A0A087XU05_POEFO Loading...

Cytochrome P450, family 27, subfamily B, polypeptide 1

AlphaFold DB , UniProt , Accession A0A087XU05, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 520 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	S	52	Low	45	Very low	180 Å²	180	150.6 Å²	150.6	100%	1.259	77%	0.772	S	S	*	*				0	48.4	0	53.1	0	0	0	0	112.5
2	A	47.1	Very low	44.9	Very low	96 Å²	96	145.7 Å²	145.7	79%	0.793	75%	0.754	S	S	*	*			trans	-120.2	16.9	-178.2	0	0	0	0	0	114.2
3	N	47	Very low	44.6	Very low	134 Å²	134	149.8 Å²	149.8	72%	0.717	75%	0.754	S	S	*	*	S	Bend	trans	-130.5	17.8	-172	-130.7	-7.1	0	0	0	115.5
4	R	43.7	Very low	44.4	Very low	236 Å²	236	153.3 Å²	153.3	89%	0.891	75%	0.754	S	S	*	*	S	Bend	trans	-110.6	-15.1	175.8	-106.1	-175.2	-173.1	-166.4	2.3	115.4
5	H	42.6	Very low	44	Very low	174 Å²	174	151.5 Å²	151.5	81%	0.806	75%	0.745	S	S	*	*	S	Bend	trans	-90.1	-18.5	177	-87.9	-28.4	0	0	0	115
6	Q	45.5	Very low	43.8	Very low	148 Å²	148	147.5 Å²	147.5	69%	0.692	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-17.3	-176.9	-139.7	162.7	1.4	0	0	113.9	T10	Q6-T10 PolarHBondContact O-OG1 3.3Å; Q6-T10 VanDerWaalsContact O-OG1 3.11Å
7	R	44.3	Very low	43.6	Very low	215 Å²	215	148 Å²	148	81%	0.811	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-16.4	177.3	-83.9	-177.6	171.1	-179.4	-2.1	114.7
8	S	43.8	Very low	43.2	Very low	78 Å²	78	149.1 Å²	149.1	55%	0.545	73%	0.734	S	S	.	*	H	α-helix	trans	-82.7	-29.4	178.5	-168.5	0	0	0	0	113.1
9	M	40.4	Very low	42.7	Very low	154 Å²	154	145.5 Å²	145.5	76%	0.759	73%	0.731	S	S	*	*	H	α-helix	trans	-82.2	-19.8	-177.8	-77.6	-171	-176.8	0	0	114	R13	M9-R13 PolarHBondContact O-N 2.89Å
10	T	47.5	Very low	42.3	Very low	93 Å²	93	145.6 Å²	145.6	57%	0.571	73%	0.733	S	S	*	*	H	α-helix	trans	-81.2	-25.4	178.9	2.6	0	0	0	0	113	Q6 R14	Q6-T10 PolarHBondContact O-OG1 3.3Å; Q6-T10 VanDerWaalsContact O-OG1 3.11Å; T10-R14 PolarHBondContact O-N 3.21Å
11	F	40.7	Very low	42.2	Very low	149 Å²	149	149.4 Å²	149.4	65%	0.654	74%	0.738	S	S	*	*	H	α-helix	trans	-77.2	-40.6	178	-163.3	-100	0	0	0	112.1	R13 R14 M15	F11-R13 PolarHBondContact O-N 3.07Å; F11-R14 PolarHBondContact O-N 3.46Å; F11-M15 HydrophobicContact CE1-SD 4.37Å; F11-M15 PolarHBondContact O-N 2.8Å
12	V	44.6	Very low	41.3	Very low	91 Å²	91	147.4 Å²	147.4	55%	0.552	72%	0.718	S	S	*	*	H	α-helix	trans	-66.3	-37	176.5	179	0	0	0	0	111.6	R14 M15 V16	V12-R14 VanDerWaalsContact C-N 3.34Å; V12-R14 PolarHBondContact O-N 2.78Å; V12-M15 PolarHBondContact O-N 2.94Å; V12-V16 WeakPolarHBondContact O-CG2 3.14Å; V12-V16 PolarHBondContact O-N 3.28Å
13	R	41.3	Very low	40.5	Very low	199 Å²	199	148.3 Å²	148.3	75%	0.751	72%	0.719	S	S	*	*	H	α-helix	trans	-66.9	-30.8	177.4	-121.4	177.3	177.2	-178.9	-0.7	113.5	M9 F11 Q17	M9-R13 PolarHBondContact O-N 2.89Å; F11-R13 PolarHBondContact O-N 3.07Å; R13-Q17 PolarHBondContact O-N 3.1Å
14	R	41.1	Very low	40.2	Very low	199 Å²	199	148.1 Å²	148.1	75%	0.751	72%	0.722	S	S	*	*	H	α-helix	trans	-78.4	-35.4	177	-90.2	-175.3	172.5	-178.6	-1.8	113.2	T10 F11 V12 Q18	T10-R14 PolarHBondContact O-N 3.21Å; F11-R14 PolarHBondContact O-N 3.46Å; V12-R14 VanDerWaalsContact C-N 3.34Å; V12-R14 PolarHBondContact O-N 2.78Å; R14-Q18 PolarHBondContact O-N 2.77Å
15	M	38.4	Very low	40	Very low	127 Å²	127	147.5 Å²	147.5	63%	0.626	72%	0.72	S	S	*	*	H	α-helix	trans	-65.7	-38.4	174.3	-85.2	-169.4	80.1	0	0	112.5	F11 V12 Q18 A19	F11-M15 HydrophobicContact CE1-SD 4.37Å; F11-M15 PolarHBondContact O-N 2.8Å; V12-M15 PolarHBondContact O-N 2.94Å; M15-Q18 PolarHBondContact O-N 2.84Å; M15-A19 PolarHBondContact O-N 2.85Å
16	V	41.2	Very low	40	Very low	87 Å²	87	146.6 Å²	146.6	53%	0.527	72%	0.721	S	S	.	*	H	α-helix	trans	-72.9	-31.8	-179.2	177.5	0	0	0	0	112	V12	V12-V16 WeakPolarHBondContact O-CG2 3.14Å; V12-V16 PolarHBondContact O-N 3.28Å
17	Q	40.5	Very low	39.4	Very low	156 Å²	156	144.2 Å²	144.2	73%	0.729	73%	0.727	S	S	*	*	H	α-helix	trans	-76.3	-20.7	175	-80.1	-175.4	-30.8	0	0	114	R13	R13-Q17 PolarHBondContact O-N 3.1Å
18	Q	35.7	Very low	39.6	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	73%	0.728	S	S	*	*	H	α-helix	trans	-85.8	-19.7	176.1	-118.1	173.5	-7	0	0	113.7	R14 M15	R14-Q18 PolarHBondContact O-N 2.77Å; M15-Q18 PolarHBondContact O-N 2.84Å
19	A	34.8	Very low	39.3	Very low	81 Å²	81	143.7 Å²	143.7	67%	0.669	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-6.8	179.1	0	0	0	0	0	114.5	M15	M15-A19 PolarHBondContact O-N 2.85Å
20	L	34.8	Very low	39.2	Very low	147 Å²	147	142.7 Å²	142.7	77%	0.77	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	12.6	-173.4	-80.4	165.5	0	0	0	115.2
21	R	39.3	Very low	39.1	Very low	226 Å²	226	142.9 Å²	142.9	85%	0.853	73%	0.728	S	S	*	*	S	Bend	trans	-109.8	86.8	159.8	-81.5	-175.7	177.2	171.9	-0.6	108.3
22	V	33.5	Very low	39.3	Very low	138 Å²	138	143 Å²	143	84%	0.836	73%	0.728	S	S	*	*	S	Bend	trans	168.6	130.3	140.4	156.6	0	0	0	0	108.9
23	S	29.3	Very low	39.3	Very low	116 Å²	116	146.7 Å²	146.7	81%	0.811	73%	0.732	S	S	*	*			trans	80.1	92.1	162.1	-147.3	0	0	0	0	118.5
24	V	42.4	Very low	39.2	Very low	129 Å²	129	143.8 Å²	143.8	78%	0.782	73%	0.729	S	S	*	*			trans	-70.3	132.1	155.2	179.1	0	0	0	0	108.6
25	R	38.2	Very low	39.2	Very low	224 Å²	224	139.8 Å²	139.8	85%	0.845	72%	0.719	S	S	*	*				175.3	123.9	126.3	-95.8	162.4	177.2	-178.1	-1.7	112.6
26	N	42	Very low	39.5	Very low	155 Å²	155	142.8 Å²	142.8	83%	0.829	72%	0.723	S	S	*	*			trans	76.9	89	155.8	-59.9	-9.8	0	0	0	119.1
27	A	34.8	Very low	39.5	Very low	98 Å²	98	146.7 Å²	146.7	81%	0.81	73%	0.728	S	S	*	*			trans	-160.6	104.7	139	0	0	0	0	0	111.3
28	F	46.8	Very low	39.3	Very low	191 Å²	191	142.4 Å²	142.4	84%	0.838	72%	0.72	S	S	*	*			trans	-68.7	-177.2	159.2	-89.5	-114.5	0	0	0	109.9
29	P	37.8	Very low	39.4	Very low	91 Å²	91	141.9 Å²	141.9	59%	0.591	72%	0.717	S	S	*	*	S	Bend	cis	-115.6	5	-41.1	20.5	1.5	0	0	0	112
30	L	38.4	Very low	39.7	Very low	132 Å²	132	143 Å²	143	69%	0.691	72%	0.721	S	S	*	*	H	α-helix	trans	-69.9	-33.2	-175.4	-92.5	149.5	0	0	0	113.6	W33 M34	L30-W33 PolarHBondContact O-N 2.63Å; L30-M34 PolarHBondContact O-N 2.77Å; L30-M34 VanDerWaalsContact O-N 3.08Å
31	V	46.3	Very low	39.8	Very low	98 Å²	98	139.5 Å²	139.5	59%	0.594	71%	0.713	S	S	*	*	H	α-helix	trans	-67.3	-38.1	178.6	-179.9	0	0	0	0	111.3	W33 M34 E35	V31-W33 VanDerWaalsContact C-N 3.27Å; V31-W33 PolarHBondContact O-N 2.79Å; V31-M34 PolarHBondContact O-N 2.8Å; V31-E35 WeakPolarHBondContact O-CG 2.94Å; V31-E35 PolarHBondContact O-N 3.36Å
32	K	44.5	Very low	39.6	Very low	152 Å²	152	132.3 Å²	132.3	66%	0.661	70%	0.701	S	S	*	*	H	α-helix	trans	-68.1	-25.1	174.2	-81.1	-174.2	173.6	-177.4	0	113.5	R36	K32-R36 WeakPolarHBondContact O-CG 3.24Å; K32-R36 PolarHBondContact O-N 2.97Å
33	W	44.9	Very low	39.7	Very low	167 Å²	167	130 Å²	130	63%	0.633	70%	0.697	S	S	*	*	H	α-helix	trans	-79	-40.2	176.2	-155.2	85.5	0	0	0	111	L30 V31 R36 W37	L30-W33 PolarHBondContact O-N 2.63Å; V31-W33 VanDerWaalsContact C-N 3.27Å; V31-W33 PolarHBondContact O-N 2.79Å; W33-R36 PolarHBondContact O-N 3.43Å; W33-W37 AromaticContact CH2-CD1 3.88Å; W33-W37 AromaticContact CH2-NE1 3.94Å; W33-W37 AromaticContact CZ3-CD1 3.87Å; W33-W37 HydrophobicContact CZ3-CG 4.48Å; W33-W37 PolarHBondContact O-N 2.99Å
34	M	38.4	Very low	40.1	Very low	138 Å²	138	130 Å²	130	68%	0.68	69%	0.694	S	S	*	*	H	α-helix	trans	-68.1	-36.1	174	-81	-178.6	144.7	0	0	113.4	L30 V31 W37 A38	L30-M34 PolarHBondContact O-N 2.77Å; L30-M34 VanDerWaalsContact O-N 3.08Å; V31-M34 PolarHBondContact O-N 2.8Å; M34-W37 PolarHBondContact O-N 2.85Å; M34-A38 WeakPolarHBondContact O-CB 3.29Å; M34-A38 PolarHBondContact O-N 2.85Å
35	E	40.6	Very low	39.7	Very low	116 Å²	116	129.5 Å²	129.5	54%	0.542	69%	0.693	S	S	.	*	H	α-helix	trans	-64.7	-42.2	173.2	-78.4	175.5	161.5	0	0	111.9	V31 W37 A38 E39	V31-E35 WeakPolarHBondContact O-CG 2.94Å; V31-E35 PolarHBondContact O-N 3.36Å; E35-W37 VanDerWaalsContact C-N 3.33Å; E35-W37 PolarHBondContact O-N 3.11Å; E35-A38 PolarHBondContact O-N 3.11Å; E35-E39 WeakPolarHBondContact O-CB 3.43Å; E35-E39 WeakPolarHBondContact O-CG 3.36Å; E35-E39 PolarHBondContact O-N 3.41Å
