact CE3-CD1 3.9Å; W138-L225 HydrophobicContact CE3-CD2 4.14Å; W138-L225 HydrophobicContact CE3-CG 4.09Å; W138-L225 HydrophobicContact CH2-CD1 4.26Å; W138-L225 HydrophobicContact CH2-CD2 3.49Å; W138-L225 VanDerWaalsContact CH2-CD2 3.49Å; W138-L225 HydrophobicContact CH2-CG 3.54Å; W138-L225 HydrophobicContact CZ2-CD2 4.18Å; W138-L225 HydrophobicContact CZ3-CD1 3.47Å; W138-L225 VanDerWaalsContact CZ3-CD1 3.47Å; W138-L225 HydrophobicContact CZ3-CD2 3.54Å; W138-L225 HydrophobicContact CZ3-CG 3.26Å; W138-R541 VanDerWaalsContact CG-CZ 3.45Å; W138-R541 VanDerWaalsContact CG-NH2 3.26Å
139	F	83.6	Confident	76.1	Confident	27 Å²	27	57.6 Å²	57.6	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-48.7	172.9	169.2	-100.2	0	0	0	111.4	S135 F136 Q141 D142 Y143 V173 W174 Q177	S135-F139 PolarHBondContact O-N 3.43Å; F136-F139 HydrophobicContact CD2-CD1 4.42Å; F136-F139 HydrophobicContact CE2-CD1 4.25Å; F136-F139 WeakPolarHBondContact O-CA 3.22Å; F136-F139 WeakPolarHBondContact O-CB 3.33Å; F136-F139 PolarHBondContact O-N 2.84Å; F136-F139 VanDerWaalsContact O-N 3.08Å; F139-Q141 VanDerWaalsContact C-N 3.34Å; F139-Q141 PolarHBondContact O-N 3.08Å; F139-D142 PolarHBondContact O-N 3.43Å; F139-Y143 AromaticContact CE2-CD2 3.76Å; F139-Y143 HydrophobicContact CE2-CD2 3.76Å; F139-Y143 HydrophobicContact CE2-CE2 4.48Å; F139-Y143 HydrophobicContact CE2-CG 4.3Å; F139-Y143 AromaticContact CZ-CD2 3.7Å; F139-Y143 HydrophobicContact CZ-CD2 3.7Å; F139-Y143 HydrophobicContact CZ-CE2 4.31Å; F139-Y143 AromaticContact CZ-CG 3.95Å; F139-Y143 HydrophobicContact CZ-CG 3.95Å; F139-Y143 WeakPolarHBondContact O-CB 3.43Å; F139-Y143 PolarHBondContact O-N 3.38Å; F139-V173 HydrophobicContact CZ-CG1 4.2Å; F139-W174 HydrophobicContact CE1-CD2 4.29Å; F139-W174 HydrophobicContact CE1-CE3 4.35Å; F139-Q177 HydrophobicContact CD1-CB 4.1Å; F139-Q177 HydrophobicContact CD1-CG 4.31Å; F139-Q177 HydrophobicContact CD2-CG 4.06Å; F139-Q177 HydrophobicContact CE1-CB 3.76Å; F139-Q177 HydrophobicContact CE1-CG 3.89Å; F139-Q177 HydrophobicContact CE2-CB 4.39Å; F139-Q177 HydrophobicContact CE2-CG 3.62Å; F139-Q177 HydrophobicContact CG-CG 4.4Å; F139-Q177 HydrophobicContact CZ-CB 3.94Å; F139-Q177 HydrophobicContact CZ-CG 3.54Å
140	V	83.7	Confident	73.5	Confident	39 Å²	39	60 Å²	60	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-56.1	-50.4	175.9	169.8	0	0	0	0	109.8	F136 R137 D142 Y143 T144 W174	F136-V140 HydrophobicContact CD1-CG2 3.88Å; F136-V140 HydrophobicContact CE1-CG2 3.52Å; F136-V140 HydrophobicContact CE2-CG2 4.38Å; F136-V140 HydrophobicContact CG-CG2 4.45Å; F136-V140 HydrophobicContact CZ-CG2 3.8Å; F136-V140 WeakPolarHBondContact O-CG2 3.35Å; F136-V140 PolarHBondContact O-N 3.26Å; R137-V140 PolarHBondContact O-N 2.89Å; V140-D142 VanDerWaalsContact C-N 3.29Å; V140-D142 PolarHBondContact O-N 3.46Å; V140-Y143 PolarHBondContact O-N 3.48Å; V140-T144 HydrophobicContact CG1-CG2 3.9Å; V140-T144 WeakPolarHBondContact O-CB 3.27Å; V140-T144 WeakPolarHBondContact O-CG2 3.34Å; V140-T144 PolarHBondContact O-N 3.38Å; V140-T144 PolarHBondContact O-OG1 3.12Å; V140-W174 HydrophobicContact CB-CH2 4.3Å; V140-W174 HydrophobicContact CG1-CH2 4.13Å; V140-W174 HydrophobicContact CG2-CH2 3.84Å; V140-W174 HydrophobicContact CG2-CZ3 3.83Å
141	Q	79	Confident	71.2	Confident	70 Å²	70	61 Å²	61	33%	0.327	37%	0.367	S	S	.	.	H	α-helix	trans	-57.8	-43.5	-179	-163.2	-175.9	-18.9	0	0	111.4	R137 W138 F139 G145 R545	R137-Q141 WeakPolarHBondContact O-CB 3.4Å; R137-Q141 PolarHBondContact O-N 2.89Å; W138-Q141 PolarHBondContact O-N 2.87Å; F139-Q141 VanDerWaalsContact C-N 3.34Å; F139-Q141 PolarHBondContact O-N 3.08Å; Q141-G145 PolarHBondContact O-N 2.93Å; Q141-G145 VanDerWaalsContact O-N 3.11Å; Q141-R545 VanDerWaalsContact O-CZ 3.23Å; Q141-R545 PolarHBondContact O-NH1 3.33Å; Q141-R545 PolarHBondContact O-NH2 2.84Å
142	D	75.9	Confident	68.8	Low	58 Å²	58	67.1 Å²	67.1	31%	0.31	40%	0.396	S	S	.	.	H	α-helix	trans	-71.6	-31.3	-178.9	-68	-24.9	0	0	0	113.1	W138 F139 V140 R541 R545	W138-D142 WeakPolarHBondContact O-CB 3.22Å; W138-D142 VanDerWaalsContact O-CG 3.29Å; W138-D142 PolarHBondContact O-N 2.96Å; F139-D142 PolarHBondContact O-N 3.43Å; V140-D142 VanDerWaalsContact C-N 3.29Å; V140-D142 PolarHBondContact O-N 3.46Å; D142-R541 IonicContact OD1-NH1 3.19Å; D142-R541 IonicContact OD2-CZ 3.76Å; D142-R541 IonicContact OD2-NH1 3.21Å; D142-R541 PolarHBondContact OD2-NH1 3.43Å; D142-R545 VanDerWaalsContact CA-NH2 3.29Å; D142-R545 IonicContact OD1-CZ 2.76Å; D142-R545 IonicContact OD1-NE 3.01Å; D142-R545 IonicContact OD1-NH2 3.5Å; D142-R545 PolarHBondContact OD1-NH2 3.45Å
143	Y	73.3	Confident	66.5	Low	80 Å²	80	70 Å²	70	31%	0.314	43%	0.429	S	S	.	.	H	α-helix	trans	-88.2	-39.9	-180	-151.1	-85	0	0	0	113.7	F139 V140 R170 V173 W174	F139-Y143 AromaticContact CE2-CD2 3.76Å; F139-Y143 HydrophobicContact CE2-CD2 3.76Å; F139-Y143 HydrophobicContact CE2-CE2 4.48Å; F139-Y143 HydrophobicContact CE2-CG 4.3Å; F139-Y143 AromaticContact CZ-CD2 3.7Å; F139-Y143 HydrophobicContact CZ-CD2 3.7Å; F139-Y143 HydrophobicContact CZ-CE2 4.31Å; F139-Y143 AromaticContact CZ-CG 3.95Å; F139-Y143 HydrophobicContact CZ-CG 3.95Å; F139-Y143 WeakPolarHBondContact O-CB 3.43Å; F139-Y143 PolarHBondContact O-N 3.38Å; V140-Y143 PolarHBondContact O-N 3.48Å; Y143-R170 HydrophobicContact CE1-CB 4.44Å; Y143-R170 HydrophobicContact CE1-CG 4.05Å; Y143-R170 WeakPolarHBondContact OH-CG 3.45Å; Y143-V173 HydrophobicContact CE2-CB 4.47Å; Y143-V173 HydrophobicContact CE2-CG1 3.73Å; Y143-W174 AromaticContact CD1-CD1 3.95Å; Y143-W174 AromaticContact CD1-CE2 3.7Å; Y143-W174 AromaticContact CD1-CZ2 3.92Å; Y143-W174 HydrophobicContact CD1-CZ2 3.92Å; Y143-W174 AromaticContact CD1-NE1 2.99Å; Y143-W174 AromaticContact CE1-CD1 3.61Å; Y143-W174 AromaticContact CE1-NE1 3.05Å; Y143-W174 HydrophobicContact CG-CZ2 4.4Å; Y143-W174 AromaticContact CG-NE1 3.87Å; Y143-W174 AromaticContact CZ-NE1 3.98Å
144	T	70.4	Confident	64.1	Low	86 Å²	86	73 Å²	73	53%	0.528	45%	0.445	S	S	.	.	H	α-helix	trans	-82.8	-29.4	-179.5	60.9	0	0	0	0	113	V140 G146 W174	V140-T144 HydrophobicContact CG1-CG2 3.9Å; V140-T144 WeakPolarHBondContact O-CB 3.27Å; V140-T144 WeakPolarHBondContact O-CG2 3.34Å; V140-T144 PolarHBondContact O-N 3.38Å; V140-T144 PolarHBondContact O-OG1 3.12Å; T144-G146 PolarHBondContact O-N 3.49Å; T144-W174 HydrophobicContact CG2-CH2 3.67Å; T144-W174 HydrophobicContact CG2-CZ2 3.59Å
145	G	56.4	Low	61.8	Low	39 Å²	39	75.9 Å²	75.9	40%	0.402	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	7.6	171.8	0	0	0	0	0	114.1	Q141 G147	Q141-G145 PolarHBondContact O-N 2.93Å; Q141-G145 VanDerWaalsContact O-N 3.11Å; G145-G147 PolarHBondContact O-N 3.49Å
146	G	48.8	Very low	59.6	Low	47 Å²	47	81.6 Å²	81.6	49%	0.485	51%	0.509	S	S	.	.			trans	-72.4	58.8	169.6	0	0	0	0	0	113.1	T144 L148	T144-G146 PolarHBondContact O-N 3.49Å; G146-L148 PolarHBondContact O-N 3.08Å
147	G	42.6	Very low	57.3	Low	55 Å²	55	90.6 Å²	90.6	57%	0.567	54%	0.541	S	S	*	.			trans	-72.3	50.7	162.2	0	0	0	0	0	112	G145 G149	G145-G147 PolarHBondContact O-N 3.49Å; G147-G149 PolarHBondContact O-N 2.96Å
148	L	44.5	Very low	55.1	Low	98 Å²	98	94.8 Å²	94.8	51%	0.513	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-66	-17.9	170	-105.3	92.4	0	0	0	112.1	G146 S150 V151 E152	G146-L148 PolarHBondContact O-N 3.08Å; L148-S150 PolarHBondContact O-N 3.2Å; L148-S150 VanDerWaalsContact O-N 3.09Å; L148-V151 PolarHBondContact O-N 3.03Å; L148-E152 PolarHBondContact O-N 3.23Å; L148-E152 VanDerWaalsContact O-N 3.11Å
149	G	40.7	Very low	53.4	Low	75 Å²	75	96.2 Å²	96.2	77%	0.773	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-62	-16.6	176.8	0	0	0	0	0	115	G147	G147-G149 PolarHBondContact O-N 2.96Å
150	S	38.4	Very low	51.7	Low	113 Å²	113	101.6 Å²	101.6	79%	0.79	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-96.9	-13.2	178.3	-168.3	0	0	0	0	114.3	L148	L148-S150 PolarHBondContact O-N 3.2Å; L148-S150 VanDerWaalsContact O-N 3.09Å
151	V	43.5	Very low	49.9	Very low	101 Å²	101	104 Å²	104	61%	0.612	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-16.9	179.7	-172.5	0	0	0	0	111.5	L148 G153	L148-V151 PolarHBondContact O-N 3.03Å; V151-G153 PolarHBondContact O-N 3.39Å; V151-G153 VanDerWaalsContact O-N 3.13Å
152	E	41	Very low	48.4	Very low	129 Å²	129	102 Å²	102	60%	0.603	63%	0.631	S	S	*	*			trans	-85.5	51.6	170.1	-74.3	172.3	145.2	0	0	112.8	L148 L154	L148-E152 PolarHBondContact O-N 3.23Å; L148-E152 VanDerWaalsContact O-N 3.11Å; E152-L154 PolarHBondContact O-N 2.88Å
153	G	42.9	Very low	47.3	Very low	73 Å²	73	104.6 Å²	104.6	75%	0.753	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	10.8	167.1	0	0	0	0	0	114.6	V151	V151-G153 PolarHBondContact O-N 3.39Å; V151-G153 VanDerWaalsContact O-N 3.13Å
154	L	39.5	Very low	46.3	Very low	164 Å²	164	107.3 Å²	107.3	86%	0.859	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	12.9	-169.3	-85.3	163.3	0	0	0	115.6	E152	E152-L154 PolarHBondContact O-N 2.88Å
155	S	41.8	Very low	45.6	Very low	104 Å²	104	113.1 Å²	113.1	73%	0.727	67%	0.668	S	S	*	*			trans	-144.2	56.2	172.1	-86.5	0	0	0	0	114	R157	S155-R157 VanDerWaalsContact C-N 3.26Å; S155-R157 PolarHBondContact O-N 3.4Å
156	S	43.1	Very low	46.2	Very low	120 Å²	120	115.4 Å²	115.4	84%	0.839	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	20.2	179.3	-166.1	0	0	0	0	115.7
157	R	42	Very low	47.4	Very low	250 Å²	250	119.2 Å²	119.2	94%	0.943	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	10.2	-175.5	-86.8	-173.6	-175.7	176	2.4	118	S155	S155-R157 VanDerWaalsContact C-N 3.26Å; S155-R157 PolarHBondContact O-N 3.4Å
158	R	41.9	Very low	49	Very low	238 Å²	238	120.5 Å²	120.5	90%	0.898	67%	0.67	S	S	*	*	S	Bend	trans	-134	20.6	177.9	-146.6	166.9	-118.3	163.9	-1.9	115.7
159	A	47.8	Very low	50.6	Low	55 Å²	55	119.4 Å²	119.4	46%	0.455	67%	0.669	S	S	.	*	H	α-helix	trans	-94.6	-0.9	-158.8	0	0	0	0	0	117.6	F163	A159-F163 WeakPolarHBondContact O-CB 3.5Å
160	T	47.6	Very low	52.5	Low	139 Å²	139	120.6 Å²	120.6	85%	0.853	65%	0.651	S	S	*	*	H	α-helix	trans	-90.7	-34.5	-173.3	45.5	0	0	0	0	114.3
161	A	45.9	Very low	54.7	Low	89 Å²	89	120.7 Å²	120.7	74%	0.736	64%	0.642	S	S	*	*	H	α-helix	trans	-85	-25.9	176.4	0	0	0	0	0	113.7
162	G	49.3	Very low	56.7	Low	29 Å²	29	119.7 Å²	119.7	30%	0.299	64%	0.639	S	S	.	*	H	α-helix	trans	-75.9	-26.3	175.3	0	0	0	0	0	113.7	Q164 R165 D166	G162-Q164 VanDerWaalsContact C-N 3.32Å; G162-Q164 PolarHBondContact O-N 2.98Å; G162-R165 PolarHBondContact O-N 3.04Å; G162-D166 WeakPolarHBondContact O-CB 3.22Å; G162-D166 VanDerWaalsContact O-CG 3.29Å; G162-D166 PolarHBondContact O-N 3.36Å
163	F	51.3	Low	58.8	Low	112 Å²	112	115.8 Å²	115.8	49%	0.491	62%	0.624	S	S	.	*	H	α-helix	trans	-64.1	-32.7	-172.5	-135.7	-101.7	0	0	0	114.3	A159 R167	A159-F163 WeakPolarHBondContact O-CB 3.5Å; F163-R167 WeakPolarHBondContact O-CB 3.24Å; F163-R167 WeakPolarHBondContact O-CG 3.19Å; F163-R167 PolarHBondContact O-N 3.45Å; F163-R167 PolarHBondContact O-NE 3Å
164	Q	53.2	Low	60.9	Low	138 Å²	138	115.8 Å²	115.8	65%	0.645	60%	0.601	S	S	*	*	H	α-helix	trans	-80.5	-39.7	-179.8	-144.3	170.2	2.6	0	0	111.1	G162 R167 C168	G162-Q164 VanDerWaalsContact C-N 3.32Å; G162-Q164 PolarHBondContact O-N 2.98Å; Q164-R167 PolarHBondContact O-N 3.43Å; Q164-C168 PolarHBondContact O-N 3.35Å
165	R	55.4	Low	63.2	Low	207 Å²	207	111.9 Å²	111.9	78%	0.781	58%	0.584	S	S	*	*	H	α-helix	trans	-66.2	-37.9	174.5	-163.4	164.9	111.7	157.8	2.9	112	G162 C168 C169	G162-R165 PolarHBondContact O-N 3.04Å; R165-C168 PolarHBondContact O-N 3.47Å; R165-C169 VanDerWaalsContact O-CB 3.28Å; R165-C169 WeakPolarHBondContact O-CB 3.36Å; R165-C169 PolarHBondContact O-N 2.83Å
166	D	68.6	Low	65.5	Low	87 Å²	87	113.1 Å²	113.1	47%	0.465	57%	0.573	S	S	.	*	H	α-helix	trans	-70.6	-30.7	174.3	-72.1	-17.4	0	0	0	112.6	G162 R170	G162-D166 WeakPolarHBondContact O-CB 3.22Å; G162-D166 VanDerWaalsContact O-CG 3.29Å; G162-D166 PolarHBondContact O-N 3.36Å; D166-R170 WeakPolarHBondContact O-CB 3.27Å; D166-R170 WeakPolarHBondContact O-CG 3.41Å; D166-R170 PolarHBondContact O-N 2.96Å; D166-R170 PolarHBondContact O-NE 2.74Å
167	R	73.9	Confident	67.6	Low	128 Å²	128	108 Å²	108	48%	0.483	54%	0.536	S	S	.	.	H	α-helix	trans	-70.2	-45.2	172.6	-82.5	-174.4	-69.9	-172.7	1.6	111.9	F163 Q164 R170 L171	F163-R167 WeakPolarHBondContact O-CB 3.24Å; F163-R167 WeakPolarHBondContact O-CG 3.19Å; F163-R167 PolarHBondContact O-N 3.45Å; F163-R167 PolarHBondContact O-NE 3Å; Q164-R167 PolarHBondContact O-N 3.43Å; R167-R170 PolarHBondContact O-N 2.77Å; R167-L171 WeakPolarHBondContact O-CB 3.34Å; R167-L171 WeakPolarHBondContact O-CG 3.4Å; R167-L171 PolarHBondContact O-N 3.29Å
168	C	77	Confident	69.8	Low	82 Å²	82	98.7 Å²	98.7	55%	0.554	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-41.9	176.3	-68.2	0	0	0	0	112.2	Q164 R165 L171 S172	Q164-C168 PolarHBondContact O-N 3.35Å; R165-C168 PolarHBondContact O-N 3.47Å; C168-L171 PolarHBondContact O-N 3.46Å; C168-S172 WeakPolarHBondContact O-CB 3.37Å; C168-S172 PolarHBondContact O-N 3.37Å
169	C	78.5	Confident	72.2	Confident	74 Å²	74	90.6 Å²	90.6	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-44.9	175.2	-172.6	0	0	0	0	111.4	R165 S172 V173	R165-C169 VanDerWaalsContact O-CB 3.28Å; R165-C169 WeakPolarHBondContact O-CB 3.36Å; R165-C169 PolarHBondContact O-N 2.83Å; C169-S172 WeakPolarHBondContact O-CB 3.45Å; C169-S172 PolarHBondContact O-N 2.76Å; C169-V173 WeakPolarHBondContact O-CG2 3.5Å; C169-V173 PolarHBondContact O-N 3.22Å
170	R	79.4	Confident	74.2	Confident	101 Å²	101	88.6 Å²	88.6	38%	0.381	46%	0.462	S	S	.	.	H	α-helix	trans	-58.6	-52.2	174	-78.2	-179.5	-75.9	-158	-0.8	111.5	Y143 D166 R167 S172 V173 W174	Y143-R170 HydrophobicContact CE1-CB 4.44Å; Y143-R170 HydrophobicContact CE1-CG 4.05Å; Y143-R170 WeakPolarHBondContact OH-CG 3.45Å; D166-R170 WeakPolarHBondContact O-CB 3.27Å; D166-R170 WeakPolarHBondContact O-CG 3.41Å; D166-R170 PolarHBondContact O-N 2.96Å; D166-R170 PolarHBondContact O-NE 2.74Å; R167-R170 PolarHBondContact O-N 2.77Å; R170-S172 VanDerWaalsContact C-N 3.27Å; R170-S172 PolarHBondContact O-N 2.78Å; R170-V173 PolarHBondContact O-N 3.46Å; R170-V173 VanDerWaalsContact O-N 3.08Å; R170-W174 PolarHBondContact O-N 3.32Å
171	L	84.3	Confident	76.2	Confident	115 Å²	115	82.7 Å²	82.7	60%	0.602	43%	0.425	S	S	*	.	H	α-helix	trans	-55.4	-44.1	176.7	-77.1	162.7	0	0	0	111.5	R167 C168 V173 W174 V175	R167-L171 WeakPolarHBondContact O-CB 3.34Å; R167-L171 WeakPolarHBondContact O-CG 3.4Å; R167-L171 PolarHBondContact O-N 3.29Å; C168-L171 PolarHBondContact O-N 3.46Å; L171-V173 PolarHBondContact O-N 3Å; L171-W174 PolarHBondContact O-N 2.82Å; L171-V175 WeakPolarHBondContact O-CB 3.45Å; L171-V175 VanDerWaalsContact O-CG2 3.24Å; L171-V175 WeakPolarHBondContact O-CG2 3.39Å; L171-V175 PolarHBondContact O-N 3.47Å
172	S	85.8	Confident	78.3	Confident	79 Å²	79	84.3 Å²	84.3	55%	0.552	42%	0.42	S	S	*	.	H	α-helix	trans	-60.9	-41.2	176.6	-175.6	0	0	0	0	112.6	C168 C169 R170 W176	C168-S172 WeakPolarHBondContact O-CB 3.37Å; C168-S172 PolarHBondContact O-N 3.37Å; C169-S172 WeakPolarHBondContact O-CB 3.45Å; C169-S172 PolarHBondContact O-N 2.76Å; R170-S172 VanDerWaalsContact C-N 3.27Å; R170-S172 PolarHBondContact O-N 2.78Å; S172-W176 WeakPolarHBondContact O-CB 3.25Å; S172-W176 PolarHBondContact O-N 3.3Å
173	V	85.4	Confident	80.2	Confident	48 Å²	48	90.1 Å²	90.1	29%	0.291	44%	0.437	S	S	.	.	H	α-helix	trans	-67.5	-41.6	177.6	172.7	0	0	0	0	111.1	F139 Y143 C169 R170 L171 W176 Q177	F139-V173 HydrophobicContact CZ-CG1 4.2Å; Y143-V173 HydrophobicContact CE2-CB 4.47Å; Y143-V173 HydrophobicContact CE2-CG1 3.73Å; C169-V173 WeakPolarHBondContact O-CG2 3.5Å; C169-V173 PolarHBondContact O-N 3.22Å; R170-V173 PolarHBondContact O-N 3.46Å; R170-V173 VanDerWaalsContact O-N 3.08Å; L171-V173 PolarHBondContact O-N 3Å; V173-W176 PolarHBondContact O-N 3.32Å; V173-Q177 HydrophobicContact CG1-CG 4.41Å; V173-Q177 WeakPolarHBondContact O-CB 3.47Å; V173-Q177 VanDerWaalsContact O-CG 3.24Å; V173-Q177 WeakPolarHBondContact O-CG 3.32Å; V173-Q177 PolarHBondContact O-N 2.89Å
174	W	87.2	Confident	82	Confident	72 Å²	72	88.2 Å²	88.2	27%	0.273	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-48.5	175.7	-83.8	80.1	0	0	0	111.8	F136 F139 V140 Y143 T144 R170 L171 W176 Q177 T178	F136-W174 HydrophobicContact CZ-CZ3 4.27Å; F139-W174 HydrophobicContact CE1-CD2 4.29Å; F139-W174 HydrophobicContact CE1-CE3 4.35Å; V140-W174 HydrophobicContact CB-CH2 4.3Å; V140-W174 HydrophobicContact CG1-CH2 4.13Å; V140-W174 HydrophobicContact CG2-CH2 3.84Å; V140-W174 HydrophobicContact CG2-CZ3 3.83Å; Y143-W174 AromaticContact CD1-CD1 3.95Å; Y143-W174 AromaticContact CD1-CE2 3.7Å; Y143-W174 AromaticContact CD1-CZ2 3.92Å; Y143-W174 HydrophobicContact CD1-CZ2 3.92Å; Y143-W174 AromaticContact CD1-NE1 2.99Å; Y143-W174 AromaticContact CE1-CD1 3.61Å; Y143-W174 AromaticContact CE1-NE1 3.05Å; Y143-W174 HydrophobicContact CG-CZ2 4.4Å; Y143-W174 AromaticContact CG-NE1 3.87Å; Y143-W174 AromaticContact CZ-NE1 3.98Å; T144-W174 HydrophobicContact CG2-CH2 3.67Å; T144-W174 HydrophobicContact CG2-CZ2 3.59Å; R170-W174 PolarHBondContact O-N 3.32Å; L171-W174 PolarHBondContact O-N 2.82Å; W174-W176 VanDerWaalsContact C-N 3.35Å; W174-W176 PolarHBondContact O-N 3.46Å; W174-Q177 PolarHBondContact O-N 2.9Å; W174-T178 WeakPolarHBondContact O-CB 3.4Å; W174-T178 PolarHBondContact O-N 3.46Å; W174-T178 PolarHBondContact O-OG1 2.83Å; W174-T178 VanDerWaalsContact O-OG1 3.09Å
175	V	88.8	Confident	83.7	Confident	82 Å²	82	86 Å²	86	50%	0.497	42%	0.42	S	S	.	.	H	α-helix	trans	-58.9	-48	176.6	170	0	0	0	0	110.3	L171 Q177 T178 I179	L171-V175 WeakPolarHBondContact O-CB 3.45Å; L171-V175 VanDerWaalsContact O-CG2 3.24Å; L171-V175 WeakPolarHBondContact O-CG2 3.39Å; L171-V175 PolarHBondContact O-N 3.47Å; V175-Q177 PolarHBondContact O-N 3.4Å; V175-T178 PolarHBondContact O-N 3.08Å; V175-I179 HydrophobicContact CG1-CD1 3.65Å; V175-I179 HydrophobicContact CG1-CG1 4.37Å; V175-I179 WeakPolarHBondContact O-CB 3.5Å; V175-I179 WeakPolarHBondContact O-CG1 3.44Å; V175-I179 PolarHBondContact O-N 3.02Å
176	W	88.8	Confident	85.2	Confident	130 Å²	130	76.1 Å²	76.1	49%	0.492	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-44.9	177.2	-179.4	-110.7	0	0	0	112.4	S172 V173 W174 I179 I180 W189	S172-W176 WeakPolarHBondContact O-CB 3.25Å; S172-W176 PolarHBondContact O-N 3.3Å; V173-W176 PolarHBondContact O-N 3.32Å; W174-W176 VanDerWaalsContact C-N 3.35Å; W174-W176 PolarHBondContact O-N 3.46Å; W176-I179 PolarHBondContact O-N 3.45Å; W176-I180 HydrophobicContact CD2-CD1 4.21Å; W176-I180 HydrophobicContact CG-CD1 4.27Å; W176-I180 HydrophobicContact CZ2-CD1 4Å; W176-I180 HydrophobicContact CZ2-CG1 4.41Å; W176-I180 WeakPolarHBondContact O-CG1 3.38Å; W176-I180 PolarHBondContact O-N 3.36Å; W176-W189 HydrophobicContact CZ2-CZ3 4.3Å; W176-W189 AromaticContact NE1-CH2 3.53Å; W176-W189 AromaticContact NE1-CZ2 3.86Å; W176-W189 AromaticContact NE1-CZ3 3.79Å
177	Q	87.6	Confident	86	Confident	14 Å²	14	72.4 Å²	72.4	7%	0.065	36%	0.363	C	S	.	.	H	α-helix	trans	-66.3	-43	178.2	-75.4	-67.3	-33.6	0	0	112.1	F139 V173 W174 V175 I179 I180 H181	F139-Q177 HydrophobicContact CD1-CB 4.1Å; F139-Q177 HydrophobicContact CD1-CG 4.31Å; F139-Q177 HydrophobicContact CD2-CG 4.06Å; F139-Q177 HydrophobicContact CE1-CB 3.76Å; F139-Q177 HydrophobicContact CE1-CG 3.89Å; F139-Q177 HydrophobicContact CE2-CB 4.39Å; F139-Q177 HydrophobicContact CE2-CG 3.62Å; F139-Q177 HydrophobicContact CG-CG 4.4Å; F139-Q177 HydrophobicContact CZ-CB 3.94Å; F139-Q177 HydrophobicContact CZ-CG 3.54Å; V173-Q177 HydrophobicContact CG1-CG 4.41Å; V173-Q177 WeakPolarHBondContact O-CB 3.47Å; V173-Q177 VanDerWaalsContact O-CG 3.24Å; V173-Q177 WeakPolarHBondContact O-CG 3.32Å; V173-Q177 PolarHBondContact O-N 2.89Å; W174-Q177 PolarHBondContact O-N 2.9Å; V175-Q177 PolarHBondContact O-N 3.4Å; Q177-I179 VanDerWaalsContact C-N 3.35Å; Q177-I179 PolarHBondContact O-N 2.91Å; Q177-I180 PolarHBondContact O-N 3.34Å; Q177-H181 PolarHBondContact O-N 2.87Å; Q177-H181 PolarHBondContact O-ND1 2.92Å; Q177-H181 PolarHBondContact OE1-CE1 3.44Å
178	T	88.1	Confident	86.7	Confident	53 Å²	53	67.2 Å²	67.2	33%	0.325	35%	0.346	S	S	.	.	H	α-helix	trans	-61	-44.3	174.7	-64.3	0	0	0	0	111.1	W174 V175 H181 I182	W174-T178 WeakPolarHBondContact O-CB 3.4Å; W174-T178 PolarHBondContact O-N 3.46Å; W174-T178 PolarHBondContact O-OG1 2.83Å; W174-T178 VanDerWaalsContact O-OG1 3.09Å; V175-T178 PolarHBondContact O-N 3.08Å; T178-H181 PolarHBondContact O-N 3.4Å; T178-H181 VanDerWaalsContact O-N 3.12Å; T178-I182 HydrophobicContact CG2-CD1 3.69Å; T178-I182 HydrophobicContact CG2-CG1 4.29Å; T178-I182 VanDerWaalsContact O-CG1 3.28Å; T178-I182 WeakPolarHBondContact O-CG1 3.17Å; T178-I182 PolarHBondContact O-N 3.11Å
179	I	91.5	Very high	87.3	Confident	68 Å²	68	67.4 Å²	67.4	35%	0.349	34%	0.335	S	S	.	.	H	α-helix	trans	-58.8	-50.6	176.3	-72.1	168.5	0	0	0	110.8	V175 W176 Q177 H181 I182 F183	V175-I179 HydrophobicContact CG1-CD1 3.65Å; V175-I179 HydrophobicContact CG1-CG1 4.37Å; V175-I179 WeakPolarHBondContact O-CB 3.5Å; V175-I179 WeakPolarHBondContact O-CG1 3.44Å; V175-I179 PolarHBondContact O-N 3.02Å; W176-I179 PolarHBondContact O-N 3.45Å; Q177-I179 VanDerWaalsContact C-N 3.35Å; Q177-I179 PolarHBondContact O-N 2.91Å; I179-H181 PolarHBondContact O-N 2.78Å; I179-I182 PolarHBondContact O-N 2.69Å; I179-F183 HydrophobicContact CG2-CD2 3.7Å; I179-F183 HydrophobicContact CG2-CE2 3.79Å; I179-F183 VanDerWaalsContact O-CD2 3.27Å; I179-F183 WeakPolarHBondContact O-CD2 3.45Å; I179-F183 PolarHBondContact O-N 2.9Å
180	I	91.4	Very high	87.8	Confident	14 Å²	14	64.6 Å²	64.6	7%	0.072	31%	0.313	C	S	.	.	H	α-helix	trans	-54.8	-40.9	176.2	-74.8	172	0	0	0	110.8	W176 Q177 Q184 M185 W189	W176-I180 HydrophobicContact CD2-CD1 4.21Å; W176-I180 HydrophobicContact CG-CD1 4.27Å; W176-I180 HydrophobicContact CZ2-CD1 4Å; W176-I180 HydrophobicContact CZ2-CG1 4.41Å; W176-I180 WeakPolarHBondContact O-CG1 3.38Å; W176-I180 PolarHBondContact O-N 3.36Å; Q177-I180 PolarHBondContact O-N 3.34Å; I180-Q184 PolarHBondContact O-N 3.29Å; I180-M185 HydrophobicContact CG2-CB 4.08Å; I180-M185 WeakPolarHBondContact CG2-O 3.34Å; I180-M185 PolarHBondContact O-N 3.39Å; I180-W189 HydrophobicContact CD1-CB 4.25Å; I180-W189 HydrophobicContact CD1-CD2 3.56Å; I180-W189 HydrophobicContact CD1-CE3 3.64Å; I180-W189 HydrophobicContact CD1-CG 3.82Å; I180-W189 HydrophobicContact CD1-CZ3 4.22Å; I180-W189 HydrophobicContact CG2-CB 3.82Å; I180-W189 HydrophobicContact CG2-CG 4.33Å
181	H	89.3	Confident	88.2	Confident	15 Å²	15	60.2 Å²	60.2	7%	0.069	30%	0.297	C	S	.	.	H	α-helix	trans	-74.1	-35	-178.1	-71.6	64.7	0	0	0	113.4	Q132 S135 F136 Q177 T178 I179 F183 Q184	Q132-H181 HydrophobicContact CG-CB 4.12Å; Q132-H181 VanDerWaalsContact CG-O 3.25Å; Q132-H181 WeakPolarHBondContact CG-O 3.3Å; Q132-H181 PolarHBondContact NE2-CD2 2.88Å; Q132-H181 PolarHBondContact O-CD2 3.05Å; S135-H181 PolarHBondContact OG-NE2 3.29Å; F136-H181 VanDerWaalsContact CB-CD2 3.45Å; F136-H181 WeakPolarHBondContact CB-CD2 3.43Å; F136-H181 HydrophobicContact CD2-CB 4.41Å; F136-H181 AromaticContact CD2-CD2 3.94Å; F136-H181 AromaticContact CD2-CG 3.92Å; F136-H181 PolarHBondContact N-NE2 3.03Å; Q177-H181 PolarHBondContact O-N 2.87Å; Q177-H181 PolarHBondContact O-ND1 2.92Å; Q177-H181 PolarHBondContact OE1-CE1 3.44Å; T178-H181 PolarHBondContact O-N 3.4Å; T178-H181 VanDerWaalsContact O-N 3.12Å; I179-H181 PolarHBondContact O-N 2.78Å; H181-F183 VanDerWaalsContact C-N 3.32Å; H181-Q184 PolarHBondContact O-N 2.99Å
182	I	89.2	Confident	88.4	Confident	122 Å²	122	58.5 Å²	58.5	63%	0.626	29%	0.288	S	S	*	.	H	α-helix	trans	-63.9	-40	174	-71.1	167.3	0	0	0	110.8	T178 I179 Q184	T178-I182 HydrophobicContact CG2-CD1 3.69Å; T178-I182 HydrophobicContact CG2-CG1 4.29Å; T178-I182 VanDerWaalsContact O-CG1 3.28Å; T178-I182 WeakPolarHBondContact O-CG1 3.17Å; T178-I182 PolarHBondContact O-N 3.11Å; I179-I182 PolarHBondContact O-N 2.69Å; I182-Q184 PolarHBondContact O-N 3.2Å
183	F	90.6	Very high	88.4	Confident	152 Å²	152	60 Å²	60	67%	0.667	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	11.2	176.8	-75.6	-68.7	0	0	0	114.3	I179 H181 M185	I179-F183 HydrophobicContact CG2-CD2 3.7Å; I179-F183 HydrophobicContact CG2-CE2 3.79Å; I179-F183 VanDerWaalsContact O-CD2 3.27Å; I179-F183 WeakPolarHBondContact O-CD2 3.45Å; I179-F183 PolarHBondContact O-N 2.9Å; H181-F183 VanDerWaalsContact C-N 3.32Å; F183-M185 HydrophobicContact CB-CG 4.33Å; F183-M185 PolarHBondContact O-N 3.48Å; F183-M185 VanDerWaalsContact O-N 3.08Å
184	Q	87.8	Confident	88.5	Confident	71 Å²	71	57.7 Å²	57.7	33%	0.332	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	20.4	-177.4	-60.7	-69.7	-0	0	0	114.4	S128 I180 H181 I182	S128-Q184 PolarHBondContact OG-OE1 2.95Å; I180-Q184 PolarHBondContact O-N 3.29Å; H181-Q184 PolarHBondContact O-N 2.99Å; I182-Q184 PolarHBondContact O-N 3.2Å
185	M	88.4	Confident	88.5	Confident	91 Å²	91	57.5 Å²	57.5	45%	0.448	27%	0.27	S	S	.	.			trans	-94.1	9.6	-177.8	-73.8	-65	-152.8	0	0	113.1	I180 F183 Q187 V188 W189	I180-M185 HydrophobicContact CG2-CB 4.08Å; I180-M185 WeakPolarHBondContact CG2-O 3.34Å; I180-M185 PolarHBondContact O-N 3.39Å; F183-M185 HydrophobicContact CB-CG 4.33Å; F183-M185 PolarHBondContact O-N 3.48Å; F183-M185 VanDerWaalsContact O-N 3.08Å; M185-Q187 PolarHBondContact O-N 3.12Å; M185-V188 PolarHBondContact O-N 3.42Å; M185-V188 HydrophobicContact SD-CB 4.24Å; M185-V188 HydrophobicContact SD-CG2 3.94Å; M185-W189 WeakPolarHBondContact O-CB 3.36Å; M185-W189 PolarHBondContact O-N 2.78Å
186	G	87.4	Confident	88.4	Confident	0 Å²	0	60 Å²	60	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-40.9	-174.7	0	0	0	0	0	113.7	W189 R190	G186-W189 PolarHBondContact O-N 3.01Å; G186-R190 WeakPolarHBondContact O-CG 3.06Å; G186-R190 PolarHBondContact O-N 3.14Å; G186-R190 VanDerWaalsContact O-N 3.09Å
187	Q	86.4	Confident	88.2	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-47.1	177.8	-60.5	174	8.1	0	0	111.3	V131 M185 W189 R190 Y191 E229	V131-Q187 HydrophobicContact CG1-CG 4.24Å; M185-Q187 PolarHBondContact O-N 3.12Å; Q187-W189 VanDerWaalsContact C-N 3.27Å; Q187-W189 PolarHBondContact O-N 3.32Å; Q187-R190 PolarHBondContact O-N 2.93Å; Q187-Y191 VanDerWaalsContact O-CD2 3.29Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.29Å; Q187-Y191 PolarHBondContact O-N 3.23Å; Q187-E229 PolarHBondContact NE2-OE1 2.94Å; Q187-E229 PolarHBondContact NE2-OE2 3.33Å; Q187-E229 PolarHBondContact OE1-OE2 3.39Å
188	V	88.3	Confident	88	Confident	19 Å²	19	54 Å²	54	12%	0.115	25%	0.25	C	S	.	.	H	α-helix	trans	-57.3	-44.2	177.2	-178.7	0	0	0	0	110.1	F94 F95 M185 R190 Y191 I192	F94-V188 HydrophobicContact CE1-CG2 4.18Å; F95-V188 HydrophobicContact CE1-CG2 4.01Å; F95-V188 HydrophobicContact CZ-CB 4.5Å; F95-V188 HydrophobicContact CZ-CG1 4.05Å; F95-V188 HydrophobicContact CZ-CG2 3.58Å; M185-V188 PolarHBondContact O-N 3.42Å; M185-V188 HydrophobicContact SD-CB 4.24Å; M185-V188 HydrophobicContact SD-CG2 3.94Å; V188-R190 VanDerWaalsContact C-N 3.34Å; V188-R190 PolarHBondContact O-N 3.13Å; V188-Y191 PolarHBondContact O-N 3.42Å; V188-I192 HydrophobicContact CG1-CD1 4.02Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 2.94Å
189	W	89.3	Confident	87.8	Confident	85 Å²	85	54.5 Å²	54.5	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-58.3	-42.8	175.4	-179.9	-103.6	0	0	0	112.9	W176 I180 M185 G186 Q187 I192 R193	W176-W189 HydrophobicContact CZ2-CZ3 4.3Å; W176-W189 AromaticContact NE1-CH2 3.53Å; W176-W189 AromaticContact NE1-CZ2 3.86Å; W176-W189 AromaticContact NE1-CZ3 3.79Å; I180-W189 HydrophobicContact CD1-CB 4.25Å; I180-W189 HydrophobicContact CD1-CD2 3.56Å; I180-W189 HydrophobicContact CD1-CE3 3.64Å; I180-W189 HydrophobicContact CD1-CG 3.82Å; I180-W189 HydrophobicContact CD1-CZ3 4.22Å; I180-W189 HydrophobicContact CG2-CB 3.82Å; I180-W189 HydrophobicContact CG2-CG 4.33Å; M185-W189 WeakPolarHBondContact O-CB 3.36Å; M185-W189 PolarHBondContact O-N 2.78Å; G186-W189 PolarHBondContact O-N 3.01Å; Q187-W189 VanDerWaalsContact C-N 3.27Å; Q187-W189 PolarHBondContact O-N 3.32Å; W189-I192 PolarHBondContact O-N 3.46Å; W189-R193 WeakPolarHBondContact O-CB 3.4Å; W189-R193 PolarHBondContact O-N 3.27Å
190	R	88.5	Confident	87.4	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.057	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-35.6	177.1	-69.1	179.2	172.5	-83.6	-0.2	112.7	S135 G186 Q187 V188 R193 T194 E218 V222	S135-R190 PolarHBondContact O-NH2 3.38Å; S135-R190 PolarHBondContact OG-NE 3.47Å; G186-R190 WeakPolarHBondContact O-CG 3.06Å; G186-R190 PolarHBondContact O-N 3.14Å; G186-R190 VanDerWaalsContact O-N 3.09Å; Q187-R190 PolarHBondContact O-N 2.93Å; V188-R190 VanDerWaalsContact C-N 3.34Å; V188-R190 PolarHBondContact O-N 3.13Å; R190-R193 PolarHBondContact O-N 3.23Å; R190-T194 WeakPolarHBondContact O-CB 3.47Å; R190-T194 PolarHBondContact O-N 2.95Å; R190-T194 PolarHBondContact O-OG1 2.96Å; R190-E218 IonicContact NH1-OE2 3.31Å; R190-V222 HydrophobicContact CB-CG2 3.35Å; R190-V222 HydrophobicContact CG-CG2 4.39Å
191	Y	87.5	Confident	86.9	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.035	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-45.1	171.8	-83.5	-76.7	0	0	0	112.1	I87 L91 Q187 V188 R193 T194 M195 V222 R226	I87-Y191 HydrophobicContact CG2-CD1 3.77Å; I87-Y191 HydrophobicContact CG2-CE1 4.34Å; L91-Y191 HydrophobicContact CD1-CG 4.3Å; L91-Y191 HydrophobicContact CD2-CD1 4.11Å; L91-Y191 HydrophobicContact CD2-CD2 3.44Å; L91-Y191 VanDerWaalsContact CD2-CD2 3.44Å; L91-Y191 HydrophobicContact CD2-CE2 4.01Å; L91-Y191 HydrophobicContact CD2-CG 3.51Å; L91-Y191 HydrophobicContact CG-CD1 4.08Å; L91-Y191 HydrophobicContact CG-CD2 4.3Å; L91-Y191 HydrophobicContact CG-CG 3.93Å; Q187-Y191 VanDerWaalsContact O-CD2 3.29Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.29Å; Q187-Y191 PolarHBondContact O-N 3.23Å; V188-Y191 PolarHBondContact O-N 3.42Å; Y191-R193 VanDerWaalsContact C-N 3.28Å; Y191-R193 PolarHBondContact O-N 2.87Å; Y191-T194 WeakPolarHBondContact O-CB 3.45Å; Y191-T194 PolarHBondContact O-N 3.31Å; Y191-M195 PolarHBondContact O-N 2.79Å; Y191-V222 HydrophobicContact CD1-CG1 3.88Å; Y191-V222 HydrophobicContact CD2-CG1 3.74Å; Y191-V222 HydrophobicContact CE1-CG1 3.5Å; Y191-V222 VanDerWaalsContact CE1-CG1 3.5Å; Y191-V222 HydrophobicContact CE2-CG1 3.29Å; Y191-V222 HydrophobicContact CG-CG1 4.01Å; Y191-R226 PolarHBondContact OH-NE 3.18Å
192	I	88.3	Confident	86.3	Confident	79 Å²	79	54.6 Å²	54.6	41%	0.405	25%	0.25	S	C	.	.	H	α-helix	trans	-58.1	-44.7	175.2	-67.5	167.3	0	0	0	110	V188 W189 T194 M195 Y196	V188-I192 HydrophobicContact CG1-CD1 4.02Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 2.94Å; W189-I192 PolarHBondContact O-N 3.46Å; I192-T194 PolarHBondContact O-N 2.76Å; I192-M195 PolarHBondContact O-N 3.22Å; I192-Y196 WeakPolarHBondContact O-CB 3.31Å; I192-Y196 PolarHBondContact O-N 3.08Å
193	R	87.5	Confident	85.9	Confident	110 Å²	110	58.5 Å²	58.5	42%	0.415	26%	0.257	S	S	.	.	H	α-helix	trans	-63.3	-40.3	177.2	-172.3	173.1	177.9	-129.2	-7.4	112.4	W189 R190 Y191 Y196 L197 E218	W189-R193 WeakPolarHBondContact O-CB 3.4Å; W189-R193 PolarHBondContact O-N 3.27Å; R190-R193 PolarHBondContact O-N 3.23Å; Y191-R193 VanDerWaalsContact C-N 3.28Å; Y191-R193 PolarHBondContact O-N 2.87Å; R193-Y196 PolarHBondContact O-N 3.35Å; R193-L197 HydrophobicContact CG-CD1 4.15Å; R193-L197 WeakPolarHBondContact O-CB 3.35Å; R193-L197 VanDerWaalsContact O-CG 3.3Å; R193-L197 WeakPolarHBondContact O-CG 3.48Å; R193-L197 PolarHBondContact O-N 3.31Å; R193-E218 IonicContact CZ-OE1 2.62Å; R193-E218 IonicContact CZ-OE2 3.67Å; R193-E218 IonicContact NH1-OE1 3.69Å; R193-E218 PolarHBondContact NH1-OE1 2.98Å; R193-E218 IonicContact NH1-OE2 2.79Å; R193-E218 PolarHBondContact NH1-OE2 3.48Å; R193-E218 IonicContact NH2-OE1 3.68Å
194	T	86.9	Confident	85.2	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-47.4	175.3	-58.2	0	0	0	0	110.7	I87 R190 Y191 I192 L197 G198 M215 Y219	I87-T194 HydrophobicContact CD1-CG2 4.23Å; R190-T194 WeakPolarHBondContact O-CB 3.47Å; R190-T194 PolarHBondContact O-N 2.95Å; R190-T194 PolarHBondContact O-OG1 2.96Å; Y191-T194 WeakPolarHBondContact O-CB 3.45Å; Y191-T194 PolarHBondContact O-N 3.31Å; I192-T194 PolarHBondContact O-N 2.76Å; T194-L197 PolarHBondContact O-N 2.91Å; T194-G198 PolarHBondContact O-N 3.46Å; T194-M215 HydrophobicContact CG2-CG 3.96Å; T194-Y219 HydrophobicContact CG2-CD2 4Å; T194-Y219 HydrophobicContact CG2-CG 4.17Å
195	M	86.4	Confident	84.4	Confident	67 Å²	67	59.8 Å²	59.8	33%	0.33	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-42.5	177.5	-174	172.5	65.6	0	0	111.9	V88 Y191 I192 G198 I199	V88-M195 HydrophobicContact CG2-SD 4.49Å; Y191-M195 PolarHBondContact O-N 2.79Å; I192-M195 PolarHBondContact O-N 3.22Å; M195-G198 PolarHBondContact O-N 2.9Å; M195-I199 HydrophobicContact CG-CD1 4.12Å; M195-I199 WeakPolarHBondContact O-CG1 3.32Å; M195-I199 PolarHBondContact O-N 3.09Å
196	Y	87.7	Confident	83.4	Confident	135 Å²	135	64.3 Å²	64.3	53%	0.529	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-48.4	175.4	172.7	-96	0	0	0	112	I192 R193 G198 I199 Q200	I192-Y196 WeakPolarHBondContact O-CB 3.31Å; I192-Y196 PolarHBondContact O-N 3.08Å; R193-Y196 PolarHBondContact O-N 3.35Å; Y196-G198 VanDerWaalsContact C-N 3.3Å; Y196-G198 PolarHBondContact O-N 3.46Å; Y196-I199 PolarHBondContact O-N 3.4Å; Y196-Q200 WeakPolarHBondContact O-CB 3.43Å; Y196-Q200 PolarHBondContact O-N 3.27Å