36	R	44.5	Very low	39.9	Very low	189 Å²	189	128 Å²	128	71%	0.713	70%	0.701	S	S	*	*	H	α-helix	trans	-66.9	-31.8	175.2	-75.5	175.2	87.1	-175.3	6.8	113.1	K32 W33 S40	K32-R36 WeakPolarHBondContact O-CG 3.24Å; K32-R36 PolarHBondContact O-N 2.97Å; W33-R36 PolarHBondContact O-N 3.43Å; R36-S40 WeakPolarHBondContact O-CB 3.05Å; R36-S40 PolarHBondContact O-N 3.2Å; R36-S40 VanDerWaalsContact O-N 3.12Å
37	W	42.6	Very low	39.4	Very low	169 Å²	169	123.3 Å²	123.3	64%	0.64	69%	0.689	S	S	*	*	H	α-helix	trans	-74.2	-37.8	175.5	-131.3	85	0	0	0	111.8	W33 M34 E35 S40 A41	W33-W37 AromaticContact CH2-CD1 3.88Å; W33-W37 AromaticContact CH2-NE1 3.94Å; W33-W37 AromaticContact CZ3-CD1 3.87Å; W33-W37 HydrophobicContact CZ3-CG 4.48Å; W33-W37 PolarHBondContact O-N 2.99Å; M34-W37 PolarHBondContact O-N 2.85Å; E35-W37 VanDerWaalsContact C-N 3.33Å; E35-W37 PolarHBondContact O-N 3.11Å; W37-S40 PolarHBondContact O-N 3.05Å; W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 3.5Å; W37-A41 VanDerWaalsContact O-N 3.13Å
38	A	35.5	Very low	39.4	Very low	66 Å²	66	123.8 Å²	123.8	55%	0.545	69%	0.687	S	S	.	*	H	α-helix	trans	-69.5	-35.1	175.3	0	0	0	0	0	112.6	M34 E35 A41 A42	M34-A38 WeakPolarHBondContact O-CB 3.29Å; M34-A38 PolarHBondContact O-N 2.85Å; E35-A38 PolarHBondContact O-N 3.11Å; A38-A41 PolarHBondContact O-N 3.01Å; A38-A42 PolarHBondContact O-N 3.38Å
39	E	38.8	Very low	38.9	Very low	156 Å²	156	119.6 Å²	119.6	73%	0.729	69%	0.688	S	S	*	*	H	α-helix	trans	-70.9	-28.8	171.6	-76.5	177.8	163.6	0	0	112.7	E35	E35-E39 WeakPolarHBondContact O-CB 3.43Å; E35-E39 WeakPolarHBondContact O-CG 3.36Å; E35-E39 PolarHBondContact O-N 3.41Å
40	S	39.8	Very low	39.1	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	70%	0.702	S	S	*	*	H	α-helix	trans	-79.3	-17.2	175	-172.8	0	0	0	0	114.1	R36 W37	R36-S40 WeakPolarHBondContact O-CB 3.05Å; R36-S40 PolarHBondContact O-N 3.2Å; R36-S40 VanDerWaalsContact O-N 3.12Å; W37-S40 PolarHBondContact O-N 3.05Å
41	A	37	Very low	39.7	Very low	73 Å²	73	127.8 Å²	127.8	60%	0.603	70%	0.704	S	S	*	*	H	α-helix	trans	-104.4	-4.6	-176.5	0	0	0	0	0	113.9	W37 A38 A43	W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 3.5Å; W37-A41 VanDerWaalsContact O-N 3.13Å; A38-A41 PolarHBondContact O-N 3.01Å; A41-A43 PolarHBondContact O-N 3.4Å
42	A	34.8	Very low	40.3	Very low	74 Å²	74	127.2 Å²	127.2	61%	0.612	71%	0.71	S	S	*	*	S	Bend	trans	-82.4	111.1	175.7	0	0	0	0	0	110.5	A38	A38-A42 PolarHBondContact O-N 3.38Å
43	A	37.2	Very low	41.3	Very low	90 Å²	90	124.5 Å²	124.5	74%	0.744	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-56.1	140.7	171.6	0	0	0	0	0	110.8	A41	A41-A43 PolarHBondContact O-N 3.4Å
44	P	36.9	Very low	43	Very low	115 Å²	115	122.5 Å²	122.5	75%	0.747	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-65.3	147.6	-178.9	27.3	-32.1	0	0	0	110.3
45	P	34.9	Very low	45.3	Very low	119 Å²	119	118.7 Å²	118.7	77%	0.773	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-63.3	144.2	174.3	27.5	-32.3	0	0	0	109.5	G47	P45-G47 PolarHBondContact O-N 3.12Å
46	L	41.2	Very low	47.2	Very low	193 Å²	193	114.3 Å²	114.3	100%	1.01	66%	0.663	S	S	*	*			trans	-60.7	79.6	172	-83.5	113.1	0	0	0	110.6
47	G	31.9	Very low	49	Very low	56 Å²	56	111.7 Å²	111.7	58%	0.577	66%	0.663	S	S	*	*			trans	-108.1	138.8	158.9	0	0	0	0	0	107.5	P45 A49	P45-G47 PolarHBondContact O-N 3.12Å; G47-A49 PolarHBondContact O-N 2.75Å
48	S	35	Very low	51	Low	109 Å²	109	108.2 Å²	108.2	76%	0.762	66%	0.657	S	S	*	*			trans	-13.2	117.4	178.3	60.9	0	0	0	0	114.1	R50	S48-R50 VanDerWaalsContact C-N 3.32Å; S48-R50 PolarHBondContact O-N 2.91Å
49	A	36.4	Very low	53.4	Low	103 Å²	103	105.4 Å²	105.4	85%	0.851	63%	0.633	S	S	*	*			trans	-51.2	97.6	172.3	0	0	0	0	0	109.5	G47 Q51	G47-A49 PolarHBondContact O-N 2.75Å; A49-Q51 PolarHBondContact O-N 2.97Å
50	R	41.3	Very low	55.7	Low	237 Å²	237	100 Å²	100	89%	0.894	61%	0.611	S	S	*	*			trans	-65.5	99.6	157	-80.7	-178.1	174.4	174.8	-2.2	103.4	S48 A52	S48-R50 VanDerWaalsContact C-N 3.32Å; S48-R50 PolarHBondContact O-N 2.91Å; R50-A52 PolarHBondContact O-N 3.48Å; R50-A52 VanDerWaalsContact O-N 3.09Å
51	Q	50.8	Low	57.8	Low	157 Å²	157	96.2 Å²	96.2	73%	0.734	59%	0.589	S	S	*	*			trans	-41.3	121.5	168.3	-112.2	168.3	-13.3	0	0	107.1	A49 V53	A49-Q51 PolarHBondContact O-N 2.97Å; Q51-V53 PolarHBondContact O-N 3.47Å; Q51-V53 VanDerWaalsContact O-N 3.09Å
52	A	58.7	Low	60	Low	87 Å²	87	93.7 Å²	93.7	72%	0.719	57%	0.566	S	S	*	*			trans	-52	123.4	170.4	0	0	0	0	0	106.7	R50 R54	R50-A52 PolarHBondContact O-N 3.48Å; R50-A52 VanDerWaalsContact O-N 3.09Å; A52-R54 PolarHBondContact O-N 3.31Å
53	V	65.5	Low	62.3	Low	95 Å²	95	94.7 Å²	94.7	58%	0.576	57%	0.565	S	S	*	*			trans	-60.2	109.9	-177.2	176.3	0	0	0	0	107.1	Q51 T55 L413	Q51-V53 PolarHBondContact O-N 3.47Å; Q51-V53 VanDerWaalsContact O-N 3.09Å; V53-T55 PolarHBondContact O-N 3.2Å; V53-L413 HydrophobicContact CG1-CB 3.51Å; V53-L413 HydrophobicContact CG1-CD2 4.09Å; V53-L413 HydrophobicContact CG1-CG 4.37Å
54	R	81.6	Confident	64.1	Low	125 Å²	125	93.3 Å²	93.3	47%	0.472	55%	0.553	S	S	.	*	B	Isolated β-bridge	trans	-69	130.8	179.1	-64.1	-179.1	179	178.8	-0.2	107.8	A52 D58 Y412 L413	A52-R54 PolarHBondContact O-N 3.31Å; R54-D58 HydrophobicContact CB-CB 4.19Å; R54-Y412 HydrophobicContact CB-CD1 3.48Å; R54-Y412 VanDerWaalsContact CB-CD1 3.48Å; R54-Y412 HydrophobicContact CB-CE1 3.6Å; R54-Y412 HydrophobicContact CB-CG 4.22Å; R54-Y412 HydrophobicContact CG-CE1 4.34Å; R54-Y412 CarbonylContact O-C 3.17Å; R54-Y412 VanDerWaalsContact O-CA 3.3Å; R54-Y412 WeakPolarHBondContact O-CA 3.47Å; R54-L413 PolarHBondContact O-N 3.26Å
55	T	86.3	Confident	65.8	Low	57 Å²	57	91.4 Å²	91.4	35%	0.35	55%	0.548	S	S	.	.			trans	-98.7	177.3	-177.6	61.8	0	0	0	0	110.6	V53 D57 D58	V53-T55 PolarHBondContact O-N 3.2Å; T55-D57 PolarHBondContact O-N 3.44Å; T55-D57 VanDerWaalsContact O-N 3.17Å; T55-D57 PolarHBondContact OG1-N 3.03Å; T55-D58 PolarHBondContact N-OD2 3.42Å; T55-D58 PolarHBondContact O-N 3.36Å; T55-D58 VanDerWaalsContact O-N 3.15Å; T55-D58 PolarHBondContact OG1-OD2 3.19Å
56	L	81.9	Confident	67.8	Low	24 Å²	24	87.7 Å²	87.7	13%	0.126	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-53	-31.3	171.1	-93.5	172.8	0	0	0	112.8	D58 M59 K96 L103 V105 P415 T418	L56-D58 VanDerWaalsContact C-N 3.32Å; L56-D58 PolarHBondContact O-N 2.94Å; L56-M59 HydrophobicContact CD2-CE 4.41Å; L56-M59 HydrophobicContact CD2-SD 4.48Å; L56-M59 WeakPolarHBondContact O-CB 3.43Å; L56-M59 PolarHBondContact O-N 3.45Å; L56-K96 WeakPolarHBondContact O-CD 3.32Å; L56-K96 PolarHBondContact O-NZ 2.93Å; L56-L103 HydrophobicContact CD1-CD2 4.4Å; L56-V105 HydrophobicContact CD2-CG2 3.54Å; L56-P415 HydrophobicContact CD1-CG 3.79Å; L56-T418 HydrophobicContact CD1-CG2 4.5Å
57	D	81.2	Confident	69.5	Low	135 Å²	135	79.5 Å²	79.5	72%	0.722	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-69.2	-33.5	-178.3	-70.2	-30.8	0	0	0	112.2	T55 M59 K96	T55-D57 PolarHBondContact O-N 3.44Å; T55-D57 VanDerWaalsContact O-N 3.17Å; T55-D57 PolarHBondContact OG1-N 3.03Å; D57-M59 VanDerWaalsContact C-N 3.26Å; D57-M59 PolarHBondContact O-N 3.34Å; D57-K96 PolarHBondContact O-NZ 3.44Å; D57-K96 VanDerWaalsContact O-NZ 3.09Å
58	D	84.6	Confident	71.4	Confident	96 Å²	96	78.7 Å²	78.7	51%	0.513	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-79.8	-5.8	178.9	-52.8	-57.7	0	0	0	113.4	R54 T55 L56 Y412	R54-D58 HydrophobicContact CB-CB 4.19Å; T55-D58 PolarHBondContact N-OD2 3.42Å; T55-D58 PolarHBondContact O-N 3.36Å; T55-D58 VanDerWaalsContact O-N 3.15Å; T55-D58 PolarHBondContact OG1-OD2 3.19Å; L56-D58 VanDerWaalsContact C-N 3.32Å; L56-D58 PolarHBondContact O-N 2.94Å; D58-Y412 HydrophobicContact CB-CE1 4.32Å