197	L	83.6	Confident	82.6	Confident	14 Å²	14	66.6 Å²	66.6	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-36.7	177.3	-69.7	168.8	0	0	0	111.6	R193 T194 Q200 S201 F211 A214 M215 E218	R193-L197 HydrophobicContact CG-CD1 4.15Å; R193-L197 WeakPolarHBondContact O-CB 3.35Å; R193-L197 VanDerWaalsContact O-CG 3.3Å; R193-L197 WeakPolarHBondContact O-CG 3.48Å; R193-L197 PolarHBondContact O-N 3.31Å; T194-L197 PolarHBondContact O-N 2.91Å; L197-Q200 PolarHBondContact O-N 3.49Å; L197-S201 WeakPolarHBondContact O-CB 3.47Å; L197-S201 PolarHBondContact O-N 3.1Å; L197-F211 HydrophobicContact CD2-CD1 4.02Å; L197-A214 HydrophobicContact CD1-CB 4.26Å; L197-A214 HydrophobicContact CD2-CB 4.38Å; L197-M215 HydrophobicContact CB-CB 3.81Å; L197-M215 HydrophobicContact CB-CG 4.47Å; L197-E218 HydrophobicContact CD1-CB 4.44Å; L197-E218 HydrophobicContact CD1-CG 3.74Å
198	G	83.4	Confident	81.9	Confident	3 Å²	3	69.2 Å²	69.2	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-50	172.7	0	0	0	0	0	112.3	T194 M195 Y196 S201 H202	T194-G198 PolarHBondContact O-N 3.46Å; M195-G198 PolarHBondContact O-N 2.9Å; Y196-G198 VanDerWaalsContact C-N 3.3Å; Y196-G198 PolarHBondContact O-N 3.46Å; G198-S201 PolarHBondContact O-N 3.1Å; G198-S201 PolarHBondContact O-OG 3.24Å; G198-H202 PolarHBondContact O-N 3.35Å
199	I	84.8	Confident	81.1	Confident	65 Å²	65	74.1 Å²	74.1	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-64	-42.9	177.3	-64.8	165.6	0	0	0	111	M195 Y196 S201 H202 R203	M195-I199 HydrophobicContact CG-CD1 4.12Å; M195-I199 WeakPolarHBondContact O-CG1 3.32Å; M195-I199 PolarHBondContact O-N 3.09Å; Y196-I199 PolarHBondContact O-N 3.4Å; I199-S201 VanDerWaalsContact C-N 3.33Å; I199-S201 PolarHBondContact O-N 3.17Å; I199-H202 PolarHBondContact O-N 3.38Å; I199-R203 HydrophobicContact CG2-CG 4.43Å; I199-R203 PolarHBondContact O-N 3.25Å; I199-R203 VanDerWaalsContact O-N 3.07Å
200	Q	83.5	Confident	80.4	Confident	34 Å²	34	72.8 Å²	72.8	16%	0.159	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-37.8	179.5	-171.8	169.3	22.3	0	0	111.9	Y196 L197 H202 R203 Q204 F211	Y196-Q200 WeakPolarHBondContact O-CB 3.43Å; Y196-Q200 PolarHBondContact O-N 3.27Å; L197-Q200 PolarHBondContact O-N 3.49Å; Q200-H202 PolarHBondContact O-N 3.25Å; Q200-R203 PolarHBondContact O-N 3.17Å; Q200-Q204 HydrophobicContact CG-CG 4.33Å; Q200-Q204 PolarHBondContact O-N 3.3Å; Q200-F211 HydrophobicContact CB-CD1 4.19Å; Q200-F211 HydrophobicContact CB-CG 4.5Å; Q200-F211 HydrophobicContact CG-CD1 3.75Å; Q200-F211 HydrophobicContact CG-CD2 4.3Å; Q200-F211 HydrophobicContact CG-CE1 3.7Å; Q200-F211 HydrophobicContact CG-CE2 4.26Å; Q200-F211 HydrophobicContact CG-CG 4.07Å; Q200-F211 HydrophobicContact CG-CZ 3.96Å
201	S	79.7	Confident	79.8	Confident	7 Å²	7	73.9 Å²	73.9	5%	0.049	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-33.8	176	80.1	0	0	0	0	112.6	L197 G198 I199 Q208 F211	L197-S201 WeakPolarHBondContact O-CB 3.47Å; L197-S201 PolarHBondContact O-N 3.1Å; G198-S201 PolarHBondContact O-N 3.1Å; G198-S201 PolarHBondContact O-OG 3.24Å; I199-S201 VanDerWaalsContact C-N 3.33Å; I199-S201 PolarHBondContact O-N 3.17Å; S201-Q208 WeakPolarHBondContact O-CG 3.24Å; S201-F211 VanDerWaalsContact CA-CB 3.47Å
202	H	76.6	Confident	79.4	Confident	58 Å²	58	77.2 Å²	77.2	27%	0.269	34%	0.336	S	S	.	.	H	α-helix	trans	-81.8	-37.6	178.3	-162.8	-87.9	0	0	0	112.8	E77 L80 G198 I199 Q200	E77-H202 VanDerWaalsContact CG-NE2 3.33Å; E77-H202 WeakPolarHBondContact CG-NE2 3.22Å; E77-H202 IonicContact OE1-CE1 3.4Å; E77-H202 PolarHBondContact OE1-CE1 3.19Å; E77-H202 IonicContact OE1-NE2 2.78Å; L80-H202 HydrophobicContact CD2-CB 4.17Å; G198-H202 PolarHBondContact O-N 3.35Å; I199-H202 PolarHBondContact O-N 3.38Å; Q200-H202 PolarHBondContact O-N 3.25Å
203	R	80.3	Confident	78.8	Confident	204 Å²	204	74.2 Å²	74.2	77%	0.77	32%	0.32	S	S	*	.	H	α-helix	trans	-70.3	-37.4	-180	-72.9	-176.4	176.1	177.4	-0.6	112.4	I199 Q200	I199-R203 HydrophobicContact CG2-CG 4.43Å; I199-R203 PolarHBondContact O-N 3.25Å; I199-R203 VanDerWaalsContact O-N 3.07Å; Q200-R203 PolarHBondContact O-N 3.17Å
204	Q	77.6	Confident	78.4	Confident	80 Å²	80	70.1 Å²	70.1	37%	0.374	31%	0.31	S	S	.	.			trans	-101.8	80.1	-176.6	-64.9	-170	-15.5	0	0	111.3	Q200 E206 N207 Q208 F211	Q200-Q204 HydrophobicContact CG-CG 4.33Å; Q200-Q204 PolarHBondContact O-N 3.3Å; Q204-E206 PolarHBondContact O-N 3.39Å; Q204-N207 CarbonylContact O-C 3.43Å; Q204-N207 PolarHBondContact O-N 3.32Å; Q204-N207 VanDerWaalsContact O-N 3.15Å; Q204-Q208 WeakPolarHBondContact O-CA 3.49Å; Q204-Q208 PolarHBondContact O-N 3.32Å; Q204-F211 HydrophobicContact CB-CD2 4.42Å; Q204-F211 HydrophobicContact CB-CE2 4.29Å
205	K	71.2	Confident	78.3	Confident	169 Å²	169	71.4 Å²	71.4	74%	0.735	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-56.2	-34.6	-177.5	-67.5	-173.1	178.3	-179.7	0	113.7	N207 Q208	K205-N207 PolarHBondContact O-N 3.07Å; K205-Q208 WeakPolarHBondContact O-CB 3.37Å
206	E	67.4	Low	78	Confident	187 Å²	187	68.7 Å²	68.7	87%	0.874	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-66.8	-35.5	-179.6	-168.4	174.1	-169.5	0	0	112.9	Q204	Q204-E206 PolarHBondContact O-N 3.39Å
207	N	69.4	Low	77.7	Confident	48 Å²	48	62.6 Å²	62.6	26%	0.257	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-110.3	17.5	-179.5	-76	-48.5	0	0	0	112.9	Q204 K205 R209 R210 F211	Q204-N207 CarbonylContact O-C 3.43Å; Q204-N207 PolarHBondContact O-N 3.32Å; Q204-N207 VanDerWaalsContact O-N 3.15Å; K205-N207 PolarHBondContact O-N 3.07Å; N207-R209 VanDerWaalsContact C-N 3.27Å; N207-R209 PolarHBondContact O-N 3.37Å; N207-R209 VanDerWaalsContact O-N 3.14Å; N207-R210 PolarHBondContact O-N 3Å; N207-R210 PolarHBondContact OD1-NH1 3.39Å; N207-F211 HydrophobicContact CB-CD2 3.86Å; N207-F211 HydrophobicContact CB-CE2 3.62Å; N207-F211 WeakPolarHBondContact O-CD2 3.05Å; N207-F211 PolarHBondContact O-N 3.25Å
208	Q	72.8	Confident	77.7	Confident	64 Å²	64	62.8 Å²	62.8	30%	0.299	28%	0.279	S	S	.	.	H	α-helix	trans	-51.7	-43.8	-171.1	174	176.2	-9.4	0	0	112.7	Q76 S201 Q204 K205 R210 F211 Y212	Q76-Q208 VanDerWaalsContact NE2-NE2 3.19Å; S201-Q208 WeakPolarHBondContact O-CG 3.24Å; Q204-Q208 WeakPolarHBondContact O-CA 3.49Å; Q204-Q208 PolarHBondContact O-N 3.32Å; K205-Q208 WeakPolarHBondContact O-CB 3.37Å; Q208-R210 PolarHBondContact O-N 3.07Å; Q208-F211 PolarHBondContact O-N 3.33Å; Q208-Y212 VanDerWaalsContact O-CB 3.3Å; Q208-Y212 WeakPolarHBondContact O-CB 3.4Å; Q208-Y212 PolarHBondContact O-N 2.89Å
209	R	71.4	Confident	77.8	Confident	123 Å²	123	63.8 Å²	63.8	46%	0.464	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-44.7	-179.2	-172.6	174.4	-179.1	-152.8	-0.9	111.8	N207 Y212 W213 V558	N207-R209 VanDerWaalsContact C-N 3.27Å; N207-R209 PolarHBondContact O-N 3.37Å; N207-R209 VanDerWaalsContact O-N 3.14Å; R209-Y212 PolarHBondContact O-N 3.27Å; R209-W213 PolarHBondContact O-N 3.01Å; R209-V558 PolarHBondContact NH1-O 3.03Å
210	R	74.7	Confident	77.7	Confident	56 Å²	56	60.9 Å²	60.9	21%	0.211	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-49.3	-178.9	-66.4	179	179.4	170.9	-4.2	111.2	N207 Q208 Y212 W213 A214 Q551 F552 P555	N207-R210 PolarHBondContact O-N 3Å; N207-R210 PolarHBondContact OD1-NH1 3.39Å; Q208-R210 PolarHBondContact O-N 3.07Å; R210-Y212 VanDerWaalsContact C-N 3.33Å; R210-Y212 PolarHBondContact O-N 2.8Å; R210-W213 PolarHBondContact O-N 3.21Å; R210-A214 WeakPolarHBondContact O-CB 3.39Å; R210-A214 PolarHBondContact O-N 3.45Å; R210-Q551 HydrophobicContact CG-CB 4.44Å; R210-Q551 PolarHBondContact NE-O 3.29Å; R210-Q551 PolarHBondContact NH2-O 3.05Å; R210-F552 PolarHBondContact NH2-O 3.31Å; R210-P555 VanDerWaalsContact NH2-CB 3.3Å; R210-P555 VanDerWaalsContact NH2-CD 3.31Å; R210-P555 VanDerWaalsContact NH2-CG 3.31Å
211	F	75.6	Confident	77.8	Confident	39 Å²	39	59.4 Å²	59.4	17%	0.171	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-35.5	179.4	-72.7	-71.1	0	0	0	112.7	L197 Q200 S201 Q204 N207 Q208 M215	L197-F211 HydrophobicContact CD2-CD1 4.02Å; Q200-F211 HydrophobicContact CB-CD1 4.19Å; Q200-F211 HydrophobicContact CB-CG 4.5Å; Q200-F211 HydrophobicContact CG-CD1 3.75Å; Q200-F211 HydrophobicContact CG-CD2 4.3Å; Q200-F211 HydrophobicContact CG-CE1 3.7Å; Q200-F211 HydrophobicContact CG-CE2 4.26Å; Q200-F211 HydrophobicContact CG-CG 4.07Å; Q200-F211 HydrophobicContact CG-CZ 3.96Å; S201-F211 VanDerWaalsContact CA-CB 3.47Å; Q204-F211 HydrophobicContact CB-CD2 4.42Å; Q204-F211 HydrophobicContact CB-CE2 4.29Å; N207-F211 HydrophobicContact CB-CD2 3.86Å; N207-F211 HydrophobicContact CB-CE2 3.62Å; N207-F211 WeakPolarHBondContact O-CD2 3.05Å; N207-F211 PolarHBondContact O-N 3.25Å; Q208-F211 PolarHBondContact O-N 3.33Å; F211-M215 VanDerWaalsContact O-CB 3.3Å; F211-M215 WeakPolarHBondContact O-CB 3.38Å; F211-M215 PolarHBondContact O-N 3.25Å
212	Y	78.1	Confident	78.3	Confident	78 Å²	78	59.3 Å²	59.3	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174.2	175.4	-96.4	0	0	0	112.3	Q208 R209 R210 M215 M216	Q208-Y212 VanDerWaalsContact O-CB 3.3Å; Q208-Y212 WeakPolarHBondContact O-CB 3.4Å; Q208-Y212 PolarHBondContact O-N 2.89Å; R209-Y212 PolarHBondContact O-N 3.27Å; R210-Y212 VanDerWaalsContact C-N 3.33Å; R210-Y212 PolarHBondContact O-N 2.8Å; Y212-M215 HydrophobicContact CD2-CE 3.68Å; Y212-M215 HydrophobicContact CE2-CE 3.79Å; Y212-M215 HydrophobicContact CG-CE 4.47Å; Y212-M215 WeakPolarHBondContact O-CB 3.26Å; Y212-M215 PolarHBondContact O-N 3.15Å; Y212-M216 HydrophobicContact CE1-CE 4Å; Y212-M216 HydrophobicContact CE2-CE 3.94Å; Y212-M216 VanDerWaalsContact CZ-CE 3.42Å; Y212-M216 PolarHBondContact O-N 2.85Å; Y212-M216 WeakPolarHBondContact OH-CE 3.24Å
213	W	76.2	Confident	78.8	Confident	17 Å²	17	56.6 Å²	56.6	6%	0.064	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-40.9	176.6	-78.4	106	0	0	0	112	R209 R210 M215 M216 Y217 H537 F538	R209-W213 PolarHBondContact O-N 3.01Å; R210-W213 PolarHBondContact O-N 3.21Å; W213-M215 VanDerWaalsContact C-N 3.33Å; W213-M215 PolarHBondContact O-N 2.75Å; W213-M216 PolarHBondContact O-N 2.67Å; W213-M216 VanDerWaalsContact O-N 3.14Å; W213-Y217 HydrophobicContact CB-CE2 4.21Å; W213-Y217 HydrophobicContact CE3-CE1 4.29Å; W213-Y217 WeakPolarHBondContact O-CD2 3.47Å; W213-Y217 VanDerWaalsContact O-CG 3.31Å; W213-Y217 PolarHBondContact O-N 2.84Å; W213-H537 AromaticContact CZ3-NE2 3.51Å; W213-F538 HydrophobicContact CE3-CZ 4.16Å; W213-F538 AromaticContact CZ3-CE2 3.86Å; W213-F538 HydrophobicContact CZ3-CE2 3.86Å; W213-F538 AromaticContact CZ3-CZ 3.61Å; W213-F538 HydrophobicContact CZ3-CZ 3.61Å
214	A	79.8	Confident	79	Confident	24 Å²	24	50.3 Å²	50.3	20%	0.198	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-45.3	173.5	0	0	0	0	0	111.7	L197 R210 M216 Y217 E218	L197-A214 HydrophobicContact CD1-CB 4.26Å; L197-A214 HydrophobicContact CD2-CB 4.38Å; R210-A214 WeakPolarHBondContact O-CB 3.39Å; R210-A214 PolarHBondContact O-N 3.45Å; A214-M216 PolarHBondContact O-N 3.19Å; A214-Y217 PolarHBondContact O-N 2.71Å; A214-E218 WeakPolarHBondContact O-CG 3.37Å; A214-E218 PolarHBondContact O-N 3.37Å; A214-E218 VanDerWaalsContact O-N 3.08Å
215	M	83.2	Confident	79.5	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.133	21%	0.211	C	C	.	.	H	α-helix	trans	-58.4	-46.3	172.9	176.5	-152.3	67	0	0	111.1	T194 L197 F211 Y212 W213 Y217 E218 Y219	T194-M215 HydrophobicContact CG2-CG 3.96Å; L197-M215 HydrophobicContact CB-CB 3.81Å; L197-M215 HydrophobicContact CB-CG 4.47Å; F211-M215 VanDerWaalsContact O-CB 3.3Å; F211-M215 WeakPolarHBondContact O-CB 3.38Å; F211-M215 PolarHBondContact O-N 3.25Å; Y212-M215 HydrophobicContact CD2-CE 3.68Å; Y212-M215 HydrophobicContact CE2-CE 3.79Å; Y212-M215 HydrophobicContact CG-CE 4.47Å; Y212-M215 WeakPolarHBondContact O-CB 3.26Å; Y212-M215 PolarHBondContact O-N 3.15Å; W213-M215 VanDerWaalsContact C-N 3.33Å; W213-M215 PolarHBondContact O-N 2.75Å; M215-Y217 VanDerWaalsContact C-N 3.34Å; M215-Y217 PolarHBondContact O-N 3.48Å; M215-E218 PolarHBondContact O-N 2.89Å; M215-Y219 VanDerWaalsContact O-CB 3.31Å; M215-Y219 WeakPolarHBondContact O-CB 3.5Å; M215-Y219 PolarHBondContact O-N 3.31Å
216	M	80.4	Confident	80.4	Confident	11 Å²	11	38.9 Å²	38.9	5%	0.054	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-37.9	-178.3	-159.1	66.3	76.8	0	0	112.3	Y212 W213 A214 Y219 A220 L276 F538	Y212-M216 HydrophobicContact CE1-CE 4Å; Y212-M216 HydrophobicContact CE2-CE 3.94Å; Y212-M216 VanDerWaalsContact CZ-CE 3.42Å; Y212-M216 PolarHBondContact O-N 2.85Å; Y212-M216 WeakPolarHBondContact OH-CE 3.24Å; W213-M216 PolarHBondContact O-N 2.67Å; W213-M216 VanDerWaalsContact O-N 3.14Å; A214-M216 PolarHBondContact O-N 3.19Å; M216-Y219 PolarHBondContact O-N 2.94Å; M216-A220 VanDerWaalsContact O-CB 3.32Å; M216-A220 WeakPolarHBondContact O-CB 3.3Å; M216-A220 PolarHBondContact O-N 3.13Å; M216-L276 HydrophobicContact CG-CD1 4.24Å; M216-L276 HydrophobicContact SD-CD1 3.32Å; M216-L276 WeakPolarHBondContact SD-CD1 3.08Å; M216-F538 HydrophobicContact CB-CE1 4.16Å; M216-F538 HydrophobicContact CB-CZ 4.44Å; M216-F538 HydrophobicContact CG-CE1 3.61Å; M216-F538 HydrophobicContact CG-CZ 3.75Å
217	Y	81.4	Confident	81.5	Confident	7 Å²	7	30.9 Å²	30.9	3%	0.027	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-42.6	174.3	-64.2	-38.9	0	0	0	113	W213 A214 M215 A220 D221 H537 F538 R544	W213-Y217 HydrophobicContact CB-CE2 4.21Å; W213-Y217 HydrophobicContact CE3-CE1 4.29Å; W213-Y217 WeakPolarHBondContact O-CD2 3.47Å; W213-Y217 VanDerWaalsContact O-CG 3.31Å; W213-Y217 PolarHBondContact O-N 2.84Å; A214-Y217 PolarHBondContact O-N 2.71Å; M215-Y217 VanDerWaalsContact C-N 3.34Å; M215-Y217 PolarHBondContact O-N 3.48Å; Y217-A220 WeakPolarHBondContact O-CB 3.42Å; Y217-A220 PolarHBondContact O-N 3.43Å; Y217-D221 PolarHBondContact O-N 3.03Å; Y217-D221 VanDerWaalsContact O-N 3.09Å; Y217-H537 AromaticContact CE1-CD2 3.47Å; Y217-H537 VanDerWaalsContact CE1-CD2 3.47Å; Y217-H537 WeakPolarHBondContact CE1-CD2 3.35Å; Y217-H537 AromaticContact CE1-NE2 3.89Å; Y217-H537 AromaticContact CZ-CD2 3.75Å; Y217-H537 PolarHBondContact OH-CD2 3.47Å; Y217-F538 AromaticContact CD1-CD1 3.65Å; Y217-F538 HydrophobicContact CD1-CD1 3.65Å; Y217-F538 AromaticContact CD1-CE1 3.67Å; Y217-F538 HydrophobicContact CD1-CE1 3.67Å; Y217-F538 HydrophobicContact CD1-CG 4.43Å; Y217-F538 HydrophobicContact CD1-CZ 4.48Å; Y217-F538 AromaticContact CE1-CD1 3.94Å; Y217-F538 HydrophobicContact CE1-CD1 3.94Å; Y217-F538 AromaticContact CE1-CE1 3.87Å; Y217-F538 HydrophobicContact CE1-CE1 3.87Å; Y217-F538 HydrophobicContact CE1-CG 4.37Å; Y217-F538 HydrophobicContact CE1-CZ 4.27Å; Y217-R544 HydrophobicContact CD1-CG 4.09Å; Y217-R544 HydrophobicContact CD2-CG 4.42Å; Y217-R544 HydrophobicContact CE1-CG 4Å; Y217-R544 HydrophobicContact CE2-CG 4.31Å; Y217-R544 HydrophobicContact CG-CG 4.31Å
218	E	84	Confident	82.3	Confident	17 Å²	17	30.5 Å²	30.5	8%	0.079	14%	0.138	C	C	.	.	H	α-helix	trans	-65.7	-42.2	175.4	-69.1	-59	140.2	0	0	111.1	R190 R193 L197 A214 M215 A220 D221 V222	R190-E218 IonicContact NH1-OE2 3.31Å; R193-E218 IonicContact CZ-OE1 2.62Å; R193-E218 IonicContact CZ-OE2 3.67Å; R193-E218 IonicContact NH1-OE1 3.69Å; R193-E218 PolarHBondContact NH1-OE1 2.98Å; R193-E218 IonicContact NH1-OE2 2.79Å; R193-E218 PolarHBondContact NH1-OE2 3.48Å; R193-E218 IonicContact NH2-OE1 3.68Å; L197-E218 HydrophobicContact CD1-CB 4.44Å; L197-E218 HydrophobicContact CD1-CG 3.74Å; A214-E218 WeakPolarHBondContact O-CG 3.37Å; A214-E218 PolarHBondContact O-N 3.37Å; A214-E218 VanDerWaalsContact O-N 3.08Å; M215-E218 PolarHBondContact O-N 2.89Å; E218-A220 VanDerWaalsContact C-N 3.3Å; E218-A220 PolarHBondContact O-N 2.94Å; E218-D221 PolarHBondContact O-N 3.49Å; E218-V222 VanDerWaalsContact O-CG2 3.28Å; E218-V222 WeakPolarHBondContact O-CG2 3.4Å; E218-V222 PolarHBondContact O-N 2.58Å
219	Y	84.8	Confident	83.2	Confident	24 Å²	24	27.7 Å²	27.7	9%	0.094	13%	0.125	C	C	.	.	H	α-helix	trans	-63.8	-37.3	177.5	-167.9	-134.1	0	0	0	111.7	I87 T194 M215 M216 V222 N223 L276	I87-Y219 HydrophobicContact CD1-CD2 4.44Å; I87-Y219 HydrophobicContact CD1-CE2 4.22Å; I87-Y219 HydrophobicContact CG1-CE2 3.92Å; T194-Y219 HydrophobicContact CG2-CD2 4Å; T194-Y219 HydrophobicContact CG2-CG 4.17Å; M215-Y219 VanDerWaalsContact O-CB 3.31Å; M215-Y219 WeakPolarHBondContact O-CB 3.5Å; M215-Y219 PolarHBondContact O-N 3.31Å; M216-Y219 PolarHBondContact O-N 2.94Å; Y219-V222 PolarHBondContact O-N 2.9Å; Y219-N223 WeakPolarHBondContact CD2-ND2 3.48Å; Y219-N223 WeakPolarHBondContact CE2-ND2 3.3Å; Y219-N223 VanDerWaalsContact CZ-ND2 3.35Å; Y219-N223 PolarHBondContact O-N 3.19Å; Y219-N223 PolarHBondContact O-ND2 2.84Å; Y219-L276 HydrophobicContact CD1-CB 4.37Å; Y219-L276 HydrophobicContact CD1-CD1 3.41Å; Y219-L276 VanDerWaalsContact CD1-CD1 3.41Å; Y219-L276 HydrophobicContact CD1-CD2 3.54Å; Y219-L276 HydrophobicContact CD1-CG 3.95Å; Y219-L276 HydrophobicContact CE1-CB 4.02Å; Y219-L276 HydrophobicContact CE1-CD1 3.86Å; Y219-L276 HydrophobicContact CE1-CD2 3.85Å; Y219-L276 HydrophobicContact CE1-CG 4.12Å; Y219-L276 HydrophobicContact CG-CD1 4.42Å; Y219-L276 HydrophobicContact CG-CD2 4.02Å; Y219-L276 WeakPolarHBondContact O-CD2 3.49Å
220	A	84	Confident	84.1	Confident	4 Å²	4	22 Å²	22	3%	0.033	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-50.2	173	0	0	0	0	0	112.6	M216 Y217 E218 V222 N223 M224 L276 W534 F538	M216-A220 VanDerWaalsContact O-CB 3.32Å; M216-A220 WeakPolarHBondContact O-CB 3.3Å; M216-A220 PolarHBondContact O-N 3.13Å; Y217-A220 WeakPolarHBondContact O-CB 3.42Å; Y217-A220 PolarHBondContact O-N 3.43Å; E218-A220 VanDerWaalsContact C-N 3.3Å; E218-A220 PolarHBondContact O-N 2.94Å; A220-V222 VanDerWaalsContact C-N 3.34Å; A220-V222 PolarHBondContact O-N 3.3Å; A220-N223 PolarHBondContact O-N 3.46Å; A220-M224 WeakPolarHBondContact O-CB 3.3Å; A220-M224 PolarHBondContact O-N 3.39Å; A220-L276 HydrophobicContact CB-CD2 4.44Å; A220-W534 VanDerWaalsContact CA-CH2 3.46Å; A220-W534 HydrophobicContact CB-CE3 4.37Å; A220-W534 HydrophobicContact CB-CH2 3.08Å; A220-W534 HydrophobicContact CB-CZ2 3.8Å; A220-W534 HydrophobicContact CB-CZ3 3.45Å; A220-W534 VanDerWaalsContact CB-CZ3 3.45Å; A220-F538 HydrophobicContact CB-CD1 3.97Å
221	D	85.8	Confident	84.8	Confident	3 Å²	3	19.7 Å²	19.7	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-44.3	179.2	-73.5	-6.1	0	0	0	111.4	W138 Y217 E218 M224 L225 R541 R544	W138-D221 HydrophobicContact CE3-CB 4.27Å; W138-D221 HydrophobicContact CZ3-CB 3.93Å; Y217-D221 PolarHBondContact O-N 3.03Å; Y217-D221 VanDerWaalsContact O-N 3.09Å; E218-D221 PolarHBondContact O-N 3.49Å; D221-M224 PolarHBondContact O-N 2.78Å; D221-L225 WeakPolarHBondContact O-CG 3.4Å; D221-L225 PolarHBondContact O-N 2.92Å; D221-R541 IonicContact OD1-CZ 3.15Å; D221-R541 IonicContact OD1-NH2 3.6Å; D221-R541 PolarHBondContact OD1-NH2 2.79Å; D221-R541 VanDerWaalsContact OD1-NH2 3.12Å; D221-R541 IonicContact OD2-CZ 2.84Å; D221-R541 VanDerWaalsContact OD2-CZ 3.23Å; D221-R541 IonicContact OD2-NH1 2.67Å; D221-R541 PolarHBondContact OD2-NH1 3.01Å; D221-R541 IonicContact OD2-NH2 2.75Å; D221-R541 PolarHBondContact OD2-NH2 3.33Å; D221-R544 IonicContact OD1-CZ 3.96Å; D221-R544 IonicContact OD1-NH1 3.87Å; D221-R544 PolarHBondContact OD1-NH1 2.94Å; D221-R544 IonicContact OD1-NH2 2.97Å; D221-R544 PolarHBondContact OD1-NH2 3.48Å; D221-R544 IonicContact OD2-NH1 2.76Å; D221-R544 PolarHBondContact OD2-NH1 3.44Å
222	V	88.8	Confident	85.5	Confident	5 Å²	5	20.8 Å²	20.8	3%	0.03	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-48.9	177.6	170.5	0	0	0	0	111.5	R190 Y191 E218 Y219 A220 M224 L225 R226	R190-V222 HydrophobicContact CB-CG2 3.35Å; R190-V222 HydrophobicContact CG-CG2 4.39Å; Y191-V222 HydrophobicContact CD1-CG1 3.88Å; Y191-V222 HydrophobicContact CD2-CG1 3.74Å; Y191-V222 HydrophobicContact CE1-CG1 3.5Å; Y191-V222 VanDerWaalsContact CE1-CG1 3.5Å; Y191-V222 HydrophobicContact CE2-CG1 3.29Å; Y191-V222 HydrophobicContact CG-CG1 4.01Å; E218-V222 VanDerWaalsContact O-CG2 3.28Å; E218-V222 WeakPolarHBondContact O-CG2 3.4Å; E218-V222 PolarHBondContact O-N 2.58Å; Y219-V222 PolarHBondContact O-N 2.9Å; A220-V222 VanDerWaalsContact C-N 3.34Å; A220-V222 PolarHBondContact O-N 3.3Å; V222-M224 VanDerWaalsContact C-N 3.27Å; V222-M224 PolarHBondContact O-N 3.32Å; V222-L225 PolarHBondContact O-N 3.5Å; V222-R226 VanDerWaalsContact O-CB 3.25Å; V222-R226 WeakPolarHBondContact O-CB 3.48Å; V222-R226 PolarHBondContact O-N 2.89Å
223	N	87.3	Confident	86.1	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-32.9	179.7	-81.2	-92.3	0	0	0	111.8	Y219 A220 L227 S272 Y273 L276	Y219-N223 WeakPolarHBondContact CD2-ND2 3.48Å; Y219-N223 WeakPolarHBondContact CE2-ND2 3.3Å; Y219-N223 VanDerWaalsContact CZ-ND2 3.35Å; Y219-N223 PolarHBondContact O-N 3.19Å; Y219-N223 PolarHBondContact O-ND2 2.84Å; A220-N223 PolarHBondContact O-N 3.46Å; N223-L227 VanDerWaalsContact O-CB 3.28Å; N223-L227 WeakPolarHBondContact O-CB 3.43Å; N223-L227 PolarHBondContact O-N 3.29Å; N223-S272 VanDerWaalsContact OD1-CB 3.3Å; N223-S272 WeakPolarHBondContact OD1-CB 3.37Å; N223-Y273 HydrophobicContact CB-CD2 4.24Å; N223-Y273 PolarHBondContact OD1-N 2.94Å; N223-L276 HydrophobicContact CB-CD2 3.83Å; N223-L276 WeakPolarHBondContact ND2-CD2 3.38Å
224	M	84.9	Confident	86.8	Confident	72 Å²	72	16.6 Å²	16.6	36%	0.355	9%	0.087	S	C	.	.	H	α-helix	trans	-70.5	-43.1	176.9	-169.5	171.4	73.5	0	0	112.5	W138 A220 D221 V222 R226 L227 L228	W138-M224 HydrophobicContact CH2-CE 3.12Å; W138-M224 HydrophobicContact CZ2-CE 3.25Å; W138-M224 HydrophobicContact CZ3-CE 4.15Å; A220-M224 WeakPolarHBondContact O-CB 3.3Å; A220-M224 PolarHBondContact O-N 3.39Å; D221-M224 PolarHBondContact O-N 2.78Å; V222-M224 VanDerWaalsContact C-N 3.27Å; V222-M224 PolarHBondContact O-N 3.32Å; M224-R226 VanDerWaalsContact C-N 3.34Å; M224-L227 PolarHBondContact O-N 3.26Å; M224-L228 PolarHBondContact O-N 2.89Å; M224-L228 VanDerWaalsContact O-N 3.1Å
225	L	89.1	Confident	87.4	Confident	4 Å²	4	15.5 Å²	15.5	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-60.7	-46.1	174	-74.4	166.9	0	0	0	111.2	V131 L134 W138 D221 V222 L227 L228 E229	V131-L225 HydrophobicContact CG1-CB 3.82Å; V131-L225 HydrophobicContact CG1-CD2 3.87Å; V131-L225 HydrophobicContact CG1-CG 4.28Å; L134-L225 HydrophobicContact CB-CD2 3.93Å; W138-L225 HydrophobicContact CE3-CD1 3.9Å; W138-L225 HydrophobicContact CE3-CD2 4.14Å; W138-L225 HydrophobicContact CE3-CG 4.09Å; W138-L225 HydrophobicContact CH2-CD1 4.26Å; W138-L225 HydrophobicContact CH2-CD2 3.49Å; W138-L225 VanDerWaalsContact CH2-CD2 3.49Å; W138-L225 HydrophobicContact CH2-CG 3.54Å; W138-L225 HydrophobicContact CZ2-CD2 4.18Å; W138-L225 HydrophobicContact CZ3-CD1 3.47Å; W138-L225 VanDerWaalsContact CZ3-CD1 3.47Å; W138-L225 HydrophobicContact CZ3-CD2 3.54Å; W138-L225 HydrophobicContact CZ3-CG 3.26Å; D221-L225 WeakPolarHBondContact O-CG 3.4Å; D221-L225 PolarHBondContact O-N 2.92Å; V222-L225 PolarHBondContact O-N 3.5Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 2.93Å; L225-L228 WeakPolarHBondContact O-CB 3.43Å; L225-L228 PolarHBondContact O-N 2.87Å; L225-E229 PolarHBondContact O-N 2.99Å
226	R	89.7	Confident	87.8	Confident	6 Å²	6	15.8 Å²	15.8	2%	0.023	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-41.1	178.9	-176.8	68	72.2	-158.3	9.3	111.8	F94 Y191 V222 M224 L228 E229 T230 V269	F94-R226 VanDerWaalsContact CD2-NH2 3.31Å; Y191-R226 PolarHBondContact OH-NE 3.18Å; V222-R226 VanDerWaalsContact O-CB 3.25Å; V222-R226 WeakPolarHBondContact O-CB 3.48Å; V222-R226 PolarHBondContact O-N 2.89Å; M224-R226 VanDerWaalsContact C-N 3.34Å; R226-L228 VanDerWaalsContact C-N 3.34Å; R226-L228 PolarHBondContact O-N 3.12Å; R226-E229 IonicContact CZ-OE2 3.82Å; R226-E229 IonicContact NH1-OE1 2.57Å; R226-E229 IonicContact NH1-OE2 3.33Å; R226-E229 PolarHBondContact NH1-OE2 3.09Å; R226-E229 PolarHBondContact O-N 2.95Å; R226-T230 WeakPolarHBondContact O-CG2 3.48Å; R226-T230 PolarHBondContact O-N 3.43Å; R226-T230 PolarHBondContact O-OG1 3.4Å; R226-V269 HydrophobicContact CB-CG1 4.25Å; R226-V269 HydrophobicContact CG-CB 4.04Å; R226-V269 HydrophobicContact CG-CG1 3.58Å; R226-V269 HydrophobicContact CG-CG2 3.24Å
227	L	89.3	Confident	88.4	Confident	19 Å²	19	15.2 Å²	15.2	10%	0.099	8%	0.079	C	C	.	.	H	α-helix	trans	-58.5	-48.3	174.5	-169.5	74.1	0	0	0	110.4	N223 M224 L225 E229 T230 F231 V269 L270 Y273 F366	N223-L227 VanDerWaalsContact O-CB 3.28Å; N223-L227 WeakPolarHBondContact O-CB 3.43Å; N223-L227 PolarHBondContact O-N 3.29Å; M224-L227 PolarHBondContact O-N 3.26Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 2.93Å; L227-E229 PolarHBondContact O-N 2.93Å; L227-T230 PolarHBondContact O-N 2.93Å; L227-T230 PolarHBondContact O-OG1 3.11Å; L227-F231 HydrophobicContact CD1-CD2 4.14Å; L227-F231 HydrophobicContact CD1-CE2 3.64Å; L227-F231 HydrophobicContact CG-CD2 4.21Å; L227-F231 HydrophobicContact CG-CE2 4.18Å; L227-F231 VanDerWaalsContact O-CD2 3.25Å; L227-F231 WeakPolarHBondContact O-CD2 3.46Å; L227-F231 PolarHBondContact O-N 3.26Å; L227-V269 HydrophobicContact CB-CG1 4.48Å; L227-V269 HydrophobicContact CD1-CG1 4.29Å; L227-L270 HydrophobicContact CD1-CD2 3.75Å; L227-Y273 HydrophobicContact CD2-CD2 4.31Å; L227-Y273 HydrophobicContact CD2-CE1 4.49Å; L227-Y273 HydrophobicContact CD2-CE2 4.24Å; L227-Y273 HydrophobicContact CD2-CG 4.48Å; L227-F366 HydrophobicContact CD2-CE2 3.92Å; L227-F366 HydrophobicContact CD2-CZ 4.1Å
228	L	87.6	Confident	89.1	Confident	39 Å²	39	15.1 Å²	15.1	20%	0.204	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-47.6	178.3	-177.8	68.2	0	0	0	112.1	V131 L134 M224 L225 R226 F231 L232 V356	V131-L228 HydrophobicContact CG2-CD2 4.5Å; L134-L228 HydrophobicContact CD1-CD2 3.3Å; M224-L228 PolarHBondContact O-N 2.89Å; M224-L228 VanDerWaalsContact O-N 3.1Å; L225-L228 WeakPolarHBondContact O-CB 3.43Å; L225-L228 PolarHBondContact O-N 2.87Å; R226-L228 VanDerWaalsContact C-N 3.34Å; R226-L228 PolarHBondContact O-N 3.12Å; L228-F231 PolarHBondContact O-N 3.26Å; L228-L232 HydrophobicContact CD1-CD1 3.83Å; L228-L232 HydrophobicContact CD1-CG 4.27Å; L228-L232 HydrophobicContact CD2-CD1 4.46Å; L228-L232 HydrophobicContact CG-CD1 3.8Å; L228-L232 HydrophobicContact CG-CG 4.5Å; L228-L232 WeakPolarHBondContact O-CB 3.2Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 2.84Å; L228-L232 VanDerWaalsContact O-N 3.14Å; L228-V356 HydrophobicContact CD1-CG1 4.06Å
229	E	90.4	Very high	89.6	Confident	6 Å²	6	14.8 Å²	14.8	3%	0.028	8%	0.077	C	C	.	.	H	α-helix	trans	-56.5	-53.7	177	-168.2	176.3	-148.5	0	0	111.5	V131 Q187 L225 R226 L227 F231 L232 E233	V131-E229 HydrophobicContact CG2-CB 3.73Å; V131-E229 HydrophobicContact CG2-CG 4.19Å; Q187-E229 PolarHBondContact NE2-OE1 2.94Å; Q187-E229 PolarHBondContact NE2-OE2 3.33Å; Q187-E229 PolarHBondContact OE1-OE2 3.39Å; L225-E229 PolarHBondContact O-N 2.99Å; R226-E229 IonicContact CZ-OE2 3.82Å; R226-E229 IonicContact NH1-OE1 2.57Å; R226-E229 IonicContact NH1-OE2 3.33Å; R226-E229 PolarHBondContact NH1-OE2 3.09Å; R226-E229 PolarHBondContact O-N 2.95Å; L227-E229 PolarHBondContact O-N 2.93Å; E229-F231 PolarHBondContact O-N 3.33Å; E229-F231 VanDerWaalsContact O-N 3.12Å; E229-L232 PolarHBondContact O-N 3.16Å; E229-E233 WeakPolarHBondContact CG-OE2 3.46Å; E229-E233 WeakPolarHBondContact O-CB 3.38Å; E229-E233 PolarHBondContact O-N 2.95Å
230	T	91.1	Very high	89.9	Confident	2 Å²	2	15 Å²	15	1%	0.012	8%	0.08	C	C	.	.	H	α-helix	trans	-59	-30.7	-176.5	51.3	0	0	0	0	114.3	R226 L227 S234 A235 V269	R226-T230 WeakPolarHBondContact O-CG2 3.48Å; R226-T230 PolarHBondContact O-N 3.43Å; R226-T230 PolarHBondContact O-OG1 3.4Å; L227-T230 PolarHBondContact O-N 2.93Å; L227-T230 PolarHBondContact O-OG1 3.11Å; T230-S234 WeakPolarHBondContact O-CB 3.48Å; T230-S234 PolarHBondContact O-N 3Å; T230-S234 VanDerWaalsContact O-N 3.13Å; T230-A235 PolarHBondContact O-N 2.83Å; T230-V269 HydrophobicContact CG2-CB 4.04Å; T230-V269 HydrophobicContact CG2-CG1 4.08Å; T230-V269 HydrophobicContact CG2-CG2 3.79Å
231	F	90.2	Very high	90.4	Very high	8 Å²	8	14.8 Å²	14.8	4%	0.035	8%	0.078	C	C	.	.	H	α-helix	trans	-87.6	-19.7	177.6	-77	-71.4	0	0	0	114	L227 L228 E229 A235 P236 L270 V360 F363	L227-F231 HydrophobicContact CD1-CD2 4.14Å; L227-F231 HydrophobicContact CD1-CE2 3.64Å; L227-F231 HydrophobicContact CG-CD2 4.21Å; L227-F231 HydrophobicContact CG-CE2 4.18Å; L227-F231 VanDerWaalsContact O-CD2 3.25Å; L227-F231 WeakPolarHBondContact O-CD2 3.46Å; L227-F231 PolarHBondContact O-N 3.26Å; L228-F231 PolarHBondContact O-N 3.26Å; E229-F231 PolarHBondContact O-N 3.33Å; E229-F231 VanDerWaalsContact O-N 3.12Å; F231-A235 HydrophobicContact CD1-CB 4.36Å; F231-P236 WeakPolarHBondContact O-CD 3.34Å; F231-L270 HydrophobicContact CE2-CD2 3.93Å; F231-L270 HydrophobicContact CE2-CG 4.45Å; F231-L270 HydrophobicContact CZ-CD1 4.14Å; F231-L270 HydrophobicContact CZ-CD2 3.94Å; F231-L270 HydrophobicContact CZ-CG 4.29Å; F231-V360 HydrophobicContact CD1-CG2 4.33Å; F231-V360 HydrophobicContact CD2-CB 4.46Å; F231-V360 HydrophobicContact CD2-CG1 4.4Å; F231-V360 HydrophobicContact CD2-CG2 3.63Å; F231-V360 HydrophobicContact CE1-CB 4.37Å; F231-V360 HydrophobicContact CE1-CG1 3.98Å; F231-V360 HydrophobicContact CE1-CG2 4.49Å; F231-V360 HydrophobicContact CE2-CB 4.3Å; F231-V360 HydrophobicContact CE2-CG1 3.77Å; F231-V360 HydrophobicContact CE2-CG2 3.81Å; F231-V360 HydrophobicContact CG-CG2 3.93Å; F231-V360 HydrophobicContact CZ-CB 4.28Å; F231-V360 HydrophobicContact CZ-CG1 3.55Å; F231-V360 HydrophobicContact CZ-CG2 4.27Å; F231-F363 AromaticContact CD1-CD2 3.98Å; F231-F363 HydrophobicContact CD1-CD2 3.98Å; F231-F363 HydrophobicContact CE1-CB 4.03Å; F231-F363 HydrophobicContact CE1-CD2 4.3Å; F231-F363 HydrophobicContact CE1-CG 4.47Å
232	L	88.7	Confident	90.7	Very high	62 Å²	62	16.3 Å²	16.3	33%	0.325	9%	0.086	S	C	.	.	H	α-helix	trans	-89.8	-30.3	174	-69.5	178.4	0	0	0	112.5	P127 L130 L228 E229	P127-L232 HydrophobicContact CB-CB 3.72Å; P127-L232 HydrophobicContact CG-CB 3.77Å; P127-L232 WeakPolarHBondContact CG-O 3.47Å; L130-L232 HydrophobicContact CD1-CD1 4.31Å; L228-L232 HydrophobicContact CD1-CD1 3.83Å; L228-L232 HydrophobicContact CD1-CG 4.27Å; L228-L232 HydrophobicContact CD2-CD1 4.46Å; L228-L232 HydrophobicContact CG-CD1 3.8Å; L228-L232 HydrophobicContact CG-CG 4.5Å; L228-L232 WeakPolarHBondContact O-CB 3.2Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 2.84Å; L228-L232 VanDerWaalsContact O-N 3.14Å; E229-L232 PolarHBondContact O-N 3.16Å
233	E	91.3	Very high	90.9	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.019	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-75.8	-177.7	174.8	171.2	-177.5	0	0	111.2	F123 V124 P127 E229 A235 P236 Q237	F123-E233 WeakPolarHBondContact O-CB 3.27Å; F123-E233 WeakPolarHBondContact O-CG 3.38Å; V124-E233 WeakPolarHBondContact CA-OE1 3.5Å; P127-E233 HydrophobicContact CB-CB 3.8Å; P127-E233 HydrophobicContact CG-CB 3.8Å; E229-E233 WeakPolarHBondContact CG-OE2 3.46Å; E229-E233 WeakPolarHBondContact O-CB 3.38Å; E229-E233 PolarHBondContact O-N 2.95Å; E233-A235 PolarHBondContact O-N 2.92Å; E233-P236 VanDerWaalsContact O-CD 3.31Å; E233-P236 WeakPolarHBondContact O-CD 3.23Å; E233-Q237 WeakPolarHBondContact O-CB 3.46Å; E233-Q237 PolarHBondContact O-N 3.35Å
234	S	90.8	Very high	91.1	Very high	4 Å²	4	16.7 Å²	16.7	3%	0.028	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-39.5	-164.1	-44.8	0	0	0	0	113.7	T230 L238	T230-S234 WeakPolarHBondContact O-CB 3.48Å; T230-S234 PolarHBondContact O-N 3Å; T230-S234 VanDerWaalsContact O-N 3.13Å; S234-L238 WeakPolarHBondContact O-CB 3.36Å; S234-L238 PolarHBondContact O-N 2.94Å
235	A	92.4	Very high	91.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-71.5	-52	-177.2	0	0	0	0	0	113	T230 F231 E233 Q237 L238 V239 L266 F363	T230-A235 PolarHBondContact O-N 2.83Å; F231-A235 HydrophobicContact CD1-CB 4.36Å; E233-A235 PolarHBondContact O-N 2.92Å; A235-Q237 VanDerWaalsContact C-N 3.31Å; A235-Q237 PolarHBondContact O-N 3.38Å; A235-L238 PolarHBondContact O-N 3.39Å; A235-V239 WeakPolarHBondContact O-CG2 3.24Å; A235-V239 PolarHBondContact O-N 3.14Å; A235-L266 HydrophobicContact CB-CD1 3.49Å; A235-L266 VanDerWaalsContact CB-CD1 3.49Å; A235-F363 HydrophobicContact CB-CD1 3.97Å; A235-F363 HydrophobicContact CB-CD2 4.16Å; A235-F363 HydrophobicContact CB-CE1 3.82Å; A235-F363 HydrophobicContact CB-CE2 4.02Å; A235-F363 HydrophobicContact CB-CG 4.14Å; A235-F363 HydrophobicContact CB-CZ 3.84Å
236	P	92.1	Very high	91.5	Very high	33 Å²	33	15.6 Å²	15.6	21%	0.214	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-38.3	173.1	-23.9	35.1	0	0	0	112.9	F123 F231 E233 V239 L240 F363	F123-P236 HydrophobicContact CD1-CB 4Å; F123-P236 HydrophobicContact CE1-CB 3.6Å; F123-P236 HydrophobicContact CE1-CG 4.35Å; F123-P236 HydrophobicContact CZ-CB 4.1Å; F231-P236 WeakPolarHBondContact O-CD 3.34Å; E233-P236 VanDerWaalsContact O-CD 3.31Å; E233-P236 WeakPolarHBondContact O-CD 3.23Å; P236-V239 PolarHBondContact O-N 3.47Å; P236-L240 WeakPolarHBondContact O-CB 3.27Å; P236-L240 PolarHBondContact O-N 2.95Å; P236-F363 HydrophobicContact CG-CZ 4.44Å
237	Q	93.1	Very high	91.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.8	-40.8	178.7	-178.5	155.4	-23.2	0	0	112.3	D101 F123 E233 A235 V239 L240 Q241	D101-Q237 PolarHBondContact OD1-NE2 3.45Å; D101-Q237 PolarHBondContact OD2-NE2 3.47Å; F123-Q237 HydrophobicContact CB-CB 4.25Å; E233-Q237 WeakPolarHBondContact O-CB 3.46Å; E233-Q237 PolarHBondContact O-N 3.35Å; A235-Q237 VanDerWaalsContact C-N 3.31Å; A235-Q237 PolarHBondContact O-N 3.38Å; Q237-V239 VanDerWaalsContact C-N 3.35Å; Q237-V239 PolarHBondContact O-N 3.18Å; Q237-L240 WeakPolarHBondContact O-CB 3.35Å; Q237-L240 PolarHBondContact O-N 3.34Å; Q237-Q241 HydrophobicContact CG-CG 4.42Å; Q237-Q241 WeakPolarHBondContact O-CB 3.29Å; Q237-Q241 VanDerWaalsContact O-CG 3.29Å; Q237-Q241 WeakPolarHBondContact O-CG 3.28Å; Q237-Q241 PolarHBondContact O-N 2.9Å
238	L	94.8	Very high	91.3	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-61.6	-42.2	174.1	-177.8	63.4	0	0	0	111.8	S234 A235 L240 Q241 L242 A259 L263 V307	S234-L238 WeakPolarHBondContact O-CB 3.36Å; S234-L238 PolarHBondContact O-N 2.94Å; A235-L238 PolarHBondContact O-N 3.39Å; L238-L240 VanDerWaalsContact C-N 3.35Å; L238-Q241 PolarHBondContact O-N 3.22Å; L238-L242 WeakPolarHBondContact O-CG 3.48Å; L238-L242 PolarHBondContact O-N 2.96Å; L238-L242 VanDerWaalsContact O-N 3.08Å; L238-A259 VanDerWaalsContact CD1-CA 3.43Å; L238-A259 HydrophobicContact CD1-CB 3.57Å; L238-A259 WeakPolarHBondContact CD1-O 3.3Å; L238-L263 HydrophobicContact CD2-CB 3.89Å; L238-L263 HydrophobicContact CD2-CD1 3.92Å; L238-L263 HydrophobicContact CD2-CG 4.45Å; L238-V307 HydrophobicContact CB-CG1 4.17Å; L238-V307 HydrophobicContact CD2-CB 4.24Å; L238-V307 HydrophobicContact CD2-CG1 3.67Å; L238-V307 HydrophobicContact CD2-CG2 4.22Å; L238-V307 HydrophobicContact CG-CG1 3.55Å
239	V	94.9	Very high	91.2	Very high	9 Å²	9	22.8 Å²	22.8	6%	0.055	13%	0.125	C	C	.	.	H	α-helix	trans	-61.8	-44.4	174.4	176.2	0	0	0	0	110.6	A235 P236 Q237 C243 V307 F310 F321 F363	A235-V239 WeakPolarHBondContact O-CG2 3.24Å; A235-V239 PolarHBondContact O-N 3.14Å; P236-V239 PolarHBondContact O-N 3.47Å; Q237-V239 VanDerWaalsContact C-N 3.35Å; Q237-V239 PolarHBondContact O-N 3.18Å; V239-C243 VanDerWaalsContact O-CB 3.24Å; V239-C243 WeakPolarHBondContact O-CB 3.42Å; V239-C243 PolarHBondContact O-N 2.62Å; V239-V307 HydrophobicContact CB-CG1 4.44Å; V239-V307 HydrophobicContact CG2-CB 4.3Å; V239-V307 HydrophobicContact CG2-CG1 3.64Å; V239-V307 HydrophobicContact CG2-CG2 4.27Å; V239-F310 HydrophobicContact CG1-CB 4.06Å; V239-F310 HydrophobicContact CG2-CB 4.16Å; V239-F310 HydrophobicContact CG2-CD2 4.26Å; V239-F321 HydrophobicContact CG1-CE1 4.36Å; V239-F321 HydrophobicContact CG1-CZ 4.01Å; V239-F363 HydrophobicContact CG2-CE1 4.17Å
240	L	91.9	Very high	90.8	Very high	29 Å²	29	29.2 Å²	29.2	15%	0.152	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-47.4	178.2	178.5	65.7	0	0	0	111.7	W116 L119 F123 P236 Q237 L238 C243 I244	W116-L240 HydrophobicContact CZ3-CD1 4.24Å; L119-L240 HydrophobicContact CB-CD2 3.93Å; F123-L240 HydrophobicContact CD2-CD2 3.93Å; F123-L240 HydrophobicContact CE2-CD2 4.03Å; P236-L240 WeakPolarHBondContact O-CB 3.27Å; P236-L240 PolarHBondContact O-N 2.95Å; Q237-L240 WeakPolarHBondContact O-CB 3.35Å; Q237-L240 PolarHBondContact O-N 3.34Å; L238-L240 VanDerWaalsContact C-N 3.35Å; L240-C243 WeakPolarHBondContact O-CB 3.38Å; L240-C243 PolarHBondContact O-N 2.9Å; L240-I244 HydrophobicContact CD1-CD1 4.16Å; L240-I244 HydrophobicContact CD1-CG1 4.43Å; L240-I244 HydrophobicContact CG-CD1 3.99Å; L240-I244 WeakPolarHBondContact O-CG1 3.35Å; L240-I244 PolarHBondContact O-N 2.93Å
241	Q	93.4	Very high	90.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-48	179.6	-74.3	171.8	-5	0	0	111.6	D101 L104 Q237 L238 C243 I244 M245 S258	D101-Q241 PolarHBondContact OD1-NE2 3.24Å; L104-Q241 HydrophobicContact CD2-CG 3.96Å; Q237-Q241 HydrophobicContact CG-CG 4.42Å; Q237-Q241 WeakPolarHBondContact O-CB 3.29Å; Q237-Q241 VanDerWaalsContact O-CG 3.29Å; Q237-Q241 WeakPolarHBondContact O-CG 3.28Å; Q237-Q241 PolarHBondContact O-N 2.9Å; L238-Q241 PolarHBondContact O-N 3.22Å; Q241-C243 VanDerWaalsContact C-N 3.31Å; Q241-C243 PolarHBondContact O-N 3.42Å; Q241-I244 PolarHBondContact O-N 2.9Å; Q241-M245 WeakPolarHBondContact O-CG 3.45Å; Q241-M245 PolarHBondContact O-N 3.05Å; Q241-S258 PolarHBondContact NE2-OG 2.83Å
242	L	93.9	Very high	90.4	Very high	34 Å²	34	36.1 Å²	36.1	18%	0.178	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-38.1	176.3	-68.9	179.5	0	0	0	111.9	L238 M245 I246 A259 V307 A311	L238-L242 WeakPolarHBondContact O-CG 3.48Å; L238-L242 PolarHBondContact O-N 2.96Å; L238-L242 VanDerWaalsContact O-N 3.08Å; L242-M245 HydrophobicContact CD2-SD 4Å; L242-M245 WeakPolarHBondContact O-CB 3.49Å; L242-M245 PolarHBondContact O-N 3.09Å; L242-I246 WeakPolarHBondContact O-CD1 3.44Å; L242-I246 VanDerWaalsContact O-CG1 3.24Å; L242-I246 WeakPolarHBondContact O-CG1 3.48Å; L242-I246 PolarHBondContact O-N 3.34Å; L242-A259 HydrophobicContact CD2-CB 4.31Å; L242-V307 HydrophobicContact CD1-CG1 3.77Å; L242-A311 HydrophobicContact CB-CB 3.44Å; L242-A311 VanDerWaalsContact CB-CB 3.44Å; L242-A311 HydrophobicContact CD1-CB 4.22Å
243	C	92.5	Very high	90.4	Very high	12 Å²	12	42.4 Å²	42.4	8%	0.081	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-42.7	176.3	-171.7	0	0	0	0	111.7	V239 L240 Q241 I246 Q247	V239-C243 VanDerWaalsContact O-CB 3.24Å; V239-C243 WeakPolarHBondContact O-CB 3.42Å; V239-C243 PolarHBondContact O-N 2.62Å; L240-C243 WeakPolarHBondContact O-CB 3.38Å; L240-C243 PolarHBondContact O-N 2.9Å; Q241-C243 VanDerWaalsContact C-N 3.31Å; Q241-C243 PolarHBondContact O-N 3.42Å; C243-I246 PolarHBondContact O-N 2.98Å; C243-Q247 WeakPolarHBondContact O-CB 3.13Å; C243-Q247 WeakPolarHBondContact O-CG 3.39Å; C243-Q247 PolarHBondContact O-N 2.72Å; C243-Q247 PolarHBondContact SG-NE2 2.98Å
244	I	91	Very high	90.3	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-42.2	176.1	-66	164.3	0	0	0	111.1	Y108 W116 L240 Q241 I246 Q247 S248	Y108-I244 HydrophobicContact CE2-CD1 4.43Å; W116-I244 HydrophobicContact CB-CD1 4.32Å; W116-I244 HydrophobicContact CD2-CD1 3.9Å; W116-I244 HydrophobicContact CD2-CG1 4.01Å; W116-I244 HydrophobicContact CE3-CD1 3.58Å; W116-I244 HydrophobicContact CE3-CG1 3.76Å; W116-I244 HydrophobicContact CG-CD1 4.22Å; W116-I244 HydrophobicContact CH2-CG1 4.36Å; W116-I244 HydrophobicContact CZ3-CD1 4.19Å; W116-I244 HydrophobicContact CZ3-CG1 3.96Å; L240-I244 HydrophobicContact CD1-CD1 4.16Å; L240-I244 HydrophobicContact CD1-CG1 4.43Å; L240-I244 HydrophobicContact CG-CD1 3.99Å; L240-I244 WeakPolarHBondContact O-CG1 3.35Å; L240-I244 PolarHBondContact O-N 2.93Å; Q241-I244 PolarHBondContact O-N 2.9Å; I244-I246 VanDerWaalsContact C-N 3.33Å; I244-I246 PolarHBondContact O-N 3.14Å; I244-Q247 PolarHBondContact O-N 3.08Å; I244-S248 VanDerWaalsContact O-CB 3.22Å; I244-S248 WeakPolarHBondContact O-CB 3.11Å; I244-S248 PolarHBondContact O-N 2.86Å; I244-S248 PolarHBondContact O-OG 2.85Å
245	M	91.7	Very high	90.3	Very high	28 Å²	28	44.7 Å²	44.7	14%	0.138	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-45	176.1	-71.9	169.2	68.5	0	0	111.7	Q241 L242 N249 K250 A251 Q255 C256	Q241-M245 WeakPolarHBondContact O-CG 3.45Å; Q241-M245 PolarHBondContact O-N 3.05Å; L242-M245 HydrophobicContact CD2-SD 4Å; L242-M245 WeakPolarHBondContact O-CB 3.49Å; L242-M245 PolarHBondContact O-N 3.09Å; M245-N249 PolarHBondContact O-N 2.96Å; M245-K250 PolarHBondContact O-N 3Å; M245-A251 HydrophobicContact CE-CB 3.84Å; M245-Q255 HydrophobicContact CG-CB 3.83Å; M245-Q255 HydrophobicContact CG-CG 4.44Å; M245-Q255 HydrophobicContact SD-CB 3.87Å; M245-C256 WeakPolarHBondContact CE-SG 3.36Å
246	I	90.9	Very high	90.3	Very high	25 Å²	25	46.5 Å²	46.5	13%	0.128	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-47.7	179.7	-66.1	161.5	0	0	0	110.6	L242 C243 I244 S248 N249 A311 L312 Y407	L242-I246 WeakPolarHBondContact O-CD1 3.44Å; L242-I246 VanDerWaalsContact O-CG1 3.24Å; L242-I246 WeakPolarHBondContact O-CG1 3.48Å; L242-I246 PolarHBondContact O-N 3.34Å; C243-I246 PolarHBondContact O-N 2.98Å; I244-I246 VanDerWaalsContact C-N 3.33Å; I244-I246 PolarHBondContact O-N 3.14Å; I246-S248 PolarHBondContact O-N 2.76Å; I246-N249 PolarHBondContact O-N 2.73Å; I246-A311 HydrophobicContact CD1-CB 4.07Å; I246-L312 HydrophobicContact CD1-CD2 3.87Å; I246-L312 HydrophobicContact CD1-CG 4.29Å; I246-Y407 PolarHBondContact O-OH 3.47Å
247	Q	89.1	Confident	90.3	Very high	77 Å²	77	47.1 Å²	47.1	36%	0.36	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-37.8	179.9	-73.2	178.2	16.6	0	0	113	C243 I244 N249 H318	C243-Q247 WeakPolarHBondContact O-CB 3.13Å; C243-Q247 WeakPolarHBondContact O-CG 3.39Å; C243-Q247 PolarHBondContact O-N 2.72Å; C243-Q247 PolarHBondContact SG-NE2 2.98Å; I244-Q247 PolarHBondContact O-N 3.08Å; Q247-N249 PolarHBondContact O-N 2.92Å; Q247-H318 PolarHBondContact NE2-NE2 2.79Å
248	S	86	Confident	90.2	Very high	60 Å²	60	47.1 Å²	47.1	42%	0.42	24%	0.242	S	C	.	.	H	α-helix	trans	-79.3	-9.7	-179.7	-53.7	0	0	0	0	112.8	I244 I246 K250	I244-S248 VanDerWaalsContact O-CB 3.22Å; I244-S248 WeakPolarHBondContact O-CB 3.11Å; I244-S248 PolarHBondContact O-N 2.86Å; I244-S248 PolarHBondContact O-OG 2.85Å; I246-S248 PolarHBondContact O-N 2.76Å; S248-K250 WeakPolarHBondContact O-CG 3.48Å; S248-K250 PolarHBondContact O-N 3.37Å; S248-K250 VanDerWaalsContact O-N 3.08Å
249	N	84.9	Confident	90.2	Very high	78 Å²	78	47.3 Å²	47.3	42%	0.417	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	30.7	-172.8	-156.2	16.5	0	0	0	113.8	M245 I246 Q247 T403 Y407	M245-N249 PolarHBondContact O-N 2.96Å; I246-N249 PolarHBondContact O-N 2.73Å; Q247-N249 PolarHBondContact O-N 2.92Å; N249-T403 PolarHBondContact ND2-O 3.12Å; N249-Y407 WeakPolarHBondContact OD1-CE1 3.46Å
250	K	83.1	Confident	90.1	Very high	141 Å²	141	52.1 Å²	52.1	61%	0.613	27%	0.269	S	S	*	.			trans	-142.2	120.5	-176.2	-72.2	-177.6	-176.5	180	0	108.9	M245 S248 E252	M245-K250 PolarHBondContact O-N 3Å; S248-K250 WeakPolarHBondContact O-CG 3.48Å; S248-K250 PolarHBondContact O-N 3.37Å; S248-K250 VanDerWaalsContact O-N 3.08Å; K250-E252 PolarHBondContact O-N 3.32Å
251	A	83.3	Confident	90.1	Very high	72 Å²	72	51.1 Å²	51.1	60%	0.595	26%	0.264	S	S	*	.			trans	-95.6	87.3	174.4	0	0	0	0	0	109.1	M245	M245-A251 HydrophobicContact CE-CB 3.84Å
252	E	88.4	Confident	90.1	Very high	83 Å²	83	51.1 Å²	51.1	39%	0.388	26%	0.264	S	S	.	.			trans	-65.8	140.5	173.4	-65.7	-71.5	145.9	0	0	109.7	K111 K250 L254 Q255 C256	K111-E252 IonicContact NZ-OE2 2.71Å; K250-E252 PolarHBondContact O-N 3.32Å; E252-L254 PolarHBondContact O-N 3.47Å; E252-Q255 HydrophobicContact CB-CB 4.45Å; E252-Q255 HydrophobicContact CB-CG 4.15Å; E252-Q255 WeakPolarHBondContact O-CB 3.31Å; E252-Q255 PolarHBondContact O-N 2.9Å; E252-C256 PolarHBondContact O-N 2.97Å; E252-C256 VanDerWaalsContact O-N 3.14Å
253	W	89.6	Confident	90.2	Very high	194 Å²	194	50.4 Å²	50.4	74%	0.735	26%	0.261	S	S	*	.	H	α-helix	trans	-54.1	-40.6	-178.5	174	-104.6	0	0	0	112.7	Q255 C256 L257	W253-Q255 PolarHBondContact O-N 3.39Å; W253-C256 PolarHBondContact O-N 3.21Å; W253-L257 WeakPolarHBondContact O-CB 3.46Å; W253-L257 PolarHBondContact O-N 3.04Å
254	L	88.1	Confident	90.2	Very high	48 Å²	48	52.3 Å²	52.3	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-63.7	-38.1	178.3	-67.8	175.2	0	0	0	112.6	L104 D107 E252 L257 S258	L104-L254 HydrophobicContact CD1-CB 4.36Å; D107-L254 HydrophobicContact CB-CD1 4.29Å; E252-L254 PolarHBondContact O-N 3.47Å; L254-L257 PolarHBondContact O-N 2.88Å; L254-S258 WeakPolarHBondContact O-CB 3.31Å; L254-S258 PolarHBondContact O-N 3.49Å
255	Q	91.3	Very high	90.3	Very high	8 Å²	8	52.4 Å²	52.4	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-43.6	178.4	-68.9	171.9	8.9	0	0	111	L104 Y108 M245 E252 W253 L257 S258 A259	L104-Q255 HydrophobicContact CD1-CG 3.66Å; L104-Q255 HydrophobicContact CD2-CG 4.49Å; Y108-Q255 PolarHBondContact OH-NE2 3.21Å; M245-Q255 HydrophobicContact CG-CB 3.83Å; M245-Q255 HydrophobicContact CG-CG 4.44Å; M245-Q255 HydrophobicContact SD-CB 3.87Å; E252-Q255 HydrophobicContact CB-CB 4.45Å; E252-Q255 HydrophobicContact CB-CG 4.15Å; E252-Q255 WeakPolarHBondContact O-CB 3.31Å; E252-Q255 PolarHBondContact O-N 2.9Å; W253-Q255 PolarHBondContact O-N 3.39Å; Q255-L257 VanDerWaalsContact C-N 3.31Å; Q255-L257 PolarHBondContact O-N 2.93Å; Q255-S258 PolarHBondContact O-N 2.94Å; Q255-A259 VanDerWaalsContact O-CB 3.29Å; Q255-A259 WeakPolarHBondContact O-CB 3.32Å; Q255-A259 PolarHBondContact O-N 3.29Å
256	C	91.9	Very high	90.4	Very high	38 Å²	38	51 Å²	51	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-42.5	174.1	-67.5	0	0	0	0	111.8	M245 E252 W253 A259 L260	M245-C256 WeakPolarHBondContact CE-SG 3.36Å; E252-C256 PolarHBondContact O-N 2.97Å; E252-C256 VanDerWaalsContact O-N 3.14Å; W253-C256 PolarHBondContact O-N 3.21Å; C256-A259 PolarHBondContact O-N 3.1Å; C256-L260 WeakPolarHBondContact O-CB 3.37Å; C256-L260 VanDerWaalsContact O-CG 3.29Å; C256-L260 WeakPolarHBondContact O-CG 3.37Å; C256-L260 PolarHBondContact O-N 3.16Å
257	L	91.8	Very high	90.5	Very high	46 Å²	46	49.9 Å²	49.9	24%	0.241	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-44.2	-179.4	-170.7	64	0	0	0	112.1	W96 T100 W253 L254 Q255 S261	W96-L257 HydrophobicContact CZ2-CD1 4.07Å; W96-L257 HydrophobicContact CZ2-CD2 3.93Å; W96-L257 HydrophobicContact CZ2-CG 4.16Å; T100-L257 HydrophobicContact CG2-CD2 4.45Å; T100-L257 HydrophobicContact CG2-CG 4.35Å; W253-L257 WeakPolarHBondContact O-CB 3.46Å; W253-L257 PolarHBondContact O-N 3.04Å; L254-L257 PolarHBondContact O-N 2.88Å; Q255-L257 VanDerWaalsContact C-N 3.31Å; Q255-L257 PolarHBondContact O-N 2.93Å; L257-S261 VanDerWaalsContact O-CB 3.31Å; L257-S261 WeakPolarHBondContact O-CB 3.19Å; L257-S261 PolarHBondContact O-N 3.44Å
258	S	92.5	Very high	90.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-49.5	173.4	-130.7	0	0	0	0	110.4	T100 D101 Q241 L254 Q255 L260 S261 S262	T100-S258 PolarHBondContact O-OG 3.21Å; D101-S258 PolarHBondContact OD1-OG 3.34Å; Q241-S258 PolarHBondContact NE2-OG 2.83Å; L254-S258 WeakPolarHBondContact O-CB 3.31Å; L254-S258 PolarHBondContact O-N 3.49Å; Q255-S258 PolarHBondContact O-N 2.94Å; S258-L260 PolarHBondContact O-N 3.49Å; S258-S261 WeakPolarHBondContact O-CA 3.01Å; S258-S261 VanDerWaalsContact O-CB 3.32Å; S258-S261 WeakPolarHBondContact O-CB 3.49Å; S258-S261 PolarHBondContact O-N 3.29Å; S258-S261 VanDerWaalsContact O-N 3.09Å; S258-S262 PolarHBondContact O-N 3.26Å; S258-S262 PolarHBondContact O-OG 2.85Å; S258-S262 VanDerWaalsContact O-OG 3.08Å
259	A	93.7	Very high	91	Very high	9 Å²	9	45.1 Å²	45.1	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-42.9	-178.3	0	0	0	0	0	112.6	L238 L242 Q255 C256 L263	L238-A259 VanDerWaalsContact CD1-CA 3.43Å; L238-A259 HydrophobicContact CD1-CB 3.57Å; L238-A259 WeakPolarHBondContact CD1-O 3.3Å; L242-A259 HydrophobicContact CD2-CB 4.31Å; Q255-A259 VanDerWaalsContact O-CB 3.29Å; Q255-A259 WeakPolarHBondContact O-CB 3.32Å; Q255-A259 PolarHBondContact O-N 3.29Å; C256-A259 PolarHBondContact O-N 3.1Å; A259-L263 VanDerWaalsContact O-CB 3.3Å; A259-L263 WeakPolarHBondContact O-CB 3.17Å; A259-L263 PolarHBondContact O-N 3.39Å
260	L	93.7	Very high	91.3	Very high	111 Å²	111	41.8 Å²	41.8	58%	0.581	21%	0.213	S	C	*	.	H	α-helix	trans	-66.6	-38.3	175.6	-73.1	172.3	0	0	0	112.2	C256 S258 T264	C256-L260 WeakPolarHBondContact O-CB 3.37Å; C256-L260 VanDerWaalsContact O-CG 3.29Å; C256-L260 WeakPolarHBondContact O-CG 3.37Å; C256-L260 PolarHBondContact O-N 3.16Å; S258-L260 PolarHBondContact O-N 3.49Å; L260-T264 WeakPolarHBondContact O-CB 3.29Å; L260-T264 PolarHBondContact O-N 2.86Å; L260-T264 PolarHBondContact O-OG1 3.13Å
261	S	91.8	Very high	91.7	Very high	7 Å²	7	35 Å²	35	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-54.3	174.8	175.2	0	0	0	0	111.2	D97 L257 S258 L263 T264 S265	D97-S261 WeakPolarHBondContact CA-OG 3.35Å; D97-S261 PolarHBondContact N-OG 3.49Å; D97-S261 PolarHBondContact OD1-OG 3.37Å; L257-S261 VanDerWaalsContact O-CB 3.31Å; L257-S261 WeakPolarHBondContact O-CB 3.19Å; L257-S261 PolarHBondContact O-N 3.44Å; S258-S261 WeakPolarHBondContact O-CA 3.01Å; S258-S261 VanDerWaalsContact O-CB 3.32Å; S258-S261 WeakPolarHBondContact O-CB 3.49Å; S258-S261 PolarHBondContact O-N 3.29Å; S258-S261 VanDerWaalsContact O-N 3.09Å; S261-L263 VanDerWaalsContact C-N 3.32Å; S261-L263 PolarHBondContact O-N 2.91Å; S261-T264 WeakPolarHBondContact O-CB 3.29Å; S261-T264 PolarHBondContact O-N 3.43Å; S261-T264 VanDerWaalsContact O-N 3.08Å; S261-S265 WeakPolarHBondContact O-CB 3.47Å; S261-S265 PolarHBondContact O-N 2.98Å
262	S	94.1	Very high	91.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-38.4	-176.9	-50.6	0	0	0	0	112	D97 S258 T264 S265 L266	D97-S262 WeakPolarHBondContact OD1-CA 3.37Å; D97-S262 VanDerWaalsContact OD1-CB 3.31Å; D97-S262 WeakPolarHBondContact OD1-CB 3.4Å; D97-S262 PolarHBondContact OD1-N 3.49Å; D97-S262 VanDerWaalsContact OD1-N 3.14Å; D97-S262 PolarHBondContact OD1-OG 3.42Å; S258-S262 PolarHBondContact O-N 3.26Å; S258-S262 PolarHBondContact O-OG 2.85Å; S258-S262 VanDerWaalsContact O-OG 3.08Å; S262-T264 PolarHBondContact O-N 3.03Å; S262-S265 PolarHBondContact O-N 3.35Å; S262-L266 VanDerWaalsContact O-CB 3.26Å; S262-L266 WeakPolarHBondContact O-CB 3.36Å; S262-L266 PolarHBondContact O-N 3.31Å
263	L	94.8	Very high	91.8	Very high	19 Å²	19	28.2 Å²	28.2	10%	0.099	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-42	173.8	-177.2	64.5	0	0	0	112	L238 A259 S261 A267 L300 I303	L238-L263 HydrophobicContact CD2-CB 3.89Å; L238-L263 HydrophobicContact CD2-CD1 3.92Å; L238-L263 HydrophobicContact CD2-CG 4.45Å; A259-L263 VanDerWaalsContact O-CB 3.3Å; A259-L263 WeakPolarHBondContact O-CB 3.17Å; A259-L263 PolarHBondContact O-N 3.39Å; S261-L263 VanDerWaalsContact C-N 3.32Å; S261-L263 PolarHBondContact O-N 2.91Å; L263-A267 WeakPolarHBondContact O-CB 3.26Å; L263-A267 PolarHBondContact O-N 2.89Å; L263-L300 HydrophobicContact CD2-CD1 4.04Å; L263-L300 HydrophobicContact CD2-CG 4.35Å; L263-L300 HydrophobicContact CG-CD1 3.71Å; L263-L300 HydrophobicContact CG-CG 4.42Å; L263-I303 HydrophobicContact CD1-CB 4.29Å; L263-I303 HydrophobicContact CD1-CG2 4.01Å
264	T	93.5	Very high	91.6	Very high	52 Å²	52	21 Å²	21	32%	0.319	11%	0.114	S	C	.	.	H	α-helix	trans	-68.3	-44.1	178.4	-57.7	0	0	0	0	111.4	V93 L260 S261 S262 A267 W268	V93-T264 HydrophobicContact CG1-CG2 4.43Å; L260-T264 WeakPolarHBondContact O-CB 3.29Å; L260-T264 PolarHBondContact O-N 2.86Å; L260-T264 PolarHBondContact O-OG1 3.13Å; S261-T264 WeakPolarHBondContact O-CB 3.29Å; S261-T264 PolarHBondContact O-N 3.43Å; S261-T264 VanDerWaalsContact O-N 3.08Å; S262-T264 PolarHBondContact O-N 3.03Å; T264-A267 PolarHBondContact O-N 3.34Å; T264-W268 VanDerWaalsContact O-CB 3.31Å; T264-W268 WeakPolarHBondContact O-CB 3.42Å; T264-W268 PolarHBondContact O-N 3.46Å
265	S	93.1	Very high	91.5	Very high	4 Å²	4	18.9 Å²	18.9	3%	0.028	10%	0.102	C	C	.	.	H	α-helix	trans	-55.3	-53.5	174.9	-180	0	0	0	0	111	V93 D97 S261 S262 A267 W268 V269	V93-S265 VanDerWaalsContact CG1-CA 3.46Å; D97-S265 WeakPolarHBondContact OD2-CB 3.47Å; D97-S265 PolarHBondContact OD2-OG 3.16Å; S261-S265 WeakPolarHBondContact O-CB 3.47Å; S261-S265 PolarHBondContact O-N 2.98Å; S262-S265 PolarHBondContact O-N 3.35Å; S265-A267 PolarHBondContact O-N 3.11Å; S265-W268 WeakPolarHBondContact O-CB 3.48Å; S265-W268 PolarHBondContact O-N 3.03Å; S265-V269 VanDerWaalsContact O-CG2 3.29Å; S265-V269 WeakPolarHBondContact O-CG2 3.36Å; S265-V269 PolarHBondContact O-N 3.31Å
266	L	93.1	Very high	91.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60	-46.1	179.1	-169	161.7	0	0	0	112	A235 S262 W268 V269 L270 I303	A235-L266 HydrophobicContact CB-CD1 3.49Å; A235-L266 VanDerWaalsContact CB-CD1 3.49Å; S262-L266 VanDerWaalsContact O-CB 3.26Å; S262-L266 WeakPolarHBondContact O-CB 3.36Å; S262-L266 PolarHBondContact O-N 3.31Å; L266-W268 VanDerWaalsContact C-N 3.34Å; L266-W268 PolarHBondContact O-N 3.41Å; L266-V269 PolarHBondContact O-N 3.33Å; L266-L270 HydrophobicContact CD2-CD1 3.62Å; L266-L270 HydrophobicContact CD2-CG 4.41Å; L266-L270 PolarHBondContact O-N 3.22Å; L266-L270 VanDerWaalsContact O-N 3.12Å; L266-I303 HydrophobicContact CD2-CD1 3.28Å; L266-I303 HydrophobicContact CD2-CG1 4.41Å; L266-I303 HydrophobicContact CD2-CG2 4.08Å
267	A	93.9	Very high	90.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.5	-38.9	177.4	0	0	0	0	0	112.4	L263 T264 S265 A271 L296 R299 L300	L263-A267 WeakPolarHBondContact O-CB 3.26Å; L263-A267 PolarHBondContact O-N 2.89Å; T264-A267 PolarHBondContact O-N 3.34Å; S265-A267 PolarHBondContact O-N 3.11Å; A267-A271 WeakPolarHBondContact O-CB 3.3Å; A267-A271 PolarHBondContact O-N 3.36Å; A267-L296 HydrophobicContact CB-CG 4.43Å; A267-R299 HydrophobicContact CB-CB 4.34Å; A267-L300 HydrophobicContact CB-CB 4.09Å; A267-L300 HydrophobicContact CB-CD1 3.92Å
268	W	93.4	Very high	89.8	Confident	29 Å²	29	16.3 Å²	16.3	11%	0.11	9%	0.085	C	C	.	.	H	α-helix	trans	-64.7	-42.6	178	-165.8	-76.5	0	0	0	111.9	W86 L89 A90 T264 S265 L266 A271 S272 L296	W86-W268 AromaticContact CD2-CZ2 3.82Å; W86-W268 HydrophobicContact CD2-CZ2 3.82Å; W86-W268 AromaticContact CE2-CE2 3.98Å; W86-W268 AromaticContact CE2-CZ2 3.9Å; W86-W268 AromaticContact CE2-NE1 3.91Å; W86-W268 HydrophobicContact CE3-CH2 4.3Å; W86-W268 AromaticContact CE3-CZ2 3.96Å; W86-W268 HydrophobicContact CE3-CZ2 3.96Å; W86-W268 HydrophobicContact CG-CZ2 4.31Å; W86-W268 HydrophobicContact CH2-CH2 4.48Å; W86-W268 HydrophobicContact CH2-CZ2 4.27Å; W86-W268 HydrophobicContact CZ2-CZ2 4.14Å; W86-W268 HydrophobicContact CZ3-CH2 4.24Å; W86-W268 HydrophobicContact CZ3-CZ2 4.19Å; W86-W268 AromaticContact NE1-NE1 3.69Å; L89-W268 HydrophobicContact CB-CH2 3.7Å; L89-W268 HydrophobicContact CB-CZ2 3.61Å; L89-W268 HydrophobicContact CD1-CH2 3.91Å; L89-W268 HydrophobicContact CD1-CZ2 4.4Å; L89-W268 HydrophobicContact CG-CH2 4.44Å; A90-W268 VanDerWaalsContact CB-NE1 3.25Å; T264-W268 VanDerWaalsContact O-CB 3.31Å; T264-W268 WeakPolarHBondContact O-CB 3.42Å; T264-W268 PolarHBondContact O-N 3.46Å; S265-W268 WeakPolarHBondContact O-CB 3.48Å; S265-W268 PolarHBondContact O-N 3.03Å; L266-W268 VanDerWaalsContact C-N 3.34Å; L266-W268 PolarHBondContact O-N 3.41Å; W268-A271 PolarHBondContact O-N 2.99Å; W268-S272 VanDerWaalsContact CD1-OG 3.27Å; W268-S272 PolarHBondContact NE1-OG 3.25Å; W268-S272 VanDerWaalsContact O-CB 3.29Å; W268-S272 WeakPolarHBondContact O-CB 3.48Å; W268-S272 PolarHBondContact O-N 2.74Å; W268-S272 PolarHBondContact O-OG 2.79Å; W268-L296 HydrophobicContact CB-CD1 4.23Å; W268-L296 HydrophobicContact CD2-CD1 3.92Å; W268-L296 HydrophobicContact CE3-CD1 3.38Å; W268-L296 HydrophobicContact CG-CD1 4.33Å; W268-L296 HydrophobicContact CZ3-CD1 3.96Å
269	V	92.3	Very high	89	Confident	9 Å²	9	17.2 Å²	17.2	6%	0.055	9%	0.09	C	C	.	.	H	α-helix	trans	-63.6	-46.7	178.4	169.5	0	0	0	0	111.1	R226 L227 T230 S265 L266 A271 S272 Y273	R226-V269 HydrophobicContact CB-CG1 4.25Å; R226-V269 HydrophobicContact CG-CB 4.04Å; R226-V269 HydrophobicContact CG-CG1 3.58Å; R226-V269 HydrophobicContact CG-CG2 3.24Å; L227-V269 HydrophobicContact CB-CG1 4.48Å; L227-V269 HydrophobicContact CD1-CG1 4.29Å; T230-V269 HydrophobicContact CG2-CB 4.04Å; T230-V269 HydrophobicContact CG2-CG1 4.08Å; T230-V269 HydrophobicContact CG2-CG2 3.79Å; S265-V269 VanDerWaalsContact O-CG2 3.29Å; S265-V269 WeakPolarHBondContact O-CG2 3.36Å; S265-V269 PolarHBondContact O-N 3.31Å; L266-V269 PolarHBondContact O-N 3.33Å; V269-A271 VanDerWaalsContact C-N 3.34Å; V269-A271 PolarHBondContact O-N 3.31Å; V269-S272 PolarHBondContact O-N 3.22Å; V269-Y273 VanDerWaalsContact O-CB 3.29Å; V269-Y273 WeakPolarHBondContact O-CB 3.25Å; V269-Y273 PolarHBondContact O-N 3.03Å
270	L	90.6	Very high	87.9	Confident	7 Å²	7	17 Å²	17	4%	0.037	9%	0.088	C	C	.	.	H	α-helix	trans	-62.1	-40.5	175.7	-76.5	171.3	0	0	0	112.8	L227 F231 L266 H274 R299 I303	L227-L270 HydrophobicContact CD1-CD2 3.75Å; F231-L270 HydrophobicContact CE2-CD2 3.93Å; F231-L270 HydrophobicContact CE2-CG 4.45Å; F231-L270 HydrophobicContact CZ-CD1 4.14Å; F231-L270 HydrophobicContact CZ-CD2 3.94Å; F231-L270 HydrophobicContact CZ-CG 4.29Å; L266-L270 HydrophobicContact CD2-CD1 3.62Å; L266-L270 HydrophobicContact CD2-CG 4.41Å; L266-L270 PolarHBondContact O-N 3.22Å; L266-L270 VanDerWaalsContact O-N 3.12Å; L270-H274 WeakPolarHBondContact O-CB 3.44Å; L270-H274 PolarHBondContact O-N 3.31Å; L270-R299 HydrophobicContact CB-CG 4.25Å; L270-R299 HydrophobicContact CD1-CB 4.43Å; L270-R299 HydrophobicContact CD1-CG 4.46Å; L270-I303 HydrophobicContact CD1-CD1 3.32Å
271	A	90.5	Very high	86.7	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-67.8	-41.8	177	0	0	0	0	0	112	W86 A267 W268 V269 H274 K275 L296	W86-A271 HydrophobicContact CZ2-CB 4.48Å; A267-A271 WeakPolarHBondContact O-CB 3.3Å; A267-A271 PolarHBondContact O-N 3.36Å; W268-A271 PolarHBondContact O-N 2.99Å; V269-A271 VanDerWaalsContact C-N 3.34Å; V269-A271 PolarHBondContact O-N 3.31Å; A271-H274 PolarHBondContact O-N 3.25Å; A271-K275 WeakPolarHBondContact O-CB 3.22Å; A271-K275 PolarHBondContact O-N 2.91Å; A271-L296 HydrophobicContact CB-CB 3.93Å; A271-L296 HydrophobicContact CB-CD1 4.47Å
272	S	88.6	Confident	85.2	Confident	3 Å²	3	18 Å²	18	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-63.9	-45.2	177.4	-61.2	0	0	0	0	111.3	W86 N223 W268 V269 H274 K275 L276	W86-S272 PolarHBondContact NE1-OG 2.72Å; N223-S272 VanDerWaalsContact OD1-CB 3.3Å; N223-S272 WeakPolarHBondContact OD1-CB 3.37Å; W268-S272 VanDerWaalsContact CD1-OG 3.27Å; W268-S272 PolarHBondContact NE1-OG 3.25Å; W268-S272 VanDerWaalsContact O-CB 3.29Å; W268-S272 WeakPolarHBondContact O-CB 3.48Å; W268-S272 PolarHBondContact O-N 2.74Å; W268-S272 PolarHBondContact O-OG 2.79Å; V269-S272 PolarHBondContact O-N 3.22Å; S272-H274 PolarHBondContact O-N 2.86Å; S272-K275 PolarHBondContact O-N 3.43Å; S272-L276 VanDerWaalsContact O-CB 3.23Å; S272-L276 WeakPolarHBondContact O-CB 3.11Å; S272-L276 PolarHBondContact O-N 3.29Å
273	Y	86.8	Confident	83.3	Confident	8 Å²	8	21 Å²	21	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-60.5	-44.5	174.1	-179.7	-95.2	0	0	0	111.7	N223 L227 V269 L276 L277 F366 W534	N223-Y273 HydrophobicContact CB-CD2 4.24Å; N223-Y273 PolarHBondContact OD1-N 2.94Å; L227-Y273 HydrophobicContact CD2-CD2 4.31Å; L227-Y273 HydrophobicContact CD2-CE1 4.49Å; L227-Y273 HydrophobicContact CD2-CE2 4.24Å; L227-Y273 HydrophobicContact CD2-CG 4.48Å; V269-Y273 VanDerWaalsContact O-CB 3.29Å; V269-Y273 WeakPolarHBondContact O-CB 3.25Å; V269-Y273 PolarHBondContact O-N 3.03Å; Y273-L276 PolarHBondContact O-N 3.2Å; Y273-L277 HydrophobicContact CD1-CD1 3.82Å; Y273-L277 HydrophobicContact CD1-CG 4.18Å; Y273-L277 HydrophobicContact CE1-CD1 3.13Å; Y273-L277 HydrophobicContact CE1-CD2 4.43Å; Y273-L277 HydrophobicContact CE1-CG 3.68Å; Y273-L277 HydrophobicContact CE2-CG 4.4Å; Y273-L277 WeakPolarHBondContact O-CB 3.47Å; Y273-L277 PolarHBondContact O-N 3.21Å; Y273-F366 AromaticContact CD1-CE2 3.66Å; Y273-F366 HydrophobicContact CD1-CE2 3.66Å; Y273-F366 HydrophobicContact CD1-CZ 4.15Å; Y273-F366 HydrophobicContact CE1-CD2 4.48Å; Y273-F366 HydrophobicContact CE1-CE1 4.49Å; Y273-F366 AromaticContact CE1-CE2 3.22Å; Y273-F366 HydrophobicContact CE1-CE2 3.22Å; Y273-F366 AromaticContact CE1-CZ 3.24Å; Y273-F366 HydrophobicContact CE1-CZ 3.24Å; Y273-F366 AromaticContact CZ-CZ 3.67Å; Y273-W534 HydrophobicContact CD2-CZ2 4.5Å; Y273-W534 AromaticContact CE2-CZ2 3.99Å; Y273-W534 HydrophobicContact CE2-CZ2 3.99Å; Y273-W534 AromaticContact CE2-NE1 3.56Å; Y273-W534 AromaticContact CZ-NE1 3.67Å; Y273-W534 PolarHBondContact OH-NE1 2.88Å; Y273-W534 VanDerWaalsContact OH-NE1 3.1Å
274	H	85.1	Confident	81.7	Confident	42 Å²	42	23 Å²	23	19%	0.194	12%	0.115	C	C	.	.	H	α-helix	trans	-66	-42.9	178.5	-170.9	71.3	0	0	0	112.9	L270 A271 S272 L276 R278 H295	L270-H274 WeakPolarHBondContact O-CB 3.44Å; L270-H274 PolarHBondContact O-N 3.31Å; A271-H274 PolarHBondContact O-N 3.25Å; S272-H274 PolarHBondContact O-N 2.86Å; H274-L276 VanDerWaalsContact C-N 3.29Å; H274-L276 PolarHBondContact O-N 3.08Å; H274-R278 PolarHBondContact O-N 3.42Å; H274-R278 VanDerWaalsContact O-N 3.17Å; H274-H295 AromaticContact CD2-CD2 3.74Å; H274-H295 AromaticContact CD2-NE2 3.67Å; H274-H295 AromaticContact CG-CE1 3.81Å; H274-H295 AromaticContact CG-NE2 3.66Å
275	K	86.1	Confident	80.2	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.017	13%	0.13	C	C	.	.	H	α-helix	trans	-58.4	-45.1	173.9	177.5	-177.9	165.6	69.9	0	110.4	A271 S272 R278 D279 M287 A292	A271-K275 WeakPolarHBondContact O-CB 3.22Å; A271-K275 PolarHBondContact O-N 2.91Å; S272-K275 PolarHBondContact O-N 3.43Å; K275-R278 PolarHBondContact O-N 3.38Å; K275-D279 IonicContact NZ-OD2 2.98Å; K275-D279 PolarHBondContact NZ-OD2 3.5Å; K275-D279 WeakPolarHBondContact O-CB 3.38Å; K275-D279 PolarHBondContact O-N 3.38Å; K275-M287 HydrophobicContact CB-SD 4.17Å; K275-M287 HydrophobicContact CG-CB 4.4Å; K275-M287 PolarHBondContact NZ-O 2.93Å; K275-A292 HydrophobicContact CD-CB 4.37Å
276	L	82.9	Confident	78.9	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-44.7	-179.3	177.1	53.4	0	0	0	113.3	M216 Y219 A220 N223 S272 Y273 H274 R278 D279 S280 W534	M216-L276 HydrophobicContact CG-CD1 4.24Å; M216-L276 HydrophobicContact SD-CD1 3.32Å; M216-L276 WeakPolarHBondContact SD-CD1 3.08Å; Y219-L276 HydrophobicContact CD1-CB 4.37Å; Y219-L276 HydrophobicContact CD1-CD1 3.41Å; Y219-L276 VanDerWaalsContact CD1-CD1 3.41Å; Y219-L276 HydrophobicContact CD1-CD2 3.54Å; Y219-L276 HydrophobicContact CD1-CG 3.95Å; Y219-L276 HydrophobicContact CE1-CB 4.02Å; Y219-L276 HydrophobicContact CE1-CD1 3.86Å; Y219-L276 HydrophobicContact CE1-CD2 3.85Å; Y219-L276 HydrophobicContact CE1-CG 4.12Å; Y219-L276 HydrophobicContact CG-CD1 4.42Å; Y219-L276 HydrophobicContact CG-CD2 4.02Å; Y219-L276 WeakPolarHBondContact O-CD2 3.49Å; A220-L276 HydrophobicContact CB-CD2 4.44Å; N223-L276 HydrophobicContact CB-CD2 3.83Å; N223-L276 WeakPolarHBondContact ND2-CD2 3.38Å; S272-L276 VanDerWaalsContact O-CB 3.23Å; S272-L276 WeakPolarHBondContact O-CB 3.11Å; S272-L276 PolarHBondContact O-N 3.29Å; Y273-L276 PolarHBondContact O-N 3.2Å; H274-L276 VanDerWaalsContact C-N 3.29Å; H274-L276 PolarHBondContact O-N 3.08Å; L276-R278 PolarHBondContact O-N 3.17Å; L276-D279 PolarHBondContact O-N 3.35Å; L276-S280 VanDerWaalsContact O-CB 3.28Å; L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.25Å; L276-S280 PolarHBondContact O-OG 2.9Å; L276-W534 HydrophobicContact CD1-CH2 4.16Å; L276-W534 HydrophobicContact CD2-CH2 3.54Å; L276-W534 HydrophobicContact CD2-CZ2 4.13Å; L276-W534 HydrophobicContact CG-CH2 3.45Å; L276-W534 VanDerWaalsContact CG-CH2 3.45Å; L276-W534 HydrophobicContact CG-CZ2 4.23Å; L276-W534 HydrophobicContact CG-CZ3 4.18Å
277	L	77.8	Confident	77.8	Confident	20 Å²	20	29.8 Å²	29.8	11%	0.105	15%	0.146	C	C	.	.	H	α-helix	trans	-55.7	-34.2	172.8	-84.5	-175.8	0	0	0	112.4	Y273 S280 W534	Y273-L277 HydrophobicContact CD1-CD1 3.82Å; Y273-L277 HydrophobicContact CD1-CG 4.18Å; Y273-L277 HydrophobicContact CE1-CD1 3.13Å; Y273-L277 HydrophobicContact CE1-CD2 4.43Å; Y273-L277 HydrophobicContact CE1-CG 3.68Å; Y273-L277 HydrophobicContact CE2-CG 4.4Å; Y273-L277 WeakPolarHBondContact O-CB 3.47Å; Y273-L277 PolarHBondContact O-N 3.21Å; L277-S280 WeakPolarHBondContact CA-OG 3.44Å; L277-S280 PolarHBondContact O-OG 2.96Å; L277-W534 HydrophobicContact CD2-CD2 3.59Å; L277-W534 HydrophobicContact CD2-CE3 4.22Å; L277-W534 HydrophobicContact CD2-CG 3.72Å; L277-W534 HydrophobicContact CD2-CZ2 4.13Å
278	R	77.9	Confident	77.2	Confident	16 Å²	16	33.1 Å²	33.1	6%	0.06	17%	0.169	C	C	.	.	H	α-helix	trans	-80.9	-40.6	178.8	-173	164	179.6	102.7	15.8	112.7	H274 K275 L276 S280 R281 K285 H434	H274-R278 PolarHBondContact O-N 3.42Å; H274-R278 VanDerWaalsContact O-N 3.17Å; K275-R278 PolarHBondContact O-N 3.38Å; L276-R278 PolarHBondContact O-N 3.17Å; R278-S280 VanDerWaalsContact C-N 3.31Å; R278-R281 PolarHBondContact O-N 3.13Å; R278-K285 PolarHBondContact NE-O 3.35Å; R278-K285 PolarHBondContact NH2-O 2.96Å; R278-H434 PolarHBondContact NH1-NE2 2.96Å
279	D	75.1	Confident	76.7	Confident	19 Å²	19	33.5 Å²	33.5	10%	0.102	17%	0.171	C	C	.	.	H	α-helix	trans	-75.8	-20.6	-178.8	-77.4	2.7	0	0	0	112.6	R79 K275 L276 R281 S286 M287	R79-D279 IonicContact NH2-OD1 3.44Å; R79-D279 IonicContact NH2-OD2 2.61Å; R79-D279 PolarHBondContact NH2-OD2 2.97Å; K275-D279 IonicContact NZ-OD2 2.98Å; K275-D279 PolarHBondContact NZ-OD2 3.5Å; K275-D279 WeakPolarHBondContact O-CB 3.38Å; K275-D279 PolarHBondContact O-N 3.38Å; L276-D279 PolarHBondContact O-N 3.35Å; D279-R281 VanDerWaalsContact C-N 3.28Å; D279-S286 WeakPolarHBondContact OD1-CA 3.25Å; D279-S286 WeakPolarHBondContact OD1-CB 3.22Å; D279-M287 PolarHBondContact OD1-N 3.36Å
280	S	71.5	Confident	76.5	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.1	172	51.4	0	0	0	0	113.7	L276 L277 R278 F538	L276-S280 VanDerWaalsContact O-CB 3.28Å; L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.25Å; L276-S280 PolarHBondContact O-OG 2.9Å; L277-S280 WeakPolarHBondContact CA-OG 3.44Å; L277-S280 PolarHBondContact O-OG 2.96Å; R278-S280 VanDerWaalsContact C-N 3.31Å; S280-F538 VanDerWaalsContact CB-CZ 3.43Å
281	R	67.9	Low	76.2	Confident	33 Å²	33	41.5 Å²	41.5	13%	0.125	20%	0.2	C	C	.	.			trans	-99.7	112.5	-173.8	-139.7	-169.2	167	-154.5	-24.3	111.5	R278 D279 D283 K284 E370	R278-R281 PolarHBondContact O-N 3.13Å; D279-R281 VanDerWaalsContact C-N 3.28Å; R281-D283 VanDerWaalsContact C-N 3.25Å; R281-D283 WeakPolarHBondContact CD-OD1 3.14Å; R281-D283 WeakPolarHBondContact CG-OD1 3.23Å; R281-D283 VanDerWaalsContact CZ-CG 3.49Å; R281-D283 IonicContact CZ-OD1 3.45Å; R281-D283 IonicContact CZ-OD2 2.73Å; R281-D283 IonicContact NE-OD1 3.86Å; R281-D283 PolarHBondContact NE-OD1 3.2Å; R281-D283 IonicContact NE-OD2 2.9Å; R281-D283 PolarHBondContact NE-OD2 3Å; R281-D283 IonicContact NH1-OD1 3.72Å; R281-D283 IonicContact NH1-OD2 3Å; R281-D283 PolarHBondContact NH1-OD2 3.39Å; R281-D283 IonicContact NH2-OD1 2.97Å; R281-D283 IonicContact NH2-OD2 3.26Å; R281-D283 PolarHBondContact NH2-OD2 3.06Å; R281-D283 PolarHBondContact O-N 2.76Å; R281-K284 HydrophobicContact CB-CB 4.48Å; R281-K284 PolarHBondContact O-N 3.17Å; R281-E370 IonicContact CZ-OE1 3.22Å; R281-E370 IonicContact CZ-OE2 2.73Å; R281-E370 VanDerWaalsContact CZ-OE2 3.22Å; R281-E370 IonicContact NH1-OE1 3.41Å; R281-E370 PolarHBondContact NH1-OE1 2.81Å; R281-E370 IonicContact NH1-OE2 3.93Å; R281-E370 PolarHBondContact NH1-OE2 3.33Å; R281-E370 IonicContact NH2-OE2 3.12Å; R281-E370 PolarHBondContact NH2-OE2 2.93Å