59	M	86.6	Confident	73.3	Confident	6 Å²	6	81.4 Å²	81.4	3%	0.03	46%	0.463	C	S	.	.	S	Bend	trans	-75.7	133.3	-179	-168.2	176.1	-73.1	0	0	110.7	L56 D57 V94 W95 K96 V105 Y412	L56-M59 HydrophobicContact CD2-CE 4.41Å; L56-M59 HydrophobicContact CD2-SD 4.48Å; L56-M59 WeakPolarHBondContact O-CB 3.43Å; L56-M59 PolarHBondContact O-N 3.45Å; D57-M59 VanDerWaalsContact C-N 3.26Å; D57-M59 PolarHBondContact O-N 3.34Å; M59-V94 HydrophobicContact CE-CG1 3.66Å; M59-V94 HydrophobicContact SD-CG1 3.88Å; M59-W95 VanDerWaalsContact SD-C 3.52Å; M59-K96 HydrophobicContact CB-CD 4.24Å; M59-K96 HydrophobicContact CB-CG 4.37Å; M59-K96 HydrophobicContact CG-CB 4.35Å; M59-K96 HydrophobicContact CG-CG 4.47Å; M59-K96 WeakPolarHBondContact O-CE 3.37Å; M59-K96 HydrophobicContact SD-CB 3.9Å; M59-V105 HydrophobicContact CE-CG1 3.89Å; M59-V105 HydrophobicContact CE-CG2 4.34Å; M59-V105 HydrophobicContact SD-CB 4.45Å; M59-V105 HydrophobicContact SD-CG1 3.76Å; M59-V105 HydrophobicContact SD-CG2 4.06Å; M59-Y412 HydrophobicContact CB-CD1 4.29Å; M59-Y412 HydrophobicContact CB-CE1 4.19Å; M59-Y412 HydrophobicContact CE-CD1 4.19Å; M59-Y412 HydrophobicContact CE-CD2 4.47Å; M59-Y412 HydrophobicContact CE-CG 3.94Å
60	P	87.6	Confident	75.1	Confident	43 Å²	43	77.5 Å²	77.5	28%	0.279	43%	0.427	S	S	.	.			trans	-66.3	155	176.1	30.2	-35.9	0	0	0	110.6	Y91 W95 K96	P60-Y91 HydrophobicContact CB-CD1 4.13Å; P60-Y91 WeakPolarHBondContact CG-O 3.33Å; P60-W95 HydrophobicContact CG-CB 4.49Å; P60-W95 CarbonylContact O-C 3.5Å; P60-W95 VanDerWaalsContact O-CA 3.24Å; P60-W95 WeakPolarHBondContact O-CA 3.43Å; P60-W95 VanDerWaalsContact O-CB 3.3Å; P60-W95 WeakPolarHBondContact O-CB 3.46Å; P60-K96 PolarHBondContact O-N 3.29Å
61	G	83.8	Confident	76.5	Confident	27 Å²	27	66.5 Å²	66.5	28%	0.278	39%	0.386	S	S	.	.			trans	171.8	158.4	177.9	0	0	0	0	0	113	K96	G61-K96 WeakPolarHBondContact CA-O 3.35Å
62	P	83.1	Confident	77.5	Confident	19 Å²	19	65.8 Å²	65.8	12%	0.123	38%	0.381	C	S	.	.			trans	-63	150.9	172	26.7	-32.6	0	0	0	110.6	S66 F67 Y91 K96 A97	P62-S66 WeakPolarHBondContact CB-OG 3.41Å; P62-F67 HydrophobicContact CB-CB 4.09Å; P62-F67 HydrophobicContact CG-CB 3.91Å; P62-F67 HydrophobicContact CG-CD2 3.75Å; P62-F67 HydrophobicContact CG-CG 4.19Å; P62-Y91 WeakPolarHBondContact CA-OH 3.35Å; P62-Y91 WeakPolarHBondContact CB-OH 3.5Å; P62-Y91 HydrophobicContact CG-CE2 4.36Å; P62-K96 WeakPolarHBondContact CD-O 3.31Å; P62-A97 HydrophobicContact CG-CB 4.18Å
63	T	81.2	Confident	77.7	Confident	96 Å²	96	64 Å²	64	59%	0.589	37%	0.367	S	S	*	.			trans	-64.8	150.4	165.3	65	0	0	0	0	109.4	A65 S66 F67	T63-A65 PolarHBondContact O-N 3.18Å; T63-A65 VanDerWaalsContact O-N 3.12Å; T63-S66 PolarHBondContact N-OG 2.94Å; T63-S66 PolarHBondContact O-N 2.87Å; T63-S66 PolarHBondContact O-OG 3.1Å; T63-S66 WeakPolarHBondContact OG1-CB 3.41Å; T63-S66 PolarHBondContact OG1-N 3.04Å; T63-S66 PolarHBondContact OG1-OG 3.4Å; T63-F67 PolarHBondContact O-N 3.12Å
64	A	76.4	Confident	77.3	Confident	60 Å²	60	67 Å²	67	50%	0.496	37%	0.367	S	S	.	.	H	α-helix	trans	-54.1	-36.2	179.9	0	0	0	0	0	112.7	A68	A64-A68 VanDerWaalsContact O-CB 3.28Å; A64-A68 WeakPolarHBondContact O-CB 3.33Å; A64-A68 PolarHBondContact O-N 3.12Å
65	A	72.9	Confident	76.2	Confident	76 Å²	76	62.8 Å²	62.8	63%	0.628	36%	0.363	S	S	*	.	H	α-helix	trans	-68.4	-43.9	176.3	0	0	0	0	0	112.6	T63 A68 W69	T63-A65 PolarHBondContact O-N 3.18Å; T63-A65 VanDerWaalsContact O-N 3.12Å; A65-A68 PolarHBondContact O-N 3.5Å; A65-W69 WeakPolarHBondContact O-CB 3.36Å; A65-W69 PolarHBondContact O-N 3.16Å
66	S	75.9	Confident	75.1	Confident	41 Å²	41	61.1 Å²	61.1	29%	0.287	36%	0.357	S	S	.	.	H	α-helix	trans	-65.4	-39.5	176.5	59.7	0	0	0	0	112.3	P62 T63 W69 D70	P62-S66 WeakPolarHBondContact CB-OG 3.41Å; T63-S66 PolarHBondContact N-OG 2.94Å; T63-S66 PolarHBondContact O-N 2.87Å; T63-S66 PolarHBondContact O-OG 3.1Å; T63-S66 WeakPolarHBondContact OG1-CB 3.41Å; T63-S66 PolarHBondContact OG1-N 3.04Å; T63-S66 PolarHBondContact OG1-OG 3.4Å; S66-W69 WeakPolarHBondContact O-CB 3.34Å; S66-W69 PolarHBondContact O-N 3.49Å; S66-D70 PolarHBondContact O-N 3.06Å
67	F	76.7	Confident	74.6	Confident	20 Å²	20	61.6 Å²	61.6	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-69.4	-39.4	177.3	-170.6	-101.7	0	0	0	112	P62 T63 W69 D70 L71 A97 S98 F99	P62-F67 HydrophobicContact CB-CB 4.09Å; P62-F67 HydrophobicContact CG-CB 3.91Å; P62-F67 HydrophobicContact CG-CD2 3.75Å; P62-F67 HydrophobicContact CG-CG 4.19Å; T63-F67 PolarHBondContact O-N 3.12Å; F67-W69 VanDerWaalsContact C-N 3.32Å; F67-W69 PolarHBondContact O-N 3.22Å; F67-D70 PolarHBondContact O-N 2.89Å; F67-L71 VanDerWaalsContact O-CB 3.24Å; F67-L71 WeakPolarHBondContact O-CB 3.44Å; F67-L71 PolarHBondContact O-N 3.18Å; F67-A97 HydrophobicContact CD2-CB 3.91Å; F67-A97 HydrophobicContact CE1-CB 4.38Å; F67-A97 HydrophobicContact CE2-CB 3.75Å; F67-A97 HydrophobicContact CG-CB 4.28Å; F67-A97 HydrophobicContact CZ-CB 3.99Å; F67-S98 WeakPolarHBondContact CD1-O 3.47Å; F67-F99 HydrophobicContact CE1-CB 4.17Å; F67-F99 HydrophobicContact CE1-CD2 4.07Å
68	A	72.3	Confident	74.3	Confident	40 Å²	40	56.8 Å²	56.8	33%	0.331	34%	0.337	S	S	.	.	H	α-helix	trans	-62.5	-40.4	172.3	0	0	0	0	0	111.5	A64 A65 L71 F72	A64-A68 VanDerWaalsContact O-CB 3.28Å; A64-A68 WeakPolarHBondContact O-CB 3.33Å; A64-A68 PolarHBondContact O-N 3.12Å; A65-A68 PolarHBondContact O-N 3.5Å; A68-L71 PolarHBondContact O-N 3.38Å; A68-F72 WeakPolarHBondContact O-CD2 3.29Å; A68-F72 PolarHBondContact O-N 3.39Å
69	W	74.4	Confident	74.2	Confident	166 Å²	166	56 Å²	56	63%	0.629	33%	0.326	S	S	*	.	H	α-helix	trans	-62	-48.5	174.4	179.6	-94	0	0	0	112	A65 S66 F67 L71 F72 A73	A65-W69 WeakPolarHBondContact O-CB 3.36Å; A65-W69 PolarHBondContact O-N 3.16Å; S66-W69 WeakPolarHBondContact O-CB 3.34Å; S66-W69 PolarHBondContact O-N 3.49Å; F67-W69 VanDerWaalsContact C-N 3.32Å; F67-W69 PolarHBondContact O-N 3.22Å; W69-L71 PolarHBondContact O-N 3.39Å; W69-F72 PolarHBondContact O-N 3.37Å; W69-A73 HydrophobicContact CD2-CB 3.66Å; W69-A73 VanDerWaalsContact CE2-CB 3.49Å; W69-A73 HydrophobicContact CE3-CB 3.97Å; W69-A73 HydrophobicContact CG-CB 4.21Å; W69-A73 HydrophobicContact CH2-CB 3.99Å; W69-A73 HydrophobicContact CZ2-CB 3.68Å; W69-A73 HydrophobicContact CZ3-CB 4.13Å; W69-A73 WeakPolarHBondContact O-CA 3.45Å; W69-A73 VanDerWaalsContact O-CB 3.24Å; W69-A73 WeakPolarHBondContact O-CB 3.26Å; W69-A73 PolarHBondContact O-N 3.1Å
70	D	73.9	Confident	74	Confident	21 Å²	21	57.7 Å²	57.7	11%	0.112	34%	0.335	C	S	.	.	H	α-helix	trans	-59.3	-39.1	176.3	-72.1	-25.5	0	0	0	111	S66 F67 R74 L83	S66-D70 PolarHBondContact O-N 3.06Å; F67-D70 PolarHBondContact O-N 2.89Å; D70-R74 IonicContact OD1-NH1 3.86Å; D70-L83 HydrophobicContact CB-CD2 4.37Å
71	L	71.6	Confident	73.9	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-69.2	-33.7	179.2	-169.7	70.1	0	0	0	114.1	F67 A68 W69 G76 L77 L80 F99	F67-L71 VanDerWaalsContact O-CB 3.24Å; F67-L71 WeakPolarHBondContact O-CB 3.44Å; F67-L71 PolarHBondContact O-N 3.18Å; A68-L71 PolarHBondContact O-N 3.38Å; W69-L71 PolarHBondContact O-N 3.39Å; L71-G76 CarbonylContact O-C 3.48Å; L71-G76 WeakPolarHBondContact O-CA 3.36Å; L71-L77 HydrophobicContact CD1-CD2 3.79Å; L71-L77 HydrophobicContact CD1-CG 4.28Å; L71-L77 HydrophobicContact CD2-CD2 4.36Å; L71-L77 HydrophobicContact CG-CD2 4.29Å; L71-L77 PolarHBondContact O-N 3.27Å; L71-L80 HydrophobicContact CD1-CD2 3.6Å; L71-F99 HydrophobicContact CD1-CD2 4.3Å; L71-F99 HydrophobicContact CD1-CE2 3.78Å; L71-F99 HydrophobicContact CD2-CD2 3.69Å; L71-F99 HydrophobicContact CD2-CE2 3.33Å; L71-F99 HydrophobicContact CD2-CZ 4.12Å; L71-F99 HydrophobicContact CG-CE2 4.19Å
72	F	70.9	Confident	74	Confident	142 Å²	142	57.5 Å²	57.5	62%	0.623	32%	0.323	S	S	*	.	H	α-helix	trans	-106.7	-26.2	-174.2	-71.6	-70.7	0	0	0	114.3	A68 W69	A68-F72 WeakPolarHBondContact O-CD2 3.29Å; A68-F72 PolarHBondContact O-N 3.39Å; W69-F72 PolarHBondContact O-N 3.37Å