282	D	60.4	Low	76.1	Confident	106 Å²	106	41.5 Å²	41.5	57%	0.567	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.3	-175.1	-70.7	-32.9	0	0	0	114.2
283	D	54.7	Low	76.2	Confident	64 Å²	64	45.2 Å²	45.2	34%	0.342	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.2	-179.9	69.7	-32.6	0	0	0	113.8	R281 R528	R281-D283 VanDerWaalsContact C-N 3.25Å; R281-D283 WeakPolarHBondContact CD-OD1 3.14Å; R281-D283 WeakPolarHBondContact CG-OD1 3.23Å; R281-D283 VanDerWaalsContact CZ-CG 3.49Å; R281-D283 IonicContact CZ-OD1 3.45Å; R281-D283 IonicContact CZ-OD2 2.73Å; R281-D283 IonicContact NE-OD1 3.86Å; R281-D283 PolarHBondContact NE-OD1 3.2Å; R281-D283 IonicContact NE-OD2 2.9Å; R281-D283 PolarHBondContact NE-OD2 3Å; R281-D283 IonicContact NH1-OD1 3.72Å; R281-D283 IonicContact NH1-OD2 3Å; R281-D283 PolarHBondContact NH1-OD2 3.39Å; R281-D283 IonicContact NH2-OD1 2.97Å; R281-D283 IonicContact NH2-OD2 3.26Å; R281-D283 PolarHBondContact NH2-OD2 3.06Å; R281-D283 PolarHBondContact O-N 2.76Å; D283-R528 IonicContact OD2-CZ 3.23Å; D283-R528 IonicContact OD2-NH1 3.83Å
284	K	60.2	Low	76.4	Confident	62 Å²	62	46 Å²	46	27%	0.27	22%	0.224	S	C	.	.	S	Bend	trans	-108.5	138.9	179.2	-75	-178.5	174	172.3	0	110.5	R281 S286 E370	R281-K284 HydrophobicContact CB-CB 4.48Å; R281-K284 PolarHBondContact O-N 3.17Å; K284-S286 PolarHBondContact O-N 2.91Å; K284-E370 IonicContact NZ-OE1 2.66Å; K284-E370 PolarHBondContact NZ-OE1 2.91Å
285	K	61.5	Low	76.7	Confident	144 Å²	144	44 Å²	44	63%	0.626	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-60.7	129.8	169.3	-173.7	175	178.5	-177.5	0	109.9	R278 P435	R278-K285 PolarHBondContact NE-O 3.35Å; R278-K285 PolarHBondContact NH2-O 2.96Å; K285-P435 HydrophobicContact CB-CB 4.07Å; K285-P435 HydrophobicContact CD-CB 4.3Å; K285-P435 HydrophobicContact CG-CB 4.41Å
286	S	66.1	Low	77	Confident	48 Å²	48	44.5 Å²	44.5	34%	0.336	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-52.8	148	176.2	55.4	0	0	0	0	112.4	R79 D279 K284	R79-S286 VanDerWaalsContact NH2-CB 3.33Å; D279-S286 WeakPolarHBondContact OD1-CA 3.25Å; D279-S286 WeakPolarHBondContact OD1-CB 3.22Å; K284-S286 PolarHBondContact O-N 2.91Å
287	M	70.4	Confident	77.5	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.03	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-79.5	127.3	-175.9	-163	173.9	173.6	0	0	110.6	K275 D279 G291 A292 H295 Y429	K275-M287 HydrophobicContact CB-SD 4.17Å; K275-M287 HydrophobicContact CG-CB 4.4Å; K275-M287 PolarHBondContact NZ-O 2.93Å; D279-M287 PolarHBondContact OD1-N 3.36Å; M287-G291 VanDerWaalsContact CE-C 3.41Å; M287-G291 VanDerWaalsContact CE-O 3.31Å; M287-G291 WeakPolarHBondContact CE-O 3.05Å; M287-A292 HydrophobicContact CE-CB 4.25Å; M287-H295 HydrophobicContact CE-CB 3.77Å; M287-Y429 HydrophobicContact CE-CE2 3.5Å
288	S	81.2	Confident	78.3	Confident	69 Å²	69	48.2 Å²	48.2	48%	0.483	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-66	143.8	170.3	179.5	0	0	0	0	110.6	R290 G291 A292	S288-R290 PolarHBondContact O-N 3.27Å; S288-R290 PolarHBondContact OG-N 3.33Å; S288-G291 WeakPolarHBondContact O-CA 3.31Å; S288-G291 PolarHBondContact O-N 3.03Å; S288-A292 PolarHBondContact O-N 3.02Å
289	Y	83.5	Confident	79.1	Confident	38 Å²	38	48.1 Å²	48.1	15%	0.149	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-30.6	175.1	-64.9	-85.3	0	0	0	112.9	R79 L82 D83 W86 G291 A292 L293	R79-Y289 PolarHBondContact O-OH 3.31Å; L82-Y289 HydrophobicContact CB-CD2 4.11Å; L82-Y289 HydrophobicContact CB-CE1 4.05Å; L82-Y289 HydrophobicContact CB-CE2 3.42Å; L82-Y289 VanDerWaalsContact CB-CE2 3.42Å; L82-Y289 WeakPolarHBondContact CB-OH 3.46Å; L82-Y289 HydrophobicContact CD1-CD2 3.85Å; L82-Y289 HydrophobicContact CD1-CE2 3.69Å; L82-Y289 HydrophobicContact CG-CE2 4.18Å; D83-Y289 WeakPolarHBondContact CA-OH 3.38Å; D83-Y289 PolarHBondContact N-OH 3.36Å; D83-Y289 PolarHBondContact OD1-OH 2.97Å; W86-Y289 HydrophobicContact CB-CE1 4.29Å; W86-Y289 AromaticContact CE3-CD1 3.93Å; W86-Y289 HydrophobicContact CE3-CD1 3.93Å; W86-Y289 HydrophobicContact CE3-CE1 4.4Å; W86-Y289 HydrophobicContact CZ3-CD1 4.47Å; Y289-G291 VanDerWaalsContact C-N 3.3Å; Y289-G291 PolarHBondContact O-N 3.44Å; Y289-A292 WeakPolarHBondContact O-CB 3.43Å; Y289-A292 PolarHBondContact O-N 3.4Å; Y289-A292 VanDerWaalsContact O-N 3.11Å; Y289-L293 WeakPolarHBondContact O-CG 3.4Å; Y289-L293 PolarHBondContact O-N 2.94Å
290	R	86.7	Confident	80	Confident	183 Å²	183	48.6 Å²	48.6	69%	0.691	24%	0.235	S	C	*	.	H	α-helix	trans	-61	-42.1	172	-65.6	-178.7	66.8	-172.2	0.8	111.5	S288 A292 L293 V294	S288-R290 PolarHBondContact O-N 3.27Å; S288-R290 PolarHBondContact OG-N 3.33Å; R290-A292 VanDerWaalsContact C-N 3.34Å; R290-L293 PolarHBondContact O-N 3.11Å; R290-V294 PolarHBondContact O-N 3.09Å; R290-V294 VanDerWaalsContact O-N 3.14Å
291	G	86.1	Confident	81.2	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-38.1	172.9	0	0	0	0	0	112	M287 S288 Y289 V294 H295	M287-G291 VanDerWaalsContact CE-C 3.41Å; M287-G291 VanDerWaalsContact CE-O 3.31Å; M287-G291 WeakPolarHBondContact CE-O 3.05Å; S288-G291 WeakPolarHBondContact O-CA 3.31Å; S288-G291 PolarHBondContact O-N 3.03Å; Y289-G291 VanDerWaalsContact C-N 3.3Å; Y289-G291 PolarHBondContact O-N 3.44Å; G291-V294 PolarHBondContact O-N 2.98Å; G291-H295 WeakPolarHBondContact O-CB 3.37Å; G291-H295 PolarHBondContact O-N 2.61Å
292	A	87.7	Confident	82.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-41.2	177.2	0	0	0	0	0	112.1	W86 K275 M287 S288 Y289 R290 H295 L296	W86-A292 HydrophobicContact CH2-CB 3.83Å; W86-A292 HydrophobicContact CZ2-CB 4.38Å; W86-A292 HydrophobicContact CZ3-CB 4.22Å; K275-A292 HydrophobicContact CD-CB 4.37Å; M287-A292 HydrophobicContact CE-CB 4.25Å; S288-A292 PolarHBondContact O-N 3.02Å; Y289-A292 WeakPolarHBondContact O-CB 3.43Å; Y289-A292 PolarHBondContact O-N 3.4Å; Y289-A292 VanDerWaalsContact O-N 3.11Å; R290-A292 VanDerWaalsContact C-N 3.34Å; A292-H295 PolarHBondContact O-N 2.82Å; A292-L296 WeakPolarHBondContact O-CB 3.48Å; A292-L296 PolarHBondContact O-N 2.75Å
293	L	90.3	Very high	84.2	Confident	80 Å²	80	45.1 Å²	45.1	42%	0.419	22%	0.217	S	C	.	.	H	α-helix	trans	-64.9	-44.8	175.1	-69.6	174.9	0	0	0	112.4	W86 Y289 R290 H295 L296 F297	W86-L293 HydrophobicContact CZ3-CD2 4.12Å; Y289-L293 WeakPolarHBondContact O-CG 3.4Å; Y289-L293 PolarHBondContact O-N 2.94Å; R290-L293 PolarHBondContact O-N 3.11Å; L293-H295 VanDerWaalsContact C-N 3.3Å; L293-H295 PolarHBondContact O-N 3.4Å; L293-L296 WeakPolarHBondContact O-CB 3.4Å; L293-L296 PolarHBondContact O-N 3.08Å; L293-L296 VanDerWaalsContact O-N 3.13Å; L293-F297 WeakPolarHBondContact O-CD2 3.42Å; L293-F297 PolarHBondContact O-N 3.19Å
294	V	91.3	Very high	86.1	Confident	25 Å²	25	43.5 Å²	43.5	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-36.9	176	176	0	0	0	0	111.4	R290 G291 L296 F297 W298 L428 L433	R290-V294 PolarHBondContact O-N 3.09Å; R290-V294 VanDerWaalsContact O-N 3.14Å; G291-V294 PolarHBondContact O-N 2.98Å; V294-L296 VanDerWaalsContact C-N 3.32Å; V294-F297 PolarHBondContact O-N 3.37Å; V294-W298 WeakPolarHBondContact O-CB 3.3Å; V294-W298 PolarHBondContact O-N 3.04Å; V294-L428 HydrophobicContact CG1-CD2 4.19Å; V294-L428 HydrophobicContact CG1-CG 4.43Å; V294-L433 HydrophobicContact CB-CD1 3.8Å; V294-L433 HydrophobicContact CG1-CD1 4.2Å; V294-L433 HydrophobicContact CG2-CD1 3.4Å
295	H	90.6	Very high	87.9	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-37.4	172.6	-172.2	-82.3	0	0	0	111.6	H274 M287 G291 A292 L293 W298 R299 Y429	H274-H295 AromaticContact CD2-CD2 3.74Å; H274-H295 AromaticContact CD2-NE2 3.67Å; H274-H295 AromaticContact CG-CE1 3.81Å; H274-H295 AromaticContact CG-NE2 3.66Å; M287-H295 HydrophobicContact CE-CB 3.77Å; G291-H295 WeakPolarHBondContact O-CB 3.37Å; G291-H295 PolarHBondContact O-N 2.61Å; A292-H295 PolarHBondContact O-N 2.82Å; L293-H295 VanDerWaalsContact C-N 3.3Å; L293-H295 PolarHBondContact O-N 3.4Å; H295-W298 AromaticContact CD2-CE3 3.5Å; H295-W298 VanDerWaalsContact CD2-CE3 3.5Å; H295-W298 AromaticContact CD2-CZ3 3.6Å; H295-W298 AromaticContact NE2-CE3 3.93Å; H295-W298 AromaticContact NE2-CZ3 3.82Å; H295-W298 WeakPolarHBondContact O-CB 3.29Å; H295-W298 PolarHBondContact O-N 3.47Å; H295-R299 PolarHBondContact CE1-NE 3.36Å; H295-R299 VanDerWaalsContact CE1-NE 3.31Å; H295-R299 PolarHBondContact NE2-NE 2.99Å; H295-R299 WeakPolarHBondContact O-CG 3.47Å; H295-R299 PolarHBondContact O-N 2.8Å; H295-Y429 HydrophobicContact CB-CD2 4.4Å; H295-Y429 HydrophobicContact CB-CE2 4.39Å
296	L	93.3	Very high	89.5	Confident	13 Å²	13	33.8 Å²	33.8	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-49.7	173.5	-177.6	148.3	0	0	0	111.3	A267 W268 A271 A292 L293 V294 W298 R299 L300	A267-L296 HydrophobicContact CB-CG 4.43Å; W268-L296 HydrophobicContact CB-CD1 4.23Å; W268-L296 HydrophobicContact CD2-CD1 3.92Å; W268-L296 HydrophobicContact CE3-CD1 3.38Å; W268-L296 HydrophobicContact CG-CD1 4.33Å; W268-L296 HydrophobicContact CZ3-CD1 3.96Å; A271-L296 HydrophobicContact CB-CB 3.93Å; A271-L296 HydrophobicContact CB-CD1 4.47Å; A292-L296 WeakPolarHBondContact O-CB 3.48Å; A292-L296 PolarHBondContact O-N 2.75Å; L293-L296 WeakPolarHBondContact O-CB 3.4Å; L293-L296 PolarHBondContact O-N 3.08Å; L293-L296 VanDerWaalsContact O-N 3.13Å; V294-L296 VanDerWaalsContact C-N 3.32Å; L296-W298 VanDerWaalsContact C-N 3.34Å; L296-W298 PolarHBondContact O-N 3.13Å; L296-R299 PolarHBondContact O-N 2.78Å; L296-R299 VanDerWaalsContact O-N 3.15Å; L296-L300 WeakPolarHBondContact O-CB 3.35Å; L296-L300 PolarHBondContact O-N 3.45Å
297	F	94.2	Very high	91	Very high	99 Å²	99	31.5 Å²	31.5	43%	0.434	15%	0.152	S	C	.	.	H	α-helix	trans	-62.3	-40	176.1	-75.7	-66.3	0	0	0	112.8	L293 V294 R299 L300 F301	L293-F297 WeakPolarHBondContact O-CD2 3.42Å; L293-F297 PolarHBondContact O-N 3.19Å; V294-F297 PolarHBondContact O-N 3.37Å; F297-R299 VanDerWaalsContact C-N 3.3Å; F297-R299 PolarHBondContact O-N 3.06Å; F297-L300 HydrophobicContact CD1-CD2 4.24Å; F297-L300 PolarHBondContact O-N 3.48Å; F297-F301 HydrophobicContact CB-CD2 4.38Å; F297-F301 HydrophobicContact CB-CE2 4.22Å; F297-F301 HydrophobicContact CD1-CE2 4.12Å; F297-F301 HydrophobicContact CD1-CZ 4.5Å; F297-F301 WeakPolarHBondContact O-CD2 3.34Å; F297-F301 PolarHBondContact O-N 3.28Å
298	W	94.2	Very high	92.2	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-55.7	-46	173	170.2	24	0	0	0	111.3	V294 H295 L296 T302 M377 Y381 C425 M426 Y429 Y430	V294-W298 WeakPolarHBondContact O-CB 3.3Å; V294-W298 PolarHBondContact O-N 3.04Å; H295-W298 AromaticContact CD2-CE3 3.5Å; H295-W298 VanDerWaalsContact CD2-CE3 3.5Å; H295-W298 AromaticContact CD2-CZ3 3.6Å; H295-W298 AromaticContact NE2-CE3 3.93Å; H295-W298 AromaticContact NE2-CZ3 3.82Å; H295-W298 WeakPolarHBondContact O-CB 3.29Å; H295-W298 PolarHBondContact O-N 3.47Å; L296-W298 VanDerWaalsContact C-N 3.34Å; L296-W298 PolarHBondContact O-N 3.13Å; W298-T302 WeakPolarHBondContact O-CG2 3.44Å; W298-T302 PolarHBondContact O-N 2.79Å; W298-T302 VanDerWaalsContact O-N 3.16Å; W298-T302 PolarHBondContact O-OG1 3.41Å; W298-M377 HydrophobicContact CH2-CE 4.13Å; W298-Y381 HydrophobicContact CZ2-CE2 4.21Å; W298-Y381 WeakPolarHBondContact CZ2-OH 3.47Å; W298-Y381 AromaticContact NE1-CZ 3.83Å; W298-Y381 PolarHBondContact NE1-OH 3.44Å; W298-C425 HydrophobicContact CB-CB 3.79Å; W298-M426 HydrophobicContact CD2-CB 3.78Å; W298-M426 HydrophobicContact CD2-CG 4.03Å; W298-M426 HydrophobicContact CE3-CB 4.38Å; W298-M426 HydrophobicContact CE3-CG 4.32Å; W298-M426 HydrophobicContact CG-CB 4.01Å; W298-M426 HydrophobicContact CH2-CG 3.76Å; W298-M426 HydrophobicContact CH2-SD 4.22Å; W298-M426 HydrophobicContact CZ2-CB 3.96Å; W298-M426 HydrophobicContact CZ2-CG 3.36Å; W298-M426 HydrophobicContact CZ2-SD 3.51Å; W298-M426 VanDerWaalsContact CZ2-SD 3.51Å; W298-M426 HydrophobicContact CZ3-CG 4.21Å; W298-Y429 HydrophobicContact CE3-CD1 4.44Å; W298-Y429 HydrophobicContact CZ3-CD1 4.14Å; W298-Y430 AromaticContact CH2-CE2 3.55Å; W298-Y430 HydrophobicContact CH2-CE2 3.55Å; W298-Y430 HydrophobicContact CZ2-CE2 4.49Å; W298-Y430 AromaticContact CZ3-CE2 3.7Å; W298-Y430 HydrophobicContact CZ3-CE2 3.7Å
299	R	94	Very high	92.9	Very high	14 Å²	14	29.6 Å²	29.6	5%	0.053	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-42.7	178.1	-62	-45.3	179.4	154.8	8.9	112.6	A267 L270 H295 L296 F297 F301 T302 I303 W365	A267-R299 HydrophobicContact CB-CB 4.34Å; L270-R299 HydrophobicContact CB-CG 4.25Å; L270-R299 HydrophobicContact CD1-CB 4.43Å; L270-R299 HydrophobicContact CD1-CG 4.46Å; H295-R299 PolarHBondContact CE1-NE 3.36Å; H295-R299 VanDerWaalsContact CE1-NE 3.31Å; H295-R299 PolarHBondContact NE2-NE 2.99Å; H295-R299 WeakPolarHBondContact O-CG 3.47Å; H295-R299 PolarHBondContact O-N 2.8Å; L296-R299 PolarHBondContact O-N 2.78Å; L296-R299 VanDerWaalsContact O-N 3.15Å; F297-R299 VanDerWaalsContact C-N 3.3Å; F297-R299 PolarHBondContact O-N 3.06Å; R299-F301 VanDerWaalsContact C-N 3.33Å; R299-F301 PolarHBondContact O-N 3.4Å; R299-T302 PolarHBondContact O-N 3.09Å; R299-T302 PolarHBondContact O-OG1 2.97Å; R299-I303 HydrophobicContact CB-CD1 4.17Å; R299-I303 VanDerWaalsContact O-CB 3.27Å; R299-I303 WeakPolarHBondContact O-CB 3.46Å; R299-I303 WeakPolarHBondContact O-CD1 3.43Å; R299-I303 WeakPolarHBondContact O-CG1 3.41Å; R299-I303 PolarHBondContact O-N 3.37Å; R299-W365 VanDerWaalsContact CZ-O 3.24Å; R299-W365 PolarHBondContact NH1-O 2.85Å; R299-W365 PolarHBondContact NH2-O 3.38Å
300	L	95.3	Very high	93.5	Very high	29 Å²	29	27.8 Å²	27.8	15%	0.152	13%	0.129	C	C	.	.	H	α-helix	trans	-53	-51.2	177.6	-168.7	79.8	0	0	0	111.3	L263 A267 L296 F297 S304	L263-L300 HydrophobicContact CD2-CD1 4.04Å; L263-L300 HydrophobicContact CD2-CG 4.35Å; L263-L300 HydrophobicContact CG-CD1 3.71Å; L263-L300 HydrophobicContact CG-CG 4.42Å; A267-L300 HydrophobicContact CB-CB 4.09Å; A267-L300 HydrophobicContact CB-CD1 3.92Å; L296-L300 WeakPolarHBondContact O-CB 3.35Å; L296-L300 PolarHBondContact O-N 3.45Å; F297-L300 HydrophobicContact CD1-CD2 4.24Å; F297-L300 PolarHBondContact O-N 3.48Å; L300-S304 WeakPolarHBondContact O-CB 3.14Å; L300-S304 PolarHBondContact O-N 2.96Å
301	F	96	Very high	94	Very high	62 Å²	62	19.1 Å²	19.1	27%	0.272	10%	0.096	S	C	.	.	H	α-helix	trans	-74.8	-40.6	-175.3	-70.5	-51.1	0	0	0	113.8	F297 R299 I303 S305 C418 S421	F297-F301 HydrophobicContact CB-CD2 4.38Å; F297-F301 HydrophobicContact CB-CE2 4.22Å; F297-F301 HydrophobicContact CD1-CE2 4.12Å; F297-F301 HydrophobicContact CD1-CZ 4.5Å; F297-F301 WeakPolarHBondContact O-CD2 3.34Å; F297-F301 PolarHBondContact O-N 3.28Å; R299-F301 VanDerWaalsContact C-N 3.33Å; R299-F301 PolarHBondContact O-N 3.4Å; F301-I303 VanDerWaalsContact C-N 3.33Å; F301-I303 PolarHBondContact O-N 3.32Å; F301-S305 PolarHBondContact O-N 3.41Å; F301-S305 VanDerWaalsContact O-N 3.13Å; F301-C418 CarbonylContact C-O 3.28Å; F301-C418 WeakPolarHBondContact CB-O 3.45Å; F301-S421 WeakPolarHBondContact CG-OG 3.29Å
302	T	95.1	Very high	94.4	Very high	9 Å²	9	19.1 Å²	19.1	6%	0.055	10%	0.096	C	C	.	.	H	α-helix	trans	-66.6	-37.3	178.5	49.7	0	0	0	0	112	W298 R299 R306 Y381	W298-T302 WeakPolarHBondContact O-CG2 3.44Å; W298-T302 PolarHBondContact O-N 2.79Å; W298-T302 VanDerWaalsContact O-N 3.16Å; W298-T302 PolarHBondContact O-OG1 3.41Å; R299-T302 PolarHBondContact O-N 3.09Å; R299-T302 PolarHBondContact O-OG1 2.97Å; T302-R306 PolarHBondContact O-N 3.06Å; T302-Y381 HydrophobicContact CG2-CE1 3.89Å
303	I	95.4	Very high	94.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-75.9	-40.5	179.3	-62.3	170.1	0	0	0	110.8	L263 L266 L270 R299 F301 S305 R306 V307 C364	L263-I303 HydrophobicContact CD1-CB 4.29Å; L263-I303 HydrophobicContact CD1-CG2 4.01Å; L266-I303 HydrophobicContact CD2-CD1 3.28Å; L266-I303 HydrophobicContact CD2-CG1 4.41Å; L266-I303 HydrophobicContact CD2-CG2 4.08Å; L270-I303 HydrophobicContact CD1-CD1 3.32Å; R299-I303 HydrophobicContact CB-CD1 4.17Å; R299-I303 VanDerWaalsContact O-CB 3.27Å; R299-I303 WeakPolarHBondContact O-CB 3.46Å; R299-I303 WeakPolarHBondContact O-CD1 3.43Å; R299-I303 WeakPolarHBondContact O-CG1 3.41Å; R299-I303 PolarHBondContact O-N 3.37Å; F301-I303 VanDerWaalsContact C-N 3.33Å; F301-I303 PolarHBondContact O-N 3.32Å; I303-S305 VanDerWaalsContact C-N 3.33Å; I303-S305 PolarHBondContact O-N 3.44Å; I303-R306 PolarHBondContact O-N 2.87Å; I303-R306 VanDerWaalsContact O-N 3.16Å; I303-V307 HydrophobicContact CG2-CG2 3.91Å; I303-V307 WeakPolarHBondContact O-CB 3.3Å; I303-V307 WeakPolarHBondContact O-CG2 3.5Å; I303-V307 PolarHBondContact O-N 3.39Å; I303-C364 HydrophobicContact CD1-CB 3.94Å; I303-C364 HydrophobicContact CG1-CB 3.8Å
304	S	95.9	Very high	95	Very high	30 Å²	30	16.2 Å²	16.2	21%	0.21	8%	0.081	C	C	.	.	H	α-helix	trans	-53.8	-49	173.6	-178.9	0	0	0	0	111.8	L300 R306 V307 L308	L300-S304 WeakPolarHBondContact O-CB 3.14Å; L300-S304 PolarHBondContact O-N 2.96Å; S304-R306 VanDerWaalsContact C-N 3.33Å; S304-R306 PolarHBondContact O-N 2.98Å; S304-V307 PolarHBondContact O-N 3.12Å; S304-L308 WeakPolarHBondContact O-CB 3.28Å; S304-L308 PolarHBondContact O-N 2.88Å
305	S	96.6	Very high	95	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-56.8	-46.1	177	178.4	0	0	0	0	112.5	F301 I303 S309 N388 V415 F419	F301-S305 PolarHBondContact O-N 3.41Å; F301-S305 VanDerWaalsContact O-N 3.13Å; I303-S305 VanDerWaalsContact C-N 3.33Å; I303-S305 PolarHBondContact O-N 3.44Å; S305-S309 WeakPolarHBondContact O-CB 3.35Å; S305-S309 PolarHBondContact O-N 3.26Å; S305-N388 PolarHBondContact OG-ND2 3.49Å; S305-V415 WeakPolarHBondContact CB-O 3.49Å; S305-V415 PolarHBondContact OG-O 3.38Å; S305-F419 WeakPolarHBondContact OG-CB 3.29Å
306	R	96.6	Very high	95.1	Very high	1 Å²	1	18.1 Å²	18.1	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-66.7	-47.7	-178.4	-174.9	58.2	162.5	-175.9	3.3	112.3	T302 I303 S304 S309 F310 H328 V362 E387 N388	T302-R306 PolarHBondContact O-N 3.06Å; I303-R306 PolarHBondContact O-N 2.87Å; I303-R306 VanDerWaalsContact O-N 3.16Å; S304-R306 VanDerWaalsContact C-N 3.33Å; S304-R306 PolarHBondContact O-N 2.98Å; R306-S309 PolarHBondContact O-N 3.15Å; R306-F310 HydrophobicContact CG-CD2 4.46Å; R306-F310 HydrophobicContact CG-CE1 4.45Å; R306-F310 HydrophobicContact CG-CE2 4.04Å; R306-F310 HydrophobicContact CG-CZ 4.07Å; R306-F310 VanDerWaalsContact CZ-CE1 3.41Å; R306-F310 VanDerWaalsContact NE-CE1 3.31Å; R306-F310 WeakPolarHBondContact O-CG 3.44Å; R306-F310 PolarHBondContact O-N 3.33Å; R306-H328 PolarHBondContact NH2-CE1 3.25Å; R306-H328 VanDerWaalsContact NH2-CE1 3.25Å; R306-H328 PolarHBondContact NH2-NE2 3.49Å; R306-V362 PolarHBondContact NE-O 2.88Å; R306-V362 PolarHBondContact NH2-O 3.48Å; R306-E387 IonicContact CZ-OE2 2.65Å; R306-E387 IonicContact NH1-OE2 3.4Å; R306-E387 PolarHBondContact NH1-OE2 3.39Å; R306-E387 IonicContact NH2-OE2 3.44Å; R306-E387 PolarHBondContact NH2-OE2 3.09Å; R306-N388 WeakPolarHBondContact CD-OD1 3.35Å; R306-N388 PolarHBondContact NH1-OD1 3.45Å
307	V	96.2	Very high	95	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-67.8	-39	-178.4	171.5	0	0	0	0	111	L238 V239 L242 I303 S304 F310 A311 F363	L238-V307 HydrophobicContact CB-CG1 4.17Å; L238-V307 HydrophobicContact CD2-CB 4.24Å; L238-V307 HydrophobicContact CD2-CG1 3.67Å; L238-V307 HydrophobicContact CD2-CG2 4.22Å; L238-V307 HydrophobicContact CG-CG1 3.55Å; V239-V307 HydrophobicContact CB-CG1 4.44Å; V239-V307 HydrophobicContact CG2-CB 4.3Å; V239-V307 HydrophobicContact CG2-CG1 3.64Å; V239-V307 HydrophobicContact CG2-CG2 4.27Å; L242-V307 HydrophobicContact CD1-CG1 3.77Å; I303-V307 HydrophobicContact CG2-CG2 3.91Å; I303-V307 WeakPolarHBondContact O-CB 3.3Å; I303-V307 WeakPolarHBondContact O-CG2 3.5Å; I303-V307 PolarHBondContact O-N 3.39Å; S304-V307 PolarHBondContact O-N 3.12Å; V307-F310 PolarHBondContact O-N 3.18Å; V307-A311 WeakPolarHBondContact O-CB 3.45Å; V307-A311 PolarHBondContact O-N 3.47Å; V307-F363 HydrophobicContact CG2-CD1 4.23Å
308	L	95.7	Very high	94.7	Very high	34 Å²	34	20.3 Å²	20.3	18%	0.178	10%	0.104	C	C	.	.	H	α-helix	trans	-63.6	-42.2	174.3	-175.2	60.5	0	0	0	111.6	S304 F310 A311 L312 V415	S304-L308 WeakPolarHBondContact O-CB 3.28Å; S304-L308 PolarHBondContact O-N 2.88Å; L308-F310 PolarHBondContact O-N 3.29Å; L308-A311 PolarHBondContact O-N 3.09Å; L308-L312 HydrophobicContact CG-CD1 4.24Å; L308-L312 WeakPolarHBondContact O-CB 3.45Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.25Å; L308-L312 PolarHBondContact O-N 2.97Å; L308-V415 HydrophobicContact CB-CG2 3.98Å; L308-V415 HydrophobicContact CD2-CG2 3.57Å; L308-V415 HydrophobicContact CG-CG2 3.59Å
309	S	96.8	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-42.1	174.6	179	0	0	0	0	112.5	S305 R306 F313 N388 L391	S305-S309 WeakPolarHBondContact O-CB 3.35Å; S305-S309 PolarHBondContact O-N 3.26Å; R306-S309 PolarHBondContact O-N 3.15Å; S309-F313 PolarHBondContact O-N 3.32Å; S309-N388 WeakPolarHBondContact OG-CA 3.33Å; S309-N388 PolarHBondContact OG-O 3.13Å; S309-L391 WeakPolarHBondContact OG-CB 3.39Å
310	F	96.4	Very high	94.5	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-45.3	174.6	-72.6	-7.4	0	0	0	112.6	V239 R306 V307 L308 L312 F313 A314 F321 F324 V362 F363 L391	V239-F310 HydrophobicContact CG1-CB 4.06Å; V239-F310 HydrophobicContact CG2-CB 4.16Å; V239-F310 HydrophobicContact CG2-CD2 4.26Å; R306-F310 HydrophobicContact CG-CD2 4.46Å; R306-F310 HydrophobicContact CG-CE1 4.45Å; R306-F310 HydrophobicContact CG-CE2 4.04Å; R306-F310 HydrophobicContact CG-CZ 4.07Å; R306-F310 VanDerWaalsContact CZ-CE1 3.41Å; R306-F310 VanDerWaalsContact NE-CE1 3.31Å; R306-F310 WeakPolarHBondContact O-CG 3.44Å; R306-F310 PolarHBondContact O-N 3.33Å; V307-F310 PolarHBondContact O-N 3.18Å; L308-F310 PolarHBondContact O-N 3.29Å; F310-L312 PolarHBondContact O-N 3.31Å; F310-F313 PolarHBondContact O-N 3.15Å; F310-A314 WeakPolarHBondContact O-CB 3.28Å; F310-A314 PolarHBondContact O-N 3.29Å; F310-F321 HydrophobicContact CB-CE2 3.73Å; F310-F321 HydrophobicContact CB-CZ 4.1Å; F310-F321 HydrophobicContact CD1-CE2 4.15Å; F310-F321 HydrophobicContact CD2-CE2 4.29Å; F310-F321 HydrophobicContact CD2-CZ 4.42Å; F310-F321 AromaticContact CG-CE2 3.82Å; F310-F321 HydrophobicContact CG-CE2 3.82Å; F310-F321 HydrophobicContact CG-CZ 4.31Å; F310-F324 HydrophobicContact CD1-CE1 4.4Å; F310-F324 HydrophobicContact CE1-CD1 4.49Å; F310-F324 AromaticContact CE1-CE1 3.57Å; F310-F324 HydrophobicContact CE1-CE1 3.57Å; F310-F324 HydrophobicContact CE1-CZ 4.31Å; F310-F324 HydrophobicContact CZ-CE1 4.06Å; F310-V362 HydrophobicContact CE2-CG1 3.95Å; F310-V362 HydrophobicContact CZ-CG1 4.04Å; F310-F363 HydrophobicContact CD2-CD1 4.43Å; F310-F363 HydrophobicContact CD2-CE1 4.16Å; F310-F363 HydrophobicContact CE2-CD1 4.14Å; F310-F363 HydrophobicContact CE2-CE1 4.11Å; F310-L391 HydrophobicContact CD1-CD1 3.72Å; F310-L391 HydrophobicContact CE1-CD1 3.78Å
311	A	95.6	Very high	94.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-41.9	179.9	0	0	0	0	0	112	L242 I246 V307 L308 S315	L242-A311 HydrophobicContact CB-CB 3.44Å; L242-A311 VanDerWaalsContact CB-CB 3.44Å; L242-A311 HydrophobicContact CD1-CB 4.22Å; I246-A311 HydrophobicContact CD1-CB 4.07Å; V307-A311 WeakPolarHBondContact O-CB 3.45Å; V307-A311 PolarHBondContact O-N 3.47Å; L308-A311 PolarHBondContact O-N 3.09Å; A311-S315 PolarHBondContact O-N 2.96Å; A311-S315 VanDerWaalsContact O-N 3.09Å
312	L	94.9	Very high	94.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-54.7	174.2	-70	166.9	0	0	0	110.3	I246 L308 F310 A314 S315 T392 W395 A411 V415	I246-L312 HydrophobicContact CD1-CD2 3.87Å; I246-L312 HydrophobicContact CD1-CG 4.29Å; L308-L312 HydrophobicContact CG-CD1 4.24Å; L308-L312 WeakPolarHBondContact O-CB 3.45Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.25Å; L308-L312 PolarHBondContact O-N 2.97Å; F310-L312 PolarHBondContact O-N 3.31Å; L312-A314 PolarHBondContact O-N 2.89Å; L312-S315 WeakPolarHBondContact O-CB 3.29Å; L312-S315 PolarHBondContact O-N 3.36Å; L312-S315 VanDerWaalsContact O-N 3.14Å; L312-S315 PolarHBondContact O-OG 3.32Å; L312-T392 HydrophobicContact CD1-CG2 4.07Å; L312-W395 VanDerWaalsContact C-CD1 3.45Å; L312-W395 HydrophobicContact CB-CB 4.3Å; L312-W395 HydrophobicContact CB-CD2 4.04Å; L312-W395 HydrophobicContact CB-CG 3.86Å; L312-W395 HydrophobicContact CD2-CD2 3.86Å; L312-W395 HydrophobicContact CD2-CE3 4.13Å; L312-W395 HydrophobicContact CD2-CH2 3.83Å; L312-W395 HydrophobicContact CD2-CZ2 3.51Å; L312-W395 HydrophobicContact CD2-CZ3 4.13Å; L312-W395 HydrophobicContact CG-CD2 4.43Å; L312-W395 PolarHBondContact O-NE1 3.32Å; L312-A411 HydrophobicContact CD1-CB 4.28Å; L312-A411 HydrophobicContact CD2-CB 4.04Å; L312-V415 HydrophobicContact CD1-CG2 3.93Å
313	F	95.7	Very high	94.2	Very high	13 Å²	13	36.3 Å²	36.3	6%	0.057	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-42.2	-179.2	-177.5	-102.1	0	0	0	113.2	S309 F310 S315 V316 F317 F321 L391 L394	S309-F313 PolarHBondContact O-N 3.32Å; F310-F313 PolarHBondContact O-N 3.15Å; F313-S315 PolarHBondContact O-N 3.02Å; F313-V316 PolarHBondContact O-N 3.13Å; F313-F317 AromaticContact CD2-CD2 3.91Å; F313-F317 HydrophobicContact CD2-CD2 3.91Å; F313-F317 HydrophobicContact CE1-CB 4.11Å; F313-F317 HydrophobicContact CE2-CB 4.22Å; F313-F317 AromaticContact CE2-CD2 3.53Å; F313-F317 HydrophobicContact CE2-CD2 3.53Å; F313-F317 HydrophobicContact CE2-CE2 4.2Å; F313-F317 HydrophobicContact CE2-CG 4.14Å; F313-F317 HydrophobicContact CZ-CB 3.89Å; F313-F317 HydrophobicContact CZ-CD2 4.06Å; F313-F317 HydrophobicContact CZ-CG 4.21Å; F313-F317 PolarHBondContact O-N 2.94Å; F313-F321 HydrophobicContact CD1-CB 4.05Å; F313-F321 HydrophobicContact CD1-CD2 4.05Å; F313-F321 HydrophobicContact CE1-CB 4.14Å; F313-L391 HydrophobicContact CB-CB 4.07Å; F313-L391 HydrophobicContact CB-CD2 4.15Å; F313-L391 HydrophobicContact CD1-CD2 3.78Å; F313-L391 HydrophobicContact CD2-CB 4.39Å; F313-L391 HydrophobicContact CD2-CD2 3.74Å; F313-L391 HydrophobicContact CE1-CD2 4.04Å; F313-L391 HydrophobicContact CE2-CD2 4.03Å; F313-L391 HydrophobicContact CG-CB 4.33Å; F313-L391 HydrophobicContact CG-CD2 3.6Å; F313-L391 HydrophobicContact CG-CG 4.49Å; F313-L391 HydrophobicContact CZ-CD2 4.16Å; F313-L394 HydrophobicContact CD2-CB 4.24Å; F313-L394 HydrophobicContact CE2-CB 4.12Å; F313-L394 HydrophobicContact CE2-CD1 3.86Å
314	A	94.7	Very high	94.2	Very high	6 Å²	6	38.4 Å²	38.4	5%	0.05	20%	0.197	C	C	.	.	H	α-helix	trans	-66.6	-20.7	178.7	0	0	0	0	0	113.3	F310 L312 V316 H318 F321	F310-A314 WeakPolarHBondContact O-CB 3.28Å; F310-A314 PolarHBondContact O-N 3.29Å; L312-A314 PolarHBondContact O-N 2.89Å; A314-V316 VanDerWaalsContact C-N 3.27Å; A314-V316 PolarHBondContact O-N 3.14Å; A314-H318 PolarHBondContact O-CD2 3.49Å; A314-F321 HydrophobicContact CB-CB 4.13Å; A314-F321 HydrophobicContact CB-CD1 3.86Å; A314-F321 HydrophobicContact CB-CD2 4.1Å; A314-F321 HydrophobicContact CB-CE1 4.3Å; A314-F321 HydrophobicContact CB-CG 3.74Å
315	S	92.1	Very high	94.1	Very high	19 Å²	19	38.9 Å²	38.9	13%	0.133	20%	0.198	C	C	.	.	H	α-helix	trans	-70.2	-25.5	178.4	86	0	0	0	0	112.9	A311 L312 F313 W395	A311-S315 PolarHBondContact O-N 2.96Å; A311-S315 VanDerWaalsContact O-N 3.09Å; L312-S315 WeakPolarHBondContact O-CB 3.29Å; L312-S315 PolarHBondContact O-N 3.36Å; L312-S315 VanDerWaalsContact O-N 3.14Å; L312-S315 PolarHBondContact O-OG 3.32Å; F313-S315 PolarHBondContact O-N 3.02Å; S315-W395 PolarHBondContact OG-NE1 3.48Å
316	V	91.5	Very high	94	Very high	48 Å²	48	42.9 Å²	42.9	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-105.7	-42.2	179.8	178.3	0	0	0	0	111.2	F313 A314	F313-V316 PolarHBondContact O-N 3.13Å; A314-V316 VanDerWaalsContact C-N 3.27Å; A314-V316 PolarHBondContact O-N 3.14Å
317	F	91.5	Very high	93.9	Very high	45 Å²	45	48.3 Å²	48.3	20%	0.197	25%	0.251	C	S	.	.			trans	-116.4	68.2	-170.6	-63	-74.8	0	0	0	113	F313 I319 Y320 F321 Y398	F313-F317 AromaticContact CD2-CD2 3.91Å; F313-F317 HydrophobicContact CD2-CD2 3.91Å; F313-F317 HydrophobicContact CE1-CB 4.11Å; F313-F317 HydrophobicContact CE2-CB 4.22Å; F313-F317 AromaticContact CE2-CD2 3.53Å; F313-F317 HydrophobicContact CE2-CD2 3.53Å; F313-F317 HydrophobicContact CE2-CE2 4.2Å; F313-F317 HydrophobicContact CE2-CG 4.14Å; F313-F317 HydrophobicContact CZ-CB 3.89Å; F313-F317 HydrophobicContact CZ-CD2 4.06Å; F313-F317 HydrophobicContact CZ-CG 4.21Å; F313-F317 PolarHBondContact O-N 2.94Å; F317-I319 PolarHBondContact O-N 2.79Å; F317-Y320 HydrophobicContact CB-CD2 4.13Å; F317-Y320 AromaticContact CD1-CD2 3.88Å; F317-Y320 HydrophobicContact CD1-CD2 3.88Å; F317-Y320 HydrophobicContact CD1-CE2 4.34Å; F317-Y320 HydrophobicContact CG-CD2 4.43Å; F317-Y320 PolarHBondContact O-N 3.31Å; F317-F321 WeakPolarHBondContact O-CB 3.39Å; F317-F321 PolarHBondContact O-N 3.38Å; F317-Y398 HydrophobicContact CE2-CD2 4.11Å; F317-Y398 HydrophobicContact CE2-CG 4.3Å; F317-Y398 HydrophobicContact CZ-CD1 4.35Å; F317-Y398 AromaticContact CZ-CD2 3.65Å; F317-Y398 HydrophobicContact CZ-CD2 3.65Å; F317-Y398 HydrophobicContact CZ-CE2 4.3Å; F317-Y398 AromaticContact CZ-CG 3.68Å; F317-Y398 HydrophobicContact CZ-CG 3.68Å
318	H	89.1	Confident	93.9	Very high	112 Å²	112	48.7 Å²	48.7	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-55.5	-48.5	-172.9	-52.5	84.1	0	0	0	114.3	Q247 A314	Q247-H318 PolarHBondContact NE2-NE2 2.79Å; A314-H318 PolarHBondContact O-CD2 3.49Å
319	I	90.6	Very high	93.8	Very high	136 Å²	136	50.5 Å²	50.5	70%	0.697	26%	0.257	S	S	*	.	H	α-helix	trans	-74.2	-43	-176.9	-59.9	175.4	0	0	0	111.1	F317 F321 G322 I323	F317-I319 PolarHBondContact O-N 2.79Å; I319-F321 PolarHBondContact O-N 3.37Å; I319-G322 PolarHBondContact O-N 2.88Å; I319-G322 VanDerWaalsContact O-N 3.12Å; I319-I323 HydrophobicContact CG2-CD1 4.31Å; I319-I323 PolarHBondContact O-N 2.92Å
320	Y	93.3	Very high	93.7	Very high	151 Å²	151	53.5 Å²	53.5	59%	0.592	28%	0.277	S	S	*	.	H	α-helix	trans	-65.7	-29.9	179.7	-62.1	-80.9	0	0	0	112.1	F317 I323 F324	F317-Y320 HydrophobicContact CB-CD2 4.13Å; F317-Y320 AromaticContact CD1-CD2 3.88Å; F317-Y320 HydrophobicContact CD1-CD2 3.88Å; F317-Y320 HydrophobicContact CD1-CE2 4.34Å; F317-Y320 HydrophobicContact CG-CD2 4.43Å; F317-Y320 PolarHBondContact O-N 3.31Å; Y320-I323 PolarHBondContact O-N 2.98Å; Y320-F324 WeakPolarHBondContact O-CB 3.29Å; Y320-F324 PolarHBondContact O-N 3.16Å
321	F	93.4	Very high	93.5	Very high	41 Å²	41	56 Å²	56	18%	0.18	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-45.8	171.3	176.1	-110.6	0	0	0	111.7	V239 F310 F313 A314 F317 I319 I323 F324 V325	V239-F321 HydrophobicContact CG1-CE1 4.36Å; V239-F321 HydrophobicContact CG1-CZ 4.01Å; F310-F321 HydrophobicContact CB-CE2 3.73Å; F310-F321 HydrophobicContact CB-CZ 4.1Å; F310-F321 HydrophobicContact CD1-CE2 4.15Å; F310-F321 HydrophobicContact CD2-CE2 4.29Å; F310-F321 HydrophobicContact CD2-CZ 4.42Å; F310-F321 AromaticContact CG-CE2 3.82Å; F310-F321 HydrophobicContact CG-CE2 3.82Å; F310-F321 HydrophobicContact CG-CZ 4.31Å; F313-F321 HydrophobicContact CD1-CB 4.05Å; F313-F321 HydrophobicContact CD1-CD2 4.05Å; F313-F321 HydrophobicContact CE1-CB 4.14Å; A314-F321 HydrophobicContact CB-CB 4.13Å; A314-F321 HydrophobicContact CB-CD1 3.86Å; A314-F321 HydrophobicContact CB-CD2 4.1Å; A314-F321 HydrophobicContact CB-CE1 4.3Å; A314-F321 HydrophobicContact CB-CG 3.74Å; F317-F321 WeakPolarHBondContact O-CB 3.39Å; F317-F321 PolarHBondContact O-N 3.38Å; I319-F321 PolarHBondContact O-N 3.37Å; F321-I323 PolarHBondContact O-N 3.47Å; F321-F324 PolarHBondContact O-N 2.78Å; F321-V325 HydrophobicContact CD1-CG2 4.45Å; F321-V325 HydrophobicContact CD2-CG2 4.12Å; F321-V325 HydrophobicContact CE1-CG2 4.01Å; F321-V325 HydrophobicContact CE2-CG2 3.64Å; F321-V325 HydrophobicContact CZ-CG2 3.58Å; F321-V325 WeakPolarHBondContact O-CG2 3.48Å; F321-V325 PolarHBondContact O-N 3.47Å
322	G	92.4	Very high	93.3	Very high	35 Å²	35	57 Å²	57	36%	0.361	30%	0.303	S	S	.	.	H	α-helix	trans	-59.6	-44.9	175.7	0	0	0	0	0	112.6	I319 V325 V326	I319-G322 PolarHBondContact O-N 2.88Å; I319-G322 VanDerWaalsContact O-N 3.12Å; G322-V325 PolarHBondContact O-N 3.1Å; G322-V326 WeakPolarHBondContact O-CG2 3.48Å; G322-V326 PolarHBondContact O-N 2.73Å; G322-V326 VanDerWaalsContact O-N 3.08Å
323	I	94.1	Very high	93.1	Very high	88 Å²	88	57 Å²	57	45%	0.451	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-46.6	176.3	-62.1	170.9	0	0	0	110.6	I319 Y320 F321 V325 V326 L327	I319-I323 HydrophobicContact CG2-CD1 4.31Å; I319-I323 PolarHBondContact O-N 2.92Å; Y320-I323 PolarHBondContact O-N 2.98Å; F321-I323 PolarHBondContact O-N 3.47Å; I323-V325 PolarHBondContact O-N 2.79Å; I323-V326 PolarHBondContact O-N 3.27Å; I323-L327 HydrophobicContact CG2-CD1 3.77Å; I323-L327 HydrophobicContact CG2-CG 4.24Å; I323-L327 WeakPolarHBondContact O-CB 3.31Å; I323-L327 VanDerWaalsContact O-CG 3.31Å; I323-L327 WeakPolarHBondContact O-CG 3.42Å; I323-L327 PolarHBondContact O-N 2.71Å