73	A	62.5	Low	74.1	Confident	51 Å²	51	58.3 Å²	58.3	42%	0.421	33%	0.326	S	S	.	.	H	α-helix	trans	-107	-22	-171	0	0	0	0	0	115.1	W69	W69-A73 HydrophobicContact CD2-CB 3.66Å; W69-A73 VanDerWaalsContact CE2-CB 3.49Å; W69-A73 HydrophobicContact CE3-CB 3.97Å; W69-A73 HydrophobicContact CG-CB 4.21Å; W69-A73 HydrophobicContact CH2-CB 3.99Å; W69-A73 HydrophobicContact CZ2-CB 3.68Å; W69-A73 HydrophobicContact CZ3-CB 4.13Å; W69-A73 WeakPolarHBondContact O-CA 3.45Å; W69-A73 VanDerWaalsContact O-CB 3.24Å; W69-A73 WeakPolarHBondContact O-CB 3.26Å; W69-A73 PolarHBondContact O-N 3.1Å
74	R	58.8	Low	74.4	Confident	157 Å²	157	54.2 Å²	54.2	59%	0.592	30%	0.301	S	S	*	.	S	Bend	trans	-107.4	30	-172.3	-83	-175	165.1	-172.2	-3.7	115.6	D70	D70-R74 IonicContact OD1-NH1 3.86Å
75	G	58.2	Low	75	Confident	36 Å²	36	54 Å²	54	37%	0.371	29%	0.291	S	S	.	.	S	Bend	trans	104.9	9.7	-177.3	0	0	0	0	0	114.1	S78	G75-S78 PolarHBondContact O-OG 3.35Å
76	G	63.7	Low	75.6	Confident	22 Å²	22	53.4 Å²	53.4	23%	0.227	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	81.9	-174.6	156.4	0	0	0	0	0	115.9	L71 S78 R79	L71-G76 CarbonylContact O-C 3.48Å; L71-G76 WeakPolarHBondContact O-CA 3.36Å; G76-S78 PolarHBondContact O-N 3.39Å; G76-R79 PolarHBondContact O-N 2.88Å
77	L	70.4	Confident	76.1	Confident	34 Å²	34	51.6 Å²	51.6	18%	0.178	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-51.1	-17.1	161.4	-71.6	162.6	0	0	0	113.8	L71 R79 L80 F99 L248	L71-L77 HydrophobicContact CD1-CD2 3.79Å; L71-L77 HydrophobicContact CD1-CG 4.28Å; L71-L77 HydrophobicContact CD2-CD2 4.36Å; L71-L77 HydrophobicContact CG-CD2 4.29Å; L71-L77 PolarHBondContact O-N 3.27Å; L77-R79 VanDerWaalsContact C-N 3.29Å; L77-R79 PolarHBondContact O-N 2.99Å; L77-L80 HydrophobicContact CD2-CD1 4.22Å; L77-L80 WeakPolarHBondContact O-CG 3.41Å; L77-F99 HydrophobicContact CD2-CE2 3.61Å; L77-F99 HydrophobicContact CD2-CZ 3.57Å; L77-L248 HydrophobicContact CB-CD1 4.28Å; L77-L248 HydrophobicContact CD1-CB 4.02Å; L77-L248 HydrophobicContact CD2-CB 4.3Å
78	S	74.9	Confident	76.6	Confident	35 Å²	35	53.1 Å²	53.1	25%	0.245	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-74.4	-14.4	-177.2	86.6	0	0	0	0	114.2	G75 G76 M502 T503	G75-S78 PolarHBondContact O-OG 3.35Å; G76-S78 PolarHBondContact O-N 3.39Å; S78-M502 CarbonylContact O-C 3.59Å; S78-M502 WeakPolarHBondContact O-CG 3.37Å; S78-T503 VanDerWaalsContact CA-O 3.29Å; S78-T503 WeakPolarHBondContact CA-O 3.48Å; S78-T503 PolarHBondContact O-N 3.33Å
79	R	82.6	Confident	77.4	Confident	80 Å²	80	59.3 Å²	59.3	30%	0.302	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-124.6	27.4	-177.5	-63.6	-175	175	-149.6	2.6	113.8	G76 L77 H81 E82 L83 E510	G76-R79 PolarHBondContact O-N 2.88Å; L77-R79 VanDerWaalsContact C-N 3.29Å; L77-R79 PolarHBondContact O-N 2.99Å; R79-H81 PolarHBondContact O-N 2.82Å; R79-H81 VanDerWaalsContact O-N 3.09Å; R79-E82 HydrophobicContact CB-CG 4.39Å; R79-E82 WeakPolarHBondContact CD-OE2 3.38Å; R79-E82 IonicContact NH1-OE1 3.51Å; R79-E82 IonicContact NH1-OE2 2.95Å; R79-E82 PolarHBondContact O-N 2.93Å; R79-L83 PolarHBondContact O-N 2.94Å; R79-E510 IonicContact NH2-OE1 2.95Å
80	L	82.1	Confident	78	Confident	41 Å²	41	57.4 Å²	57.4	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-55.9	-28.6	179	-74.7	173	0	0	0	113.8	L71 L77 L83 T503	L71-L80 HydrophobicContact CD1-CD2 3.6Å; L77-L80 HydrophobicContact CD2-CD1 4.22Å; L77-L80 WeakPolarHBondContact O-CG 3.41Å; L80-L83 HydrophobicContact CD2-CD1 4.1Å; L80-T503 HydrophobicContact CB-CG2 4.16Å; L80-T503 HydrophobicContact CD1-CG2 4.32Å
81	H	85.2	Confident	78.7	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-38.2	176.6	63.6	-84.1	0	0	0	112.5	R79 L83 Q84 P396 F425 P501 T503 L507	R79-H81 PolarHBondContact O-N 2.82Å; R79-H81 VanDerWaalsContact O-N 3.09Å; H81-L83 VanDerWaalsContact C-N 3.33Å; H81-L83 PolarHBondContact O-N 3.3Å; H81-Q84 WeakPolarHBondContact O-CB 3.43Å; H81-Q84 PolarHBondContact O-N 3.21Å; H81-P396 HydrophobicContact CB-CB 4Å; H81-F425 HydrophobicContact CB-CB 4.48Å; H81-F425 HydrophobicContact CB-CD1 4Å; H81-F425 HydrophobicContact CB-CD2 4.11Å; H81-F425 HydrophobicContact CB-CE1 4.25Å; H81-F425 HydrophobicContact CB-CE2 4.35Å; H81-F425 HydrophobicContact CB-CG 3.94Å; H81-F425 HydrophobicContact CB-CZ 4.43Å; H81-F425 AromaticContact CD2-CE1 3.73Å; H81-F425 AromaticContact CD2-CE2 3.89Å; H81-F425 AromaticContact CD2-CZ 3.48Å; H81-F425 VanDerWaalsContact CD2-CZ 3.48Å; H81-F425 WeakPolarHBondContact CD2-CZ 3.46Å; H81-F425 WeakPolarHBondContact O-CD1 3.38Å; H81-P501 PolarHBondContact CE1-O 3.12Å; H81-T503 PolarHBondContact ND1-OG1 2.94Å; H81-L507 HydrophobicContact CB-CD1 4.07Å
82	E	86.1	Confident	79.5	Confident	64 Å²	64	60.4 Å²	60.4	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-66.1	-36.5	176.4	-59.2	-175.8	169.3	0	0	111.2	R79 Q84 L85 E86	R79-E82 HydrophobicContact CB-CG 4.39Å; R79-E82 WeakPolarHBondContact CD-OE2 3.38Å; R79-E82 IonicContact NH1-OE1 3.51Å; R79-E82 IonicContact NH1-OE2 2.95Å; R79-E82 PolarHBondContact O-N 2.93Å; E82-Q84 PolarHBondContact O-N 3.32Å; E82-Q84 VanDerWaalsContact O-N 3.15Å; E82-L85 WeakPolarHBondContact O-CB 3.23Å; E82-L85 PolarHBondContact O-N 2.88Å; E82-E86 PolarHBondContact O-N 2.99Å; E82-E86 VanDerWaalsContact O-N 3.09Å
83	L	85	Confident	80.3	Confident	35 Å²	35	56.9 Å²	56.9	18%	0.183	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-24.2	175.6	-65.6	-179.9	0	0	0	113.2	D70 R79 L80 H81 G87	D70-L83 HydrophobicContact CB-CD2 4.37Å; R79-L83 PolarHBondContact O-N 2.94Å; L80-L83 HydrophobicContact CD2-CD1 4.1Å; H81-L83 VanDerWaalsContact C-N 3.33Å; H81-L83 PolarHBondContact O-N 3.3Å; L83-G87 PolarHBondContact O-N 3.45Å
84	Q	88	Confident	81.7	Confident	11 Å²	11	54.8 Å²	54.8	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-42.8	173.2	-58.1	-177.4	21.2	0	0	111.1	H81 E82 G87 V88 P396 A397 C423 A426	H81-Q84 WeakPolarHBondContact O-CB 3.43Å; H81-Q84 PolarHBondContact O-N 3.21Å; E82-Q84 PolarHBondContact O-N 3.32Å; E82-Q84 VanDerWaalsContact O-N 3.15Å; Q84-G87 PolarHBondContact O-N 2.88Å; Q84-V88 WeakPolarHBondContact O-CG2 3.5Å; Q84-V88 PolarHBondContact O-N 2.87Å; Q84-P396 PolarHBondContact NE2-O 3.18Å; Q84-P396 PolarHBondContact OE1-O 2.75Å; Q84-A397 VanDerWaalsContact NE2-CB 3.33Å; Q84-C423 HydrophobicContact CB-CB 4.29Å; Q84-C423 HydrophobicContact CG-CB 4.22Å; Q84-C423 VanDerWaalsContact OE1-C 3.28Å; Q84-C423 VanDerWaalsContact OE1-CB 3.22Å; Q84-A426 HydrophobicContact CB-CB 4.05Å
85	L	88.1	Confident	83.3	Confident	56 Å²	56	47.6 Å²	47.6	29%	0.293	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-44.8	178.1	-61.4	178.9	0	0	0	111	E82 G87 V88 Q89 F425 A426 R429	E82-L85 WeakPolarHBondContact O-CB 3.23Å; E82-L85 PolarHBondContact O-N 2.88Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.05Å; L85-V88 PolarHBondContact O-N 2.68Å; L85-Q89 WeakPolarHBondContact O-CG 3.34Å; L85-Q89 PolarHBondContact O-N 3.16Å; L85-Q89 VanDerWaalsContact O-N 3.09Å; L85-F425 HydrophobicContact CD1-CD1 4.35Å; L85-F425 HydrophobicContact CD1-CE1 3.74Å; L85-F425 HydrophobicContact CD2-CD1 4.41Å; L85-F425 HydrophobicContact CG-CD1 4.15Å; L85-F425 HydrophobicContact CG-CE1 4.05Å; L85-A426 HydrophobicContact CD2-CB 4.12Å; L85-R429 HydrophobicContact CD2-CB 4.27Å
86	E	86.6	Confident	84.9	Confident	62 Å²	62	48.1 Å²	48.1	29%	0.29	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-39.2	175	-66.6	-168.1	-166.8	0	0	112	E82 Q89 R90	E82-E86 PolarHBondContact O-N 2.99Å; E82-E86 VanDerWaalsContact O-N 3.09Å; E86-Q89 PolarHBondContact O-N 3.32Å; E86-R90 WeakPolarHBondContact O-CB 3.35Å; E86-R90 WeakPolarHBondContact O-CG 3.34Å; E86-R90 PolarHBondContact O-N 3.5Å; E86-R90 IonicContact OE2-CZ 2.73Å; E86-R90 IonicContact OE2-NH1 3.17Å; E86-R90 IonicContact OE2-NH2 3.17Å; E86-R90 PolarHBondContact OE2-NH2 3.5Å
87	G	85.3	Confident	86	Confident	4 Å²	4	47.1 Å²	47.1	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-47.3	177.2	0	0	0	0	0	112	L83 Q84 L85 Q89 R90 Y91	L83-G87 PolarHBondContact O-N 3.45Å; Q84-G87 PolarHBondContact O-N 2.88Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.05Å; G87-Q89 PolarHBondContact O-N 2.84Å; G87-R90 PolarHBondContact O-N 2.88Å; G87-Y91 WeakPolarHBondContact O-CB 3.49Å; G87-Y91 PolarHBondContact O-N 3.17Å