324	F	95.1	Very high	92.8	Very high	45 Å²	45	62.5 Å²	62.5	20%	0.197	33%	0.328	C	S	.	.	H	α-helix	trans	-58.6	-47.2	177.9	170	-94.3	0	0	0	111.8	F310 Y320 F321 V326 L327 H328 E387 L391	F310-F324 HydrophobicContact CD1-CE1 4.4Å; F310-F324 HydrophobicContact CE1-CD1 4.49Å; F310-F324 AromaticContact CE1-CE1 3.57Å; F310-F324 HydrophobicContact CE1-CE1 3.57Å; F310-F324 HydrophobicContact CE1-CZ 4.31Å; F310-F324 HydrophobicContact CZ-CE1 4.06Å; Y320-F324 WeakPolarHBondContact O-CB 3.29Å; Y320-F324 PolarHBondContact O-N 3.16Å; F321-F324 PolarHBondContact O-N 2.78Å; F324-V326 PolarHBondContact O-N 3.11Å; F324-L327 PolarHBondContact O-N 2.84Å; F324-H328 HydrophobicContact CZ-CB 4.41Å; F324-H328 VanDerWaalsContact O-CB 3.26Å; F324-H328 WeakPolarHBondContact O-CB 3.4Å; F324-H328 PolarHBondContact O-N 2.88Å; F324-E387 HydrophobicContact CZ-CG 4.47Å; F324-L391 HydrophobicContact CD2-CD2 4.46Å; F324-L391 HydrophobicContact CE1-CD1 3.94Å; F324-L391 HydrophobicContact CE2-CD2 4.41Å; F324-L391 HydrophobicContact CZ-CD1 3.94Å; F324-L391 HydrophobicContact CZ-CD2 4.47Å
325	V	94.3	Very high	92.6	Very high	40 Å²	40	67.6 Å²	67.6	24%	0.242	35%	0.346	C	S	.	.	H	α-helix	trans	-61.1	-44.8	179.5	170.3	0	0	0	0	111.2	F321 G322 I323 W329	F321-V325 HydrophobicContact CD1-CG2 4.45Å; F321-V325 HydrophobicContact CD2-CG2 4.12Å; F321-V325 HydrophobicContact CE1-CG2 4.01Å; F321-V325 HydrophobicContact CE2-CG2 3.64Å; F321-V325 HydrophobicContact CZ-CG2 3.58Å; F321-V325 WeakPolarHBondContact O-CG2 3.48Å; F321-V325 PolarHBondContact O-N 3.47Å; G322-V325 PolarHBondContact O-N 3.1Å; I323-V325 PolarHBondContact O-N 2.79Å; V325-W329 VanDerWaalsContact O-CB 3.22Å; V325-W329 WeakPolarHBondContact O-CB 3.38Å; V325-W329 PolarHBondContact O-N 3.06Å
326	V	94.8	Very high	92.2	Very high	83 Å²	83	66.8 Å²	66.8	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-45.3	178.6	173.6	0	0	0	0	111.3	G322 I323 F324 W329 C330	G322-V326 WeakPolarHBondContact O-CG2 3.48Å; G322-V326 PolarHBondContact O-N 2.73Å; G322-V326 VanDerWaalsContact O-N 3.08Å; I323-V326 PolarHBondContact O-N 3.27Å; F324-V326 PolarHBondContact O-N 3.11Å; V326-W329 PolarHBondContact O-N 2.91Å; V326-C330 WeakPolarHBondContact O-CB 3.32Å; V326-C330 PolarHBondContact O-N 2.9Å; V326-C330 PolarHBondContact O-SG 3.33Å
327	L	94.9	Very high	91.9	Very high	115 Å²	115	67.8 Å²	67.8	60%	0.602	34%	0.343	S	S	*	.	H	α-helix	trans	-63.5	-45.6	178.3	-72.1	176.1	0	0	0	111.9	I323 F324 W329 C330 A331	I323-L327 HydrophobicContact CG2-CD1 3.77Å; I323-L327 HydrophobicContact CG2-CG 4.24Å; I323-L327 WeakPolarHBondContact O-CB 3.31Å; I323-L327 VanDerWaalsContact O-CG 3.31Å; I323-L327 WeakPolarHBondContact O-CG 3.42Å; I323-L327 PolarHBondContact O-N 2.71Å; F324-L327 PolarHBondContact O-N 2.84Å; L327-W329 VanDerWaalsContact C-N 3.35Å; L327-C330 PolarHBondContact O-N 3.23Å; L327-A331 WeakPolarHBondContact O-CB 3.15Å; L327-A331 PolarHBondContact O-N 3.36Å
328	H	94.4	Very high	91.5	Very high	9 Å²	9	71.9 Å²	71.9	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-41.8	177.6	-175.3	94.8	0	0	0	111.2	R306 F324 A331 M332 E387	R306-H328 PolarHBondContact NH2-CE1 3.25Å; R306-H328 VanDerWaalsContact NH2-CE1 3.25Å; R306-H328 PolarHBondContact NH2-NE2 3.49Å; F324-H328 HydrophobicContact CZ-CB 4.41Å; F324-H328 VanDerWaalsContact O-CB 3.26Å; F324-H328 WeakPolarHBondContact O-CB 3.4Å; F324-H328 PolarHBondContact O-N 2.88Å; H328-A331 PolarHBondContact O-N 3.33Å; H328-M332 WeakPolarHBondContact NE2-CG 3.18Å; H328-M332 WeakPolarHBondContact O-CB 3.49Å; H328-M332 WeakPolarHBondContact O-CG 2.79Å; H328-M332 PolarHBondContact O-N 3.42Å; H328-E387 VanDerWaalsContact CE1-CD 3.48Å; H328-E387 IonicContact CE1-OE1 3.82Å; H328-E387 PolarHBondContact CE1-OE1 3.09Å; H328-E387 IonicContact CE1-OE2 3.82Å; H328-E387 PolarHBondContact CE1-OE2 2.92Å; H328-E387 VanDerWaalsContact ND1-CD 3.34Å; H328-E387 IonicContact ND1-OE1 3.86Å; H328-E387 PolarHBondContact ND1-OE1 3.49Å; H328-E387 IonicContact ND1-OE2 2.91Å; H328-E387 PolarHBondContact ND1-OE2 2.9Å
329	W	94.7	Very high	90.6	Very high	72 Å²	72	67.3 Å²	67.3	27%	0.273	35%	0.345	S	S	.	.	H	α-helix	trans	-60.2	-47.8	174.4	170.8	65.5	0	0	0	112.1	V325 V326 L327 A331 M332 A333 M355 V362	V325-W329 VanDerWaalsContact O-CB 3.22Å; V325-W329 WeakPolarHBondContact O-CB 3.38Å; V325-W329 PolarHBondContact O-N 3.06Å; V326-W329 PolarHBondContact O-N 2.91Å; L327-W329 VanDerWaalsContact C-N 3.35Å; W329-A331 VanDerWaalsContact C-N 3.31Å; W329-A331 PolarHBondContact O-N 3.34Å; W329-M332 PolarHBondContact O-N 3.36Å; W329-A333 VanDerWaalsContact O-CB 3.27Å; W329-A333 WeakPolarHBondContact O-CB 3.19Å; W329-A333 PolarHBondContact O-N 3.03Å; W329-M355 HydrophobicContact CH2-CE 3.23Å; W329-M355 HydrophobicContact CZ2-CB 4.49Å; W329-M355 HydrophobicContact CZ2-CE 3.2Å; W329-M355 HydrophobicContact CZ2-SD 4.05Å; W329-M355 HydrophobicContact CZ3-CE 4.22Å; W329-M355 PolarHBondContact NE1-O 2.91Å; W329-V362 HydrophobicContact CB-CG2 3.95Å
330	C	93.8	Very high	89.4	Confident	63 Å²	63	62.5 Å²	62.5	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-58	-44.1	175.6	-72.9	0	0	0	0	111.6	V326 L327 F334	V326-C330 WeakPolarHBondContact O-CB 3.32Å; V326-C330 PolarHBondContact O-N 2.9Å; V326-C330 PolarHBondContact O-SG 3.33Å; L327-C330 PolarHBondContact O-N 3.23Å; C330-F334 VanDerWaalsContact O-CB 3.26Å; C330-F334 WeakPolarHBondContact O-CB 3.49Å; C330-F334 PolarHBondContact O-N 2.98Å
331	A	93.1	Very high	88.1	Confident	54 Å²	54	55.8 Å²	55.8	45%	0.446	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-44.6	177.5	0	0	0	0	0	112.2	L327 H328 W329 F334 W335	L327-A331 WeakPolarHBondContact O-CB 3.15Å; L327-A331 PolarHBondContact O-N 3.36Å; H328-A331 PolarHBondContact O-N 3.33Å; W329-A331 VanDerWaalsContact C-N 3.31Å; W329-A331 PolarHBondContact O-N 3.34Å; A331-F334 PolarHBondContact O-N 2.9Å; A331-W335 WeakPolarHBondContact O-CB 3.36Å; A331-W335 PolarHBondContact O-N 2.9Å
332	M	91.8	Very high	86.4	Confident	20 Å²	20	58.3 Å²	58.3	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-69.9	-39.9	178.7	-69.6	-58.7	145.5	0	0	112.4	H328 W329 W335 V336 Y361 Y380 V383	H328-M332 WeakPolarHBondContact NE2-CG 3.18Å; H328-M332 WeakPolarHBondContact O-CB 3.49Å; H328-M332 WeakPolarHBondContact O-CG 2.79Å; H328-M332 PolarHBondContact O-N 3.42Å; W329-M332 PolarHBondContact O-N 3.36Å; M332-W335 WeakPolarHBondContact O-CB 3.36Å; M332-W335 PolarHBondContact O-N 3.48Å; M332-V336 VanDerWaalsContact O-CG2 3.27Å; M332-V336 WeakPolarHBondContact O-CG2 3.27Å; M332-V336 PolarHBondContact O-N 2.94Å; M332-Y361 HydrophobicContact SD-CD1 4.04Å; M332-Y380 HydrophobicContact SD-CD2 4.41Å; M332-Y380 HydrophobicContact SD-CE2 4.35Å; M332-V383 HydrophobicContact CE-CG1 4.3Å
333	A	90.4	Very high	84.8	Confident	3 Å²	3	57.7 Å²	57.7	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-46.1	174.4	0	0	0	0	0	110.9	W329 W335 V336 I337 M355	W329-A333 VanDerWaalsContact O-CB 3.27Å; W329-A333 WeakPolarHBondContact O-CB 3.19Å; W329-A333 PolarHBondContact O-N 3.03Å; A333-W335 PolarHBondContact O-N 3Å; A333-V336 PolarHBondContact O-N 3.5Å; A333-I337 WeakPolarHBondContact O-CD1 3.49Å; A333-I337 VanDerWaalsContact O-CG1 3.23Å; A333-I337 WeakPolarHBondContact O-CG1 3.26Å; A333-I337 PolarHBondContact O-N 3.4Å; A333-M355 HydrophobicContact CB-SD 3.78Å
334	F	89.9	Confident	83	Confident	128 Å²	128	54.8 Å²	54.8	56%	0.561	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-43.9	174.8	-177	-95.3	0	0	0	112	C330 A331 V336 I337 H338	C330-F334 VanDerWaalsContact O-CB 3.26Å; C330-F334 WeakPolarHBondContact O-CB 3.49Å; C330-F334 PolarHBondContact O-N 2.98Å; A331-F334 PolarHBondContact O-N 2.9Å; F334-V336 VanDerWaalsContact C-N 3.3Å; F334-V336 PolarHBondContact O-N 3.37Å; F334-I337 PolarHBondContact O-N 3.31Å; F334-H338 AromaticContact CD1-CD2 3.7Å; F334-H338 AromaticContact CD2-CD2 3.59Å; F334-H338 AromaticContact CD2-NE2 3.82Å; F334-H338 AromaticContact CE1-CD2 3.33Å; F334-H338 WeakPolarHBondContact CE1-CD2 3.41Å; F334-H338 AromaticContact CE1-NE2 3.72Å; F334-H338 AromaticContact CE2-CD2 3.22Å; F334-H338 WeakPolarHBondContact CE2-CD2 3.45Å; F334-H338 AromaticContact CE2-NE2 3.01Å; F334-H338 WeakPolarHBondContact CE2-NE2 3.2Å; F334-H338 AromaticContact CG-CD2 3.83Å; F334-H338 AromaticContact CZ-CD2 3.09Å; F334-H338 WeakPolarHBondContact CZ-CD2 3.33Å; F334-H338 AromaticContact CZ-CE1 3.9Å; F334-H338 AromaticContact CZ-NE2 2.96Å; F334-H338 WeakPolarHBondContact CZ-NE2 3.2Å; F334-H338 WeakPolarHBondContact O-CB 2.93Å; F334-H338 PolarHBondContact O-N 3.26Å
335	W	88.9	Confident	81.1	Confident	113 Å²	113	59.8 Å²	59.8	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-39.4	175.1	179.1	-88.9	0	0	0	112.7	A331 M332 A333 G339 V379	A331-W335 WeakPolarHBondContact O-CB 3.36Å; A331-W335 PolarHBondContact O-N 2.9Å; M332-W335 WeakPolarHBondContact O-CB 3.36Å; M332-W335 PolarHBondContact O-N 3.48Å; A333-W335 PolarHBondContact O-N 3Å; W335-G339 PolarHBondContact O-N 3.18Å; W335-G339 VanDerWaalsContact O-N 3.17Å; W335-V379 HydrophobicContact CH2-CG1 4.06Å; W335-V379 HydrophobicContact CZ2-CG1 4.41Å
336	V	85.6	Confident	80	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-69.8	-45	177.1	173.3	0	0	0	0	110.9	M332 A333 F334 G339 T341 N354 V357 Y361 V368	M332-V336 VanDerWaalsContact O-CG2 3.27Å; M332-V336 WeakPolarHBondContact O-CG2 3.27Å; M332-V336 PolarHBondContact O-N 2.94Å; A333-V336 PolarHBondContact O-N 3.5Å; F334-V336 VanDerWaalsContact C-N 3.3Å; F334-V336 PolarHBondContact O-N 3.37Å; V336-G339 WeakPolarHBondContact O-CA 3.25Å; V336-G339 PolarHBondContact O-N 3.42Å; V336-G339 VanDerWaalsContact O-N 3.08Å; V336-T341 HydrophobicContact CG1-CG2 4.32Å; V336-N354 HydrophobicContact CG1-CB 3.96Å; V336-N354 WeakPolarHBondContact CG1-OD1 3.38Å; V336-V357 HydrophobicContact CG1-CG1 4.11Å; V336-V357 HydrophobicContact CG2-CG1 4.07Å; V336-Y361 HydrophobicContact CG2-CD2 4.35Å; V336-Y361 HydrophobicContact CG2-CE1 4.5Å; V336-Y361 HydrophobicContact CG2-CE2 4.15Å; V336-V368 HydrophobicContact CG1-CG1 4.31Å
337	I	84.3	Confident	79	Confident	70 Å²	70	64.4 Å²	64.4	36%	0.359	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-48.7	179.6	-67	163.4	0	0	0	111.2	A333 F334 G339 G340 N354	A333-I337 WeakPolarHBondContact O-CD1 3.49Å; A333-I337 VanDerWaalsContact O-CG1 3.23Å; A333-I337 WeakPolarHBondContact O-CG1 3.26Å; A333-I337 PolarHBondContact O-N 3.4Å; F334-I337 PolarHBondContact O-N 3.31Å; I337-G339 PolarHBondContact O-N 2.95Å; I337-G340 PolarHBondContact O-N 2.86Å; I337-G340 VanDerWaalsContact O-N 3.12Å; I337-N354 HydrophobicContact CG1-CB 3.92Å
338	H	82.8	Confident	78.1	Confident	131 Å²	131	69.3 Å²	69.3	61%	0.606	35%	0.346	S	S	*	.	H	α-helix	trans	-66.1	-16.2	174.8	-86.9	-81.4	0	0	0	113.3	F334 G340	F334-H338 AromaticContact CD1-CD2 3.7Å; F334-H338 AromaticContact CD2-CD2 3.59Å; F334-H338 AromaticContact CD2-NE2 3.82Å; F334-H338 AromaticContact CE1-CD2 3.33Å; F334-H338 WeakPolarHBondContact CE1-CD2 3.41Å; F334-H338 AromaticContact CE1-NE2 3.72Å; F334-H338 AromaticContact CE2-CD2 3.22Å; F334-H338 WeakPolarHBondContact CE2-CD2 3.45Å; F334-H338 AromaticContact CE2-NE2 3.01Å; F334-H338 WeakPolarHBondContact CE2-NE2 3.2Å; F334-H338 AromaticContact CG-CD2 3.83Å; F334-H338 AromaticContact CZ-CD2 3.09Å; F334-H338 WeakPolarHBondContact CZ-CD2 3.33Å; F334-H338 AromaticContact CZ-CE1 3.9Å; F334-H338 AromaticContact CZ-NE2 2.96Å; F334-H338 WeakPolarHBondContact CZ-NE2 3.2Å; F334-H338 WeakPolarHBondContact O-CB 2.93Å; F334-H338 PolarHBondContact O-N 3.26Å; H338-G340 PolarHBondContact O-N 3.27Å; H338-G340 VanDerWaalsContact O-N 3.13Å
339	G	71.3	Confident	77	Confident	15 Å²	15	74.1 Å²	74.1	16%	0.155	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-8.7	171.2	0	0	0	0	0	114.2	W335 V336 I337 R369	W335-G339 PolarHBondContact O-N 3.18Å; W335-G339 VanDerWaalsContact O-N 3.17Å; V336-G339 WeakPolarHBondContact O-CA 3.25Å; V336-G339 PolarHBondContact O-N 3.42Å; V336-G339 VanDerWaalsContact O-N 3.08Å; I337-G339 PolarHBondContact O-N 2.95Å; G339-R369 WeakPolarHBondContact O-CD 3.49Å; G339-R369 PolarHBondContact O-NH1 2.97Å
340	G	64.3	Low	76.2	Confident	36 Å²	36	71.8 Å²	71.8	37%	0.371	36%	0.361	S	S	.	.			trans	63.3	63.9	177.5	0	0	0	0	0	110.6	I337 H338 Y531	I337-G340 PolarHBondContact O-N 2.86Å; I337-G340 VanDerWaalsContact O-N 3.12Å; H338-G340 PolarHBondContact O-N 3.27Å; H338-G340 VanDerWaalsContact O-N 3.13Å; G340-Y531 PolarHBondContact O-OH 3.29Å; G340-Y531 VanDerWaalsContact O-OH 3.06Å
341	T	65.3	Low	75.5	Confident	10 Å²	10	72 Å²	72	6%	0.061	36%	0.36	C	S	.	.			trans	-76.7	159.1	171.4	53.2	0	0	0	0	109.4	V336 F343 E350 N354 V368	V336-T341 HydrophobicContact CG1-CG2 4.32Å; T341-F343 VanDerWaalsContact CB-CE2 3.49Å; T341-F343 HydrophobicContact CG2-CD2 4.12Å; T341-F343 HydrophobicContact CG2-CE2 3.43Å; T341-F343 VanDerWaalsContact CG2-CE2 3.43Å; T341-F343 HydrophobicContact CG2-CZ 4.25Å; T341-E350 WeakPolarHBondContact CB-OE1 3.3Å; T341-E350 PolarHBondContact OG1-OE1 3.45Å; T341-N354 PolarHBondContact OG1-ND2 3.48Å; T341-N354 PolarHBondContact OG1-OD1 3.49Å; T341-V368 HydrophobicContact CG2-CG1 3.73Å
342	D	58.4	Low	74.9	Confident	94 Å²	94	74.9 Å²	74.9	50%	0.503	37%	0.367	S	S	.	.			trans	-148	63.8	168.6	-89.4	-53.6	0	0	0	106.7	E350 K529 Y531	D342-E350 PolarHBondContact N-OE1 3.48Å; D342-K529 VanDerWaalsContact O-CD 3.29Å; D342-K529 WeakPolarHBondContact O-CD 3.49Å; D342-K529 WeakPolarHBondContact O-CE 3.11Å; D342-K529 PolarHBondContact O-NZ 2.94Å; D342-Y531 HydrophobicContact CB-CE2 3.77Å; D342-Y531 WeakPolarHBondContact CB-OH 3.46Å; D342-Y531 VanDerWaalsContact N-CZ 3.29Å; D342-Y531 PolarHBondContact N-OH 2.94Å
343	F	58	Low	74.3	Confident	22 Å²	22	76.5 Å²	76.5	10%	0.096	37%	0.374	C	S	.	.			trans	-78.2	-53.8	-176.8	-69.3	-66.4	0	0	0	112.2	T341 E350 F353 V368 K529 Y531 A533	T341-F343 VanDerWaalsContact CB-CE2 3.49Å; T341-F343 HydrophobicContact CG2-CD2 4.12Å; T341-F343 HydrophobicContact CG2-CE2 3.43Å; T341-F343 VanDerWaalsContact CG2-CE2 3.43Å; T341-F343 HydrophobicContact CG2-CZ 4.25Å; F343-E350 HydrophobicContact CB-CG 4.35Å; F343-F353 HydrophobicContact CB-CD1 4.27Å; F343-F353 HydrophobicContact CD1-CE1 4.23Å; F343-F353 AromaticContact CD2-CD1 3.31Å; F343-F353 HydrophobicContact CD2-CD1 3.31Å; F343-F353 AromaticContact CD2-CE1 3.34Å; F343-F353 HydrophobicContact CD2-CE1 3.34Å; F343-F353 HydrophobicContact CD2-CG 4.41Å; F343-F353 HydrophobicContact CD2-CZ 4.43Å; F343-F353 HydrophobicContact CE1-CE1 4.29Å; F343-F353 AromaticContact CE2-CD1 3.74Å; F343-F353 HydrophobicContact CE2-CD1 3.74Å; F343-F353 AromaticContact CE2-CE1 3.34Å; F343-F353 HydrophobicContact CE2-CE1 3.34Å; F343-F353 HydrophobicContact CE2-CZ 4.44Å; F343-F353 AromaticContact CG-CD1 3.86Å; F343-F353 HydrophobicContact CG-CD1 3.86Å; F343-F353 AromaticContact CG-CE1 3.78Å; F343-F353 HydrophobicContact CG-CE1 3.78Å; F343-F353 AromaticContact CZ-CE1 3.84Å; F343-F353 HydrophobicContact CZ-CE1 3.84Å; F343-V368 HydrophobicContact CE2-CG1 3.29Å; F343-V368 HydrophobicContact CZ-CB 4.43Å; F343-V368 HydrophobicContact CZ-CG1 3.28Å; F343-V368 VanDerWaalsContact CZ-O 3.22Å; F343-V368 WeakPolarHBondContact CZ-O 3.28Å; F343-K529 PolarHBondContact O-NZ 2.82Å; F343-Y531 HydrophobicContact CE1-CD1 4.44Å; F343-Y531 HydrophobicContact CE1-CG 4.13Å; F343-Y531 HydrophobicContact CZ-CD1 4.37Å; F343-Y531 HydrophobicContact CZ-CG 4.5Å; F343-A533 HydrophobicContact CD1-CB 4.08Å; F343-A533 HydrophobicContact CE1-CB 3.41Å; F343-A533 VanDerWaalsContact CE1-CB 3.41Å; F343-A533 HydrophobicContact CZ-CB 4.18Å
344	C	57.2	Low	73.9	Confident	26 Å²	26	76.5 Å²	76.5	18%	0.176	37%	0.373	C	S	.	.	S	Bend	trans	-95.2	161.8	-169.8	-58	0	0	0	0	111.6	S346 E349 E350	C344-S346 VanDerWaalsContact C-N 3.31Å; C344-E349 HydrophobicContact CB-CB 3.46Å; C344-E349 VanDerWaalsContact CB-CB 3.46Å; C344-E349 VanDerWaalsContact SG-C 3.55Å; C344-E349 VanDerWaalsContact SG-CB 3.58Å; C344-E350 HydrophobicContact CB-CB 4.07Å
345	M	56	Low	73.7	Confident	151 Å²	151	73.3 Å²	73.3	74%	0.744	36%	0.361	S	S	*	.	S	Bend	trans	-75.6	-26.5	174	-65.8	-63.2	-173	0	0	111.2
346	S	70.9	Confident	73.5	Confident	42 Å²	42	70.8 Å²	70.8	29%	0.294	36%	0.358	S	S	.	.	S	Bend	trans	-103.2	140.7	174.1	75.4	0	0	0	0	111.4	C344 W348 E349 E350	C344-S346 VanDerWaalsContact C-N 3.31Å; S346-W348 PolarHBondContact O-N 2.89Å; S346-E349 PolarHBondContact O-N 3.45Å; S346-E349 VanDerWaalsContact OG-CB 3.24Å; S346-E349 WeakPolarHBondContact OG-CB 3.37Å; S346-E349 WeakPolarHBondContact OG-CG 3.4Å; S346-E349 PolarHBondContact OG-N 3.36Å; S346-E349 PolarHBondContact OG-OE2 2.99Å; S346-E350 PolarHBondContact O-N 3.09Å
347	K	73.6	Confident	73.4	Confident	178 Å²	178	71 Å²	71	77%	0.774	36%	0.359	S	S	*	.	H	α-helix	trans	-59.8	-33.1	176.4	-66.3	-171.6	176.2	-178.1	0	112.2	E350 V351	K347-E350 PolarHBondContact O-N 3.41Å; K347-V351 VanDerWaalsContact O-CG2 3.3Å; K347-V351 WeakPolarHBondContact O-CG2 3.36Å; K347-V351 PolarHBondContact O-N 3.21Å
348	W	75.1	Confident	73.7	Confident	217 Å²	217	67.6 Å²	67.6	82%	0.822	34%	0.342	S	S	*	.	H	α-helix	trans	-71	-43	-179.1	-63	113	0	0	0	113.2	S346 E350 V351 L352	S346-W348 PolarHBondContact O-N 2.89Å; W348-E350 PolarHBondContact O-N 3.46Å; W348-V351 PolarHBondContact O-N 3.34Å; W348-L352 WeakPolarHBondContact O-CB 3.38Å; W348-L352 PolarHBondContact O-N 2.88Å
349	E	72.3	Confident	74	Confident	110 Å²	110	63.5 Å²	63.5	51%	0.514	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-33.7	175.5	-72.8	167	153.1	0	0	111.5	C344 S346 L352 F353	C344-E349 HydrophobicContact CB-CB 3.46Å; C344-E349 VanDerWaalsContact CB-CB 3.46Å; C344-E349 VanDerWaalsContact SG-C 3.55Å; C344-E349 VanDerWaalsContact SG-CB 3.58Å; S346-E349 PolarHBondContact O-N 3.45Å; S346-E349 VanDerWaalsContact OG-CB 3.24Å; S346-E349 WeakPolarHBondContact OG-CB 3.37Å; S346-E349 WeakPolarHBondContact OG-CG 3.4Å; S346-E349 PolarHBondContact OG-N 3.36Å; S346-E349 PolarHBondContact OG-OE2 2.99Å; E349-L352 PolarHBondContact O-N 3.48Å; E349-F353 WeakPolarHBondContact O-CB 3.45Å; E349-F353 PolarHBondContact O-N 3.29Å
350	E	77.4	Confident	74.9	Confident	24 Å²	24	63 Å²	63	11%	0.112	32%	0.32	C	S	.	.	H	α-helix	trans	-70.1	-44.6	177.6	-162.1	-165.6	143.1	0	0	112.3	T341 D342 F343 C344 S346 K347 W348 L352 F353 N354	T341-E350 WeakPolarHBondContact CB-OE1 3.3Å; T341-E350 PolarHBondContact OG1-OE1 3.45Å; D342-E350 PolarHBondContact N-OE1 3.48Å; F343-E350 HydrophobicContact CB-CG 4.35Å; C344-E350 HydrophobicContact CB-CB 4.07Å; S346-E350 PolarHBondContact O-N 3.09Å; K347-E350 PolarHBondContact O-N 3.41Å; W348-E350 PolarHBondContact O-N 3.46Å; E350-L352 VanDerWaalsContact C-N 3.28Å; E350-L352 PolarHBondContact O-N 3.37Å; E350-F353 PolarHBondContact O-N 3.08Å; E350-N354 WeakPolarHBondContact O-CB 3.49Å; E350-N354 VanDerWaalsContact O-CG 3.28Å; E350-N354 PolarHBondContact O-N 3.43Å; E350-N354 PolarHBondContact O-ND2 2.98Å
351	V	80.2	Confident	76.2	Confident	66 Å²	66	61.3 Å²	61.3	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-57.2	-46	172.9	170.6	0	0	0	0	109.9	K347 W348 F353 N354 M355	K347-V351 VanDerWaalsContact O-CG2 3.3Å; K347-V351 WeakPolarHBondContact O-CG2 3.36Å; K347-V351 PolarHBondContact O-N 3.21Å; W348-V351 PolarHBondContact O-N 3.34Å; V351-F353 PolarHBondContact O-N 3.43Å; V351-N354 PolarHBondContact O-N 2.84Å; V351-M355 HydrophobicContact CG1-CG 4.44Å; V351-M355 WeakPolarHBondContact O-CG 3.44Å; V351-M355 PolarHBondContact O-N 2.88Å
352	L	79.4	Confident	77.5	Confident	116 Å²	116	61 Å²	61	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-60.5	-44.7	177	-178.5	64.8	0	0	0	112.3	W348 E349 E350 N354 M355 V356	W348-L352 WeakPolarHBondContact O-CB 3.38Å; W348-L352 PolarHBondContact O-N 2.88Å; E349-L352 PolarHBondContact O-N 3.48Å; E350-L352 VanDerWaalsContact C-N 3.28Å; E350-L352 PolarHBondContact O-N 3.37Å; L352-N354 PolarHBondContact O-N 2.93Å; L352-M355 PolarHBondContact O-N 3.14Å; L352-V356 WeakPolarHBondContact O-CG2 3.37Å; L352-V356 PolarHBondContact O-N 3.47Å; L352-V356 VanDerWaalsContact O-N 3.09Å
353	F	78.3	Confident	79.2	Confident	54 Å²	54	57.5 Å²	57.5	24%	0.237	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-45.1	176.7	177.6	-95.1	0	0	0	111.8	F343 E349 E350 V351 M355 V356 V357	F343-F353 HydrophobicContact CB-CD1 4.27Å; F343-F353 HydrophobicContact CD1-CE1 4.23Å; F343-F353 AromaticContact CD2-CD1 3.31Å; F343-F353 HydrophobicContact CD2-CD1 3.31Å; F343-F353 AromaticContact CD2-CE1 3.34Å; F343-F353 HydrophobicContact CD2-CE1 3.34Å; F343-F353 HydrophobicContact CD2-CG 4.41Å; F343-F353 HydrophobicContact CD2-CZ 4.43Å; F343-F353 HydrophobicContact CE1-CE1 4.29Å; F343-F353 AromaticContact CE2-CD1 3.74Å; F343-F353 HydrophobicContact CE2-CD1 3.74Å; F343-F353 AromaticContact CE2-CE1 3.34Å; F343-F353 HydrophobicContact CE2-CE1 3.34Å; F343-F353 HydrophobicContact CE2-CZ 4.44Å; F343-F353 AromaticContact CG-CD1 3.86Å; F343-F353 HydrophobicContact CG-CD1 3.86Å; F343-F353 AromaticContact CG-CE1 3.78Å; F343-F353 HydrophobicContact CG-CE1 3.78Å; F343-F353 AromaticContact CZ-CE1 3.84Å; F343-F353 HydrophobicContact CZ-CE1 3.84Å; E349-F353 WeakPolarHBondContact O-CB 3.45Å; E349-F353 PolarHBondContact O-N 3.29Å; E350-F353 PolarHBondContact O-N 3.08Å; V351-F353 PolarHBondContact O-N 3.43Å; F353-M355 VanDerWaalsContact C-N 3.3Å; F353-M355 PolarHBondContact O-N 3.41Å; F353-V356 PolarHBondContact O-N 2.78Å; F353-V357 HydrophobicContact CD1-CG2 4.02Å; F353-V357 HydrophobicContact CE1-CG2 3.57Å; F353-V357 HydrophobicContact CE2-CG2 4.26Å; F353-V357 HydrophobicContact CZ-CG2 3.71Å; F353-V357 WeakPolarHBondContact O-CG2 3.34Å; F353-V357 PolarHBondContact O-N 2.82Å
354	N	82.9	Confident	80.8	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-35.7	177.6	-71.3	-24.9	0	0	0	112.5	V336 I337 T341 E350 V351 L352 V357 G358	V336-N354 HydrophobicContact CG1-CB 3.96Å; V336-N354 WeakPolarHBondContact CG1-OD1 3.38Å; I337-N354 HydrophobicContact CG1-CB 3.92Å; T341-N354 PolarHBondContact OG1-ND2 3.48Å; T341-N354 PolarHBondContact OG1-OD1 3.49Å; E350-N354 WeakPolarHBondContact O-CB 3.49Å; E350-N354 VanDerWaalsContact O-CG 3.28Å; E350-N354 PolarHBondContact O-N 3.43Å; E350-N354 PolarHBondContact O-ND2 2.98Å; V351-N354 PolarHBondContact O-N 2.84Å; L352-N354 PolarHBondContact O-N 2.93Å; N354-V357 PolarHBondContact O-N 3.35Å; N354-G358 PolarHBondContact O-N 2.9Å
355	M	85.5	Confident	82.4	Confident	61 Å²	61	55.5 Å²	55.5	30%	0.3	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-42.9	174.9	-68.9	-65.8	-89.7	0	0	111.8	W329 A333 V351 L352 F353 G358 V359	W329-M355 HydrophobicContact CH2-CE 3.23Å; W329-M355 HydrophobicContact CZ2-CB 4.49Å; W329-M355 HydrophobicContact CZ2-CE 3.2Å; W329-M355 HydrophobicContact CZ2-SD 4.05Å; W329-M355 HydrophobicContact CZ3-CE 4.22Å; W329-M355 PolarHBondContact NE1-O 2.91Å; A333-M355 HydrophobicContact CB-SD 3.78Å; V351-M355 HydrophobicContact CG1-CG 4.44Å; V351-M355 WeakPolarHBondContact O-CG 3.44Å; V351-M355 PolarHBondContact O-N 2.88Å; L352-M355 PolarHBondContact O-N 3.14Å; F353-M355 VanDerWaalsContact C-N 3.3Å; F353-M355 PolarHBondContact O-N 3.41Å; M355-G358 WeakPolarHBondContact O-CA 3.43Å; M355-G358 PolarHBondContact O-N 2.85Å; M355-V359 PolarHBondContact O-N 3Å
356	V	83.9	Confident	83.6	Confident	60 Å²	60	49 Å²	49	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-45.1	175.2	173.3	0	0	0	0	110.8	L228 L352 F353 G358 V359 V360	L228-V356 HydrophobicContact CD1-CG1 4.06Å; L352-V356 WeakPolarHBondContact O-CG2 3.37Å; L352-V356 PolarHBondContact O-N 3.47Å; L352-V356 VanDerWaalsContact O-N 3.09Å; F353-V356 PolarHBondContact O-N 2.78Å; V356-G358 VanDerWaalsContact C-N 3.26Å; V356-G358 PolarHBondContact O-N 2.89Å; V356-V359 WeakPolarHBondContact O-CB 3.39Å; V356-V359 PolarHBondContact O-N 2.95Å; V356-V359 VanDerWaalsContact O-N 3.1Å; V356-V360 PolarHBondContact O-N 2.83Å
357	V	84.8	Confident	83.9	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.024	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-37.5	173.6	167.8	0	0	0	0	111.3	V336 F353 N354 V359 V360 Y361 F366 V368	V336-V357 HydrophobicContact CG1-CG1 4.11Å; V336-V357 HydrophobicContact CG2-CG1 4.07Å; F353-V357 HydrophobicContact CD1-CG2 4.02Å; F353-V357 HydrophobicContact CE1-CG2 3.57Å; F353-V357 HydrophobicContact CE2-CG2 4.26Å; F353-V357 HydrophobicContact CZ-CG2 3.71Å; F353-V357 WeakPolarHBondContact O-CG2 3.34Å; F353-V357 PolarHBondContact O-N 2.82Å; N354-V357 PolarHBondContact O-N 3.35Å; V357-V359 VanDerWaalsContact C-N 3.27Å; V357-V359 PolarHBondContact O-N 3.43Å; V357-V360 WeakPolarHBondContact O-CB 3.5Å; V357-V360 PolarHBondContact O-N 3.44Å; V357-V360 VanDerWaalsContact O-N 3.1Å; V357-Y361 HydrophobicContact CG1-CD2 3.77Å; V357-Y361 HydrophobicContact CG1-CE2 3.66Å; V357-Y361 VanDerWaalsContact O-CD2 3.31Å; V357-Y361 WeakPolarHBondContact O-CD2 3.39Å; V357-Y361 PolarHBondContact O-N 3.16Å; V357-F366 HydrophobicContact CG1-CD1 4.14Å; V357-F366 HydrophobicContact CG2-CD1 4.32Å; V357-F366 HydrophobicContact CG2-CE1 4.14Å; V357-V368 HydrophobicContact CG1-CG2 3.33Å
358	G	89.9	Confident	83.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-55.6	-40.9	173	0	0	0	0	0	112.4	N354 M355 V356 Y361 V362	N354-G358 PolarHBondContact O-N 2.9Å; M355-G358 WeakPolarHBondContact O-CA 3.43Å; M355-G358 PolarHBondContact O-N 2.85Å; V356-G358 VanDerWaalsContact C-N 3.26Å; V356-G358 PolarHBondContact O-N 2.89Å; G358-Y361 WeakPolarHBondContact O-CB 3.38Å; G358-Y361 PolarHBondContact O-N 2.87Å; G358-V362 PolarHBondContact O-N 2.91Å
359	V	89.6	Confident	82.8	Confident	44 Å²	44	35.3 Å²	35.3	27%	0.267	18%	0.177	S	C	.	.	H	α-helix	trans	-62.4	-44.2	174.7	179	0	0	0	0	110.9	M355 V356 V357 Y361 V362	M355-V359 PolarHBondContact O-N 3Å; V356-V359 WeakPolarHBondContact O-CB 3.39Å; V356-V359 PolarHBondContact O-N 2.95Å; V356-V359 VanDerWaalsContact O-N 3.1Å; V357-V359 VanDerWaalsContact C-N 3.27Å; V357-V359 PolarHBondContact O-N 3.43Å; V359-Y361 VanDerWaalsContact C-N 3.25Å; V359-Y361 PolarHBondContact O-N 2.89Å; V359-V362 VanDerWaalsContact O-CB 3.3Å; V359-V362 WeakPolarHBondContact O-CB 3.32Å; V359-V362 WeakPolarHBondContact O-CG2 3.31Å; V359-V362 PolarHBondContact O-N 3.45Å
360	V	90.3	Very high	82.1	Confident	5 Å²	5	32 Å²	32	3%	0.03	16%	0.162	C	C	.	.	H	α-helix	trans	-58	-40.6	176.3	178.6	0	0	0	0	111.4	F231 V356 V357 V362 F363 C364 F366	F231-V360 HydrophobicContact CD1-CG2 4.33Å; F231-V360 HydrophobicContact CD2-CB 4.46Å; F231-V360 HydrophobicContact CD2-CG1 4.4Å; F231-V360 HydrophobicContact CD2-CG2 3.63Å; F231-V360 HydrophobicContact CE1-CB 4.37Å; F231-V360 HydrophobicContact CE1-CG1 3.98Å; F231-V360 HydrophobicContact CE1-CG2 4.49Å; F231-V360 HydrophobicContact CE2-CB 4.3Å; F231-V360 HydrophobicContact CE2-CG1 3.77Å; F231-V360 HydrophobicContact CE2-CG2 3.81Å; F231-V360 HydrophobicContact CG-CG2 3.93Å; F231-V360 HydrophobicContact CZ-CB 4.28Å; F231-V360 HydrophobicContact CZ-CG1 3.55Å; F231-V360 HydrophobicContact CZ-CG2 4.27Å; V356-V360 PolarHBondContact O-N 2.83Å; V357-V360 WeakPolarHBondContact O-CB 3.5Å; V357-V360 PolarHBondContact O-N 3.44Å; V357-V360 VanDerWaalsContact O-N 3.1Å; V360-V362 PolarHBondContact O-N 3.4Å; V360-F363 PolarHBondContact O-N 3.33Å; V360-F363 VanDerWaalsContact O-N 3.11Å; V360-C364 PolarHBondContact O-N 3.01Å; V360-C364 VanDerWaalsContact O-O 3.12Å; V360-F366 HydrophobicContact CG1-CB 3.65Å; V360-F366 HydrophobicContact CG1-CD2 4.15Å; V360-F366 HydrophobicContact CG1-CG 4.05Å
361	Y	91.4	Very high	81.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.6	-22.3	-179.2	-94.1	-113	0	0	0	114.3	M332 V336 V357 G358 V359 F363 C364 W365 F366 V368 Y380	M332-Y361 HydrophobicContact SD-CD1 4.04Å; V336-Y361 HydrophobicContact CG2-CD2 4.35Å; V336-Y361 HydrophobicContact CG2-CE1 4.5Å; V336-Y361 HydrophobicContact CG2-CE2 4.15Å; V357-Y361 HydrophobicContact CG1-CD2 3.77Å; V357-Y361 HydrophobicContact CG1-CE2 3.66Å; V357-Y361 VanDerWaalsContact O-CD2 3.31Å; V357-Y361 WeakPolarHBondContact O-CD2 3.39Å; V357-Y361 PolarHBondContact O-N 3.16Å; G358-Y361 WeakPolarHBondContact O-CB 3.38Å; G358-Y361 PolarHBondContact O-N 2.87Å; V359-Y361 VanDerWaalsContact C-N 3.25Å; V359-Y361 PolarHBondContact O-N 2.89Å; Y361-F363 PolarHBondContact O-N 2.98Å; Y361-C364 WeakPolarHBondContact CA-O 3.24Å; Y361-W365 AromaticContact CE1-CE3 3.66Å; Y361-W365 HydrophobicContact CE1-CE3 3.66Å; Y361-W365 HydrophobicContact CE1-CH2 4.47Å; Y361-W365 AromaticContact CE1-CZ3 3.57Å; Y361-W365 HydrophobicContact CE1-CZ3 3.57Å; Y361-W365 AromaticContact CZ-CZ3 3.99Å; Y361-F366 HydrophobicContact CD2-CB 4.07Å; Y361-F366 HydrophobicContact CE2-CB 3.79Å; Y361-F366 WeakPolarHBondContact CE2-O 3.15Å; Y361-F366 PolarHBondContact OH-O 3.32Å; Y361-V368 HydrophobicContact CE2-CG2 3.74Å; Y361-Y380 AromaticContact CD1-CD2 3.95Å; Y361-Y380 HydrophobicContact CD1-CD2 3.95Å; Y361-Y380 AromaticContact CD1-CE2 3.75Å; Y361-Y380 HydrophobicContact CD1-CE2 3.75Å; Y361-Y380 HydrophobicContact CE1-CD2 4.26Å; Y361-Y380 HydrophobicContact CE1-CE2 4.42Å; Y361-Y380 HydrophobicContact CG-CE2 4.46Å; Y361-Y380 WeakPolarHBondContact O-CE2 3.36Å; Y361-Y380 PolarHBondContact O-OH 2.87Å
362	V	92.9	Very high	80.4	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-37	172.3	179.5	0	0	0	0	111.1	R306 F310 W329 G358 V359 V360	R306-V362 PolarHBondContact NE-O 2.88Å; R306-V362 PolarHBondContact NH2-O 3.48Å; F310-V362 HydrophobicContact CE2-CG1 3.95Å; F310-V362 HydrophobicContact CZ-CG1 4.04Å; W329-V362 HydrophobicContact CB-CG2 3.95Å; G358-V362 PolarHBondContact O-N 2.91Å; V359-V362 VanDerWaalsContact O-CB 3.3Å; V359-V362 WeakPolarHBondContact O-CB 3.32Å; V359-V362 WeakPolarHBondContact O-CG2 3.31Å; V359-V362 PolarHBondContact O-N 3.45Å; V360-V362 PolarHBondContact O-N 3.4Å
363	F	93.3	Very high	80.2	Confident	20 Å²	20	38 Å²	38	9%	0.088	19%	0.19	C	C	.	.	H	α-helix	trans	-101.6	-40.8	-175.1	-64.1	-81.9	0	0	0	113.1	F231 A235 P236 V239 V307 F310 V360 Y361	F231-F363 AromaticContact CD1-CD2 3.98Å; F231-F363 HydrophobicContact CD1-CD2 3.98Å; F231-F363 HydrophobicContact CE1-CB 4.03Å; F231-F363 HydrophobicContact CE1-CD2 4.3Å; F231-F363 HydrophobicContact CE1-CG 4.47Å; A235-F363 HydrophobicContact CB-CD1 3.97Å; A235-F363 HydrophobicContact CB-CD2 4.16Å; A235-F363 HydrophobicContact CB-CE1 3.82Å; A235-F363 HydrophobicContact CB-CE2 4.02Å; A235-F363 HydrophobicContact CB-CG 4.14Å; A235-F363 HydrophobicContact CB-CZ 3.84Å; P236-F363 HydrophobicContact CG-CZ 4.44Å; V239-F363 HydrophobicContact CG2-CE1 4.17Å; V307-F363 HydrophobicContact CG2-CD1 4.23Å; F310-F363 HydrophobicContact CD2-CD1 4.43Å; F310-F363 HydrophobicContact CD2-CE1 4.16Å; F310-F363 HydrophobicContact CE2-CD1 4.14Å; F310-F363 HydrophobicContact CE2-CE1 4.11Å; V360-F363 PolarHBondContact O-N 3.33Å; V360-F363 VanDerWaalsContact O-N 3.11Å; Y361-F363 PolarHBondContact O-N 2.98Å
364	C	92.7	Very high	80.3	Confident	4 Å²	4	44.8 Å²	44.8	3%	0.027	21%	0.214	C	C	.	.	S	Bend	trans	-154.2	156	-174	77.6	0	0	0	0	115	I303 V360 Y361 F366 Y380	I303-C364 HydrophobicContact CD1-CB 3.94Å; I303-C364 HydrophobicContact CG1-CB 3.8Å; V360-C364 PolarHBondContact O-N 3.01Å; V360-C364 VanDerWaalsContact O-O 3.12Å; Y361-C364 WeakPolarHBondContact CA-O 3.24Å; C364-F366 PolarHBondContact O-N 3.04Å; C364-Y380 VanDerWaalsContact CA-OH 3.23Å; C364-Y380 WeakPolarHBondContact CA-OH 3.37Å; C364-Y380 PolarHBondContact N-OH 3.38Å; C364-Y380 PolarHBondContact O-OH 3.33Å
365	W	89.3	Confident	80.4	Confident	3 Å²	3	53 Å²	53	1%	0.011	25%	0.246	C	C	.	.			trans	-67.3	115.8	175.1	174.9	-104.3	0	0	0	111.5	R299 Y361 R376 M377 Y380 Y381	R299-W365 VanDerWaalsContact CZ-O 3.24Å; R299-W365 PolarHBondContact NH1-O 2.85Å; R299-W365 PolarHBondContact NH2-O 3.38Å; Y361-W365 AromaticContact CE1-CE3 3.66Å; Y361-W365 HydrophobicContact CE1-CE3 3.66Å; Y361-W365 HydrophobicContact CE1-CH2 4.47Å; Y361-W365 AromaticContact CE1-CZ3 3.57Å; Y361-W365 HydrophobicContact CE1-CZ3 3.57Å; Y361-W365 AromaticContact CZ-CZ3 3.99Å; W365-R376 HydrophobicContact CH2-CB 3.73Å; W365-R376 HydrophobicContact CZ2-CB 4.41Å; W365-M377 HydrophobicContact CZ2-CB 4.36Å; W365-Y380 HydrophobicContact CB-CD1 3.64Å; W365-Y380 HydrophobicContact CB-CE1 3.53Å; W365-Y380 HydrophobicContact CB-CG 4.44Å; W365-Y380 HydrophobicContact CD2-CD1 4.29Å; W365-Y380 HydrophobicContact CD2-CG 4.32Å; W365-Y380 VanDerWaalsContact CE3-CB 3.46Å; W365-Y380 AromaticContact CE3-CD1 3.77Å; W365-Y380 HydrophobicContact CE3-CD1 3.77Å; W365-Y380 AromaticContact CE3-CD2 3.8Å; W365-Y380 HydrophobicContact CE3-CD2 3.8Å; W365-Y380 HydrophobicContact CE3-CE1 4.47Å; W365-Y380 HydrophobicContact CE3-CE2 4.5Å; W365-Y380 AromaticContact CE3-CG 3.38Å; W365-Y380 HydrophobicContact CE3-CG 3.38Å; W365-Y380 HydrophobicContact CG-CD1 4.29Å; W365-Y380 HydrophobicContact CZ3-CD2 4.31Å; W365-Y380 HydrophobicContact CZ3-CG 4.02Å; W365-Y380 PolarHBondContact N-OH 3.46Å; W365-Y381 HydrophobicContact CB-CE2 4.3Å
366	F	82.3	Confident	80.4	Confident	13 Å²	13	52.3 Å²	52.3	6%	0.057	24%	0.24	C	C	.	.			trans	-113.4	123.8	174.9	-175.3	-99.6	0	0	0	110.3	L227 Y273 V357 V360 Y361 C364 V368	L227-F366 HydrophobicContact CD2-CE2 3.92Å; L227-F366 HydrophobicContact CD2-CZ 4.1Å; Y273-F366 AromaticContact CD1-CE2 3.66Å; Y273-F366 HydrophobicContact CD1-CE2 3.66Å; Y273-F366 HydrophobicContact CD1-CZ 4.15Å; Y273-F366 HydrophobicContact CE1-CD2 4.48Å; Y273-F366 HydrophobicContact CE1-CE1 4.49Å; Y273-F366 AromaticContact CE1-CE2 3.22Å; Y273-F366 HydrophobicContact CE1-CE2 3.22Å; Y273-F366 AromaticContact CE1-CZ 3.24Å; Y273-F366 HydrophobicContact CE1-CZ 3.24Å; Y273-F366 AromaticContact CZ-CZ 3.67Å; V357-F366 HydrophobicContact CG1-CD1 4.14Å; V357-F366 HydrophobicContact CG2-CD1 4.32Å; V357-F366 HydrophobicContact CG2-CE1 4.14Å; V360-F366 HydrophobicContact CG1-CB 3.65Å; V360-F366 HydrophobicContact CG1-CD2 4.15Å; V360-F366 HydrophobicContact CG1-CG 4.05Å; Y361-F366 HydrophobicContact CD2-CB 4.07Å; Y361-F366 HydrophobicContact CE2-CB 3.79Å; Y361-F366 WeakPolarHBondContact CE2-O 3.15Å; Y361-F366 PolarHBondContact OH-O 3.32Å; C364-F366 PolarHBondContact O-N 3.04Å; F366-V368 HydrophobicContact CD1-CG2 3.78Å; F366-V368 HydrophobicContact CE1-CG2 4.37Å; F366-V368 PolarHBondContact O-N 2.91Å
367	N	77.1	Confident	80.6	Confident	41 Å²	41	50.2 Å²	50.2	22%	0.219	23%	0.226	C	C	.	.			trans	-82.6	110.5	-174.9	-172.3	18.9	0	0	0	112	R369	N367-R369 PolarHBondContact OD1-N 3.15Å; N367-R369 PolarHBondContact OD1-O 3.44Å; N367-R369 VanDerWaalsContact OD1-O 3.09Å
368	V	65.6	Low	80.9	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.024	25%	0.251	C	S	.	.			trans	-98.7	-27.7	-175.6	-173.5	0	0	0	0	112.6	V336 T341 F343 V357 Y361 F366 P532	V336-V368 HydrophobicContact CG1-CG1 4.31Å; T341-V368 HydrophobicContact CG2-CG1 3.73Å; F343-V368 HydrophobicContact CE2-CG1 3.29Å; F343-V368 HydrophobicContact CZ-CB 4.43Å; F343-V368 HydrophobicContact CZ-CG1 3.28Å; F343-V368 VanDerWaalsContact CZ-O 3.22Å; F343-V368 WeakPolarHBondContact CZ-O 3.28Å; V357-V368 HydrophobicContact CG1-CG2 3.33Å; Y361-V368 HydrophobicContact CE2-CG2 3.74Å; F366-V368 HydrophobicContact CD1-CG2 3.78Å; F366-V368 HydrophobicContact CE1-CG2 4.37Å; F366-V368 PolarHBondContact O-N 2.91Å; V368-P532 WeakPolarHBondContact O-CD 3.3Å
369	R	60.2	Low	81	Confident	105 Å²	105	56 Å²	56	40%	0.396	26%	0.262	S	S	.	.	S	Bend	trans	-128.4	137.2	-174.7	-168.8	170.4	176.2	-167.1	0.1	113.3	G339 N367 Y531 P532	G339-R369 WeakPolarHBondContact O-CD 3.49Å; G339-R369 PolarHBondContact O-NH1 2.97Å; N367-R369 PolarHBondContact OD1-N 3.15Å; N367-R369 PolarHBondContact OD1-O 3.44Å; N367-R369 VanDerWaalsContact OD1-O 3.09Å; R369-Y531 HydrophobicContact CB-CD1 4.26Å; R369-Y531 HydrophobicContact CG-CD1 3.8Å; R369-Y531 HydrophobicContact CG-CE1 3.95Å; R369-P532 WeakPolarHBondContact O-CG 3.36Å
370	E	57.7	Low	81.1	Confident	41 Å²	41	54.4 Å²	54.4	19%	0.192	25%	0.251	C	S	.	.			trans	-88.4	122.3	-179.2	-125.6	161.3	-150.3	0	0	108.6	R281 K284 R530 P532	R281-E370 IonicContact CZ-OE1 3.22Å; R281-E370 IonicContact CZ-OE2 2.73Å; R281-E370 VanDerWaalsContact CZ-OE2 3.22Å; R281-E370 IonicContact NH1-OE1 3.41Å; R281-E370 PolarHBondContact NH1-OE1 2.81Å; R281-E370 IonicContact NH1-OE2 3.93Å; R281-E370 PolarHBondContact NH1-OE2 3.33Å; R281-E370 IonicContact NH2-OE2 3.12Å; R281-E370 PolarHBondContact NH2-OE2 2.93Å; K284-E370 IonicContact NZ-OE1 2.66Å; K284-E370 PolarHBondContact NZ-OE1 2.91Å; E370-R530 PolarHBondContact N-O 2.78Å; E370-P532 HydrophobicContact CB-CB 4.34Å; E370-P532 HydrophobicContact CB-CG 4.16Å; E370-P532 HydrophobicContact CG-CB 3.85Å; E370-P532 HydrophobicContact CG-CG 4.16Å; E370-P532 WeakPolarHBondContact OE1-CA 3.18Å
371	G	59.2	Low	81.3	Confident	58 Å²	58	55 Å²	55	60%	0.598	25%	0.253	S	S	*	.	S	Bend	trans	169.5	-156.9	-173.4	0	0	0	0	0	112.4	T373	G371-T373 WeakPolarHBondContact O-CG2 3.08Å; G371-T373 PolarHBondContact O-N 2.99Å
372	R	63.1	Low	81.5	Confident	240 Å²	240	59.1 Å²	59.1	91%	0.906	28%	0.278	S	S	*	.			trans	-68.6	73.9	173.2	-66.2	-179.6	-179	169.1	-0	110	R374	R372-R374 VanDerWaalsContact C-N 3.28Å; R372-R374 PolarHBondContact O-N 3.4Å
373	T	73.9	Confident	81.6	Confident	34 Å²	34	61.3 Å²	61.3	21%	0.209	29%	0.291	C	S	.	.	H	α-helix	trans	-73.1	-18.3	-173.8	53.2	0	0	0	0	113.5	G371 R376 M377	G371-T373 WeakPolarHBondContact O-CG2 3.08Å; G371-T373 PolarHBondContact O-N 2.99Å; T373-R376 PolarHBondContact O-N 3.17Å; T373-M377 WeakPolarHBondContact O-CB 3.34Å; T373-M377 PolarHBondContact O-N 2.98Å
374	R	81.3	Confident	81.7	Confident	197 Å²	197	60.7 Å²	60.7	74%	0.743	29%	0.289	S	S	*	.	H	α-helix	trans	-57.6	-52.7	-177.6	-63.6	-176.1	-176.3	173	1.2	112.3	R372 R376 M377 V378	R372-R374 VanDerWaalsContact C-N 3.28Å; R372-R374 PolarHBondContact O-N 3.4Å; R374-R376 PolarHBondContact O-N 2.98Å; R374-M377 PolarHBondContact O-N 3.33Å; R374-V378 WeakPolarHBondContact O-CG2 3.29Å; R374-V378 PolarHBondContact O-N 3.5Å
375	Y	83.8	Confident	81.8	Confident	175 Å²	175	63.7 Å²	63.7	69%	0.686	31%	0.305	S	S	*	.	H	α-helix	trans	-63.5	-45.7	-178.5	-179.2	-100.9	0	0	0	111.7	M377 V378 V379	Y375-M377 VanDerWaalsContact C-N 3.3Å; Y375-M377 PolarHBondContact O-N 2.95Å; Y375-V378 PolarHBondContact O-N 3.23Å; Y375-V379 HydrophobicContact CD1-CG2 4.06Å; Y375-V379 HydrophobicContact CD2-CG2 4.48Å; Y375-V379 HydrophobicContact CE1-CG2 3.62Å; Y375-V379 HydrophobicContact CE2-CG2 4.08Å; Y375-V379 HydrophobicContact CG-CG2 4.47Å; Y375-V379 WeakPolarHBondContact O-CG2 3.37Å; Y375-V379 PolarHBondContact O-N 3.31Å
376	R	86.6	Confident	82.2	Confident	47 Å²	47	68.7 Å²	68.7	18%	0.177	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-39.7	178.7	-59.8	-179.7	69.3	-158.9	4.3	112.3	W365 T373 R374 Y380	W365-R376 HydrophobicContact CH2-CB 3.73Å; W365-R376 HydrophobicContact CZ2-CB 4.41Å; T373-R376 PolarHBondContact O-N 3.17Å; R374-R376 PolarHBondContact O-N 2.98Å; R376-Y380 WeakPolarHBondContact O-CB 3.23Å; R376-Y380 PolarHBondContact O-N 3.39Å
377	M	87.4	Confident	82.8	Confident	15 Å²	15	69.7 Å²	69.7	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-45.1	176.4	-176.5	179.7	-72.4	0	0	111.2	W298 W365 T373 R374 Y375 Y380 Y381 M426 Y430	W298-M377 HydrophobicContact CH2-CE 4.13Å; W365-M377 HydrophobicContact CZ2-CB 4.36Å; T373-M377 WeakPolarHBondContact O-CB 3.34Å; T373-M377 PolarHBondContact O-N 2.98Å; R374-M377 PolarHBondContact O-N 3.33Å; Y375-M377 VanDerWaalsContact C-N 3.3Å; Y375-M377 PolarHBondContact O-N 2.95Å; M377-Y380 PolarHBondContact O-N 2.77Å; M377-Y381 HydrophobicContact CG-CD2 3.65Å; M377-Y381 HydrophobicContact CG-CE2 3.56Å; M377-Y381 WeakPolarHBondContact O-CD2 3.27Å; M377-Y381 PolarHBondContact O-N 2.96Å; M377-Y381 HydrophobicContact SD-CE2 4.3Å; M377-M426 HydrophobicContact CG-SD 4.27Å; M377-M426 HydrophobicContact SD-SD 3.55Å; M377-Y430 HydrophobicContact CE-CE2 4.06Å; M377-Y430 HydrophobicContact SD-CE2 4.13Å
378	V	90.6	Very high	83.8	Confident	90 Å²	90	67.8 Å²	67.8	55%	0.545	33%	0.325	S	S	.	.	H	α-helix	trans	-59.6	-50.6	175.9	170.4	0	0	0	0	110.6	R374 Y375 Y380 Y381 T382	R374-V378 WeakPolarHBondContact O-CG2 3.29Å; R374-V378 PolarHBondContact O-N 3.5Å; Y375-V378 PolarHBondContact O-N 3.23Å; V378-Y380 VanDerWaalsContact C-N 3.31Å; V378-Y380 PolarHBondContact O-N 3.5Å; V378-Y381 PolarHBondContact O-N 3.29Å; V378-T382 WeakPolarHBondContact O-CB 3.47Å; V378-T382 PolarHBondContact O-N 2.64Å; V378-T382 PolarHBondContact O-OG1 2.98Å
379	V	92	Very high	85.3	Confident	36 Å²	36	68.9 Å²	68.9	22%	0.218	34%	0.335	C	S	.	.	H	α-helix	trans	-55	-47.7	177.7	171.4	0	0	0	0	111.1	W335 Y375 T382 V383	W335-V379 HydrophobicContact CH2-CG1 4.06Å; W335-V379 HydrophobicContact CZ2-CG1 4.41Å; Y375-V379 HydrophobicContact CD1-CG2 4.06Å; Y375-V379 HydrophobicContact CD2-CG2 4.48Å; Y375-V379 HydrophobicContact CE1-CG2 3.62Å; Y375-V379 HydrophobicContact CE2-CG2 4.08Å; Y375-V379 HydrophobicContact CG-CG2 4.47Å; Y375-V379 WeakPolarHBondContact O-CG2 3.37Å; Y375-V379 PolarHBondContact O-N 3.31Å; V379-T382 PolarHBondContact O-N 2.96Å; V379-V383 WeakPolarHBondContact O-CG2 3.46Å; V379-V383 PolarHBondContact O-N 2.57Å
380	Y	92.6	Very high	87	Confident	10 Å²	10	68 Å²	68	4%	0.039	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-49.6	178.6	176.4	-91.8	0	0	0	112.6	M332 Y361 C364 W365 R376 M377 V378 T382 V383 V384	M332-Y380 HydrophobicContact SD-CD2 4.41Å; M332-Y380 HydrophobicContact SD-CE2 4.35Å; Y361-Y380 AromaticContact CD1-CD2 3.95Å; Y361-Y380 HydrophobicContact CD1-CD2 3.95Å; Y361-Y380 AromaticContact CD1-CE2 3.75Å; Y361-Y380 HydrophobicContact CD1-CE2 3.75Å; Y361-Y380 HydrophobicContact CE1-CD2 4.26Å; Y361-Y380 HydrophobicContact CE1-CE2 4.42Å; Y361-Y380 HydrophobicContact CG-CE2 4.46Å; Y361-Y380 WeakPolarHBondContact O-CE2 3.36Å; Y361-Y380 PolarHBondContact O-OH 2.87Å; C364-Y380 VanDerWaalsContact CA-OH 3.23Å; C364-Y380 WeakPolarHBondContact CA-OH 3.37Å; C364-Y380 PolarHBondContact N-OH 3.38Å; C364-Y380 PolarHBondContact O-OH 3.33Å; W365-Y380 HydrophobicContact CB-CD1 3.64Å; W365-Y380 HydrophobicContact CB-CE1 3.53Å; W365-Y380 HydrophobicContact CB-CG 4.44Å; W365-Y380 HydrophobicContact CD2-CD1 4.29Å; W365-Y380 HydrophobicContact CD2-CG 4.32Å; W365-Y380 VanDerWaalsContact CE3-CB 3.46Å; W365-Y380 AromaticContact CE3-CD1 3.77Å; W365-Y380 HydrophobicContact CE3-CD1 3.77Å; W365-Y380 AromaticContact CE3-CD2 3.8Å; W365-Y380 HydrophobicContact CE3-CD2 3.8Å; W365-Y380 HydrophobicContact CE3-CE1 4.47Å; W365-Y380 HydrophobicContact CE3-CE2 4.5Å; W365-Y380 AromaticContact CE3-CG 3.38Å; W365-Y380 HydrophobicContact CE3-CG 3.38Å; W365-Y380 HydrophobicContact CG-CD1 4.29Å; W365-Y380 HydrophobicContact CZ3-CD2 4.31Å; W365-Y380 HydrophobicContact CZ3-CG 4.02Å; W365-Y380 PolarHBondContact N-OH 3.46Å; R376-Y380 WeakPolarHBondContact O-CB 3.23Å; R376-Y380 PolarHBondContact O-N 3.39Å; M377-Y380 PolarHBondContact O-N 2.77Å; V378-Y380 VanDerWaalsContact C-N 3.31Å; V378-Y380 PolarHBondContact O-N 3.5Å; Y380-T382 VanDerWaalsContact C-N 3.28Å; Y380-T382 PolarHBondContact O-N 2.91Å; Y380-V383 PolarHBondContact O-N 3.2Å; Y380-V384 HydrophobicContact CD1-CG2 4.07Å; Y380-V384 HydrophobicContact CD2-CG2 4.44Å; Y380-V384 HydrophobicContact CE1-CG2 3.57Å; Y380-V384 HydrophobicContact CE2-CG2 4Å; Y380-V384 HydrophobicContact CG-CG2 4.48Å; Y380-V384 WeakPolarHBondContact O-CG2 3.23Å; Y380-V384 PolarHBondContact O-N 3.15Å
381	Y	94.2	Very high	88.8	Confident	18 Å²	18	66.3 Å²	66.3	7%	0.071	33%	0.329	C	S	.	.	H	α-helix	trans	-65.7	-32.4	-179.8	-81.1	-68.5	0	0	0	112.5	W298 T302 W365 M377 V378 L385 F419 M426	W298-Y381 HydrophobicContact CZ2-CE2 4.21Å; W298-Y381 WeakPolarHBondContact CZ2-OH 3.47Å; W298-Y381 AromaticContact NE1-CZ 3.83Å; W298-Y381 PolarHBondContact NE1-OH 3.44Å; T302-Y381 HydrophobicContact CG2-CE1 3.89Å; W365-Y381 HydrophobicContact CB-CE2 4.3Å; M377-Y381 HydrophobicContact CG-CD2 3.65Å; M377-Y381 HydrophobicContact CG-CE2 3.56Å; M377-Y381 WeakPolarHBondContact O-CD2 3.27Å; M377-Y381 PolarHBondContact O-N 2.96Å; M377-Y381 HydrophobicContact SD-CE2 4.3Å; V378-Y381 PolarHBondContact O-N 3.29Å; Y381-L385 VanDerWaalsContact O-CB 3.28Å; Y381-L385 WeakPolarHBondContact O-CB 3.49Å; Y381-L385 PolarHBondContact O-N 2.99Å; Y381-F419 HydrophobicContact CD1-CE2 4.05Å; Y381-F419 AromaticContact CD1-CZ 3.97Å; Y381-F419 HydrophobicContact CD1-CZ 3.97Å; Y381-F419 WeakPolarHBondContact O-CZ 3.3Å; Y381-M426 HydrophobicContact CD2-SD 4.15Å; Y381-M426 HydrophobicContact CE2-SD 3.63Å
382	T	95.1	Very high	90.5	Very high	86 Å²	86	63.7 Å²	63.7	53%	0.528	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-44.7	172.5	-58	0	0	0	0	111.6	V378 V379 Y380 L385 L386	V378-T382 WeakPolarHBondContact O-CB 3.47Å; V378-T382 PolarHBondContact O-N 2.64Å; V378-T382 PolarHBondContact O-OG1 2.98Å; V379-T382 PolarHBondContact O-N 2.96Å; Y380-T382 VanDerWaalsContact C-N 3.28Å; Y380-T382 PolarHBondContact O-N 2.91Å; T382-L385 PolarHBondContact O-N 2.92Å; T382-L386 WeakPolarHBondContact O-CB 3.37Å; T382-L386 PolarHBondContact O-N 2.94Å
383	V	95.3	Very high	92.1	Very high	51 Å²	51	55.8 Å²	55.8	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-47.8	175.3	170.1	0	0	0	0	110.6	M332 V379 Y380 L385 L386 E387	M332-V383 HydrophobicContact CE-CG1 4.3Å; V379-V383 WeakPolarHBondContact O-CG2 3.46Å; V379-V383 PolarHBondContact O-N 2.57Å; Y380-V383 PolarHBondContact O-N 3.2Å; V383-L385 PolarHBondContact O-N 3.47Å; V383-L386 PolarHBondContact O-N 3.22Å; V383-E387 HydrophobicContact CG1-CG 4.35Å; V383-E387 WeakPolarHBondContact O-CB 3.37Å; V383-E387 WeakPolarHBondContact O-CG 3.42Å; V383-E387 PolarHBondContact O-N 3.43Å
384	V	94.9	Very high	93.1	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-40.5	178.9	172	0	0	0	0	111.9	Y380 E387 N388 F419	Y380-V384 HydrophobicContact CD1-CG2 4.07Å; Y380-V384 HydrophobicContact CD2-CG2 4.44Å; Y380-V384 HydrophobicContact CE1-CG2 3.57Å; Y380-V384 HydrophobicContact CE2-CG2 4Å; Y380-V384 HydrophobicContact CG-CG2 4.48Å; Y380-V384 WeakPolarHBondContact O-CG2 3.23Å; Y380-V384 PolarHBondContact O-N 3.15Å; V384-E387 PolarHBondContact O-N 3.21Å; V384-N388 VanDerWaalsContact O-CB 3.3Å; V384-N388 WeakPolarHBondContact O-CB 3.13Å; V384-N388 PolarHBondContact O-N 3.4Å; V384-N388 PolarHBondContact O-OD1 2.87Å; V384-F419 HydrophobicContact CG1-CE2 4.09Å
385	L	96.1	Very high	93.7	Very high	68 Å²	68	48 Å²	48	36%	0.356	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.7	178	60.5	0	0	0	111.4	Y381 T382 V383 N388 A389 F416 F419	Y381-L385 VanDerWaalsContact O-CB 3.28Å; Y381-L385 WeakPolarHBondContact O-CB 3.49Å; Y381-L385 PolarHBondContact O-N 2.99Å; T382-L385 PolarHBondContact O-N 2.92Å; V383-L385 PolarHBondContact O-N 3.47Å; L385-N388 PolarHBondContact O-N 3.49Å; L385-A389 WeakPolarHBondContact O-CB 3.4Å; L385-A389 PolarHBondContact O-N 2.86Å; L385-F416 HydrophobicContact CD1-CD1 4.41Å; L385-F416 HydrophobicContact CD1-CE1 4.4Å; L385-F419 HydrophobicContact CB-CE1 3.9Å; L385-F419 HydrophobicContact CB-CE2 4.46Å; L385-F419 HydrophobicContact CB-CZ 3.79Å; L385-F419 HydrophobicContact CD1-CD1 3.79Å; L385-F419 HydrophobicContact CD1-CE1 3.83Å; L385-F419 HydrophobicContact CD1-CG 4.35Å; L385-F419 HydrophobicContact CD1-CZ 4.42Å; L385-F419 HydrophobicContact CD2-CE1 4.15Å; L385-F419 HydrophobicContact CG-CE1 4.17Å
386	L	96.9	Very high	94.2	Very high	107 Å²	107	45.6 Å²	45.6	56%	0.56	25%	0.246	S	C	*	.	H	α-helix	trans	-62.8	-46.6	178.6	179.2	63.3	0	0	0	111.1	T382 V383 A389 I390	T382-L386 WeakPolarHBondContact O-CB 3.37Å; T382-L386 PolarHBondContact O-N 2.94Å; V383-L386 PolarHBondContact O-N 3.22Å; L386-A389 PolarHBondContact O-N 3.43Å; L386-I390 HydrophobicContact CD1-CD1 4.06Å; L386-I390 HydrophobicContact CD1-CG1 4.39Å; L386-I390 HydrophobicContact CG-CD1 3.89Å; L386-I390 VanDerWaalsContact O-CG1 3.29Å; L386-I390 WeakPolarHBondContact O-CG1 3.39Å; L386-I390 PolarHBondContact O-N 3.37Å
387	E	96.3	Very high	94.5	Very high	34 Å²	34	46.8 Å²	46.8	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-46.4	176.4	-73.1	176.8	168.7	0	0	111.6	R306 F324 H328 V383 V384 A389 I390 L391	R306-E387 IonicContact CZ-OE2 2.65Å; R306-E387 IonicContact NH1-OE2 3.4Å; R306-E387 PolarHBondContact NH1-OE2 3.39Å; R306-E387 IonicContact NH2-OE2 3.44Å; R306-E387 PolarHBondContact NH2-OE2 3.09Å; F324-E387 HydrophobicContact CZ-CG 4.47Å; H328-E387 VanDerWaalsContact CE1-CD 3.48Å; H328-E387 IonicContact CE1-OE1 3.82Å; H328-E387 PolarHBondContact CE1-OE1 3.09Å; H328-E387 IonicContact CE1-OE2 3.82Å; H328-E387 PolarHBondContact CE1-OE2 2.92Å; H328-E387 VanDerWaalsContact ND1-CD 3.34Å; H328-E387 IonicContact ND1-OE1 3.86Å; H328-E387 PolarHBondContact ND1-OE1 3.49Å; H328-E387 IonicContact ND1-OE2 2.91Å; H328-E387 PolarHBondContact ND1-OE2 2.9Å; V383-E387 HydrophobicContact CG1-CG 4.35Å; V383-E387 WeakPolarHBondContact O-CB 3.37Å; V383-E387 WeakPolarHBondContact O-CG 3.42Å; V383-E387 PolarHBondContact O-N 3.43Å; V384-E387 PolarHBondContact O-N 3.21Å; E387-A389 PolarHBondContact O-N 2.75Å; E387-I390 PolarHBondContact O-N 3.38Å; E387-L391 WeakPolarHBondContact O-CB 3.49Å; E387-L391 WeakPolarHBondContact O-CG 3.33Å; E387-L391 PolarHBondContact O-N 2.97Å
388	N	96.5	Very high	94.8	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-38.3	177.8	-72.1	4.5	0	0	0	111.2	S305 R306 S309 V384 L385 T392 V415	S305-N388 PolarHBondContact OG-ND2 3.49Å; R306-N388 WeakPolarHBondContact CD-OD1 3.35Å; R306-N388 PolarHBondContact NH1-OD1 3.45Å; S309-N388 WeakPolarHBondContact OG-CA 3.33Å; S309-N388 PolarHBondContact OG-O 3.13Å; V384-N388 VanDerWaalsContact O-CB 3.3Å; V384-N388 WeakPolarHBondContact O-CB 3.13Å; V384-N388 PolarHBondContact O-N 3.4Å; V384-N388 PolarHBondContact O-OD1 2.87Å; L385-N388 PolarHBondContact O-N 3.49Å; N388-T392 WeakPolarHBondContact O-CB 3.42Å; N388-T392 VanDerWaalsContact O-CG2 3.3Å; N388-T392 WeakPolarHBondContact O-CG2 3.45Å; N388-T392 PolarHBondContact O-N 2.9Å; N388-T392 PolarHBondContact O-OG1 3.25Å; N388-V415 HydrophobicContact CB-CG1 4.39Å
389	A	96.9	Very high	94.7	Very high	28 Å²	28	50.5 Å²	50.5	23%	0.231	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-49.1	174.6	0	0	0	0	0	111.4	L385 L386 E387 L391 T392 S393 F416	L385-A389 WeakPolarHBondContact O-CB 3.4Å; L385-A389 PolarHBondContact O-N 2.86Å; L386-A389 PolarHBondContact O-N 3.43Å; E387-A389 PolarHBondContact O-N 2.75Å; A389-L391 PolarHBondContact O-N 3.24Å; A389-T392 PolarHBondContact O-N 3.31Å; A389-T392 PolarHBondContact O-OG1 3.44Å; A389-T392 VanDerWaalsContact O-OG1 3.13Å; A389-S393 VanDerWaalsContact O-CB 3.24Å; A389-S393 WeakPolarHBondContact O-CB 3.4Å; A389-S393 PolarHBondContact O-N 3.29Å; A389-S393 PolarHBondContact O-OG 2.94Å; A389-F416 HydrophobicContact CB-CE1 4.3Å; A389-F416 HydrophobicContact CB-CZ 4.29Å
390	I	96.7	Very high	94.5	Very high	86 Å²	86	53.1 Å²	53.1	44%	0.441	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-49.2	178.6	-68.5	165.9	0	0	0	110.9	L386 E387 T392 S393 L394	L386-I390 HydrophobicContact CD1-CD1 4.06Å; L386-I390 HydrophobicContact CD1-CG1 4.39Å; L386-I390 HydrophobicContact CG-CD1 3.89Å; L386-I390 VanDerWaalsContact O-CG1 3.29Å; L386-I390 WeakPolarHBondContact O-CG1 3.39Å; L386-I390 PolarHBondContact O-N 3.37Å; E387-I390 PolarHBondContact O-N 3.38Å; I390-T392 PolarHBondContact O-N 2.86Å; I390-S393 PolarHBondContact O-N 3.44Å; I390-L394 HydrophobicContact CG2-CD1 3.81Å; I390-L394 HydrophobicContact CG2-CG 4.35Å; I390-L394 WeakPolarHBondContact O-CB 3.42Å; I390-L394 VanDerWaalsContact O-CG 3.26Å; I390-L394 WeakPolarHBondContact O-CG 3.44Å; I390-L394 PolarHBondContact O-N 3.28Å
391	L	95.9	Very high	94.1	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-43.3	-178	-67.2	177.4	0	0	0	112	S309 F310 F313 F324 E387 A389 W395	S309-L391 WeakPolarHBondContact OG-CB 3.39Å; F310-L391 HydrophobicContact CD1-CD1 3.72Å; F310-L391 HydrophobicContact CE1-CD1 3.78Å; F313-L391 HydrophobicContact CB-CB 4.07Å; F313-L391 HydrophobicContact CB-CD2 4.15Å; F313-L391 HydrophobicContact CD1-CD2 3.78Å; F313-L391 HydrophobicContact CD2-CB 4.39Å; F313-L391 HydrophobicContact CD2-CD2 3.74Å; F313-L391 HydrophobicContact CE1-CD2 4.04Å; F313-L391 HydrophobicContact CE2-CD2 4.03Å; F313-L391 HydrophobicContact CG-CB 4.33Å; F313-L391 HydrophobicContact CG-CD2 3.6Å; F313-L391 HydrophobicContact CG-CG 4.49Å; F313-L391 HydrophobicContact CZ-CD2 4.16Å; F324-L391 HydrophobicContact CD2-CD2 4.46Å; F324-L391 HydrophobicContact CE1-CD1 3.94Å; F324-L391 HydrophobicContact CE2-CD2 4.41Å; F324-L391 HydrophobicContact CZ-CD1 3.94Å; F324-L391 HydrophobicContact CZ-CD2 4.47Å; E387-L391 WeakPolarHBondContact O-CB 3.49Å; E387-L391 WeakPolarHBondContact O-CG 3.33Å; E387-L391 PolarHBondContact O-N 2.97Å; A389-L391 PolarHBondContact O-N 3.24Å; L391-W395 WeakPolarHBondContact O-CB 3.36Å; L391-W395 PolarHBondContact O-N 3.45Å
392	T	95.4	Very high	93.6	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-72	-35.5	177.3	53.5	0	0	0	0	113	L312 N388 A389 I390 W395 Y396 V415	L312-T392 HydrophobicContact CD1-CG2 4.07Å; N388-T392 WeakPolarHBondContact O-CB 3.42Å; N388-T392 VanDerWaalsContact O-CG2 3.3Å; N388-T392 WeakPolarHBondContact O-CG2 3.45Å; N388-T392 PolarHBondContact O-N 2.9Å; N388-T392 PolarHBondContact O-OG1 3.25Å; A389-T392 PolarHBondContact O-N 3.31Å; A389-T392 PolarHBondContact O-OG1 3.44Å; A389-T392 VanDerWaalsContact O-OG1 3.13Å; I390-T392 PolarHBondContact O-N 2.86Å; T392-W395 PolarHBondContact O-N 3.39Å; T392-Y396 WeakPolarHBondContact O-CB 3.35Å; T392-Y396 PolarHBondContact O-N 2.85Å; T392-V415 HydrophobicContact CG2-CB 4.24Å; T392-V415 HydrophobicContact CG2-CG1 3.98Å; T392-V415 HydrophobicContact CG2-CG2 3.88Å
393	S	94.8	Very high	93	Very high	75 Å²	75	59.5 Å²	59.5	52%	0.524	34%	0.336	S	S	.	.	H	α-helix	trans	-66.1	-43	173.8	-66.5	0	0	0	0	112.1	A389 I390 W395 Y396 A397	A389-S393 VanDerWaalsContact O-CB 3.24Å; A389-S393 WeakPolarHBondContact O-CB 3.4Å; A389-S393 PolarHBondContact O-N 3.29Å; A389-S393 PolarHBondContact O-OG 2.94Å; I390-S393 PolarHBondContact O-N 3.44Å; S393-W395 VanDerWaalsContact C-N 3.33Å; S393-W395 PolarHBondContact O-N 3.48Å; S393-Y396 PolarHBondContact O-N 3.34Å; S393-A397 WeakPolarHBondContact O-CB 3.35Å; S393-A397 PolarHBondContact O-N 3.43Å
394	L	95.1	Very high	92.5	Very high	66 Å²	66	57.5 Å²	57.5	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-42.7	174.6	-73.5	172.3	0	0	0	111.1	F313 I390 A397 Y398	F313-L394 HydrophobicContact CD2-CB 4.24Å; F313-L394 HydrophobicContact CE2-CB 4.12Å; F313-L394 HydrophobicContact CE2-CD1 3.86Å; I390-L394 HydrophobicContact CG2-CD1 3.81Å; I390-L394 HydrophobicContact CG2-CG 4.35Å; I390-L394 WeakPolarHBondContact O-CB 3.42Å; I390-L394 VanDerWaalsContact O-CG 3.26Å; I390-L394 WeakPolarHBondContact O-CG 3.44Å; I390-L394 PolarHBondContact O-N 3.28Å; L394-A397 PolarHBondContact O-N 2.97Å; L394-Y398 HydrophobicContact CD2-CE2 4.36Å; L394-Y398 WeakPolarHBondContact O-CD2 3.16Å; L394-Y398 PolarHBondContact O-N 2.89Å
395	W	95.1	Very high	92.1	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-47.2	173	176.1	79.4	0	0	0	112	L312 S315 L391 T392 S393 A397 Y398 R399 T404 Y407 A408 I412	L312-W395 VanDerWaalsContact C-CD1 3.45Å; L312-W395 HydrophobicContact CB-CB 4.3Å; L312-W395 HydrophobicContact CB-CD2 4.04Å; L312-W395 HydrophobicContact CB-CG 3.86Å; L312-W395 HydrophobicContact CD2-CD2 3.86Å; L312-W395 HydrophobicContact CD2-CE3 4.13Å; L312-W395 HydrophobicContact CD2-CH2 3.83Å; L312-W395 HydrophobicContact CD2-CZ2 3.51Å; L312-W395 HydrophobicContact CD2-CZ3 4.13Å; L312-W395 HydrophobicContact CG-CD2 4.43Å; L312-W395 PolarHBondContact O-NE1 3.32Å; S315-W395 PolarHBondContact OG-NE1 3.48Å; L391-W395 WeakPolarHBondContact O-CB 3.36Å; L391-W395 PolarHBondContact O-N 3.45Å; T392-W395 PolarHBondContact O-N 3.39Å; S393-W395 VanDerWaalsContact C-N 3.33Å; S393-W395 PolarHBondContact O-N 3.48Å; W395-A397 VanDerWaalsContact C-N 3.29Å; W395-A397 PolarHBondContact O-N 3.3Å; W395-Y398 PolarHBondContact O-N 2.93Å; W395-R399 VanDerWaalsContact O-CB 3.3Å; W395-R399 WeakPolarHBondContact O-CB 3.47Å; W395-R399 PolarHBondContact O-N 3.01Å; W395-T404 HydrophobicContact CH2-CG2 3.67Å; W395-T404 HydrophobicContact CZ2-CG2 3.41Å; W395-T404 VanDerWaalsContact CZ2-CG2 3.41Å; W395-Y407 HydrophobicContact CZ2-CE2 4.5Å; W395-A408 HydrophobicContact CH2-CB 3.88Å; W395-A408 HydrophobicContact CZ3-CB 4.13Å; W395-I412 HydrophobicContact CZ3-CD1 4.28Å; W395-I412 HydrophobicContact CZ3-CG1 4.2Å
396	Y	93.6	Very high	91.6	Very high	124 Å²	124	62.8 Å²	62.8	49%	0.486	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-33.9	-179.7	-174.6	-102.2	0	0	0	113.3	T392 S393 I412	T392-Y396 WeakPolarHBondContact O-CB 3.35Å; T392-Y396 PolarHBondContact O-N 2.85Å; S393-Y396 PolarHBondContact O-N 3.34Å; Y396-I412 HydrophobicContact CD2-CD1 3.42Å; Y396-I412 VanDerWaalsContact CD2-CD1 3.42Å; Y396-I412 HydrophobicContact CE2-CD1 4.06Å; Y396-I412 HydrophobicContact CG-CD1 3.95Å
397	A	93.6	Very high	91.2	Very high	72 Å²	72	60.4 Å²	60.4	60%	0.595	35%	0.348	S	S	*	.	H	α-helix	trans	-73.4	-32	179.4	0	0	0	0	0	113.5	S393 L394 W395	S393-A397 WeakPolarHBondContact O-CB 3.35Å; S393-A397 PolarHBondContact O-N 3.43Å; L394-A397 PolarHBondContact O-N 2.97Å; W395-A397 VanDerWaalsContact C-N 3.29Å; W395-A397 PolarHBondContact O-N 3.3Å
398	Y	92.6	Very high	90.9	Very high	155 Å²	155	58.8 Å²	58.8	61%	0.608	34%	0.341	S	S	*	.	H	α-helix	trans	-113.3	5.1	-173.8	-68.3	-83.1	0	0	0	114.3	F317 L394 W395	F317-Y398 HydrophobicContact CE2-CD2 4.11Å; F317-Y398 HydrophobicContact CE2-CG 4.3Å; F317-Y398 HydrophobicContact CZ-CD1 4.35Å; F317-Y398 AromaticContact CZ-CD2 3.65Å; F317-Y398 HydrophobicContact CZ-CD2 3.65Å; F317-Y398 HydrophobicContact CZ-CE2 4.3Å; F317-Y398 AromaticContact CZ-CG 3.68Å; F317-Y398 HydrophobicContact CZ-CG 3.68Å; L394-Y398 HydrophobicContact CD2-CE2 4.36Å; L394-Y398 WeakPolarHBondContact O-CD2 3.16Å; L394-Y398 PolarHBondContact O-N 2.89Å; W395-Y398 PolarHBondContact O-N 2.93Å
399	R	89.1	Confident	90.7	Very high	27 Å²	27	62.8 Å²	62.8	10%	0.102	37%	0.369	C	S	.	.	S	Bend	trans	-68	154.1	173.6	70.4	179.6	-177.8	96.8	-5.8	111.3	W395 P401 D405	W395-R399 VanDerWaalsContact O-CB 3.3Å; W395-R399 WeakPolarHBondContact O-CB 3.47Å; W395-R399 PolarHBondContact O-N 3.01Å; R399-P401 VanDerWaalsContact O-CD 3.27Å; R399-P401 WeakPolarHBondContact O-CD 3.21Å; R399-D405 IonicContact CZ-OD1 3.95Å; R399-D405 IonicContact NH1-OD1 3.42Å; R399-D405 PolarHBondContact NH1-OD1 2.89Å; R399-D405 IonicContact NH2-OD1 3.75Å; R399-D405 PolarHBondContact NH2-OD1 2.92Å
400	D	87.6	Confident	90.5	Very high	91 Å²	91	69.2 Å²	69.2	49%	0.487	39%	0.392	S	S	.	.			trans	-73	117.7	164.5	-173	-15.7	0	0	0	109.8	A402 T404	D400-A402 VanDerWaalsContact C-N 3.34Å; D400-A402 PolarHBondContact O-N 3.33Å; D400-A402 PolarHBondContact OD1-N 2.86Å; D400-T404 VanDerWaalsContact O-CB 3.22Å; D400-T404 WeakPolarHBondContact O-CB 3.32Å; D400-T404 PolarHBondContact O-OG1 2.98Å
401	P	85.4	Confident	90.3	Very high	84 Å²	84	65.8 Å²	65.8	55%	0.545	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-36.9	178.9	-22.1	35.1	0	0	0	113.1	R399 T403 D405	R399-P401 VanDerWaalsContact O-CD 3.27Å; R399-P401 WeakPolarHBondContact O-CD 3.21Å; P401-T403 PolarHBondContact O-N 2.61Å; P401-D405 WeakPolarHBondContact O-CB 3.46Å; P401-D405 PolarHBondContact O-N 3.36Å
402	A	82.7	Confident	90.2	Very high	93 Å²	93	67.5 Å²	67.5	77%	0.769	39%	0.385	S	S	*	.	H	α-helix	trans	-67.6	-36.5	-168.1	0	0	0	0	0	113.2	D400	D400-A402 VanDerWaalsContact C-N 3.34Å; D400-A402 PolarHBondContact O-N 3.33Å; D400-A402 PolarHBondContact OD1-N 2.86Å
403	T	82.1	Confident	90.2	Very high	71 Å²	71	70.2 Å²	70.2	44%	0.436	40%	0.404	S	S	.	.	H	α-helix	trans	-91.3	-24.7	-177.2	55.1	0	0	0	0	113.5	N249 P401	N249-T403 PolarHBondContact ND2-O 3.12Å; P401-T403 PolarHBondContact O-N 2.61Å
404	T	86	Confident	90.2	Very high	10 Å²	10	67.6 Å²	67.6	6%	0.061	39%	0.389	C	S	.	.	H	α-helix	trans	-110.7	-14.2	-159.6	-36.7	0	0	0	0	112.8	W395 D400 A406 Y407 A408	W395-T404 HydrophobicContact CH2-CG2 3.67Å; W395-T404 HydrophobicContact CZ2-CG2 3.41Å; W395-T404 VanDerWaalsContact CZ2-CG2 3.41Å; D400-T404 VanDerWaalsContact O-CB 3.22Å; D400-T404 WeakPolarHBondContact O-CB 3.32Å; D400-T404 PolarHBondContact O-OG1 2.98Å; T404-A406 VanDerWaalsContact C-N 3.29Å; T404-A406 PolarHBondContact O-N 3.36Å; T404-Y407 HydrophobicContact CG2-CD2 4.5Å; T404-Y407 HydrophobicContact CG2-CE1 3.94Å; T404-Y407 HydrophobicContact CG2-CE2 3.69Å; T404-Y407 WeakPolarHBondContact CG2-OH 3.29Å; T404-Y407 PolarHBondContact O-N 3.02Å; T404-A408 VanDerWaalsContact O-CB 3.3Å; T404-A408 WeakPolarHBondContact O-CB 3.27Å; T404-A408 PolarHBondContact O-N 3.24Å
405	D	85.8	Confident	90.3	Very high	96 Å²	96	64.5 Å²	64.5	51%	0.513	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-37	-170.9	-143.3	46.3	0	0	0	113.9	R399 P401 Y407	R399-D405 IonicContact CZ-OD1 3.95Å; R399-D405 IonicContact NH1-OD1 3.42Å; R399-D405 PolarHBondContact NH1-OD1 2.89Å; R399-D405 IonicContact NH2-OD1 3.75Å; R399-D405 PolarHBondContact NH2-OD1 2.92Å; P401-D405 WeakPolarHBondContact O-CB 3.46Å; P401-D405 PolarHBondContact O-N 3.36Å; D405-Y407 VanDerWaalsContact C-N 3.25Å; D405-Y407 PolarHBondContact O-N 2.85Å
406	A	86.6	Confident	90.4	Very high	88 Å²	88	68 Å²	68	73%	0.727	39%	0.388	S	S	*	.	H	α-helix	trans	-59.2	-33.6	-176.9	0	0	0	0	0	113.5	T404	T404-A406 VanDerWaalsContact C-N 3.29Å; T404-A406 PolarHBondContact O-N 3.36Å
407	Y	88.4	Confident	90.6	Very high	57 Å²	57	67.2 Å²	67.2	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-116.9	-7.3	-178	67.2	-89.4	0	0	0	114.1	I246 N249 W395 T404 D405 S409 F410 A411	I246-Y407 PolarHBondContact O-OH 3.47Å; N249-Y407 WeakPolarHBondContact OD1-CE1 3.46Å; W395-Y407 HydrophobicContact CZ2-CE2 4.5Å; T404-Y407 HydrophobicContact CG2-CD2 4.5Å; T404-Y407 HydrophobicContact CG2-CE1 3.94Å; T404-Y407 HydrophobicContact CG2-CE2 3.69Å; T404-Y407 WeakPolarHBondContact CG2-OH 3.29Å; T404-Y407 PolarHBondContact O-N 3.02Å; D405-Y407 VanDerWaalsContact C-N 3.25Å; D405-Y407 PolarHBondContact O-N 2.85Å; Y407-S409 VanDerWaalsContact C-N 3.34Å; Y407-S409 PolarHBondContact O-N 2.79Å; Y407-F410 PolarHBondContact O-N 3.24Å; Y407-F410 VanDerWaalsContact O-N 3.13Å; Y407-A411 WeakPolarHBondContact O-CB 3.37Å; Y407-A411 PolarHBondContact O-N 2.85Å
408	A	90	Very high	90.7	Very high	0 Å²	0	65 Å²	65	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-57.1	-45.4	-178.2	0	0	0	0	0	112.7	W395 T404 F410 A411 I412	W395-A408 HydrophobicContact CH2-CB 3.88Å; W395-A408 HydrophobicContact CZ3-CB 4.13Å; T404-A408 VanDerWaalsContact O-CB 3.3Å; T404-A408 WeakPolarHBondContact O-CB 3.27Å; T404-A408 PolarHBondContact O-N 3.24Å; A408-F410 PolarHBondContact O-N 3.13Å; A408-A411 PolarHBondContact O-N 3.44Å; A408-I412 WeakPolarHBondContact O-CG1 3.43Å; A408-I412 PolarHBondContact O-N 2.85Å
409	S	90.4	Very high	90.9	Very high	85 Å²	85	58.5 Å²	58.5	59%	0.594	35%	0.346	S	S	*	.	H	α-helix	trans	-61.6	-42.4	176.9	-60.8	0	0	0	0	112	Y407 C413	Y407-S409 VanDerWaalsContact C-N 3.34Å; Y407-S409 PolarHBondContact O-N 2.79Å; S409-C413 WeakPolarHBondContact O-CB 3.29Å; S409-C413 PolarHBondContact O-N 3.19Å
410	F	92.9	Very high	91.3	Very high	163 Å²	163	59.9 Å²	59.9	72%	0.715	36%	0.363	S	S	*	.	H	α-helix	trans	-67.8	-38.7	177.4	-69.9	-67.6	0	0	0	112.4	Y407 A408 G414	Y407-F410 PolarHBondContact O-N 3.24Å; Y407-F410 VanDerWaalsContact O-N 3.13Å; A408-F410 PolarHBondContact O-N 3.13Å; F410-G414 WeakPolarHBondContact O-CA 3.33Å; F410-G414 PolarHBondContact O-N 2.99Å
411	A	92.6	Very high	91.7	Very high	15 Å²	15	57.2 Å²	57.2	12%	0.124	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-48.5	178.2	0	0	0	0	0	111.6	L312 Y407 A408 G414 V415	L312-A411 HydrophobicContact CD1-CB 4.28Å; L312-A411 HydrophobicContact CD2-CB 4.04Å; Y407-A411 WeakPolarHBondContact O-CB 3.37Å; Y407-A411 PolarHBondContact O-N 2.85Å; A408-A411 PolarHBondContact O-N 3.44Å; A411-G414 PolarHBondContact O-N 3.36Å; A411-V415 WeakPolarHBondContact O-CG2 3.37Å; A411-V415 PolarHBondContact O-N 2.92Å
412	I	94.4	Very high	92.2	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.205	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-47.9	177.7	-66.5	171.5	0	0	0	110.5	W395 Y396 A408 G414 V415 F416	W395-I412 HydrophobicContact CZ3-CD1 4.28Å; W395-I412 HydrophobicContact CZ3-CG1 4.2Å; Y396-I412 HydrophobicContact CD2-CD1 3.42Å; Y396-I412 VanDerWaalsContact CD2-CD1 3.42Å; Y396-I412 HydrophobicContact CE2-CD1 4.06Å; Y396-I412 HydrophobicContact CG-CD1 3.95Å; A408-I412 WeakPolarHBondContact O-CG1 3.43Å; A408-I412 PolarHBondContact O-N 2.85Å; I412-G414 VanDerWaalsContact C-N 3.27Å; I412-G414 PolarHBondContact O-N 3.48Å; I412-V415 PolarHBondContact O-N 3.47Å; I412-F416 HydrophobicContact CG2-CD2 3.95Å; I412-F416 HydrophobicContact CG2-CE2 3.77Å; I412-F416 VanDerWaalsContact O-CD2 3.25Å; I412-F416 WeakPolarHBondContact O-CD2 3.31Å; I412-F416 PolarHBondContact O-N 3.14Å
413	C	95.7	Very high	92.8	Very high	61 Å²	61	50.6 Å²	50.6	41%	0.412	30%	0.3	S	S	.	.	H	α-helix	trans	-58	-43.3	176.3	-169.6	0	0	0	0	110.9	S409 V415 F416 L417	S409-C413 WeakPolarHBondContact O-CB 3.29Å; S409-C413 PolarHBondContact O-N 3.19Å; C413-V415 PolarHBondContact O-N 3.13Å; C413-F416 PolarHBondContact O-N 3.19Å; C413-L417 VanDerWaalsContact O-CB 3.26Å; C413-L417 WeakPolarHBondContact O-CB 3.28Å; C413-L417 VanDerWaalsContact O-CG 3.25Å; C413-L417 WeakPolarHBondContact O-CG 3.43Å; C413-L417 PolarHBondContact O-N 3.23Å; C413-L417 WeakPolarHBondContact SG-CD1 3.44Å
414	G	95.3	Very high	93.4	Very high	20 Å²	20	49.8 Å²	49.8	21%	0.206	30%	0.301	C	S	.	.	H	α-helix	trans	-56.8	-45.1	176.1	0	0	0	0	0	113.2	F410 A411 I412 F416 C418	F410-G414 WeakPolarHBondContact O-CA 3.33Å; F410-G414 PolarHBondContact O-N 2.99Å; A411-G414 PolarHBondContact O-N 3.36Å; I412-G414 VanDerWaalsContact C-N 3.27Å; I412-G414 PolarHBondContact O-N 3.48Å; G414-F416 PolarHBondContact O-N 3.4Å; G414-C418 WeakPolarHBondContact O-CB 3.31Å; G414-C418 PolarHBondContact O-N 3.15Å; G414-C418 PolarHBondContact O-SG 3.42Å
415	V	97	Very high	93.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-50	178.3	173.8	0	0	0	0	111.1	S305 L308 L312 N388 T392 A411 I412 C413 F419	S305-V415 WeakPolarHBondContact CB-O 3.49Å; S305-V415 PolarHBondContact OG-O 3.38Å; L308-V415 HydrophobicContact CB-CG2 3.98Å; L308-V415 HydrophobicContact CD2-CG2 3.57Å; L308-V415 HydrophobicContact CG-CG2 3.59Å; L312-V415 HydrophobicContact CD1-CG2 3.93Å; N388-V415 HydrophobicContact CB-CG1 4.39Å; T392-V415 HydrophobicContact CG2-CB 4.24Å; T392-V415 HydrophobicContact CG2-CG1 3.98Å; T392-V415 HydrophobicContact CG2-CG2 3.88Å; A411-V415 WeakPolarHBondContact O-CG2 3.37Å; A411-V415 PolarHBondContact O-N 2.92Å; I412-V415 PolarHBondContact O-N 3.47Å; C413-V415 PolarHBondContact O-N 3.13Å; V415-F419 PolarHBondContact O-N 2.88Å; V415-F419 VanDerWaalsContact O-N 3.11Å
416	F	96.9	Very high	93.9	Very high	77 Å²	77	47.2 Å²	47.2	34%	0.338	29%	0.288	S	S	.	.	H	α-helix	trans	-76.3	-37.6	-175.8	-66.8	-67.4	0	0	0	113.1	L385 A389 I412 C413 G414 F419 A420	L385-F416 HydrophobicContact CD1-CD1 4.41Å; L385-F416 HydrophobicContact CD1-CE1 4.4Å; A389-F416 HydrophobicContact CB-CE1 4.3Å; A389-F416 HydrophobicContact CB-CZ 4.29Å; I412-F416 HydrophobicContact CG2-CD2 3.95Å; I412-F416 HydrophobicContact CG2-CE2 3.77Å; I412-F416 VanDerWaalsContact O-CD2 3.25Å; I412-F416 WeakPolarHBondContact O-CD2 3.31Å; I412-F416 PolarHBondContact O-N 3.14Å; C413-F416 PolarHBondContact O-N 3.19Å; G414-F416 PolarHBondContact O-N 3.4Å; F416-F419 PolarHBondContact O-N 3.48Å; F416-A420 WeakPolarHBondContact O-CB 3.3Å; F416-A420 PolarHBondContact O-N 3.36Å