88	V	88.8	Confident	86.4	Confident	52 Å²	52	47.3 Å²	47.3	32%	0.315	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-45.9	175.7	173	0	0	0	0	111.5	Q84 L85 R90 G92 W95 A108 A426	Q84-V88 WeakPolarHBondContact O-CG2 3.5Å; Q84-V88 PolarHBondContact O-N 2.87Å; L85-V88 PolarHBondContact O-N 2.68Å; V88-R90 PolarHBondContact O-N 3.29Å; V88-G92 VanDerWaalsContact O-CA 3.27Å; V88-G92 WeakPolarHBondContact O-CA 3.31Å; V88-G92 PolarHBondContact O-N 3.37Å; V88-W95 HydrophobicContact CG2-CH2 4.05Å; V88-W95 HydrophobicContact CG2-CZ3 3.8Å; V88-A108 HydrophobicContact CG2-CB 3.3Å; V88-A426 HydrophobicContact CG2-CB 3.99Å
89	Q	87.7	Confident	86.3	Confident	169 Å²	169	47.2 Å²	47.2	79%	0.79	23%	0.233	S	C	*	.	H	α-helix	trans	-65.7	-36.5	-179	-71.4	178.4	2.8	0	0	113.1	L85 E86 G87	L85-Q89 WeakPolarHBondContact O-CG 3.34Å; L85-Q89 PolarHBondContact O-N 3.16Å; L85-Q89 VanDerWaalsContact O-N 3.09Å; E86-Q89 PolarHBondContact O-N 3.32Å; G87-Q89 PolarHBondContact O-N 2.84Å
90	R	87.7	Confident	85.9	Confident	127 Å²	127	45.9 Å²	45.9	48%	0.479	24%	0.244	S	C	.	.	H	α-helix	trans	-88.1	-37.6	-176	-68.7	-175.9	-169.8	158	17.2	113.8	E86 G87 V88	E86-R90 WeakPolarHBondContact O-CB 3.35Å; E86-R90 WeakPolarHBondContact O-CG 3.34Å; E86-R90 PolarHBondContact O-N 3.5Å; E86-R90 IonicContact OE2-CZ 2.73Å; E86-R90 IonicContact OE2-NH1 3.17Å; E86-R90 IonicContact OE2-NH2 3.17Å; E86-R90 PolarHBondContact OE2-NH2 3.5Å; G87-R90 PolarHBondContact O-N 2.88Å; V88-R90 PolarHBondContact O-N 3.29Å
91	Y	87.9	Confident	85.5	Confident	65 Å²	65	48.4 Å²	48.4	26%	0.255	26%	0.263	S	S	.	.	H	α-helix	trans	-118.9	-10.5	-168.2	-52.8	-64.6	0	0	0	113.6	P60 P62 G87 W95	P60-Y91 HydrophobicContact CB-CD1 4.13Å; P60-Y91 WeakPolarHBondContact CG-O 3.33Å; P62-Y91 WeakPolarHBondContact CA-OH 3.35Å; P62-Y91 WeakPolarHBondContact CB-OH 3.5Å; P62-Y91 HydrophobicContact CG-CE2 4.36Å; G87-Y91 WeakPolarHBondContact O-CB 3.49Å; G87-Y91 PolarHBondContact O-N 3.17Å; Y91-W95 HydrophobicContact CD2-CB 4.34Å; Y91-W95 HydrophobicContact CD2-CG 4.18Å; Y91-W95 HydrophobicContact CG-CB 4.15Å; Y91-W95 HydrophobicContact CG-CG 4.47Å
92	G	88.9	Confident	85.1	Confident	23 Å²	23	50.8 Å²	50.8	24%	0.237	28%	0.275	C	S	.	.			trans	88	-160.7	-179	0	0	0	0	0	113.4	V88 V94	V88-G92 VanDerWaalsContact O-CA 3.27Å; V88-G92 WeakPolarHBondContact O-CA 3.31Å; V88-G92 PolarHBondContact O-N 3.37Å; G92-V94 VanDerWaalsContact C-N 3.3Å; G92-V94 PolarHBondContact O-N 2.83Å
93	P	88.8	Confident	85.1	Confident	68 Å²	68	51.1 Å²	51.1	44%	0.442	28%	0.278	S	S	.	.	S	Bend	trans	-72.6	-17.7	-167.1	27.8	-35.5	0	0	0	114.8	A108 D109 L112	P93-A108 PolarHBondContact O-N 2.72Å; P93-D109 HydrophobicContact CB-CB 3.8Å; P93-L112 HydrophobicContact CB-CD1 4.29Å
94	V	91.4	Very high	85.3	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	128.8	178.5	-176	0	0	0	0	109.9	M59 G92 V105 H106 V107 L112	M59-V94 HydrophobicContact CE-CG1 3.66Å; M59-V94 HydrophobicContact SD-CG1 3.88Å; G92-V94 VanDerWaalsContact C-N 3.3Å; G92-V94 PolarHBondContact O-N 2.83Å; V94-V105 HydrophobicContact CG1-CG1 3.91Å; V94-H106 VanDerWaalsContact CA-O 3.31Å; V94-H106 WeakPolarHBondContact CA-O 3.35Å; V94-V107 HydrophobicContact CG1-CG2 4.47Å; V94-V107 HydrophobicContact CG2-CG1 4.4Å; V94-V107 HydrophobicContact CG2-CG2 4.48Å; V94-L112 HydrophobicContact CG2-CD1 3.28Å
95	W	92.4	Very high	85.5	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162.1	177.1	72.7	96.9	0	0	0	111.8	M59 P60 V88 Y91 V105 H106 A108 C423	M59-W95 VanDerWaalsContact SD-C 3.52Å; P60-W95 HydrophobicContact CG-CB 4.49Å; P60-W95 CarbonylContact O-C 3.5Å; P60-W95 VanDerWaalsContact O-CA 3.24Å; P60-W95 WeakPolarHBondContact O-CA 3.43Å; P60-W95 VanDerWaalsContact O-CB 3.3Å; P60-W95 WeakPolarHBondContact O-CB 3.46Å; V88-W95 HydrophobicContact CG2-CH2 4.05Å; V88-W95 HydrophobicContact CG2-CZ3 3.8Å; Y91-W95 HydrophobicContact CD2-CB 4.34Å; Y91-W95 HydrophobicContact CD2-CG 4.18Å; Y91-W95 HydrophobicContact CG-CB 4.15Å; Y91-W95 HydrophobicContact CG-CG 4.47Å; W95-V105 CarbonylContact O-C 3.57Å; W95-H106 HydrophobicContact CD2-CB 3.53Å; W95-H106 AromaticContact CE2-CG 3.58Å; W95-H106 HydrophobicContact CE3-CB 3.88Å; W95-H106 HydrophobicContact CG-CB 4.16Å; W95-H106 HydrophobicContact CH2-CB 3.7Å; W95-H106 HydrophobicContact CZ2-CB 3.33Å; W95-H106 AromaticContact CZ2-CG 3.66Å; W95-H106 AromaticContact CZ2-ND1 3.93Å; W95-H106 HydrophobicContact CZ3-CB 3.95Å; W95-H106 PolarHBondContact N-O 3.39Å; W95-H106 VanDerWaalsContact N-O 3.1Å; W95-H106 AromaticContact NE1-CD2 3.58Å; W95-H106 AromaticContact NE1-CG 3.6Å; W95-H106 PolarHBondContact O-N 3.03Å; W95-A108 HydrophobicContact CH2-CB 4.1Å; W95-A108 HydrophobicContact CZ3-CB 3.73Å; W95-C423 HydrophobicContact CH2-CB 4.48Å
96	K	91.1	Very high	85.7	Confident	47 Å²	47	47.9 Å²	47.9	20%	0.204	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	143.6	173.4	66.2	-178.3	174.7	-162.6	0	111	L56 D57 M59 P60 G61 P62 L103 T104	L56-K96 WeakPolarHBondContact O-CD 3.32Å; L56-K96 PolarHBondContact O-NZ 2.93Å; D57-K96 PolarHBondContact O-NZ 3.44Å; D57-K96 VanDerWaalsContact O-NZ 3.09Å; M59-K96 HydrophobicContact CB-CD 4.24Å; M59-K96 HydrophobicContact CB-CG 4.37Å; M59-K96 HydrophobicContact CG-CB 4.35Å; M59-K96 HydrophobicContact CG-CG 4.47Å; M59-K96 WeakPolarHBondContact O-CE 3.37Å; M59-K96 HydrophobicContact SD-CB 3.9Å; P60-K96 PolarHBondContact O-N 3.29Å; G61-K96 WeakPolarHBondContact CA-O 3.35Å; P62-K96 WeakPolarHBondContact CD-O 3.31Å; K96-L103 HydrophobicContact CB-CD1 4.31Å; K96-T104 CarbonylContact C-O 3.55Å; K96-T104 WeakPolarHBondContact CA-O 3.1Å
97	A	86.4	Confident	86	Confident	1 Å²	1	45 Å²	45	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	149.1	170	0	0	0	0	0	110.5	P62 F67 T104	P62-A97 HydrophobicContact CG-CB 4.18Å; F67-A97 HydrophobicContact CD2-CB 3.91Å; F67-A97 HydrophobicContact CE1-CB 4.38Å; F67-A97 HydrophobicContact CE2-CB 3.75Å; F67-A97 HydrophobicContact CG-CB 4.28Å; F67-A97 HydrophobicContact CZ-CB 3.99Å; A97-T104 PolarHBondContact N-O 2.84Å; A97-T104 PolarHBondContact O-N 2.94Å
98	S	80.3	Confident	86.3	Confident	38 Å²	38	45.1 Å²	45.1	27%	0.266	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113	179.8	-62.1	0	0	0	0	110.3	F67 I102	F67-S98 WeakPolarHBondContact CD1-O 3.47Å; S98-I102 WeakPolarHBondContact CA-O 3.45Å
99	F	72.5	Confident	86.4	Confident	33 Å²	33	45.1 Å²	45.1	15%	0.145	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	97.4	173.8	-173.2	-89.9	0	0	0	109.3	F67 L71 L77 I102 A252	F67-F99 HydrophobicContact CE1-CB 4.17Å; F67-F99 HydrophobicContact CE1-CD2 4.07Å; L71-F99 HydrophobicContact CD1-CD2 4.3Å; L71-F99 HydrophobicContact CD1-CE2 3.78Å; L71-F99 HydrophobicContact CD2-CD2 3.69Å; L71-F99 HydrophobicContact CD2-CE2 3.33Å; L71-F99 HydrophobicContact CD2-CZ 4.12Å; L71-F99 HydrophobicContact CG-CE2 4.19Å; L77-F99 HydrophobicContact CD2-CE2 3.61Å; L77-F99 HydrophobicContact CD2-CZ 3.57Å; F99-I102 PolarHBondContact N-O 3.09Å; F99-I102 PolarHBondContact O-N 2.98Å; F99-A252 HydrophobicContact CE1-CB 3.65Å; F99-A252 HydrophobicContact CZ-CB 3.78Å
100	G	73.4	Confident	86.4	Confident	52 Å²	52	37.3 Å²	37.3	54%	0.536	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-123	-172.6	0	0	0	0	0	110.9	I102	G100-I102 VanDerWaalsContact C-N 3.28Å; G100-I102 PolarHBondContact O-N 2.75Å
101	P	73.1	Confident	86.6	Confident	93 Å²	93	33.7 Å²	33.7	60%	0.604	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.6	177.9	32.4	-32.9	0	0	0	114.2
102	I	78.2	Confident	86.7	Confident	52 Å²	52	31.7 Å²	31.7	27%	0.267	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.4	-170.1	-54.5	177.2	0	0	0	110.3	S98 F99 G100 L419	S98-I102 WeakPolarHBondContact CA-O 3.45Å; F99-I102 PolarHBondContact N-O 3.09Å; F99-I102 PolarHBondContact O-N 2.98Å; G100-I102 VanDerWaalsContact C-N 3.28Å; G100-I102 PolarHBondContact O-N 2.75Å; I102-L419 HydrophobicContact CG2-CD2 3.75Å