417	L	97.1	Very high	94.1	Very high	107 Å²	107	48.1 Å²	48.1	56%	0.56	28%	0.279	S	S	*	.	H	α-helix	trans	-66.1	-40.4	175.2	-71.2	-178.1	0	0	0	112	C413 F419 A420 S421	C413-L417 VanDerWaalsContact O-CB 3.26Å; C413-L417 WeakPolarHBondContact O-CB 3.28Å; C413-L417 VanDerWaalsContact O-CG 3.25Å; C413-L417 WeakPolarHBondContact O-CG 3.43Å; C413-L417 PolarHBondContact O-N 3.23Å; C413-L417 WeakPolarHBondContact SG-CD1 3.44Å; L417-F419 VanDerWaalsContact C-N 3.34Å; L417-A420 PolarHBondContact O-N 3.36Å; L417-S421 WeakPolarHBondContact O-CB 3.32Å; L417-S421 PolarHBondContact O-N 2.9Å; L417-S421 PolarHBondContact O-OG 3.27Å
418	C	96.8	Very high	94.1	Very high	24 Å²	24	49.4 Å²	49.4	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-41	172.8	-70.6	0	0	0	0	111	F301 G414 S421 G422	F301-C418 CarbonylContact C-O 3.28Å; F301-C418 WeakPolarHBondContact CB-O 3.45Å; G414-C418 WeakPolarHBondContact O-CB 3.31Å; G414-C418 PolarHBondContact O-N 3.15Å; G414-C418 PolarHBondContact O-SG 3.42Å; C418-S421 WeakPolarHBondContact CA-OG 3.36Å; C418-S421 PolarHBondContact O-OG 2.89Å; C418-G422 PolarHBondContact O-N 3.02Å
419	F	96.8	Very high	94	Very high	19 Å²	19	49.5 Å²	49.5	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-48.9	176.5	-167.5	-98.3	0	0	0	111.9	S305 Y381 V384 L385 V415 F416 L417 S421 G422 V423	S305-F419 WeakPolarHBondContact OG-CB 3.29Å; Y381-F419 HydrophobicContact CD1-CE2 4.05Å; Y381-F419 AromaticContact CD1-CZ 3.97Å; Y381-F419 HydrophobicContact CD1-CZ 3.97Å; Y381-F419 WeakPolarHBondContact O-CZ 3.3Å; V384-F419 HydrophobicContact CG1-CE2 4.09Å; L385-F419 HydrophobicContact CB-CE1 3.9Å; L385-F419 HydrophobicContact CB-CE2 4.46Å; L385-F419 HydrophobicContact CB-CZ 3.79Å; L385-F419 HydrophobicContact CD1-CD1 3.79Å; L385-F419 HydrophobicContact CD1-CE1 3.83Å; L385-F419 HydrophobicContact CD1-CG 4.35Å; L385-F419 HydrophobicContact CD1-CZ 4.42Å; L385-F419 HydrophobicContact CD2-CE1 4.15Å; L385-F419 HydrophobicContact CG-CE1 4.17Å; V415-F419 PolarHBondContact O-N 2.88Å; V415-F419 VanDerWaalsContact O-N 3.11Å; F416-F419 PolarHBondContact O-N 3.48Å; L417-F419 VanDerWaalsContact C-N 3.34Å; F419-S421 PolarHBondContact O-N 3.27Å; F419-G422 PolarHBondContact O-N 2.65Å; F419-V423 HydrophobicContact CD1-CG2 4.08Å; F419-V423 HydrophobicContact CE1-CG2 3.74Å; F419-V423 HydrophobicContact CZ-CG2 4.15Å; F419-V423 WeakPolarHBondContact O-CG2 3.33Å; F419-V423 PolarHBondContact O-N 3.41Å
420	A	96.8	Very high	93.7	Very high	56 Å²	56	49 Å²	49	46%	0.463	28%	0.275	S	S	.	.	H	α-helix	trans	-61.9	-44.9	-179	0	0	0	0	0	112.2	F416 L417 G422 V423 A424	F416-A420 WeakPolarHBondContact O-CB 3.3Å; F416-A420 PolarHBondContact O-N 3.36Å; L417-A420 PolarHBondContact O-N 3.36Å; A420-G422 PolarHBondContact O-N 3.44Å; A420-V423 PolarHBondContact O-N 2.66Å; A420-A424 WeakPolarHBondContact O-CB 3.09Å; A420-A424 PolarHBondContact O-N 2.89Å
421	S	96.6	Very high	93.1	Very high	36 Å²	36	42.3 Å²	42.3	25%	0.252	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-39.9	174.9	54	0	0	0	0	112.1	F301 L417 C418 F419 A424 C425	F301-S421 WeakPolarHBondContact CG-OG 3.29Å; L417-S421 WeakPolarHBondContact O-CB 3.32Å; L417-S421 PolarHBondContact O-N 2.9Å; L417-S421 PolarHBondContact O-OG 3.27Å; C418-S421 WeakPolarHBondContact CA-OG 3.36Å; C418-S421 PolarHBondContact O-OG 2.89Å; F419-S421 PolarHBondContact O-N 3.27Å; S421-A424 PolarHBondContact O-N 3.27Å; S421-C425 PolarHBondContact O-N 2.96Å; S421-C425 PolarHBondContact O-SG 2.9Å; S421-C425 VanDerWaalsContact O-SG 3.36Å
422	G	95.5	Very high	92.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-46.4	173.2	0	0	0	0	0	113.1	C418 F419 A420 C425 M426	C418-G422 PolarHBondContact O-N 3.02Å; F419-G422 PolarHBondContact O-N 2.65Å; A420-G422 PolarHBondContact O-N 3.44Å; G422-C425 PolarHBondContact O-N 3.4Å; G422-M426 PolarHBondContact O-N 2.97Å
423	V	94.4	Very high	91.4	Very high	37 Å²	37	46.5 Å²	46.5	22%	0.224	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-39.5	175.2	173.9	0	0	0	0	111.3	F419 A420 M426 I427	F419-V423 HydrophobicContact CD1-CG2 4.08Å; F419-V423 HydrophobicContact CE1-CG2 3.74Å; F419-V423 HydrophobicContact CZ-CG2 4.15Å; F419-V423 WeakPolarHBondContact O-CG2 3.33Å; F419-V423 PolarHBondContact O-N 3.41Å; A420-V423 PolarHBondContact O-N 2.66Å; V423-M426 HydrophobicContact CG1-CE 4.34Å; V423-M426 WeakPolarHBondContact O-CB 3.42Å; V423-M426 PolarHBondContact O-N 3.41Å; V423-I427 HydrophobicContact CG1-CD1 3.95Å; V423-I427 HydrophobicContact CG1-CG1 4.48Å; V423-I427 WeakPolarHBondContact O-CG1 3.32Å; V423-I427 PolarHBondContact O-N 2.89Å
424	A	94.5	Very high	90.1	Very high	55 Å²	55	45.7 Å²	45.7	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-45.3	175.5	0	0	0	0	0	111.8	A420 S421 M426 I427 L428	A420-A424 WeakPolarHBondContact O-CB 3.09Å; A420-A424 PolarHBondContact O-N 2.89Å; S421-A424 PolarHBondContact O-N 3.27Å; A424-M426 VanDerWaalsContact C-N 3.3Å; A424-M426 PolarHBondContact O-N 3.42Å; A424-I427 PolarHBondContact O-N 2.94Å; A424-L428 WeakPolarHBondContact O-CB 3.22Å; A424-L428 PolarHBondContact O-N 3.49Å
425	C	93.4	Very high	88.4	Confident	23 Å²	23	46.8 Å²	46.8	16%	0.155	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-37.6	173.9	-70.1	0	0	0	0	112.2	W298 S421 G422 L428 Y429	W298-C425 HydrophobicContact CB-CB 3.79Å; S421-C425 PolarHBondContact O-N 2.96Å; S421-C425 PolarHBondContact O-SG 2.9Å; S421-C425 VanDerWaalsContact O-SG 3.36Å; G422-C425 PolarHBondContact O-N 3.4Å; C425-L428 PolarHBondContact O-N 2.73Å; C425-Y429 WeakPolarHBondContact O-CB 3.28Å; C425-Y429 PolarHBondContact O-N 3Å
426	M	90.6	Very high	86.5	Confident	29 Å²	29	52.8 Å²	52.8	14%	0.143	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-49	173.8	-177.8	-174.3	74.1	0	0	111.8	W298 M377 Y381 G422 V423 A424 L428 Y429 Y430	W298-M426 HydrophobicContact CD2-CB 3.78Å; W298-M426 HydrophobicContact CD2-CG 4.03Å; W298-M426 HydrophobicContact CE3-CB 4.38Å; W298-M426 HydrophobicContact CE3-CG 4.32Å; W298-M426 HydrophobicContact CG-CB 4.01Å; W298-M426 HydrophobicContact CH2-CG 3.76Å; W298-M426 HydrophobicContact CH2-SD 4.22Å; W298-M426 HydrophobicContact CZ2-CB 3.96Å; W298-M426 HydrophobicContact CZ2-CG 3.36Å; W298-M426 HydrophobicContact CZ2-SD 3.51Å; W298-M426 VanDerWaalsContact CZ2-SD 3.51Å; W298-M426 HydrophobicContact CZ3-CG 4.21Å; M377-M426 HydrophobicContact CG-SD 4.27Å; M377-M426 HydrophobicContact SD-SD 3.55Å; Y381-M426 HydrophobicContact CD2-SD 4.15Å; Y381-M426 HydrophobicContact CE2-SD 3.63Å; G422-M426 PolarHBondContact O-N 2.97Å; V423-M426 HydrophobicContact CG1-CE 4.34Å; V423-M426 WeakPolarHBondContact O-CB 3.42Å; V423-M426 PolarHBondContact O-N 3.41Å; A424-M426 VanDerWaalsContact C-N 3.3Å; A424-M426 PolarHBondContact O-N 3.42Å; M426-L428 VanDerWaalsContact C-N 3.33Å; M426-L428 PolarHBondContact O-N 3.2Å; M426-Y429 WeakPolarHBondContact O-CB 3.37Å; M426-Y429 PolarHBondContact O-N 3.04Å; M426-Y430 HydrophobicContact CG-CD2 3.79Å; M426-Y430 HydrophobicContact CG-CE2 3.88Å; M426-Y430 VanDerWaalsContact O-CD2 3.31Å; M426-Y430 WeakPolarHBondContact O-CD2 3.31Å; M426-Y430 PolarHBondContact O-N 3.4Å
427	I	89.8	Confident	84.4	Confident	107 Å²	107	50 Å²	50	55%	0.549	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-44.2	179.3	-67.5	167	0	0	0	109.8	V423 A424 Y429 Y430 G431	V423-I427 HydrophobicContact CG1-CD1 3.95Å; V423-I427 HydrophobicContact CG1-CG1 4.48Å; V423-I427 WeakPolarHBondContact O-CG1 3.32Å; V423-I427 PolarHBondContact O-N 2.89Å; A424-I427 PolarHBondContact O-N 2.94Å; I427-Y429 VanDerWaalsContact C-N 3.33Å; I427-Y429 PolarHBondContact O-N 3.47Å; I427-Y430 PolarHBondContact O-N 3.33Å; I427-G431 PolarHBondContact O-N 3.44Å
428	L	89.3	Confident	82	Confident	84 Å²	84	49.4 Å²	49.4	44%	0.44	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-44.6	175.2	-179.5	65.6	0	0	0	111.8	V294 A424 C425 M426 V432	V294-L428 HydrophobicContact CG1-CD2 4.19Å; V294-L428 HydrophobicContact CG1-CG 4.43Å; A424-L428 WeakPolarHBondContact O-CB 3.22Å; A424-L428 PolarHBondContact O-N 3.49Å; C425-L428 PolarHBondContact O-N 2.73Å; M426-L428 VanDerWaalsContact C-N 3.33Å; M426-L428 PolarHBondContact O-N 3.2Å; L428-V432 HydrophobicContact CD1-CB 4.41Å; L428-V432 HydrophobicContact CD1-CG2 4.09Å; L428-V432 PolarHBondContact O-N 3.31Å
429	Y	87.1	Confident	79.4	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	33%	0.328	C	S	.	.	I	π-helix	trans	-59.3	-52.4	176.6	175.4	-99.6	0	0	0	111.2	M287 H295 W298 C425 M426 I427 L433 H434	M287-Y429 HydrophobicContact CE-CE2 3.5Å; H295-Y429 HydrophobicContact CB-CD2 4.4Å; H295-Y429 HydrophobicContact CB-CE2 4.39Å; W298-Y429 HydrophobicContact CE3-CD1 4.44Å; W298-Y429 HydrophobicContact CZ3-CD1 4.14Å; C425-Y429 WeakPolarHBondContact O-CB 3.28Å; C425-Y429 PolarHBondContact O-N 3Å; M426-Y429 WeakPolarHBondContact O-CB 3.37Å; M426-Y429 PolarHBondContact O-N 3.04Å; I427-Y429 VanDerWaalsContact C-N 3.33Å; I427-Y429 PolarHBondContact O-N 3.47Å; Y429-L433 HydrophobicContact CD2-CB 4.42Å; Y429-L433 CarbonylContact O-C 3.59Å; Y429-L433 PolarHBondContact O-N 2.97Å; Y429-L433 VanDerWaalsContact O-N 3.13Å; Y429-H434 HydrophobicContact CE1-CB 4.49Å; Y429-H434 AromaticContact CE1-CD2 3.86Å; Y429-H434 WeakPolarHBondContact O-CB 3.35Å; Y429-H434 PolarHBondContact O-N 3.35Å
430	Y	83.8	Confident	76.5	Confident	75 Å²	75	65 Å²	65	29%	0.294	36%	0.358	S	S	.	.	I	π-helix	trans	-73.6	-29.4	-177.4	-76.6	-69.6	0	0	0	114.5	W298 M377 M426 I427 H434	W298-Y430 AromaticContact CH2-CE2 3.55Å; W298-Y430 HydrophobicContact CH2-CE2 3.55Å; W298-Y430 HydrophobicContact CZ2-CE2 4.49Å; W298-Y430 AromaticContact CZ3-CE2 3.7Å; W298-Y430 HydrophobicContact CZ3-CE2 3.7Å; M377-Y430 HydrophobicContact CE-CE2 4.06Å; M377-Y430 HydrophobicContact SD-CE2 4.13Å; M426-Y430 HydrophobicContact CG-CD2 3.79Å; M426-Y430 HydrophobicContact CG-CE2 3.88Å; M426-Y430 VanDerWaalsContact O-CD2 3.31Å; M426-Y430 WeakPolarHBondContact O-CD2 3.31Å; M426-Y430 PolarHBondContact O-N 3.4Å; I427-Y430 PolarHBondContact O-N 3.33Å; Y430-H434 HydrophobicContact CD1-CB 4.22Å; Y430-H434 AromaticContact CE1-CD2 3.97Å
431	G	80.1	Confident	73.8	Confident	22 Å²	22	73.6 Å²	73.6	23%	0.227	38%	0.378	C	S	.	.	I	π-helix	trans	-79.2	-42.2	-179.1	0	0	0	0	0	113.8	I427	I427-G431 PolarHBondContact O-N 3.44Å
432	V	79.1	Confident	70.9	Confident	97 Å²	97	79.2 Å²	79.2	59%	0.588	40%	0.402	S	S	*	.	I	π-helix	trans	-114.4	-39.5	-170	-177	0	0	0	0	113	L428	L428-V432 HydrophobicContact CD1-CB 4.41Å; L428-V432 HydrophobicContact CD1-CG2 4.09Å; L428-V432 PolarHBondContact O-N 3.31Å
433	L	73.3	Confident	68	Low	47 Å²	47	87.4 Å²	87.4	25%	0.246	45%	0.445	C	S	.	.	I	π-helix	trans	-105.3	-13.1	-166.4	-63.6	172.6	0	0	0	114	V294 Y429	V294-L433 HydrophobicContact CB-CD1 3.8Å; V294-L433 HydrophobicContact CG1-CD1 4.2Å; V294-L433 HydrophobicContact CG2-CD1 3.4Å; Y429-L433 HydrophobicContact CD2-CB 4.42Å; Y429-L433 CarbonylContact O-C 3.59Å; Y429-L433 PolarHBondContact O-N 2.97Å; Y429-L433 VanDerWaalsContact O-N 3.13Å
434	H	68.6	Low	65	Low	44 Å²	44	89.9 Å²	89.9	20%	0.204	47%	0.469	C	S	.	.			trans	-69.7	125.5	178.9	-174.2	-102.4	0	0	0	109.4	R278 Y429 Y430 M436 G437	R278-H434 PolarHBondContact NH1-NE2 2.96Å; Y429-H434 HydrophobicContact CE1-CB 4.49Å; Y429-H434 AromaticContact CE1-CD2 3.86Å; Y429-H434 WeakPolarHBondContact O-CB 3.35Å; Y429-H434 PolarHBondContact O-N 3.35Å; Y430-H434 HydrophobicContact CD1-CB 4.22Å; Y430-H434 AromaticContact CE1-CD2 3.97Å; H434-M436 PolarHBondContact ND1-N 3Å; H434-M436 PolarHBondContact O-N 3.43Å; H434-G437 PolarHBondContact ND1-N 3.14Å; H434-G437 VanDerWaalsContact ND1-N 3.2Å; H434-G437 PolarHBondContact O-N 2.99Å
435	P	58.5	Low	62.4	Low	42 Å²	42	93.3 Å²	93.3	27%	0.273	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.6	-170.8	-22.1	32.8	0	0	0	114.8	K285	K285-P435 HydrophobicContact CB-CB 4.07Å; K285-P435 HydrophobicContact CD-CB 4.3Å; K285-P435 HydrophobicContact CG-CB 4.41Å
436	M	56.9	Low	59.6	Low	126 Å²	126	95.9 Å²	95.9	62%	0.621	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	13.3	174.8	-57.2	-66.8	-156	0	0	112	H434	H434-M436 PolarHBondContact ND1-N 3Å; H434-M436 PolarHBondContact O-N 3.43Å
437	G	53.6	Low	56.9	Low	18 Å²	18	100.3 Å²	100.3	19%	0.186	54%	0.541	C	S	.	.	S	Bend	trans	-63.6	149.4	173.9	0	0	0	0	0	109.7	H434 R439	H434-G437 PolarHBondContact ND1-N 3.14Å; H434-G437 VanDerWaalsContact ND1-N 3.2Å; H434-G437 PolarHBondContact O-N 2.99Å; G437-R439 PolarHBondContact O-N 2.95Å
438	P	45.8	Very low	54.2	Low	95 Å²	95	99.6 Å²	99.6	62%	0.617	54%	0.544	S	S	*	.			trans	-55.3	111.2	165.9	24.1	-29	0	0	0	105.4	M440	P438-M440 VanDerWaalsContact C-N 3.34Å; P438-M440 PolarHBondContact O-N 3.07Å
439	R	42.4	Very low	51.5	Low	228 Å²	228	98.7 Å²	98.7	86%	0.86	55%	0.549	S	S	*	.			trans	-53.5	109	174	-78.2	-178.9	174.3	171.7	-1.9	105.2	G437 R441	G437-R439 PolarHBondContact O-N 2.95Å; R439-R441 PolarHBondContact O-N 3.21Å
440	M	37.5	Very low	49	Very low	144 Å²	144	107.2 Å²	107.2	71%	0.709	59%	0.588	S	S	*	*			trans	-63.3	88.5	175	-138.8	167.9	109.6	0	0	105.7	P438 M442	P438-M440 VanDerWaalsContact C-N 3.34Å; P438-M440 PolarHBondContact O-N 3.07Å; M440-M442 PolarHBondContact O-N 2.86Å
441	R	38.2	Very low	46.6	Very low	236 Å²	236	111.1 Å²	111.1	89%	0.891	61%	0.614	S	S	*	*			trans	-72.2	72.3	169.4	-84.3	-176.8	169.9	168.2	-3.3	106.2	R439	R439-R441 PolarHBondContact O-N 3.21Å
442	M	37.3	Very low	44.3	Very low	153 Å²	153	116.7 Å²	116.7	75%	0.754	64%	0.638	S	S	*	*			trans	-164.3	88.7	168.8	-133	176	-83.4	0	0	111.2	M440	M440-M442 PolarHBondContact O-N 2.86Å
443	L	33.9	Very low	42.3	Very low	173 Å²	173	122.1 Å²	122.1	91%	0.906	65%	0.648	S	S	*	*	S	Bend		-180	66.6	129.3	-112.6	129.5	0	0	0	108.9
444	A	31.3	Very low	40.4	Very low	88 Å²	88	123.2 Å²	123.2	73%	0.727	67%	0.671	S	S	*	*			trans	-155.5	54.3	156.4	0	0	0	0	0	107.7	S446	A444-S446 PolarHBondContact O-N 3.47Å
445	S	40.1	Very low	38.5	Very low	127 Å²	127	127.8 Å²	127.8	89%	0.888	70%	0.696	S	S	*	*			trans	-70.7	72.2	154.3	55	0	0	0	0	107.3
446	S	34.3	Very low	37	Very low	77 Å²	77	131.6 Å²	131.6	54%	0.538	72%	0.72	S	S	.	*			trans	-98	120.9	156.5	-178	0	0	0	0	105.8	A444 C448 A449	A444-S446 PolarHBondContact O-N 3.47Å; S446-C448 PolarHBondContact O-N 3.36Å; S446-A449 PolarHBondContact O-N 3.23Å; S446-A449 VanDerWaalsContact O-N 3.15Å
447	C	33.3	Very low	35.7	Very low	123 Å²	123	133.2 Å²	133.2	83%	0.831	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-4.9	-177.9	-156.8	0	0	0	0	114.1
448	C	33.4	Very low	34.5	Very low	91 Å²	91	137.6 Å²	137.6	62%	0.615	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-13.7	179.3	-57.4	0	0	0	0	115.1	S446	S446-C448 PolarHBondContact O-N 3.36Å
449	A	32	Very low	33.7	Very low	66 Å²	66	138.9 Å²	138.9	55%	0.545	76%	0.764	S	S	.	*	S	Bend	trans	-82.3	-25.6	-178.5	0	0	0	0	0	113.9	S446 L451	S446-A449 PolarHBondContact O-N 3.23Å; S446-A449 VanDerWaalsContact O-N 3.15Å; A449-L451 VanDerWaalsContact C-N 3.31Å
450	E	34.5	Very low	33	Very low	179 Å²	179	137.1 Å²	137.1	84%	0.836	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-27.3	174.8	-84.9	-94	143.3	0	0	112.3
451	L	33.5	Very low	32.5	Very low	158 Å²	158	135.2 Å²	135.2	83%	0.827	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-16.8	-177.8	-138.3	80.8	0	0	0	113.9	A449	A449-L451 VanDerWaalsContact C-N 3.31Å
452	L	32	Very low	32	Very low	139 Å²	139	132.2 Å²	132.2	73%	0.728	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-10.4	-173.5	-111	95.3	0	0	0	115.1
453	W	37.6	Very low	31.6	Very low	210 Å²	210	131.2 Å²	131.2	80%	0.795	77%	0.774	S	S	*	*			trans	-134.7	47.3	-178.9	-74.5	96.9	0	0	0	112.8	L455	W453-L455 PolarHBondContact O-N 3.22Å
454	G	33.2	Very low	31.5	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	77%	0.774	S	S	*	*			trans	-68.2	66.2	170	0	0	0	0	0	113.5
455	L	28.7	Very low	31.3	Very low	139 Å²	139	131.1 Å²	131.1	73%	0.728	77%	0.769	S	S	*	*			trans	-127.6	116.7	161.8	-81.3	165.5	0	0	0	108.4	W453 L457	W453-L455 PolarHBondContact O-N 3.22Å; L455-L457 PolarHBondContact O-N 3.46Å
456	P	27.8	Very low	30.8	Very low	122 Å²	122	131.2 Å²	131.2	79%	0.792	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-66.1	119.3	174.3	27.4	-29.5	0	0	0	108
457	L	29	Very low	30.5	Very low	161 Å²	161	133.6 Å²	133.6	84%	0.843	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61.2	133.9	163	-77	160.2	0	0	0	107.7	L455	L455-L457 PolarHBondContact O-N 3.46Å
458	P	28.6	Very low	30.3	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.9	144.4	176.6	27.5	-31.4	0	0	0	109.5
459	P	29.7	Very low	29.9	Very low	123 Å²	123	132.9 Å²	132.9	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.8	145.9	178.9	24.7	-32	0	0	0	111	A461	P459-A461 PolarHBondContact O-N 2.68Å
460	E	27.8	Very low	29.8	Very low	191 Å²	191	135.9 Å²	135.9	89%	0.893	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-52.6	118.8	172.8	-73.9	171	142.8	0	0	109.3	E462	E460-E462 PolarHBondContact O-N 3.48Å
461	A	27.2	Very low	29.4	Very low	103 Å²	103	139.3 Å²	139.3	85%	0.851	80%	0.804	S	S	*	*			trans	-69	115.2	174.5	0	0	0	0	0	109.2	P459	P459-A461 PolarHBondContact O-N 2.68Å
462	E	27.7	Very low	29	Very low	173 Å²	173	135.4 Å²	135.4	81%	0.808	80%	0.802	S	S	*	*			trans	-63.2	153	165.1	-71.8	-162.8	158.3	0	0	111.1	E460 M464	E460-E462 PolarHBondContact O-N 3.48Å; E462-M464 PolarHBondContact O-N 3.5Å; E462-M464 VanDerWaalsContact O-N 3.12Å
463	P	28.6	Very low	28.7	Very low	133 Å²	133	135 Å²	135	86%	0.864	81%	0.81	S	S	*	*			trans	-69.6	110.4	-176	27.5	-32	0	0	0	110.4
464	M	30.6	Very low	28.1	Very low	183 Å²	183	133.8 Å²	133.8	90%	0.901	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-87.7	126.2	-179.5	-148.3	-179.3	-73.7	0	0	110.9	E462	E462-M464 PolarHBondContact O-N 3.5Å; E462-M464 VanDerWaalsContact O-N 3.12Å
465	A	27.7	Very low	27.8	Very low	76 Å²	76	135.5 Å²	135.5	63%	0.628	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-64.8	158.8	170.4	0	0	0	0	0	111.9
466	P	29.5	Very low	27.6	Very low	128 Å²	128	134.8 Å²	134.8	83%	0.831	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.3	132.3	-174	31.3	-31.5	0	0	0	111
467	T	27.3	Very low	28.1	Very low	128 Å²	128	134.2 Å²	134.2	79%	0.785	82%	0.818	S	S	*	*			trans	-140.2	155.5	169	24.8	0	0	0	0	111
468	P	29	Very low	27.9	Very low	123 Å²	123	133.7 Å²	133.7	80%	0.799	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.2	150.8	-149.6	-1.6	20.9	0	0	0	113.4
469	G	26.3	Very low	27.8	Very low	75 Å²	75	140.5 Å²	140.5	77%	0.773	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-70.8	151.4	-177.7	0	0	0	0	0	114.5
470	P	29.7	Very low	27.6	Very low	130 Å²	130	138.3 Å²	138.3	84%	0.844	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-95.1	138.8	171.7	32.2	-24.7	0	0	0	112.5
471	R	25.3	Very low	27.5	Very low	251 Å²	251	134.1 Å²	134.1	95%	0.947	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-59.3	143.1	168.2	-73.6	172.7	165.9	165	-4.7	112.3
472	G	25.3	Very low	27.5	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	83%	0.834	S	S	*	*				84.8	112.9	126.8	0	0	0	0	0	118.9
473	S	26.7	Very low	27.4	Very low	129 Å²	129	130 Å²	130	90%	0.902	83%	0.834	S	S	*	*			trans	-156.3	128.6	130.5	50.2	0	0	0	0	110.7
474	Q	25.1	Very low	27.2	Very low	186 Å²	186	132.6 Å²	132.6	87%	0.869	84%	0.835	S	S	*	*			trans	-77.3	151.3	-178.7	-67.2	169.4	-16.3	0	0	111.5
475	A	25.8	Very low	27	Very low	106 Å²	106	133.5 Å²	133.5	88%	0.876	84%	0.837	S	S	*	*			trans	-147.3	110.9	143.6	0	0	0	0	0	109.1
476	T	25.3	Very low	26.8	Very low	124 Å²	124	139.1 Å²	139.1	76%	0.761	85%	0.852	S	S	*	*			trans	-91.6	-172.8	172	34.8	0	0	0	0	110
477	P	38.2	Very low	26.5	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	85%	0.847	S	S	*	*				-130.5	173.8	-67	38	-21.8	0	0	0	111.3
478	T	25.2	Very low	26.3	Very low	151 Å²	151	137.8 Å²	137.8	93%	0.926	85%	0.849	S	S	*	*			trans	-146.1	140.1	152.1	-27	0	0	0	0	112.3
479	R	26.1	Very low	26.1	Very low	252 Å²	252	138.1 Å²	138.1	95%	0.951	84%	0.844	S	S	*	*			trans	-83.6	159.8	-160.6	-111.1	172.9	157	140.4	-7.1	114.7
480	G	25.2	Very low	26	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	85%	0.846	S	S	*	*			trans	131.1	131.5	141.5	0	0	0	0	0	112.4
481	A	26.2	Very low	25.7	Very low	103 Å²	103	142.6 Å²	142.6	85%	0.851	84%	0.842	S	S	*	*			cis	-162.9	151.2	-7.9	0	0	0	0	0	105.8
482	A	25.8	Very low	26.2	Very low	110 Å²	110	135.6 Å²	135.6	91%	0.909	83%	0.83	S	S	*	*			trans	-77.9	151	171.2	0	0	0	0	0	110.8
483	G	25.8	Very low	26.1	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	83%	0.827	S	S	*	*			trans	-164.7	111.3	168.4	0	0	0	0	0	110.6
484	E	25.6	Very low	26	Very low	188 Å²	188	138.3 Å²	138.3	88%	0.879	82%	0.821	S	S	*	*			trans	-62.6	147.1	174.9	-68.6	153.6	93.4	0	0	113.2
485	Q	25.3	Very low	26.1	Very low	203 Å²	203	136.1 Å²	136.1	95%	0.949	82%	0.82	S	S	*	*			trans	-164.9	148.2	133.7	-141.8	104.8	35.9	0	0	111.9
486	M	24	Very low	26	Very low	193 Å²	193	137.2 Å²	137.2	95%	0.951	82%	0.82	S	S	*	*			trans	-117.7	153.4	-168.2	-170.6	-178.6	-168.1	0	0	109.8
487	G	24	Very low	26.1	Very low	70 Å²	70	139.1 Å²	139.1	72%	0.722	83%	0.825	S	S	*	*			trans	116.6	103.7	162.7	0	0	0	0	0	114.6
488	L	23.5	Very low	25.6	Very low	158 Å²	158	139.5 Å²	139.5	83%	0.827	83%	0.827	S	S	*	*				80.3	115.7	82.8	-133.2	88.9	0	0	0	114.9
489	D	23.7	Very low	26	Very low	130 Å²	130	138 Å²	138	70%	0.695	82%	0.818	S	S	*	*				134.2	123.9	128.4	-88.1	-14	0	0	0	120.3
490	E	24.2	Very low	26.2	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	81%	0.811	S	S	*	*			trans	76.6	121.1	140	-59.3	-165.6	134.8	0	0	125.6
491	T	24.3	Very low	26.2	Very low	126 Å²	126	138.9 Å²	138.9	77%	0.773	81%	0.809	S	S	*	*			trans	-41.7	-172.4	164.7	67.5	0	0	0	0	118.5
492	P	35.5	Very low	26.5	Very low	104 Å²	104	140.1 Å²	140.1	68%	0.675	81%	0.806	S	S	*	*			cis	-138.2	-172	-3.5	26.7	-0.3	0	0	0	115.1
493	T	23.5	Very low	26.5	Very low	119 Å²	119	144.3 Å²	144.3	73%	0.73	80%	0.798	S	S	*	*			trans	115.2	109.5	151.1	64.4	0	0	0	0	119.2
494	D	23.6	Very low	26.6	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	79%	0.794	S	S	*	*			trans	50	110.4	136.3	-62.1	-17.3	0	0	0	120
495	T	26.5	Very low	26.9	Very low	140 Å²	140	142.5 Å²	142.5	86%	0.859	79%	0.789	S	S	*	*				-158.2	117.4	123.3	15.5	0	0	0	0	110.3	L497	T495-L497 PolarHBondContact O-N 3Å
496	C	25.1	Very low	27.4	Very low	128 Å²	128	139 Å²	139	87%	0.865	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-54.2	118.7	168.7	-53.4	0	0	0	0	110.2	P498	C496-P498 WeakPolarHBondContact O-CD 3.44Å
497	L	26	Very low	28.2	Very low	165 Å²	165	134 Å²	134	86%	0.864	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.6	122.8	166.6	-73.6	168.1	0	0	0	108.9	T495 V499	T495-L497 PolarHBondContact O-N 3Å; L497-V499 PolarHBondContact O-N 3.04Å
498	P	27.8	Very low	29	Very low	118 Å²	118	134.4 Å²	134.4	77%	0.766	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-73.3	124.8	169.7	28.4	-29.1	0	0	0	110	C496	C496-P498 WeakPolarHBondContact O-CD 3.44Å
499	V	34.2	Very low	30.2	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	72%	0.718	S	S	*	*	S	Bend	trans	-47.1	132.3	160.8	162.3	0	0	0	0	110.9	L497	L497-V499 PolarHBondContact O-N 3.04Å
500	F	31	Very low	31.4	Very low	185 Å²	185	129.4 Å²	129.4	81%	0.811	73%	0.734	S	S	*	*			trans	70.3	104	179.2	-63.9	-73.7	0	0	0	118.3
501	Q	25.5	Very low	32.7	Very low	161 Å²	161	124.6 Å²	124.6	75%	0.752	72%	0.724	S	S	*	*			trans	-131.2	89.6	151.8	-149.8	174.8	38.1	0	0	109.9	R503	Q501-R503 PolarHBondContact O-N 3.14Å
502	V	31.6	Very low	33.4	Very low	130 Å²	130	121.3 Å²	121.3	79%	0.788	72%	0.715	S	S	*	*			trans	-79.6	100.6	164.2	177.7	0	0	0	0	107.1
503	R	25	Very low	34	Very low	198 Å²	198	124.2 Å²	124.2	75%	0.747	71%	0.712	S	S	*	*			trans	-108.9	100.4	156.2	-83.3	-177.5	175	162.7	-1	107.4	Q501 T505	Q501-R503 PolarHBondContact O-N 3.14Å; R503-T505 PolarHBondContact O-N 3.49Å; R503-T505 VanDerWaalsContact O-N 3.09Å
504	S	27.8	Very low	34.7	Very low	101 Å²	101	122.8 Å²	122.8	71%	0.706	71%	0.705	S	S	*	*			trans	-68.2	99.6	160.3	175.1	0	0	0	0	106.7	E506	S504-E506 PolarHBondContact O-N 3.15Å
505	T	33.6	Very low	35.9	Very low	126 Å²	126	119.6 Å²	119.6	77%	0.773	69%	0.687	S	S	*	*			trans	-65.1	104.2	165.6	45.8	0	0	0	0	107.1	R503	R503-T505 PolarHBondContact O-N 3.49Å; R503-T505 VanDerWaalsContact O-N 3.09Å
506	E	35.7	Very low	36.6	Very low	131 Å²	131	117.4 Å²	117.4	61%	0.612	68%	0.675	S	S	*	*			trans	-54.1	128.6	171.1	-71.7	-179.1	155.5	0	0	108.5	S504 V508	S504-E506 PolarHBondContact O-N 3.15Å; E506-V508 WeakPolarHBondContact O-CG2 3.48Å; E506-V508 PolarHBondContact O-N 3.2Å
507	P	39.3	Very low	37.2	Very low	87 Å²	87	117 Å²	117	57%	0.565	67%	0.671	S	S	*	*			trans	-66.3	133.5	-178	27.8	-33	0	0	0	108.8	I515	P507-I515 HydrophobicContact CB-CD1 4.09Å; P507-I515 HydrophobicContact CG-CB 4.43Å; P507-I515 VanDerWaalsContact O-CB 3.23Å; P507-I515 WeakPolarHBondContact O-CB 3.36Å; P507-I515 WeakPolarHBondContact O-CG1 3.47Å; P507-I515 PolarHBondContact O-N 3.46Å
508	V	41.9	Very low	38.1	Very low	79 Å²	79	117.2 Å²	117.2	48%	0.479	67%	0.668	S	S	.	*	B	Isolated β-bridge	trans	-115.3	140.2	-172.7	-155.4	0	0	0	0	108.2	E506 G512 R513	E506-V508 WeakPolarHBondContact O-CG2 3.48Å; E506-V508 PolarHBondContact O-N 3.2Å; V508-G512 VanDerWaalsContact CG1-O 3.29Å; V508-G512 WeakPolarHBondContact CG1-O 3.39Å; V508-R513 CarbonylContact C-O 3.52Å; V508-R513 WeakPolarHBondContact CA-O 2.95Å; V508-R513 VanDerWaalsContact CG1-N 3.31Å; V508-R513 WeakPolarHBondContact CG1-O 3Å
509	D	47.3	Very low	38.8	Very low	60 Å²	60	112.8 Å²	112.8	32%	0.321	64%	0.643	S	S	.	*			trans	-65	168.2	174.6	77.2	1.1	0	0	0	111.2	A511 G512 R513 I515	D509-A511 PolarHBondContact O-N 3.17Å; D509-A511 VanDerWaalsContact OD1-C 3.25Å; D509-A511 WeakPolarHBondContact OD1-CA 3.35Å; D509-A511 WeakPolarHBondContact OD1-CB 3.39Å; D509-A511 PolarHBondContact OD1-N 2.89Å; D509-G512 PolarHBondContact O-N 3.05Å; D509-G512 PolarHBondContact OD1-N 3.41Å; D509-R513 PolarHBondContact N-O 3.15Å; D509-R513 WeakPolarHBondContact OD1-CB 3.49Å; D509-R513 PolarHBondContact OD1-N 3.34Å; D509-R513 IonicContact OD2-NE 3.89Å; D509-R513 PolarHBondContact OD2-NE 3.21Å; D509-R513 IonicContact OD2-NH2 3.06Å; D509-I515 HydrophobicContact CB-CG1 4.39Å
510	A	49.4	Very low	39.1	Very low	123 Å²	123	112.3 Å²	112.3	100%	1.017	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-5.1	179.4	0	0	0	0	0	114.3
511	A	51.4	Low	40.1	Very low	72 Å²	72	107.5 Å²	107.5	60%	0.595	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	10.2	177.1	0	0	0	0	0	112.9	D509	D509-A511 PolarHBondContact O-N 3.17Å; D509-A511 VanDerWaalsContact OD1-C 3.25Å; D509-A511 WeakPolarHBondContact OD1-CA 3.35Å; D509-A511 WeakPolarHBondContact OD1-CB 3.39Å; D509-A511 PolarHBondContact OD1-N 2.89Å
512	G	40.1	Very low	41.2	Very low	57 Å²	57	103.2 Å²	103.2	59%	0.588	61%	0.607	S	S	*	*	S	Bend	trans	80.6	15.4	175.4	0	0	0	0	0	114.9	V508 D509	V508-G512 VanDerWaalsContact CG1-O 3.29Å; V508-G512 WeakPolarHBondContact CG1-O 3.39Å; D509-G512 PolarHBondContact O-N 3.05Å; D509-G512 PolarHBondContact OD1-N 3.41Å
513	R	48.6	Very low	42.5	Very low	164 Å²	164	102.1 Å²	102.1	62%	0.619	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-92	134.8	174.5	-67.7	-176.5	-83.3	-142.8	-9.8	112.4	V508 D509 I515	V508-R513 CarbonylContact C-O 3.52Å; V508-R513 WeakPolarHBondContact CA-O 2.95Å; V508-R513 VanDerWaalsContact CG1-N 3.31Å; V508-R513 WeakPolarHBondContact CG1-O 3Å; D509-R513 PolarHBondContact N-O 3.15Å; D509-R513 WeakPolarHBondContact OD1-CB 3.49Å; D509-R513 PolarHBondContact OD1-N 3.34Å; D509-R513 IonicContact OD2-NE 3.89Å; D509-R513 PolarHBondContact OD2-NE 3.21Å; D509-R513 IonicContact OD2-NH2 3.06Å; R513-I515 PolarHBondContact O-N 3.49Å
514	P	38.1	Very low	44.1	Very low	89 Å²	89	94.1 Å²	94.1	58%	0.578	56%	0.563	S	S	*	*	B	Isolated β-bridge	trans	-57	127.2	175.8	-7.6	13.3	0	0	0	110	P516	P514-P516 WeakPolarHBondContact O-CD 3.31Å
515	I	47.1	Very low	45.5	Very low	77 Å²	77	92.3 Å²	92.3	40%	0.395	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-74.5	119.5	172	-63.3	167.9	0	0	0	106.1	P507 D509 R513	P507-I515 HydrophobicContact CB-CD1 4.09Å; P507-I515 HydrophobicContact CG-CB 4.43Å; P507-I515 VanDerWaalsContact O-CB 3.23Å; P507-I515 WeakPolarHBondContact O-CB 3.36Å; P507-I515 WeakPolarHBondContact O-CG1 3.47Å; P507-I515 PolarHBondContact O-N 3.46Å; D509-I515 HydrophobicContact CB-CG1 4.39Å; R513-I515 PolarHBondContact O-N 3.49Å
516	P	41.5	Very low	46.8	Very low	94 Å²	94	86.8 Å²	86.8	61%	0.61	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-56.7	131.7	174.8	-16.6	27.7	0	0	0	108.1	P514 E518	P514-P516 WeakPolarHBondContact O-CD 3.31Å; P516-E518 PolarHBondContact O-N 3.19Å
517	P	37.4	Very low	47.8	Very low	121 Å²	121	85.4 Å²	85.4	79%	0.786	51%	0.513	S	S	*	.			trans	-58	114.5	176.8	22.3	-30.9	0	0	0	108	G519	P517-G519 VanDerWaalsContact C-N 3.27Å; P517-G519 PolarHBondContact O-N 2.51Å
518	E	44.8	Very low	48.8	Very low	168 Å²	168	83.6 Å²	83.6	79%	0.785	50%	0.495	S	S	*	.			trans	-62.2	99	165.1	-72.7	-172.7	170.5	0	0	105.4	P516	P516-E518 PolarHBondContact O-N 3.19Å
519	G	42.4	Very low	49.6	Very low	25 Å²	25	83.3 Å²	83.3	26%	0.258	49%	0.488	S	S	.	.			trans	-51.6	162.1	173.9	0	0	0	0	0	110.7	P517 L521 A557	P517-G519 VanDerWaalsContact C-N 3.27Å; P517-G519 PolarHBondContact O-N 2.51Å; G519-L521 PolarHBondContact O-N 3.45Å; G519-A557 WeakPolarHBondContact O-CB 3.29Å
520	P	41.9	Very low	49.8	Very low	110 Å²	110	89.6 Å²	89.6	71%	0.714	51%	0.507	S	S	*	.			trans	-52.6	114.8	-174.4	21.9	-33.2	0	0	0	109.8	I522 A557	P520-I522 WeakPolarHBondContact O-CG1 3.35Å; P520-I522 PolarHBondContact O-N 3.46Å; P520-A557 WeakPolarHBondContact O-CB 3.42Å
521	L	50.5	Low	50	Low	85 Å²	85	85 Å²	85	45%	0.445	46%	0.463	S	S	.	.			trans	-66.3	96.7	-173.7	-151	98.4	0	0	0	108.5	G519 K523 A557	G519-L521 PolarHBondContact O-N 3.45Å; L521-K523 VanDerWaalsContact C-N 3.31Å; L521-K523 HydrophobicContact CD2-CD 4.06Å; L521-K523 HydrophobicContact CD2-CG 3.71Å; L521-K523 HydrophobicContact CG-CG 4.46Å; L521-K523 PolarHBondContact O-N 2.88Å; L521-A557 CarbonylContact C-O 3.45Å; L521-A557 VanDerWaalsContact C-O 3.28Å; L521-A557 WeakPolarHBondContact CA-O 3.3Å; L521-A557 WeakPolarHBondContact CG-O 3.08Å
522	I	50.5	Low	49.9	Very low	70 Å²	70	82.4 Å²	82.4	36%	0.359	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	93.7	175.9	-55.2	178.5	0	0	0	106.4	P520 L550 A557 V558 G559	P520-I522 WeakPolarHBondContact O-CG1 3.35Å; P520-I522 PolarHBondContact O-N 3.46Å; I522-L550 HydrophobicContact CD1-CD2 4.05Å; I522-L550 HydrophobicContact CG2-CD1 4.37Å; I522-A557 PolarHBondContact N-O 3.11Å; I522-V558 HydrophobicContact CB-CG2 4.19Å; I522-V558 HydrophobicContact CD1-CG2 4.44Å; I522-G559 PolarHBondContact O-N 3.44Å; I522-G559 VanDerWaalsContact O-N 3.15Å
523	K	57.5	Low	50.6	Low	107 Å²	107	80.1 Å²	80.1	47%	0.465	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	109.1	173.7	-68.1	177.5	-175.7	173.5	0	108.2	L521 D525 G559	L521-K523 VanDerWaalsContact C-N 3.31Å; L521-K523 HydrophobicContact CD2-CD 4.06Å; L521-K523 HydrophobicContact CD2-CG 3.71Å; L521-K523 HydrophobicContact CG-CG 4.46Å; L521-K523 PolarHBondContact O-N 2.88Å; K523-D525 PolarHBondContact O-N 3.11Å; K523-G559 WeakPolarHBondContact CA-O 3.33Å
524	I	59.8	Low	51.1	Low	31 Å²	31	73.6 Å²	73.6	16%	0.159	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	102.6	170.2	-53.3	171.2	0	0	0	106.4	M526 I547 L550 V558 G559 R561	I524-M526 HydrophobicContact CB-CE 4.1Å; I524-M526 HydrophobicContact CG2-CE 3.65Å; I524-M526 HydrophobicContact CG2-CG 4.1Å; I524-M526 PolarHBondContact O-N 3.06Å; I524-I547 HydrophobicContact CD1-CG1 3.8Å; I524-L550 HydrophobicContact CD1-CD1 3.6Å; I524-L550 HydrophobicContact CG1-CD1 4.14Å; I524-V558 HydrophobicContact CD1-CG1 4.47Å; I524-G559 PolarHBondContact N-O 3.24Å; I524-G559 VanDerWaalsContact N-O 3.13Å; I524-R561 PolarHBondContact O-N 3.34Å; I524-R561 VanDerWaalsContact O-O 3.05Å
525	D	55.8	Low	52.4	Low	62 Å²	62	70.2 Å²	70.2	33%	0.332	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	107.3	175	-80.5	-13.3	0	0	0	109.1	K523 R561 R563	K523-D525 PolarHBondContact O-N 3.11Å; D525-R561 WeakPolarHBondContact CA-O 3.23Å; D525-R561 WeakPolarHBondContact OD1-CD 3.32Å; D525-R563 HydrophobicContact CB-CG 4.44Å; D525-R563 IonicContact OD2-CZ 3.47Å; D525-R563 VanDerWaalsContact OD2-CZ 3.26Å; D525-R563 IonicContact OD2-NE 3.99Å; D525-R563 PolarHBondContact OD2-NE 3.37Å; D525-R563 IonicContact OD2-NH2 3.43Å; D525-R563 PolarHBondContact OD2-NH2 2.99Å
526	M	62.5	Low	53.2	Low	10 Å²	10	67.8 Å²	67.8	5%	0.049	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.6	173.2	-68.5	174.9	-137.2	0	0	109.6	I524 R528 H537 L543 I547 I560 R561 Y562 R563	I524-M526 HydrophobicContact CB-CE 4.1Å; I524-M526 HydrophobicContact CG2-CE 3.65Å; I524-M526 HydrophobicContact CG2-CG 4.1Å; I524-M526 PolarHBondContact O-N 3.06Å; M526-R528 PolarHBondContact O-N 2.95Å; M526-H537 HydrophobicContact CE-CB 4.34Å; M526-H537 HydrophobicContact SD-CB 4.1Å; M526-L543 HydrophobicContact CE-CD1 4.49Å; M526-L543 HydrophobicContact CE-CD2 4.4Å; M526-L543 HydrophobicContact SD-CD2 3.81Å; M526-I547 HydrophobicContact CE-CD1 3.72Å; M526-I547 HydrophobicContact CE-CG1 4.32Å; M526-I560 HydrophobicContact CE-CB 4.26Å; M526-I560 HydrophobicContact CE-CD1 4.19Å; M526-I560 HydrophobicContact CE-CG1 3.9Å; M526-I560 HydrophobicContact CE-CG2 3.49Å; M526-I560 VanDerWaalsContact CE-CG2 3.49Å; M526-I560 HydrophobicContact SD-CG2 4.12Å; M526-R561 PolarHBondContact N-O 2.97Å; M526-Y562 HydrophobicContact CB-CD1 4.21Å; M526-Y562 HydrophobicContact CB-CE1 4.34Å; M526-Y562 WeakPolarHBondContact O-CA 3.14Å; M526-Y562 HydrophobicContact SD-CE1 4.3Å; M526-R563 PolarHBondContact O-N 2.9Å