103	L	85.2	Confident	86.8	Confident	71 Å²	71	30.7 Å²	30.7	37%	0.372	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	128.2	167.8	-177.6	68.5	0	0	0	109.7	L56 K96	L56-L103 HydrophobicContact CD1-CD2 4.4Å; K96-L103 HydrophobicContact CB-CD1 4.31Å
104	T	89	Confident	86.9	Confident	8 Å²	8	29.2 Å²	29.2	5%	0.049	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.5	-179.1	-53.5	0	0	0	0	110.6	K96 A97 L419 T421	K96-T104 CarbonylContact C-O 3.55Å; K96-T104 WeakPolarHBondContact CA-O 3.1Å; A97-T104 PolarHBondContact N-O 2.84Å; A97-T104 PolarHBondContact O-N 2.94Å; T104-L419 CarbonylContact C-O 3.56Å; T104-L419 WeakPolarHBondContact CA-O 3.31Å; T104-L419 HydrophobicContact CG2-CD2 4.24Å; T104-L419 HydrophobicContact CG2-CG 4.16Å; T104-T421 WeakPolarHBondContact CG2-OG1 3.38Å
105	V	91.9	Very high	86.9	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.7	169.2	176.6	0	0	0	0	108.5	L56 M59 V94 W95 V107 I414 T418 L419 I420 T421	L56-V105 HydrophobicContact CD2-CG2 3.54Å; M59-V105 HydrophobicContact CE-CG1 3.89Å; M59-V105 HydrophobicContact CE-CG2 4.34Å; M59-V105 HydrophobicContact SD-CB 4.45Å; M59-V105 HydrophobicContact SD-CG1 3.76Å; M59-V105 HydrophobicContact SD-CG2 4.06Å; V94-V105 HydrophobicContact CG1-CG1 3.91Å; W95-V105 CarbonylContact O-C 3.57Å; V105-V107 HydrophobicContact CG1-CG2 4.27Å; V105-I414 HydrophobicContact CG1-CD1 3.94Å; V105-T418 HydrophobicContact CG2-CG2 3.79Å; V105-L419 PolarHBondContact N-O 3.14Å; V105-I420 HydrophobicContact CB-CG1 4.49Å; V105-I420 CarbonylContact O-C 3.58Å; V105-I420 VanDerWaalsContact O-CA 3.26Å; V105-I420 WeakPolarHBondContact O-CA 3.33Å; V105-T421 PolarHBondContact O-N 2.92Å
106	H	92.6	Very high	86.8	Confident	27 Å²	27	31.6 Å²	31.6	13%	0.125	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.3	177.3	-66.9	-97.3	0	0	0	109.8	V94 W95 T421	V94-H106 VanDerWaalsContact CA-O 3.31Å; V94-H106 WeakPolarHBondContact CA-O 3.35Å; W95-H106 HydrophobicContact CD2-CB 3.53Å; W95-H106 AromaticContact CE2-CG 3.58Å; W95-H106 HydrophobicContact CE3-CB 3.88Å; W95-H106 HydrophobicContact CG-CB 4.16Å; W95-H106 HydrophobicContact CH2-CB 3.7Å; W95-H106 HydrophobicContact CZ2-CB 3.33Å; W95-H106 AromaticContact CZ2-CG 3.66Å; W95-H106 AromaticContact CZ2-ND1 3.93Å; W95-H106 HydrophobicContact CZ3-CB 3.95Å; W95-H106 PolarHBondContact N-O 3.39Å; W95-H106 VanDerWaalsContact N-O 3.1Å; W95-H106 AromaticContact NE1-CD2 3.58Å; W95-H106 AromaticContact NE1-CG 3.6Å; W95-H106 PolarHBondContact O-N 3.03Å; H106-T421 WeakPolarHBondContact CA-O 3.47Å
107	V	92.6	Very high	86.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.5	178.5	-176.2	0	0	0	0	108.3	V94 V105 L112 I113 V409 I420 T421 C423	V94-V107 HydrophobicContact CG1-CG2 4.47Å; V94-V107 HydrophobicContact CG2-CG1 4.4Å; V94-V107 HydrophobicContact CG2-CG2 4.48Å; V105-V107 HydrophobicContact CG1-CG2 4.27Å; V107-L112 HydrophobicContact CG1-CB 3.5Å; V107-I113 HydrophobicContact CG1-CG1 3.98Å; V107-V409 HydrophobicContact CG2-CG1 4.42Å; V107-I420 HydrophobicContact CG2-CG2 3.79Å; V107-T421 PolarHBondContact N-O 3.44Å; V107-C423 PolarHBondContact O-N 3.12Å
108	A	91.8	Very high	86.8	Confident	8 Å²	8	39 Å²	39	7%	0.066	22%	0.217	C	C	.	.			trans	-126.5	19.4	-173.9	0	0	0	0	0	113.3	V88 P93 W95 C423 A426 T427	V88-A108 HydrophobicContact CG2-CB 3.3Å; P93-A108 PolarHBondContact O-N 2.72Å; W95-A108 HydrophobicContact CH2-CB 4.1Å; W95-A108 HydrophobicContact CZ3-CB 3.73Å; A108-C423 HydrophobicContact CB-CB 3.83Å; A108-A426 HydrophobicContact CB-CB 4.09Å; A108-T427 VanDerWaalsContact O-CG2 3.29Å; A108-T427 WeakPolarHBondContact O-CG2 3.42Å
109	D	90.8	Very high	87.2	Confident	52 Å²	52	39.1 Å²	39.1	28%	0.278	21%	0.213	S	C	.	.			trans	-111.7	130.4	172.4	175.2	-79.6	0	0	0	109.9	P93 A111 L112 I113	P93-D109 HydrophobicContact CB-CB 3.8Å; D109-A111 VanDerWaalsContact C-N 3.32Å; D109-A111 PolarHBondContact O-N 3.14Å; D109-A111 WeakPolarHBondContact OD1-CA 3.18Å; D109-A111 VanDerWaalsContact OD1-CB 3.3Å; D109-A111 WeakPolarHBondContact OD1-CB 3.34Å; D109-A111 PolarHBondContact OD1-N 3.24Å; D109-L112 HydrophobicContact CB-CB 4.07Å; D109-L112 HydrophobicContact CB-CD1 3.9Å; D109-L112 HydrophobicContact CB-CG 3.85Å; D109-L112 PolarHBondContact O-N 2.97Å; D109-L112 PolarHBondContact OD1-N 2.74Å; D109-I113 VanDerWaalsContact O-CG1 3.31Å; D109-I113 WeakPolarHBondContact O-CG1 3.41Å; D109-I113 PolarHBondContact O-N 2.93Å
110	P	89.3	Confident	87.8	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.032	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-35.6	-177.3	-25.2	33.6	0	0	0	115	E114 T427 V433 H453 A456	P110-E114 PolarHBondContact O-N 3.05Å; P110-T427 HydrophobicContact CG-CG2 4.49Å; P110-V433 HydrophobicContact CG-CG2 4.05Å; P110-H453 HydrophobicContact CB-CB 3.78Å; P110-H453 VanDerWaalsContact CB-ND1 3.33Å; P110-H453 WeakPolarHBondContact CB-ND1 3.4Å; P110-H453 HydrophobicContact CG-CB 4.41Å; P110-H453 PolarHBondContact O-CE1 3.03Å; P110-H453 VanDerWaalsContact O-CE1 3.26Å; P110-A456 HydrophobicContact CB-CB 4.1Å; P110-A456 HydrophobicContact CG-CB 3.75Å
111	A	90.6	Very high	88.3	Confident	50 Å²	50	37.9 Å²	37.9	41%	0.413	20%	0.199	S	C	.	.	H	α-helix	trans	-73.4	-36.3	179.3	0	0	0	0	0	110.8	D109 E114 Q115	D109-A111 VanDerWaalsContact C-N 3.32Å; D109-A111 PolarHBondContact O-N 3.14Å; D109-A111 WeakPolarHBondContact OD1-CA 3.18Å; D109-A111 VanDerWaalsContact OD1-CB 3.3Å; D109-A111 WeakPolarHBondContact OD1-CB 3.34Å; D109-A111 PolarHBondContact OD1-N 3.24Å; A111-E114 WeakPolarHBondContact O-CB 3.44Å; A111-E114 PolarHBondContact O-N 2.75Å; A111-Q115 PolarHBondContact O-N 2.83Å
112	L	91	Very high	88.8	Confident	24 Å²	24	39.2 Å²	39.2	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-69.8	-36.9	173.3	-59.4	-174	0	0	0	112.3	P93 V94 V107 D109 E114 Q115 V116 V409	P93-L112 HydrophobicContact CB-CD1 4.29Å; V94-L112 HydrophobicContact CG2-CD1 3.28Å; V107-L112 HydrophobicContact CG1-CB 3.5Å; D109-L112 HydrophobicContact CB-CB 4.07Å; D109-L112 HydrophobicContact CB-CD1 3.9Å; D109-L112 HydrophobicContact CB-CG 3.85Å; D109-L112 PolarHBondContact O-N 2.97Å; D109-L112 PolarHBondContact OD1-N 2.74Å; L112-E114 VanDerWaalsContact C-N 3.31Å; L112-E114 PolarHBondContact O-N 2.84Å; L112-Q115 WeakPolarHBondContact O-CB 3.46Å; L112-Q115 PolarHBondContact O-N 3.44Å; L112-V116 WeakPolarHBondContact O-CG2 3.42Å; L112-V116 PolarHBondContact O-N 2.65Å; L112-V409 HydrophobicContact CB-CG1 4.06Å; L112-V409 HydrophobicContact CD2-CG1 4.4Å
113	I	90.8	Very high	89.2	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-60	-44.6	171.4	-71.2	171.6	0	0	0	110.2	V107 D109 Q115 V116 L117 L422 T427 Y455	V107-I113 HydrophobicContact CG1-CG1 3.98Å; D109-I113 VanDerWaalsContact O-CG1 3.31Å; D109-I113 WeakPolarHBondContact O-CG1 3.41Å; D109-I113 PolarHBondContact O-N 2.93Å; I113-Q115 VanDerWaalsContact C-N 3.33Å; I113-Q115 PolarHBondContact O-N 3.34Å; I113-V116 PolarHBondContact O-N 3.42Å; I113-L117 HydrophobicContact CG2-CD1 3.71Å; I113-L117 HydrophobicContact CG2-CG 4.38Å; I113-L117 VanDerWaalsContact O-CG 3.27Å; I113-L117 WeakPolarHBondContact O-CG 3.46Å; I113-L117 PolarHBondContact O-N 3.36Å; I113-L422 HydrophobicContact CB-CD2 4.48Å; I113-L422 HydrophobicContact CD1-CB 4.37Å; I113-L422 HydrophobicContact CG1-CB 4.32Å; I113-L422 HydrophobicContact CG1-CD2 4.06Å; I113-L422 HydrophobicContact CG2-CD1 4.23Å; I113-L422 HydrophobicContact CG2-CD2 4.29Å; I113-T427 HydrophobicContact CD1-CG2 3.46Å; I113-T427 VanDerWaalsContact CD1-CG2 3.46Å; I113-Y455 HydrophobicContact CG2-CD1 4.29Å