527	P	56.2	Low	54.3	Low	102 Å²	102	63.3 Å²	63.3	66%	0.662	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	123.6	170.8	25.5	-31.6	0	0	0	108.5	K529	P527-K529 PolarHBondContact O-N 2.97Å
528	R	59.3	Low	55.8	Low	50 Å²	50	57.7 Å²	57.7	19%	0.189	29%	0.294	C	S	.	.			trans	-76.6	111.4	179.5	-168.9	169.8	-114.5	-179.3	-2	109.2	D283 M526 R563 D564	D283-R528 IonicContact OD2-CZ 3.23Å; D283-R528 IonicContact OD2-NH1 3.83Å; M526-R528 PolarHBondContact O-N 2.95Å; R528-R563 WeakPolarHBondContact CB-O 3.48Å; R528-R563 PolarHBondContact N-O 3.25Å; R528-R563 VanDerWaalsContact N-O 3.15Å; R528-D564 WeakPolarHBondContact CD-OD1 3.17Å; R528-D564 IonicContact CZ-OD1 3.86Å; R528-D564 IonicContact NE-OD1 3.92Å; R528-D564 IonicContact NH1-OD1 3.35Å; R528-D564 PolarHBondContact NH1-OD1 2.96Å; R528-D564 IonicContact NH1-OD2 3.74Å
529	K	58.7	Low	56.8	Low	72 Å²	72	52.9 Å²	52.9	31%	0.313	28%	0.276	S	S	.	.			trans	-72.8	137.1	175	-53.8	-170	170.1	-172.2	0	109.6	D342 F343 P527 Y531	D342-K529 VanDerWaalsContact O-CD 3.29Å; D342-K529 WeakPolarHBondContact O-CD 3.49Å; D342-K529 WeakPolarHBondContact O-CE 3.11Å; D342-K529 PolarHBondContact O-NZ 2.94Å; F343-K529 PolarHBondContact O-NZ 2.82Å; P527-K529 PolarHBondContact O-N 2.97Å; K529-Y531 HydrophobicContact CB-CD2 3.55Å; K529-Y531 HydrophobicContact CB-CE2 3.96Å; K529-Y531 HydrophobicContact CD-CD2 4.36Å; K529-Y531 HydrophobicContact CD-CE2 4.48Å; K529-Y531 PolarHBondContact O-N 3.47Å
530	R	52.2	Low	58.2	Low	192 Å²	192	53.9 Å²	53.9	73%	0.725	28%	0.275	S	S	*	.	S	Bend	trans	-77.8	54	178.3	-70.8	-173	-177.9	-161.7	2.5	111.8	E370	E370-R530 PolarHBondContact N-O 2.78Å
531	Y	53.2	Low	59.7	Low	26 Å²	26	49.3 Å²	49.3	10%	0.102	24%	0.244	C	C	.	.			trans	-127.7	147.1	179.4	-55	-75.8	0	0	0	111.2	G340 D342 F343 R369 K529 A533	G340-Y531 PolarHBondContact O-OH 3.29Å; G340-Y531 VanDerWaalsContact O-OH 3.06Å; D342-Y531 HydrophobicContact CB-CE2 3.77Å; D342-Y531 WeakPolarHBondContact CB-OH 3.46Å; D342-Y531 VanDerWaalsContact N-CZ 3.29Å; D342-Y531 PolarHBondContact N-OH 2.94Å; F343-Y531 HydrophobicContact CE1-CD1 4.44Å; F343-Y531 HydrophobicContact CE1-CG 4.13Å; F343-Y531 HydrophobicContact CZ-CD1 4.37Å; F343-Y531 HydrophobicContact CZ-CG 4.5Å; R369-Y531 HydrophobicContact CB-CD1 4.26Å; R369-Y531 HydrophobicContact CG-CD1 3.8Å; R369-Y531 HydrophobicContact CG-CE1 3.95Å; K529-Y531 HydrophobicContact CB-CD2 3.55Å; K529-Y531 HydrophobicContact CB-CE2 3.96Å; K529-Y531 HydrophobicContact CD-CD2 4.36Å; K529-Y531 HydrophobicContact CD-CE2 4.48Å; K529-Y531 PolarHBondContact O-N 3.47Å; Y531-A533 PolarHBondContact O-N 3.26Å
532	P	49.3	Very low	60.7	Low	18 Å²	18	54 Å²	54	12%	0.117	26%	0.256	C	S	.	.	S	Bend	trans	-81.9	-1.8	175.8	20.7	-0.8	0	0	0	111.8	V368 R369 E370	V368-P532 WeakPolarHBondContact O-CD 3.3Å; R369-P532 WeakPolarHBondContact O-CG 3.36Å; E370-P532 HydrophobicContact CB-CB 4.34Å; E370-P532 HydrophobicContact CB-CG 4.16Å; E370-P532 HydrophobicContact CG-CB 3.85Å; E370-P532 HydrophobicContact CG-CG 4.16Å; E370-P532 WeakPolarHBondContact OE1-CA 3.18Å
533	A	55.8	Low	61.6	Low	9 Å²	9	52.3 Å²	52.3	7%	0.074	25%	0.247	C	C	.	.	S	Bend	trans	-95.8	131.9	173.3	0	0	0	0	0	107.5	F343 Y531	F343-A533 HydrophobicContact CD1-CB 4.08Å; F343-A533 HydrophobicContact CE1-CB 3.41Å; F343-A533 VanDerWaalsContact CE1-CB 3.41Å; F343-A533 HydrophobicContact CZ-CB 4.18Å; Y531-A533 PolarHBondContact O-N 3.26Å
534	W	57.8	Low	62.5	Low	27 Å²	27	48 Å²	48	10%	0.102	23%	0.228	C	C	.	.			trans	24.8	118.2	161.6	-61.3	110.7	0	0	0	116.2	A220 Y273 L276 L277 A536 F538 V539	A220-W534 VanDerWaalsContact CA-CH2 3.46Å; A220-W534 HydrophobicContact CB-CE3 4.37Å; A220-W534 HydrophobicContact CB-CH2 3.08Å; A220-W534 HydrophobicContact CB-CZ2 3.8Å; A220-W534 HydrophobicContact CB-CZ3 3.45Å; A220-W534 VanDerWaalsContact CB-CZ3 3.45Å; Y273-W534 HydrophobicContact CD2-CZ2 4.5Å; Y273-W534 AromaticContact CE2-CZ2 3.99Å; Y273-W534 HydrophobicContact CE2-CZ2 3.99Å; Y273-W534 AromaticContact CE2-NE1 3.56Å; Y273-W534 AromaticContact CZ-NE1 3.67Å; Y273-W534 PolarHBondContact OH-NE1 2.88Å; Y273-W534 VanDerWaalsContact OH-NE1 3.1Å; L276-W534 HydrophobicContact CD1-CH2 4.16Å; L276-W534 HydrophobicContact CD2-CH2 3.54Å; L276-W534 HydrophobicContact CD2-CZ2 4.13Å; L276-W534 HydrophobicContact CG-CH2 3.45Å; L276-W534 VanDerWaalsContact CG-CH2 3.45Å; L276-W534 HydrophobicContact CG-CZ2 4.23Å; L276-W534 HydrophobicContact CG-CZ3 4.18Å; L277-W534 HydrophobicContact CD2-CD2 3.59Å; L277-W534 HydrophobicContact CD2-CE3 4.22Å; L277-W534 HydrophobicContact CD2-CG 3.72Å; L277-W534 HydrophobicContact CD2-CZ2 4.13Å; W534-A536 PolarHBondContact O-N 3.24Å; W534-F538 HydrophobicContact CB-CB 3.89Å; W534-F538 HydrophobicContact CD2-CB 3.89Å; W534-F538 HydrophobicContact CD2-CG 4.36Å; W534-F538 HydrophobicContact CE3-CB 3.3Å; W534-F538 AromaticContact CE3-CD1 3.54Å; W534-F538 HydrophobicContact CE3-CD1 3.54Å; W534-F538 AromaticContact CE3-CD2 3.91Å; W534-F538 HydrophobicContact CE3-CD2 3.91Å; W534-F538 HydrophobicContact CE3-CE1 4.32Å; W534-F538 AromaticContact CE3-CG 3.31Å; W534-F538 HydrophobicContact CE3-CG 3.31Å; W534-F538 HydrophobicContact CG-CB 4.18Å; W534-F538 HydrophobicContact CH2-CD1 4.46Å; W534-F538 HydrophobicContact CZ3-CB 4.03Å; W534-F538 AromaticContact CZ3-CD1 3.36Å; W534-F538 HydrophobicContact CZ3-CD1 3.36Å; W534-F538 HydrophobicContact CZ3-CD2 4.37Å; W534-F538 AromaticContact CZ3-CE1 3.85Å; W534-F538 HydrophobicContact CZ3-CE1 3.85Å; W534-F538 AromaticContact CZ3-CG 3.68Å; W534-F538 HydrophobicContact CZ3-CG 3.68Å; W534-V539 HydrophobicContact CB-CG2 3.44Å; W534-V539 VanDerWaalsContact CB-CG2 3.44Å; W534-V539 HydrophobicContact CG-CG2 4.15Å
535	D	65.7	Low	63	Low	18 Å²	18	49.4 Å²	49.4	10%	0.096	23%	0.231	C	C	.	.			trans	-50.7	146.9	163.4	-69.6	-38.4	0	0	0	109.5	H537 F538 Y562	D535-H537 VanDerWaalsContact CB-CE1 3.42Å; D535-H537 WeakPolarHBondContact CB-CE1 3.38Å; D535-H537 WeakPolarHBondContact CB-ND1 3.39Å; D535-H537 PolarHBondContact O-N 3.13Å; D535-H537 IonicContact OD2-CE1 2.85Å; D535-F538 HydrophobicContact CB-CD2 4.2Å; D535-F538 WeakPolarHBondContact O-CB 3.36Å; D535-F538 PolarHBondContact O-N 3.04Å; D535-Y562 HydrophobicContact CB-CE1 4Å; D535-Y562 PolarHBondContact OD2-OH 3.24Å
536	A	65.1	Low	63.7	Low	26 Å²	26	50.2 Å²	50.2	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-52.2	-32.3	-169.5	0	0	0	0	0	113.3	W534 F538 V539 D540 L543	W534-A536 PolarHBondContact O-N 3.24Å; A536-F538 VanDerWaalsContact C-N 3.28Å; A536-F538 PolarHBondContact O-N 3.02Å; A536-V539 PolarHBondContact O-N 2.76Å; A536-D540 WeakPolarHBondContact O-CB 3.26Å; A536-D540 PolarHBondContact O-N 3.42Å; A536-L543 HydrophobicContact CB-CD2 4.25Å
537	H	63.9	Low	64.1	Low	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-73.1	-11.9	178.7	77.1	-84.9	0	0	0	114.4	W213 Y217 M526 D535 L543 R544 I547 Y562	W213-H537 AromaticContact CZ3-NE2 3.51Å; Y217-H537 AromaticContact CE1-CD2 3.47Å; Y217-H537 VanDerWaalsContact CE1-CD2 3.47Å; Y217-H537 WeakPolarHBondContact CE1-CD2 3.35Å; Y217-H537 AromaticContact CE1-NE2 3.89Å; Y217-H537 AromaticContact CZ-CD2 3.75Å; Y217-H537 PolarHBondContact OH-CD2 3.47Å; M526-H537 HydrophobicContact CE-CB 4.34Å; M526-H537 HydrophobicContact SD-CB 4.1Å; D535-H537 VanDerWaalsContact CB-CE1 3.42Å; D535-H537 WeakPolarHBondContact CB-CE1 3.38Å; D535-H537 WeakPolarHBondContact CB-ND1 3.39Å; D535-H537 PolarHBondContact O-N 3.13Å; D535-H537 IonicContact OD2-CE1 2.85Å; H537-L543 HydrophobicContact CB-CD2 3.74Å; H537-L543 HydrophobicContact CB-CG 3.93Å; H537-R544 WeakPolarHBondContact O-CD 3.48Å; H537-R544 WeakPolarHBondContact O-CG 3.48Å; H537-I547 HydrophobicContact CB-CD1 3.47Å; H537-I547 VanDerWaalsContact CB-CD1 3.47Å; H537-Y562 PolarHBondContact CE1-OH 3.25Å; H537-Y562 PolarHBondContact ND1-OH 3.44Å
538	F	68.7	Low	64.7	Low	4 Å²	4	47.9 Å²	47.9	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-85.2	-32.8	169.2	-81.9	-81.3	0	0	0	112.3	W213 M216 Y217 A220 S280 W534 D535 A536 R544	W213-F538 HydrophobicContact CE3-CZ 4.16Å; W213-F538 AromaticContact CZ3-CE2 3.86Å; W213-F538 HydrophobicContact CZ3-CE2 3.86Å; W213-F538 AromaticContact CZ3-CZ 3.61Å; W213-F538 HydrophobicContact CZ3-CZ 3.61Å; M216-F538 HydrophobicContact CB-CE1 4.16Å; M216-F538 HydrophobicContact CB-CZ 4.44Å; M216-F538 HydrophobicContact CG-CE1 3.61Å; M216-F538 HydrophobicContact CG-CZ 3.75Å; Y217-F538 AromaticContact CD1-CD1 3.65Å; Y217-F538 HydrophobicContact CD1-CD1 3.65Å; Y217-F538 AromaticContact CD1-CE1 3.67Å; Y217-F538 HydrophobicContact CD1-CE1 3.67Å; Y217-F538 HydrophobicContact CD1-CG 4.43Å; Y217-F538 HydrophobicContact CD1-CZ 4.48Å; Y217-F538 AromaticContact CE1-CD1 3.94Å; Y217-F538 HydrophobicContact CE1-CD1 3.94Å; Y217-F538 AromaticContact CE1-CE1 3.87Å; Y217-F538 HydrophobicContact CE1-CE1 3.87Å; Y217-F538 HydrophobicContact CE1-CG 4.37Å; Y217-F538 HydrophobicContact CE1-CZ 4.27Å; A220-F538 HydrophobicContact CB-CD1 3.97Å; S280-F538 VanDerWaalsContact CB-CZ 3.43Å; W534-F538 HydrophobicContact CB-CB 3.89Å; W534-F538 HydrophobicContact CD2-CB 3.89Å; W534-F538 HydrophobicContact CD2-CG 4.36Å; W534-F538 HydrophobicContact CE3-CB 3.3Å; W534-F538 AromaticContact CE3-CD1 3.54Å; W534-F538 HydrophobicContact CE3-CD1 3.54Å; W534-F538 AromaticContact CE3-CD2 3.91Å; W534-F538 HydrophobicContact CE3-CD2 3.91Å; W534-F538 HydrophobicContact CE3-CE1 4.32Å; W534-F538 AromaticContact CE3-CG 3.31Å; W534-F538 HydrophobicContact CE3-CG 3.31Å; W534-F538 HydrophobicContact CG-CB 4.18Å; W534-F538 HydrophobicContact CH2-CD1 4.46Å; W534-F538 HydrophobicContact CZ3-CB 4.03Å; W534-F538 AromaticContact CZ3-CD1 3.36Å; W534-F538 HydrophobicContact CZ3-CD1 3.36Å; W534-F538 HydrophobicContact CZ3-CD2 4.37Å; W534-F538 AromaticContact CZ3-CE1 3.85Å; W534-F538 HydrophobicContact CZ3-CE1 3.85Å; W534-F538 AromaticContact CZ3-CG 3.68Å; W534-F538 HydrophobicContact CZ3-CG 3.68Å; D535-F538 HydrophobicContact CB-CD2 4.2Å; D535-F538 WeakPolarHBondContact O-CB 3.36Å; D535-F538 PolarHBondContact O-N 3.04Å; A536-F538 VanDerWaalsContact C-N 3.28Å; A536-F538 PolarHBondContact O-N 3.02Å; F538-R544 PolarHBondContact O-NE 2.86Å; F538-R544 PolarHBondContact O-NH2 2.88Å
539	V	66.5	Low	65.2	Low	67 Å²	67	48.5 Å²	48.5	41%	0.406	23%	0.23	S	C	.	.	H	α-helix	trans	-81.4	-48.3	179	-174.3	0	0	0	0	110.2	W534 A536 R541	W534-V539 HydrophobicContact CB-CG2 3.44Å; W534-V539 VanDerWaalsContact CB-CG2 3.44Å; W534-V539 HydrophobicContact CG-CG2 4.15Å; A536-V539 PolarHBondContact O-N 2.76Å; V539-R541 PolarHBondContact O-N 2.88Å
540	D	70.8	Confident	65.6	Low	45 Å²	45	47 Å²	47	24%	0.241	23%	0.225	C	C	.	.			trans	-82.7	107.8	-174.7	-174.7	6.5	0	0	0	112.1	A536 R542 L543 R544	A536-D540 WeakPolarHBondContact O-CB 3.26Å; A536-D540 PolarHBondContact O-N 3.42Å; D540-R542 PolarHBondContact O-N 3.47Å; D540-R542 VanDerWaalsContact OD1-CB 3.3Å; D540-R542 WeakPolarHBondContact OD1-CB 3.27Å; D540-R542 PolarHBondContact OD1-N 3.21Å; D540-L543 HydrophobicContact CB-CB 3.95Å; D540-L543 PolarHBondContact O-N 3.2Å; D540-R544 WeakPolarHBondContact O-CG 3.48Å; D540-R544 PolarHBondContact O-N 3.36Å; D540-R544 VanDerWaalsContact O-N 3.09Å
541	R	73.6	Confident	66.3	Low	14 Å²	14	38.2 Å²	38.2	5%	0.053	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-28.1	174.6	-68.6	-174.6	-177.6	-77.5	-20.6	112.9	W138 D142 D221 V539 R545	W138-R541 VanDerWaalsContact CG-CZ 3.45Å; W138-R541 VanDerWaalsContact CG-NH2 3.26Å; D142-R541 IonicContact OD1-NH1 3.19Å; D142-R541 IonicContact OD2-CZ 3.76Å; D142-R541 IonicContact OD2-NH1 3.21Å; D142-R541 PolarHBondContact OD2-NH1 3.43Å; D221-R541 IonicContact OD1-CZ 3.15Å; D221-R541 IonicContact OD1-NH2 3.6Å; D221-R541 PolarHBondContact OD1-NH2 2.79Å; D221-R541 VanDerWaalsContact OD1-NH2 3.12Å; D221-R541 IonicContact OD2-CZ 2.84Å; D221-R541 VanDerWaalsContact OD2-CZ 3.23Å; D221-R541 IonicContact OD2-NH1 2.67Å; D221-R541 PolarHBondContact OD2-NH1 3.01Å; D221-R541 IonicContact OD2-NH2 2.75Å; D221-R541 PolarHBondContact OD2-NH2 3.33Å; V539-R541 PolarHBondContact O-N 2.88Å; R541-R545 WeakPolarHBondContact O-CG 3.42Å; R541-R545 PolarHBondContact O-N 2.79Å
542	R	71.1	Confident	66.9	Low	185 Å²	185	44.6 Å²	44.6	70%	0.698	22%	0.221	S	C	*	.	H	α-helix	trans	-68.9	-46.7	177.3	-60	-179.3	179.6	-168.1	0.4	110	D540 R544 R545 T546	D540-R542 PolarHBondContact O-N 3.47Å; D540-R542 VanDerWaalsContact OD1-CB 3.3Å; D540-R542 WeakPolarHBondContact OD1-CB 3.27Å; D540-R542 PolarHBondContact OD1-N 3.21Å; R542-R544 PolarHBondContact O-N 3.08Å; R542-R545 WeakPolarHBondContact O-CB 3.44Å; R542-R545 PolarHBondContact O-N 2.81Å; R542-R545 VanDerWaalsContact O-N 3.15Å; R542-T546 PolarHBondContact O-N 3.06Å; R542-T546 VanDerWaalsContact O-N 3.15Å; R542-T546 PolarHBondContact O-OG1 3.13Å
543	L	71.1	Confident	67.7	Low	34 Å²	34	49.1 Å²	49.1	18%	0.178	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-40.4	177.1	-171	57.4	0	0	0	112.4	M526 A536 H537 D540 R545 T546 I547	M526-L543 HydrophobicContact CE-CD1 4.49Å; M526-L543 HydrophobicContact CE-CD2 4.4Å; M526-L543 HydrophobicContact SD-CD2 3.81Å; A536-L543 HydrophobicContact CB-CD2 4.25Å; H537-L543 HydrophobicContact CB-CD2 3.74Å; H537-L543 HydrophobicContact CB-CG 3.93Å; D540-L543 HydrophobicContact CB-CB 3.95Å; D540-L543 PolarHBondContact O-N 3.2Å; L543-R545 VanDerWaalsContact C-N 3.26Å; L543-R545 PolarHBondContact O-N 3.4Å; L543-T546 PolarHBondContact O-N 3.38Å; L543-I547 HydrophobicContact CD1-CD1 4.44Å; L543-I547 HydrophobicContact CG-CD1 4.03Å; L543-I547 WeakPolarHBondContact O-CD1 3.3Å; L543-I547 VanDerWaalsContact O-CG1 3.32Å; L543-I547 WeakPolarHBondContact O-CG1 3.36Å; L543-I547 PolarHBondContact O-N 3.28Å
544	R	74.7	Confident	68.1	Low	15 Å²	15	50 Å²	50	6%	0.057	25%	0.248	C	C	.	.	H	α-helix	trans	-53	-43.8	171.8	-72.4	-171.4	-104.5	-176	-3.1	112.4	Y217 D221 H537 F538 D540 R542 I547 N548	Y217-R544 HydrophobicContact CD1-CG 4.09Å; Y217-R544 HydrophobicContact CD2-CG 4.42Å; Y217-R544 HydrophobicContact CE1-CG 4Å; Y217-R544 HydrophobicContact CE2-CG 4.31Å; Y217-R544 HydrophobicContact CG-CG 4.31Å; D221-R544 IonicContact OD1-CZ 3.96Å; D221-R544 IonicContact OD1-NH1 3.87Å; D221-R544 PolarHBondContact OD1-NH1 2.94Å; D221-R544 IonicContact OD1-NH2 2.97Å; D221-R544 PolarHBondContact OD1-NH2 3.48Å; D221-R544 IonicContact OD2-NH1 2.76Å; D221-R544 PolarHBondContact OD2-NH1 3.44Å; H537-R544 WeakPolarHBondContact O-CD 3.48Å; H537-R544 WeakPolarHBondContact O-CG 3.48Å; F538-R544 PolarHBondContact O-NE 2.86Å; F538-R544 PolarHBondContact O-NH2 2.88Å; D540-R544 WeakPolarHBondContact O-CG 3.48Å; D540-R544 PolarHBondContact O-N 3.36Å; D540-R544 VanDerWaalsContact O-N 3.09Å; R542-R544 PolarHBondContact O-N 3.08Å; R544-I547 PolarHBondContact O-N 2.91Å; R544-N548 WeakPolarHBondContact O-CB 3.01Å; R544-N548 VanDerWaalsContact O-CG 3.23Å; R544-N548 PolarHBondContact O-N 2.7Å; R544-N548 PolarHBondContact O-ND2 2.89Å
545	R	71.6	Confident	68.2	Low	62 Å²	62	51.4 Å²	51.4	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-48.3	-180	-70.6	173.1	-159.8	174.2	6.8	111.5	Q141 D142 R541 R542 L543 I547 N548 V549	Q141-R545 VanDerWaalsContact O-CZ 3.23Å; Q141-R545 PolarHBondContact O-NH1 3.33Å; Q141-R545 PolarHBondContact O-NH2 2.84Å; D142-R545 VanDerWaalsContact CA-NH2 3.29Å; D142-R545 IonicContact OD1-CZ 2.76Å; D142-R545 IonicContact OD1-NE 3.01Å; D142-R545 IonicContact OD1-NH2 3.5Å; D142-R545 PolarHBondContact OD1-NH2 3.45Å; R541-R545 WeakPolarHBondContact O-CG 3.42Å; R541-R545 PolarHBondContact O-N 2.79Å; R542-R545 WeakPolarHBondContact O-CB 3.44Å; R542-R545 PolarHBondContact O-N 2.81Å; R542-R545 VanDerWaalsContact O-N 3.15Å; L543-R545 VanDerWaalsContact C-N 3.26Å; L543-R545 PolarHBondContact O-N 3.4Å; R545-I547 VanDerWaalsContact C-N 3.25Å; R545-I547 PolarHBondContact O-N 3.03Å; R545-N548 PolarHBondContact O-N 3.4Å; R545-N548 VanDerWaalsContact O-N 3.13Å; R545-V549 WeakPolarHBondContact O-CB 3.19Å; R545-V549 WeakPolarHBondContact O-CG2 3.37Å; R545-V549 PolarHBondContact O-N 3.27Å
546	T	70.7	Confident	67.6	Low	78 Å²	78	56.6 Å²	56.6	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-56.6	-44.3	177.6	-52.3	0	0	0	0	110.7	R542 L543 V549 L550	R542-T546 PolarHBondContact O-N 3.06Å; R542-T546 VanDerWaalsContact O-N 3.15Å; R542-T546 PolarHBondContact O-OG1 3.13Å; L543-T546 PolarHBondContact O-N 3.38Å; T546-V549 PolarHBondContact O-N 3.03Å; T546-L550 HydrophobicContact CG2-CD1 3.96Å; T546-L550 WeakPolarHBondContact O-CB 3.19Å; T546-L550 VanDerWaalsContact O-CG 3.23Å; T546-L550 WeakPolarHBondContact O-CG 3.2Å; T546-L550 PolarHBondContact O-N 3.09Å
547	I	70.1	Confident	66.8	Low	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-46.9	176	-67.2	161.9	0	0	0	111.3	I524 M526 H537 L543 R544 R545 V549 L550 Q551 I560	I524-I547 HydrophobicContact CD1-CG1 3.8Å; M526-I547 HydrophobicContact CE-CD1 3.72Å; M526-I547 HydrophobicContact CE-CG1 4.32Å; H537-I547 HydrophobicContact CB-CD1 3.47Å; H537-I547 VanDerWaalsContact CB-CD1 3.47Å; L543-I547 HydrophobicContact CD1-CD1 4.44Å; L543-I547 HydrophobicContact CG-CD1 4.03Å; L543-I547 WeakPolarHBondContact O-CD1 3.3Å; L543-I547 VanDerWaalsContact O-CG1 3.32Å; L543-I547 WeakPolarHBondContact O-CG1 3.36Å; L543-I547 PolarHBondContact O-N 3.28Å; R544-I547 PolarHBondContact O-N 2.91Å; R545-I547 VanDerWaalsContact C-N 3.25Å; R545-I547 PolarHBondContact O-N 3.03Å; I547-V549 PolarHBondContact O-N 3.38Å; I547-L550 PolarHBondContact O-N 3.03Å; I547-Q551 HydrophobicContact CG2-CG 4.33Å; I547-Q551 VanDerWaalsContact O-CB 3.3Å; I547-Q551 WeakPolarHBondContact O-CB 3.39Å; I547-Q551 VanDerWaalsContact O-CG 3.27Å; I547-Q551 WeakPolarHBondContact O-CG 3.44Å; I547-Q551 PolarHBondContact O-N 3.21Å; I547-I560 HydrophobicContact CD1-CD1 3.93Å; I547-I560 HydrophobicContact CG1-CD1 4.44Å; I547-I560 HydrophobicContact CG2-CD1 4.15Å
548	N	69.3	Low	66.2	Low	63 Å²	63	55.5 Å²	55.5	34%	0.337	28%	0.28	S	S	.	.	H	α-helix	trans	-64.3	-39.4	-179.8	-74.7	-20.1	0	0	0	112.3	R544 R545 Q551 F552	R544-N548 WeakPolarHBondContact O-CB 3.01Å; R544-N548 VanDerWaalsContact O-CG 3.23Å; R544-N548 PolarHBondContact O-N 2.7Å; R544-N548 PolarHBondContact O-ND2 2.89Å; R545-N548 PolarHBondContact O-N 3.4Å; R545-N548 VanDerWaalsContact O-N 3.13Å; N548-Q551 PolarHBondContact O-N 3.39Å; N548-F552 WeakPolarHBondContact O-CB 3.13Å; N548-F552 PolarHBondContact O-N 3.22Å
549	V	69	Low	65.6	Low	63 Å²	63	56.1 Å²	56.1	38%	0.382	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-47.7	176.6	170.5	0	0	0	0	110.6	R545 T546 I547 Q551 F552 I553	R545-V549 WeakPolarHBondContact O-CB 3.19Å; R545-V549 WeakPolarHBondContact O-CG2 3.37Å; R545-V549 PolarHBondContact O-N 3.27Å; T546-V549 PolarHBondContact O-N 3.03Å; I547-V549 PolarHBondContact O-N 3.38Å; V549-Q551 VanDerWaalsContact C-N 3.31Å; V549-Q551 PolarHBondContact O-N 2.92Å; V549-F552 WeakPolarHBondContact O-CB 3.43Å; V549-F552 PolarHBondContact O-N 3.36Å; V549-F552 VanDerWaalsContact O-N 3.09Å; V549-I553 HydrophobicContact CG1-CD1 3.78Å; V549-I553 WeakPolarHBondContact O-CG1 3.33Å; V549-I553 PolarHBondContact O-N 3.3Å
550	L	67.3	Low	65.3	Low	40 Å²	40	54.3 Å²	54.3	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-45	176.5	-72.2	171.2	0	0	0	110.6	I522 I524 T546 I547 F552 I553 S554 V558	I522-L550 HydrophobicContact CD1-CD2 4.05Å; I522-L550 HydrophobicContact CG2-CD1 4.37Å; I524-L550 HydrophobicContact CD1-CD1 3.6Å; I524-L550 HydrophobicContact CG1-CD1 4.14Å; T546-L550 HydrophobicContact CG2-CD1 3.96Å; T546-L550 WeakPolarHBondContact O-CB 3.19Å; T546-L550 VanDerWaalsContact O-CG 3.23Å; T546-L550 WeakPolarHBondContact O-CG 3.2Å; T546-L550 PolarHBondContact O-N 3.09Å; I547-L550 PolarHBondContact O-N 3.03Å; L550-F552 VanDerWaalsContact C-N 3.27Å; L550-F552 PolarHBondContact O-N 3.48Å; L550-I553 PolarHBondContact O-N 3.07Å; L550-S554 PolarHBondContact O-N 3.26Å; L550-V558 HydrophobicContact CB-CG1 4.14Å; L550-V558 HydrophobicContact CB-CG2 3.82Å; L550-V558 WeakPolarHBondContact O-CG2 3.38Å
551	Q	66.9	Low	64.7	Low	8 Å²	8	57.5 Å²	57.5	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-61.2	-35.1	175.3	-77.8	-177.7	7.2	0	0	112.1	R210 I547 N548 V549 S554 P555 V558	R210-Q551 HydrophobicContact CG-CB 4.44Å; R210-Q551 PolarHBondContact NE-O 3.29Å; R210-Q551 PolarHBondContact NH2-O 3.05Å; I547-Q551 HydrophobicContact CG2-CG 4.33Å; I547-Q551 VanDerWaalsContact O-CB 3.3Å; I547-Q551 WeakPolarHBondContact O-CB 3.39Å; I547-Q551 VanDerWaalsContact O-CG 3.27Å; I547-Q551 WeakPolarHBondContact O-CG 3.44Å; I547-Q551 PolarHBondContact O-N 3.21Å; N548-Q551 PolarHBondContact O-N 3.39Å; V549-Q551 VanDerWaalsContact C-N 3.31Å; V549-Q551 PolarHBondContact O-N 2.92Å; Q551-S554 CarbonylContact O-C 3.57Å; Q551-P555 WeakPolarHBondContact O-CA 3.46Å; Q551-V558 HydrophobicContact CG-CB 4.3Å; Q551-V558 HydrophobicContact CG-CG1 4.14Å
552	F	66.1	Low	64.1	Low	160 Å²	160	58.2 Å²	58.2	70%	0.702	29%	0.286	S	S	*	.	H	α-helix	trans	-65.7	-47.4	176.6	-180	-97.4	0	0	0	111.9	R210 N548 V549 L550	R210-F552 PolarHBondContact NH2-O 3.31Å; N548-F552 WeakPolarHBondContact O-CB 3.13Å; N548-F552 PolarHBondContact O-N 3.22Å; V549-F552 WeakPolarHBondContact O-CB 3.43Å; V549-F552 PolarHBondContact O-N 3.36Å; V549-F552 VanDerWaalsContact O-N 3.09Å; L550-F552 VanDerWaalsContact C-N 3.27Å; L550-F552 PolarHBondContact O-N 3.48Å
553	I	66.3	Low	63.4	Low	113 Å²	113	54 Å²	54	58%	0.579	27%	0.27	S	S	*	.	H	α-helix	trans	-69	-40.3	-179.2	-63.1	166.7	0	0	0	110.8	V549 L550	V549-I553 HydrophobicContact CG1-CD1 3.78Å; V549-I553 WeakPolarHBondContact O-CG1 3.33Å; V549-I553 PolarHBondContact O-N 3.3Å; L550-I553 PolarHBondContact O-N 3.07Å
554	S	64.6	Low	62.5	Low	28 Å²	28	56.6 Å²	56.6	20%	0.196	28%	0.284	C	S	.	.			trans	-140.6	89.4	-178.6	-169.2	0	0	0	0	112.3	L550 Q551 N556 A557 V558	L550-S554 PolarHBondContact O-N 3.26Å; Q551-S554 CarbonylContact O-C 3.57Å; S554-N556 VanDerWaalsContact C-N 3.3Å; S554-N556 PolarHBondContact O-N 2.84Å; S554-A557 WeakPolarHBondContact OG-CB 3.35Å; S554-V558 WeakPolarHBondContact O-CG2 3.15Å
555	P	59.1	Low	61.1	Low	56 Å²	56	57.9 Å²	57.9	36%	0.364	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-34.2	-177.5	17.3	-23.2	0	0	0	113.4	R210 Q551	R210-P555 VanDerWaalsContact NH2-CB 3.3Å; R210-P555 VanDerWaalsContact NH2-CD 3.31Å; R210-P555 VanDerWaalsContact NH2-CG 3.31Å; Q551-P555 WeakPolarHBondContact O-CA 3.46Å
556	N	52.4	Low	59.9	Low	128 Å²	128	59.2 Å²	59.2	68%	0.684	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-19.4	-173.3	-64.5	-16.3	0	0	0	112.8	S554	S554-N556 VanDerWaalsContact C-N 3.3Å; S554-N556 PolarHBondContact O-N 2.84Å
557	A	48.1	Very low	58.5	Low	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-9.7	-174.4	0	0	0	0	0	114.4	G519 P520 L521 I522 S554	G519-A557 WeakPolarHBondContact O-CB 3.29Å; P520-A557 WeakPolarHBondContact O-CB 3.42Å; L521-A557 CarbonylContact C-O 3.45Å; L521-A557 VanDerWaalsContact C-O 3.28Å; L521-A557 WeakPolarHBondContact CA-O 3.3Å; L521-A557 WeakPolarHBondContact CG-O 3.08Å; I522-A557 PolarHBondContact N-O 3.11Å; S554-A557 WeakPolarHBondContact OG-CB 3.35Å
558	V	51.3	Low	57.2	Low	3 Å²	3	62.2 Å²	62.2	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.8	-176.5	-179.6	0	0	0	0	111.4	R209 I522 I524 L550 Q551 S554	R209-V558 PolarHBondContact NH1-O 3.03Å; I522-V558 HydrophobicContact CB-CG2 4.19Å; I522-V558 HydrophobicContact CD1-CG2 4.44Å; I524-V558 HydrophobicContact CD1-CG1 4.47Å; L550-V558 HydrophobicContact CB-CG1 4.14Å; L550-V558 HydrophobicContact CB-CG2 3.82Å; L550-V558 WeakPolarHBondContact O-CG2 3.38Å; Q551-V558 HydrophobicContact CG-CB 4.3Å; Q551-V558 HydrophobicContact CG-CG1 4.14Å; S554-V558 WeakPolarHBondContact O-CG2 3.15Å
559	G	56.8	Low	55.8	Low	16 Å²	16	67 Å²	67	17%	0.165	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.1	174.9	0	0	0	0	0	110.6	I522 K523 I524	I522-G559 PolarHBondContact O-N 3.44Å; I522-G559 VanDerWaalsContact O-N 3.15Å; K523-G559 WeakPolarHBondContact CA-O 3.33Å; I524-G559 PolarHBondContact N-O 3.24Å; I524-G559 VanDerWaalsContact N-O 3.13Å
560	I	60.8	Low	54.6	Low	30 Å²	30	70 Å²	70	15%	0.154	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.5	169.3	-63.2	169.5	0	0	0	107.1	M526 I547 Y562	M526-I560 HydrophobicContact CE-CB 4.26Å; M526-I560 HydrophobicContact CE-CD1 4.19Å; M526-I560 HydrophobicContact CE-CG1 3.9Å; M526-I560 HydrophobicContact CE-CG2 3.49Å; M526-I560 VanDerWaalsContact CE-CG2 3.49Å; M526-I560 HydrophobicContact SD-CG2 4.12Å; I547-I560 HydrophobicContact CD1-CD1 3.93Å; I547-I560 HydrophobicContact CG1-CD1 4.44Å; I547-I560 HydrophobicContact CG2-CD1 4.15Å; I560-Y562 HydrophobicContact CG2-CD2 4.34Å; I560-Y562 HydrophobicContact CG2-CE1 4.08Å; I560-Y562 HydrophobicContact CG2-CE2 3.75Å
561	R	58.6	Low	53.5	Low	112 Å²	112	71.8 Å²	71.8	42%	0.423	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.3	174.8	-171.5	178.9	-172.7	-172.2	1.4	108.7	I524 D525 M526	I524-R561 PolarHBondContact O-N 3.34Å; I524-R561 VanDerWaalsContact O-O 3.05Å; D525-R561 WeakPolarHBondContact CA-O 3.23Å; D525-R561 WeakPolarHBondContact OD1-CD 3.32Å; M526-R561 PolarHBondContact N-O 2.97Å
562	Y	60.2	Low	52.4	Low	29 Å²	29	75.9 Å²	75.9	11%	0.114	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	127.9	172	-63.8	-74.6	0	0	0	109.2	M526 D535 H537 I560	M526-Y562 HydrophobicContact CB-CD1 4.21Å; M526-Y562 HydrophobicContact CB-CE1 4.34Å; M526-Y562 WeakPolarHBondContact O-CA 3.14Å; M526-Y562 HydrophobicContact SD-CE1 4.3Å; D535-Y562 HydrophobicContact CB-CE1 4Å; D535-Y562 PolarHBondContact OD2-OH 3.24Å; H537-Y562 PolarHBondContact CE1-OH 3.25Å; H537-Y562 PolarHBondContact ND1-OH 3.44Å; I560-Y562 HydrophobicContact CG2-CD2 4.34Å; I560-Y562 HydrophobicContact CG2-CE1 4.08Å; I560-Y562 HydrophobicContact CG2-CE2 3.75Å
563	R	56.5	Low	51.2	Low	96 Å²	96	73 Å²	73	36%	0.362	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	114.8	169.4	-72	-171.4	179.5	-174.7	-0	108.8	D525 M526 R528	D525-R563 HydrophobicContact CB-CG 4.44Å; D525-R563 IonicContact OD2-CZ 3.47Å; D525-R563 VanDerWaalsContact OD2-CZ 3.26Å; D525-R563 IonicContact OD2-NE 3.99Å; D525-R563 PolarHBondContact OD2-NE 3.37Å; D525-R563 IonicContact OD2-NH2 3.43Å; D525-R563 PolarHBondContact OD2-NH2 2.99Å; M526-R563 PolarHBondContact O-N 2.9Å; R528-R563 WeakPolarHBondContact CB-O 3.48Å; R528-R563 PolarHBondContact N-O 3.25Å; R528-R563 VanDerWaalsContact N-O 3.15Å
564	D	51.6	Low	50	Low	88 Å²	88	75.6 Å²	75.6	47%	0.471	38%	0.379	S	S	.	.			trans	-74.4	134	167.5	-65.9	-45.6	0	0	0	108.5	R528 P566 L567	R528-D564 WeakPolarHBondContact CD-OD1 3.17Å; R528-D564 IonicContact CZ-OD1 3.86Å; R528-D564 IonicContact NE-OD1 3.92Å; R528-D564 IonicContact NH1-OD1 3.35Å; R528-D564 PolarHBondContact NH1-OD1 2.96Å; R528-D564 IonicContact NH1-OD2 3.74Å; D564-P566 VanDerWaalsContact C-N 3.32Å; D564-P566 WeakPolarHBondContact O-CD 3.4Å; D564-L567 PolarHBondContact O-N 3.19Å
565	G	46.7	Very low	49	Very low	43 Å²	43	80.8 Å²	80.8	44%	0.443	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-23.5	-172.3	0	0	0	0	0	119.1	L567 L568	G565-L567 VanDerWaalsContact C-N 3.29Å; G565-L567 PolarHBondContact O-N 3.12Å; G565-L568 PolarHBondContact O-N 3.22Å
566	P	45.1	Very low	48.2	Very low	90 Å²	90	82.6 Å²	82.6	58%	0.584	41%	0.414	S	S	*	.	H	α-helix	trans	-62.4	-35.3	176.2	-21.3	32.7	0	0	0	113.2	D564 L568 Y569 E570	D564-P566 VanDerWaalsContact C-N 3.32Å; D564-P566 WeakPolarHBondContact O-CD 3.4Å; P566-L568 VanDerWaalsContact C-N 3.31Å; P566-L568 PolarHBondContact O-N 2.91Å; P566-Y569 PolarHBondContact O-N 2.82Å; P566-E570 PolarHBondContact O-N 3.04Å
567	L	41.2	Very low	47.5	Very low	57 Å²	57	80.8 Å²	80.8	30%	0.298	41%	0.412	S	S	.	.	H	α-helix	trans	-71.6	-27	-176.2	-151.5	96.3	0	0	0	112.4	D564 G565 L571	D564-L567 PolarHBondContact O-N 3.19Å; G565-L567 VanDerWaalsContact C-N 3.29Å; G565-L567 PolarHBondContact O-N 3.12Å; L567-L571 HydrophobicContact CD2-CD1 4Å; L567-L571 HydrophobicContact CG-CD1 4.34Å; L567-L571 WeakPolarHBondContact O-CB 3.45Å; L567-L571 PolarHBondContact O-N 2.93Å
568	L	42.4	Very low	46.9	Very low	84 Å²	84	89.9 Å²	89.9	44%	0.44	46%	0.459	S	S	.	.	H	α-helix	trans	-74.2	-35.9	180	-170	71.5	0	0	0	111.4	G565 P566 L572	G565-L568 PolarHBondContact O-N 3.22Å; P566-L568 VanDerWaalsContact C-N 3.31Å; P566-L568 PolarHBondContact O-N 2.91Å; L568-L572 HydrophobicContact CG-CD1 3.98Å; L568-L572 VanDerWaalsContact O-CB 3.27Å; L568-L572 WeakPolarHBondContact O-CB 3.47Å; L568-L572 WeakPolarHBondContact O-CD1 3.29Å; L568-L572 VanDerWaalsContact O-CG 3.29Å; L568-L572 WeakPolarHBondContact O-CG 3.49Å; L568-L572 PolarHBondContact O-N 3.26Å
569	Y	41	Very low	46.7	Very low	163 Å²	163	94.2 Å²	94.2	64%	0.639	48%	0.481	S	S	*	.	H	α-helix	trans	-68.6	-45.7	175.9	-166.5	-95.9	0	0	0	110.1	P566 L571 L572 Q573	P566-Y569 PolarHBondContact O-N 2.82Å; Y569-L571 PolarHBondContact O-N 3.35Å; Y569-L572 PolarHBondContact O-N 3.39Å; Y569-Q573 VanDerWaalsContact O-CB 3.26Å; Y569-Q573 WeakPolarHBondContact O-CB 3.42Å; Y569-Q573 PolarHBondContact O-N 3.43Å
570	E	42.7	Very low	46.2	Very low	127 Å²	127	98.3 Å²	98.3	59%	0.593	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-40.2	176.7	-72.2	-178.1	173.2	0	0	113	P566 Q573 Y574	P566-E570 PolarHBondContact O-N 3.04Å; E570-Q573 PolarHBondContact O-N 3.25Å; E570-Y574 WeakPolarHBondContact O-CB 3.44Å; E570-Y574 PolarHBondContact O-N 3.22Å
571	L	44.3	Very low	45.4	Very low	76 Å²	76	102.1 Å²	102.1	40%	0.398	52%	0.517	S	S	.	.	H	α-helix	trans	-68.5	-41.9	175.5	-100.1	148.7	0	0	0	113.2	L567 Y569 Q573 Y574 E575	L567-L571 HydrophobicContact CD2-CD1 4Å; L567-L571 HydrophobicContact CG-CD1 4.34Å; L567-L571 WeakPolarHBondContact O-CB 3.45Å; L567-L571 PolarHBondContact O-N 2.93Å; Y569-L571 PolarHBondContact O-N 3.35Å; L571-Q573 VanDerWaalsContact C-N 3.31Å; L571-Y574 PolarHBondContact O-N 2.99Å; L571-E575 PolarHBondContact O-N 2.87Å
572	L	43.9	Very low	44.6	Very low	95 Å²	95	101.5 Å²	101.5	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-36.2	175.8	-80.4	166.3	0	0	0	111.5	L568 Y569 Y574 E575 S576	L568-L572 HydrophobicContact CG-CD1 3.98Å; L568-L572 VanDerWaalsContact O-CB 3.27Å; L568-L572 WeakPolarHBondContact O-CB 3.47Å; L568-L572 WeakPolarHBondContact O-CD1 3.29Å; L568-L572 VanDerWaalsContact O-CG 3.29Å; L568-L572 WeakPolarHBondContact O-CG 3.49Å; L568-L572 PolarHBondContact O-N 3.26Å; Y569-L572 PolarHBondContact O-N 3.39Å; L572-Y574 VanDerWaalsContact C-N 3.32Å; L572-E575 PolarHBondContact O-N 3.05Å; L572-S576 VanDerWaalsContact O-CB 3.29Å; L572-S576 WeakPolarHBondContact O-CB 3.35Å; L572-S576 PolarHBondContact O-N 3.15Å; L572-S576 PolarHBondContact O-OG 2.83Å; L572-S576 VanDerWaalsContact O-OG 3.09Å
573	Q	41.3	Very low	43.6	Very low	100 Å²	100	106.1 Å²	106.1	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-66.8	-39.1	176.4	-142	163.2	2.4	0	0	110.4	Y569 E570 L571 S576 S577	Y569-Q573 VanDerWaalsContact O-CB 3.26Å; Y569-Q573 WeakPolarHBondContact O-CB 3.42Å; Y569-Q573 PolarHBondContact O-N 3.43Å; E570-Q573 PolarHBondContact O-N 3.25Å; L571-Q573 VanDerWaalsContact C-N 3.31Å; Q573-S576 WeakPolarHBondContact CA-OG 3.49Å; Q573-S576 PolarHBondContact O-N 2.78Å; Q573-S576 PolarHBondContact O-OG 3.18Å; Q573-S577 WeakPolarHBondContact O-CB 3.45Å; Q573-S577 PolarHBondContact O-N 3.45Å; Q573-S577 VanDerWaalsContact O-N 3.14Å; Q573-S577 PolarHBondContact O-OG 3.03Å
574	Y	42	Very low	42.8	Very low	167 Å²	167	106.7 Å²	106.7	66%	0.655	56%	0.56	S	S	*	*	H	α-helix	trans	-67.3	-42.2	175.3	-147.9	-95.1	0	0	0	112.9	E570 L571 L572 S576 S577 L578	E570-Y574 WeakPolarHBondContact O-CB 3.44Å; E570-Y574 PolarHBondContact O-N 3.22Å; L571-Y574 PolarHBondContact O-N 2.99Å; L572-Y574 VanDerWaalsContact C-N 3.32Å; Y574-S576 VanDerWaalsContact C-N 3.33Å; Y574-S577 WeakPolarHBondContact CA-OG 3.18Å; Y574-S577 PolarHBondContact O-N 3.03Å; Y574-S577 PolarHBondContact O-OG 2.95Å; Y574-L578 HydrophobicContact CD1-CD1 4.31Å; Y574-L578 HydrophobicContact CE1-CD1 4.36Å; Y574-L578 PolarHBondContact O-N 3.31Å
575	E	43.5	Very low	42.1	Very low	137 Å²	137	108.1 Å²	108.1	64%	0.64	57%	0.567	S	S	*	*	H	α-helix	trans	-70.1	-25.8	174.6	-83.3	-178.8	165.3	0	0	113.2	L571 L572	L571-E575 PolarHBondContact O-N 2.87Å; L572-E575 PolarHBondContact O-N 3.05Å
576	S	40.9	Very low	41.8	Very low	93 Å²	93	113.1 Å²	113.1	65%	0.65	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-10.7	174.9	69.2	0	0	0	0	114.2	L572 Q573 Y574	L572-S576 VanDerWaalsContact O-CB 3.29Å; L572-S576 WeakPolarHBondContact O-CB 3.35Å; L572-S576 PolarHBondContact O-N 3.15Å; L572-S576 PolarHBondContact O-OG 2.83Å; L572-S576 VanDerWaalsContact O-OG 3.09Å; Q573-S576 WeakPolarHBondContact CA-OG 3.49Å; Q573-S576 PolarHBondContact O-N 2.78Å; Q573-S576 PolarHBondContact O-OG 3.18Å; Y574-S576 VanDerWaalsContact C-N 3.33Å
577	S	38.9	Very low	41.5	Very low	90 Å²	90	115 Å²	115	63%	0.629	58%	0.576	S	S	*	*			trans	-103.9	-1.3	-179.9	60.2	0	0	0	0	114.2	Q573 Y574	Q573-S577 WeakPolarHBondContact O-CB 3.45Å; Q573-S577 PolarHBondContact O-N 3.45Å; Q573-S577 VanDerWaalsContact O-N 3.14Å; Q573-S577 PolarHBondContact O-OG 3.03Å; Y574-S577 WeakPolarHBondContact CA-OG 3.18Å; Y574-S577 PolarHBondContact O-N 3.03Å; Y574-S577 PolarHBondContact O-OG 2.95Å
578	L	35.9	Very low	41.5	Very low	191 Å²	191	120.3 Å²	120.3	100%	1	60%	0.601	S	S	*	*			trans	-97.8	0	162.8	-81.5	157.4	0	0	0	108.4	Y574	Y574-L578 HydrophobicContact CD1-CD1 4.31Å; Y574-L578 HydrophobicContact CE1-CD1 4.36Å; Y574-L578 PolarHBondContact O-N 3.31Å

Retrieved 578 of 578 residues in 958.1 ms (Link to these results)

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