114	E	91	Very high	89.3	Confident	38 Å²	38	35.6 Å²	35.6	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-44.1	174.1	177.4	169.9	-148.9	0	0	111.8	P110 A111 L112 V116 L117 R118 H453 Y455	P110-E114 PolarHBondContact O-N 3.05Å; A111-E114 WeakPolarHBondContact O-CB 3.44Å; A111-E114 PolarHBondContact O-N 2.75Å; L112-E114 VanDerWaalsContact C-N 3.31Å; L112-E114 PolarHBondContact O-N 2.84Å; E114-V116 VanDerWaalsContact C-N 3.31Å; E114-V116 PolarHBondContact O-N 3.42Å; E114-L117 PolarHBondContact O-N 3.22Å; E114-R118 HydrophobicContact CG-CG 4.07Å; E114-R118 WeakPolarHBondContact O-CB 3.48Å; E114-R118 WeakPolarHBondContact O-CG 3.23Å; E114-R118 PolarHBondContact O-N 2.95Å; E114-R118 IonicContact OE1-CZ 2.94Å; E114-R118 IonicContact OE1-NE 3.76Å; E114-R118 PolarHBondContact OE1-NE 2.92Å; E114-R118 IonicContact OE1-NH2 3.13Å; E114-R118 PolarHBondContact OE1-NH2 2.89Å; E114-H453 IonicContact OE2-CE1 3.92Å; E114-H453 IonicContact OE2-NE2 2.67Å; E114-Y455 HydrophobicContact CB-CD1 4.41Å; E114-Y455 HydrophobicContact CB-CD2 3.63Å; E114-Y455 HydrophobicContact CB-CE2 3.78Å; E114-Y455 HydrophobicContact CB-CG 3.96Å; E114-Y455 VanDerWaalsContact CD-CE2 3.44Å; E114-Y455 HydrophobicContact CG-CD2 3.91Å; E114-Y455 HydrophobicContact CG-CE2 3.52Å; E114-Y455 WeakPolarHBondContact OE1-CE2 3.42Å
115	Q	91	Very high	89.1	Confident	64 Å²	64	37.1 Å²	37.1	30%	0.299	19%	0.185	S	C	.	.	H	α-helix	trans	-59.9	-39.7	177.8	-177.5	174	14.7	0	0	112.4	A111 L112 I113 Q119 E408	A111-Q115 PolarHBondContact O-N 2.83Å; L112-Q115 WeakPolarHBondContact O-CB 3.46Å; L112-Q115 PolarHBondContact O-N 3.44Å; I113-Q115 VanDerWaalsContact C-N 3.33Å; I113-Q115 PolarHBondContact O-N 3.34Å; Q115-Q119 WeakPolarHBondContact O-CG 3.49Å; Q115-Q119 PolarHBondContact O-NE2 3.12Å; Q115-E408 PolarHBondContact NE2-O 3.21Å
116	V	89.8	Confident	88.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-50.6	173.8	173.4	0	0	0	0	110.4	L112 I113 E114 R118 Q119 I402 V409 I420 L422	L112-V116 WeakPolarHBondContact O-CG2 3.42Å; L112-V116 PolarHBondContact O-N 2.65Å; I113-V116 PolarHBondContact O-N 3.42Å; E114-V116 VanDerWaalsContact C-N 3.31Å; E114-V116 PolarHBondContact O-N 3.42Å; V116-R118 PolarHBondContact O-N 3.49Å; V116-Q119 PolarHBondContact O-N 2.8Å; V116-Q119 VanDerWaalsContact O-N 3.12Å; V116-I402 HydrophobicContact CG1-CD1 4.47Å; V116-V409 HydrophobicContact CG2-CB 4.47Å; V116-V409 HydrophobicContact CG2-CG1 3.98Å; V116-V409 HydrophobicContact CG2-CG2 3.6Å; V116-I420 HydrophobicContact CG1-CD1 4.17Å; V116-I420 HydrophobicContact CG1-CG2 4.33Å; V116-I420 HydrophobicContact CG2-CG2 4.32Å; V116-L422 HydrophobicContact CB-CD2 4.34Å; V116-L422 HydrophobicContact CG1-CD2 4.19Å
117	L	88.9	Confident	88.2	Confident	18 Å²	18	40.2 Å²	40.2	9%	0.094	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-33.2	-174	-68.1	171.5	0	0	0	112.9	I113 E114 Q119 E120 R400 L422 Y455 V462	I113-L117 HydrophobicContact CG2-CD1 3.71Å; I113-L117 HydrophobicContact CG2-CG 4.38Å; I113-L117 VanDerWaalsContact O-CG 3.27Å; I113-L117 WeakPolarHBondContact O-CG 3.46Å; I113-L117 PolarHBondContact O-N 3.36Å; E114-L117 PolarHBondContact O-N 3.22Å; L117-Q119 PolarHBondContact O-N 3.04Å; L117-E120 WeakPolarHBondContact CD2-OE1 3.21Å; L117-E120 WeakPolarHBondContact O-CB 3.28Å; L117-E120 WeakPolarHBondContact O-CG 3.32Å; L117-E120 PolarHBondContact O-N 3Å; L117-R400 HydrophobicContact CD2-CG 4.33Å; L117-L422 HydrophobicContact CD1-CD1 4.42Å; L117-L422 HydrophobicContact CD2-CD1 3.94Å; L117-L422 HydrophobicContact CG-CD1 4.28Å; L117-Y455 HydrophobicContact CB-CE1 4.34Å; L117-Y455 HydrophobicContact CD1-CD1 3.52Å; L117-Y455 HydrophobicContact CD1-CE1 3.48Å; L117-Y455 VanDerWaalsContact CD1-CE1 3.48Å; L117-V462 HydrophobicContact CD1-CB 4.18Å
118	R	89.1	Confident	87.2	Confident	184 Å²	184	44.9 Å²	44.9	69%	0.694	23%	0.225	S	C	*	.	H	α-helix	trans	-69.2	-21.3	174.8	-74.8	-178.7	177.1	-159.2	2.9	113.2	E114 V116	E114-R118 HydrophobicContact CG-CG 4.07Å; E114-R118 WeakPolarHBondContact O-CB 3.48Å; E114-R118 WeakPolarHBondContact O-CG 3.23Å; E114-R118 PolarHBondContact O-N 2.95Å; E114-R118 IonicContact OE1-CZ 2.94Å; E114-R118 IonicContact OE1-NE 3.76Å; E114-R118 PolarHBondContact OE1-NE 2.92Å; E114-R118 IonicContact OE1-NH2 3.13Å; E114-R118 PolarHBondContact OE1-NH2 2.89Å; V116-R118 PolarHBondContact O-N 3.49Å
119	Q	88.7	Confident	86.6	Confident	41 Å²	41	46.3 Å²	46.3	19%	0.192	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	6	178.5	-68.3	-179	81.4	0	0	113.1	Q115 V116 L117 I402 I407 E408	Q115-Q119 WeakPolarHBondContact O-CG 3.49Å; Q115-Q119 PolarHBondContact O-NE2 3.12Å; V116-Q119 PolarHBondContact O-N 2.8Å; V116-Q119 VanDerWaalsContact O-N 3.12Å; L117-Q119 PolarHBondContact O-N 3.04Å; Q119-I402 HydrophobicContact CB-CD1 4.44Å; Q119-I407 HydrophobicContact CB-CG2 4.08Å; Q119-E408 PolarHBondContact NE2-O 3.47Å
120	E	84.8	Confident	86	Confident	39 Å²	39	46 Å²	46	18%	0.182	23%	0.233	C	C	.	.			trans	-61.5	141.2	175.5	-74.9	-177	165.7	0	0	112.5	L117 P124 R400	L117-E120 WeakPolarHBondContact CD2-OE1 3.21Å; L117-E120 WeakPolarHBondContact O-CB 3.28Å; L117-E120 WeakPolarHBondContact O-CG 3.32Å; L117-E120 PolarHBondContact O-N 3Å; E120-P124 HydrophobicContact CB-CG 4.41Å; E120-R400 WeakPolarHBondContact OE1-CD 3.28Å; E120-R400 IonicContact OE1-CZ 3.46Å; E120-R400 IonicContact OE1-NE 2.77Å; E120-R400 PolarHBondContact OE1-NE 2.94Å; E120-R400 IonicContact OE1-NH2 3.22Å
121	G	83.3	Confident	85.7	Confident	20 Å²	20	45.9 Å²	45.9	21%	0.206	23%	0.233	C	C	.	.			trans	-74.9	-173	174.2	0	0	0	0	0	113.7	H123 E404	G121-H123 VanDerWaalsContact C-N 3.26Å; G121-H123 PolarHBondContact O-N 3.44Å; G121-E404 WeakPolarHBondContact CA-OE1 3.42Å; G121-E404 WeakPolarHBondContact CA-OE2 3.33Å
122	Q	84.1	Confident	85.5	Confident	122 Å²	122	44.1 Å²	44.1	57%	0.57	22%	0.215	S	C	*	.	S	Bend	trans	-65.2	-33.4	-178.4	-177.6	171.7	-6.3	0	0	112.3	P124 E404 K464	Q122-P124 WeakPolarHBondContact O-CD 3.26Å; Q122-E404 PolarHBondContact N-OE1 2.89Å; Q122-K464 PolarHBondContact O-NZ 3.17Å
123	H	87.6	Confident	85.4	Confident	40 Å²	40	43.9 Å²	43.9	19%	0.185	21%	0.213	C	C	.	.	S	Bend	trans	-120.7	81.2	-177.4	-56.4	-87.8	0	0	0	110.7	G121 M125 G150	G121-H123 VanDerWaalsContact C-N 3.26Å; G121-H123 PolarHBondContact O-N 3.44Å; H123-M125 PolarHBondContact O-N 2.99Å; H123-G150 PolarHBondContact ND1-O 2.93Å
124	P	85.9	Confident	85.2	Confident	7 Å²	7	46.9 Å²	46.9	5%	0.045	23%	0.229	C	C	.	.			trans	-58.8	133.5	-177	-22.8	32.5	0	0	0	111.6	E120 Q122 K464 R465	E120-P124 HydrophobicContact CB-CG 4.41Å; Q122-P124 WeakPolarHBondContact O-CD 3.26Å; P124-K464 HydrophobicContact CG-CB 4.48Å; P124-R465 HydrophobicContact CB-CB 4.27Å; P124-R465 WeakPolarHBondContact O-CD 3.37Å; P124-R465 PolarHBondContact O-NH1 2.97Å
125	M	86.4	Confident	85.1	Confident	40 Å²	40	45 Å²	45	20%	0.197	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-106.3	142.4	175.6	-63.8	172.8	74.4	0	0	109.9	H123 E149 R400 V401	H123-M125 PolarHBondContact O-N 2.99Å; M125-E149 HydrophobicContact CE-CB 4.42Å; M125-E149 HydrophobicContact CE-CG 4.11Å; M125-E149 VanDerWaalsContact CE-OE2 3.29Å; M125-E149 WeakPolarHBondContact CE-OE2 3.46Å; M125-E149 HydrophobicContact CG-CG 4.48Å; M125-R400 CarbonylContact O-C 3.55Å; M125-R400 WeakPolarHBondContact O-CA 3.2Å; M125-V401 HydrophobicContact CB-CB 4.13Å; M125-V401 PolarHBondContact O-N 3.35Å
126	R	84.4	Confident	85	Confident	63 Å²	63	42 Å²	42	24%	0.238	21%	0.206	C	C	.	.			trans	-94.9	-68.6	179	-70.4	-171.9	179.4	-178.4	-1	111.6	A399 R400 L419 R465	R126-A399 WeakPolarHBondContact CA-O 3.43Å; R126-A399 CarbonylContact O-C 3.54Å; R126-A399 VanDerWaalsContact O-CB 3.28Å; R126-A399 WeakPolarHBondContact O-CB 3.14Å; R126-R400 CarbonylContact O-C 3.56Å; R126-R400 PolarHBondContact O-N 2.62Å; R126-L419 WeakPolarHBondContact O-CD1 3.21Å; R126-R465 PolarHBondContact NH2-O 2.91Å
127	S	80.8	Confident	85	Confident	28 Å²	28	48.7 Å²	48.7	20%	0.196	24%	0.235	C	C	.	.			trans	-154.9	159.7	173	75.6	0	0	0	0	108	L129	S127-L129 PolarHBondContact O-N 3.44Å; S127-L129 WeakPolarHBondContact OG-CG 3.33Å
128	N	71.4	Confident	85	Confident	99 Å²	99	52.5 Å²	52.5	53%	0.529	26%	0.256	S	S	.	.			trans	-69.2	-14.5	-176.1	-164.6	7.4	0	0	0	113	S130 K133	N128-S130 PolarHBondContact O-N 3.33Å; N128-K133 VanDerWaalsContact O-CD 3.24Å; N128-K133 WeakPolarHBondContact O-CD 3.3Å; N128-K133 WeakPolarHBondContact O-CE 3.46Å; N128-K133 PolarHBondContact O-NZ 3.23Å; N128-K133 PolarHBondContact OD1-NZ 3.21Å
129	L	78.1	Confident	84.9	Confident	38 Å²	38	48.7 Å²	48.7	20%	0.199	24%	0.241	C	C	.	.			trans	36.6	50.7	-176.2	-66.9	176.6	0	0	0	112.5	S127 S131 W132 K133 M251	S127-L129 PolarHBondContact O-N 3.44Å; S127-L129 WeakPolarHBondContact OG-CG 3.33Å; L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.45Å; L129-W132 HydrophobicContact CB-CB 4.32Å; L129-W132 HydrophobicContact CB-CG 4.42Å; L129-W132 HydrophobicContact CD1-CE3 4.42Å; L129-W132 WeakPolarHBondContact O-CB 3.42Å; L129-W132 PolarHBondContact O-N 3.13Å; L129-K133 PolarHBondContact O-N 3Å; L129-K133 VanDerWaalsContact O-N 3.17Å; L129-M251 HydrophobicContact CD2-SD 4.42Å
130	S	78.2	Confident	84.9	Confident	46 Å²	46	48.4 Å²	48.4	32%	0.322	25%	0.25	S	C	.	.	H	α-helix	trans	-54.4	-46	-165.1	49.3	0	0	0	0	112.9	N128 W132 K133 D134	N128-S130 PolarHBondContact O-N 3.33Å; S130-W132 PolarHBondContact O-N 3.42Å; S130-K133 PolarHBondContact O-N 3Å; S130-K133 VanDerWaalsContact O-N 3.12Å; S130-D134 WeakPolarHBondContact O-CB 3.23Å; S130-D134 PolarHBondContact O-N 3.39Å
131	S	83.6	Confident	85	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-53.8	-39.9	177.4	-54.7	0	0	0	0	112.9	L129 Y135 T250 W265 F268	L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.45Å; S131-Y135 PolarHBondContact O-N 2.9Å; S131-Y135 VanDerWaalsContact O-N 3.13Å; S131-T250 PolarHBondContact OG-OG1 2.82Å; S131-T250 VanDerWaalsContact OG-OG1 3.12Å; S131-W265 WeakPolarHBondContact O-CH2 3.47Å; S131-F268 WeakPolarHBondContact O-CE1 3.47Å
132	W	87.7	Confident	85.2	Confident	13 Å²	13	50.5 Å²	50.5	5%	0.049	26%	0.255	C	S	.	.	H	α-helix	trans	-72.9	-43.6	-178.8	-66.3	30.2	0	0	0	110.2	L129 S130 D134 Y135 R136 L146 T147 M243 T247 F268 W272 L328	L129-W132 HydrophobicContact CB-CB 4.32Å; L129-W132 HydrophobicContact CB-CG 4.42Å; L129-W132 HydrophobicContact CD1-CE3 4.42Å; L129-W132 WeakPolarHBondContact O-CB 3.42Å; L129-W132 PolarHBondContact O-N 3.13Å; S130-W132 PolarHBondContact O-N 3.42Å; W132-D134 VanDerWaalsContact C-N 3.31Å; W132-D134 PolarHBondContact O-N 2.99Å; W132-Y135 PolarHBondContact O-N 3.44Å; W132-R136 VanDerWaalsContact O-CG 3.31Å; W132-R136 WeakPolarHBondContact O-CG 3.49Å; W132-R136 PolarHBondContact O-N 2.95Å; W132-L146 HydrophobicContact CZ3-CD1 4.2Å; W132-T147 HydrophobicContact CB-CG2 3.86Å; W132-T147 HydrophobicContact CE3-CG2 3.87Å; W132-M243 HydrophobicContact CH2-CE 4.27Å; W132-M243 HydrophobicContact CH2-SD 4.36Å; W132-M243 HydrophobicContact CZ2-CE 4.03Å; W132-M243 HydrophobicContact CZ2-SD 3.6Å; W132-T247 HydrophobicContact CZ2-CG2 4.41Å; W132-T247 VanDerWaalsContact NE1-CG2 3.26Å; W132-T247 PolarHBondContact NE1-OG1 2.87Å; W132-F268 AromaticContact CD1-CE2 3.94Å; W132-F268 AromaticContact CD1-CZ 3.51Å; W132-F268 HydrophobicContact CG-CZ 4.24Å; W132-F268 AromaticContact NE1-CE2 3.86Å; W132-F268 AromaticContact NE1-CZ 3.92Å; W132-W272 HydrophobicContact CD2-CH2 4.32Å; W132-W272 AromaticContact CD2-CZ2 3.56Å; W132-W272 HydrophobicContact CD2-CZ2 3.56Å; W132-W272 AromaticContact CE2-CZ2 3.73Å; W132-W272 AromaticContact CE3-CH2 3.79Å; W132-W272 HydrophobicContact CE3-CH2 3.79Å; W132-W272 AromaticContact CE3-CZ2 3.5Å; W132-W272 HydrophobicContact CE3-CZ2 3.5Å; W132-W272 HydrophobicContact CG-CZ2 4.24Å; W132-W272 HydrophobicContact CH2-CH2 4.14Å; W132-W272 AromaticContact CH2-CZ2 3.88Å; W132-W272 HydrophobicContact CH2-CZ2 3.88Å; W132-W272 AromaticContact CZ2-CZ2 3.9Å; W132-W272 HydrophobicContact CZ2-CZ2 3.9Å; W132-W272 AromaticContact CZ3-CH2 3.69Å; W132-W272 HydrophobicContact CZ3-CH2 3.69Å; W132-W272 AromaticContact CZ3-CZ2 3.67Å; W132-W272 HydrophobicContact CZ3-CZ2 3.67Å; W132-L328 HydrophobicContact CH2-CD2 3.55Å; W132-L328 HydrophobicContact CZ2-CD2 4.46Å; W132-L328 HydrophobicContact CZ3-CD2 3.9Å
133	K	87.4	Confident	85.4	Confident	18 Å²	18	46.9 Å²	46.9	8%	0.078	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-38.3	176.8	-67.4	-175.6	-176.4	166.7	0	112.1	N128 L129 S130 R136 K137 F143 T147 E149	N128-K133 VanDerWaalsContact O-CD 3.24Å; N128-K133 WeakPolarHBondContact O-CD 3.3Å; N128-K133 WeakPolarHBondContact O-CE 3.46Å; N128-K133 PolarHBondContact O-NZ 3.23Å; N128-K133 PolarHBondContact OD1-NZ 3.21Å; L129-K133 PolarHBondContact O-N 3Å; L129-K133 VanDerWaalsContact O-N 3.17Å; S130-K133 PolarHBondContact O-N 3Å; S130-K133 VanDerWaalsContact O-N 3.12Å; K133-R136 PolarHBondContact O-N 2.62Å; K133-K137 WeakPolarHBondContact O-CG 3.43Å; K133-K137 PolarHBondContact O-N 2.95Å; K133-F143 HydrophobicContact CB-CE1 3.87Å; K133-F143 HydrophobicContact CB-CZ 4.47Å; K133-F143 HydrophobicContact CG-CD1 4.26Å; K133-F143 HydrophobicContact CG-CE1 3.87Å; K133-T147 WeakPolarHBondContact CE-O 3.22Å; K133-E149 IonicContact NZ-OE1 2.8Å; K133-E149 PolarHBondContact NZ-OE1 3.15Å; K133-E149 IonicContact NZ-OE2 2.75Å; K133-E149 PolarHBondContact NZ-OE2 3.13Å
134	D	87.1	Confident	85.3	Confident	64 Å²	64	45 Å²	45	34%	0.342	23%	0.229	S	C	.	.	H	α-helix	trans	-65.1	-41.5	178	-68.7	-20.8	0	0	0	111.1	S130 W132 K137 L138 W265	S130-D134 WeakPolarHBondContact O-CB 3.23Å; S130-D134 PolarHBondContact O-N 3.39Å; W132-D134 VanDerWaalsContact C-N 3.31Å; W132-D134 PolarHBondContact O-N 2.99Å; D134-K137 PolarHBondContact O-N 3.4Å; D134-L138 VanDerWaalsContact O-CB 3.32Å; D134-L138 WeakPolarHBondContact O-CB 3.34Å; D134-L138 PolarHBondContact O-N 3.36Å; D134-W265 HydrophobicContact CB-CH2 3.9Å; D134-W265 HydrophobicContact CB-CZ2 4.43Å
135	Y	89.3	Confident	85.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-47.9	171.3	167.5	-93.4	0	0	0	112.2	S131 W132 K137 L138 R139 H141 C269 W272 D273 F276	S131-Y135 PolarHBondContact O-N 2.9Å; S131-Y135 VanDerWaalsContact O-N 3.13Å; W132-Y135 PolarHBondContact O-N 3.44Å; Y135-K137 VanDerWaalsContact C-N 3.32Å; Y135-K137 PolarHBondContact O-N 3.17Å; Y135-L138 WeakPolarHBondContact O-CB 3.41Å; Y135-L138 PolarHBondContact O-N 3.14Å; Y135-L138 VanDerWaalsContact O-N 3.16Å; Y135-R139 HydrophobicContact CD2-CG 4.2Å; Y135-R139 HydrophobicContact CE2-CG 3.62Å; Y135-R139 PolarHBondContact O-N 2.77Å; Y135-H141 AromaticContact CE1-CD2 3.97Å; Y135-C269 HydrophobicContact CD2-CB 4.19Å; Y135-C269 HydrophobicContact CE2-CB 4.33Å; Y135-W272 HydrophobicContact CD1-CB 3.97Å; Y135-W272 HydrophobicContact CD1-CD2 4.42Å; Y135-W272 HydrophobicContact CD1-CG 4.03Å; Y135-W272 HydrophobicContact CD2-CB 3.97Å; Y135-W272 HydrophobicContact CD2-CG 4.48Å; Y135-W272 HydrophobicContact CE1-CB 3.53Å; Y135-W272 HydrophobicContact CE1-CD2 4.4Å; Y135-W272 HydrophobicContact CE1-CG 4Å; Y135-W272 HydrophobicContact CE2-CB 3.51Å; Y135-W272 HydrophobicContact CE2-CG 4.43Å; Y135-W272 HydrophobicContact CG-CB 4.19Å; Y135-W272 HydrophobicContact CG-CG 4.29Å; Y135-D273 WeakPolarHBondContact CE2-OD1 3.39Å; Y135-D273 VanDerWaalsContact CZ-OD1 3.3Å; Y135-D273 WeakPolarHBondContact OH-CA 3.42Å; Y135-D273 PolarHBondContact OH-N 2.87Å; Y135-D273 PolarHBondContact OH-OD1 3.47Å; Y135-F276 HydrophobicContact CE1-CD2 4.37Å; Y135-F276 HydrophobicContact CE1-CE2 4.42Å
136	R	89.7	Confident	85.4	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-44.9	179.4	-64.6	-69.1	-172	-104.8	-4.7	111.4	W132 K133 R139 G140 H141 N142 F143 W272 E325	W132-R136 VanDerWaalsContact O-CG 3.31Å; W132-R136 WeakPolarHBondContact O-CG 3.49Å; W132-R136 PolarHBondContact O-N 2.95Å; K133-R136 PolarHBondContact O-N 2.62Å; R136-R139 PolarHBondContact O-N 2.73Å; R136-G140 PolarHBondContact O-N 3.42Å; R136-H141 HydrophobicContact CB-CB 4.45Å; R136-H141 PolarHBondContact O-N 3.18Å; R136-N142 WeakPolarHBondContact CD-O 3.45Å; R136-F143 HydrophobicContact CB-CD1 4.05Å; R136-F143 HydrophobicContact CB-CE1 3.82Å; R136-F143 HydrophobicContact CG-CD1 4.1Å; R136-F143 HydrophobicContact CG-CE1 4.29Å; R136-W272 VanDerWaalsContact NH1-CE3 3.31Å; R136-E325 IonicContact CZ-OE1 3.06Å; R136-E325 IonicContact NE-OE1 2.75Å; R136-E325 IonicContact NH2-OE1 3.35Å; R136-E325 PolarHBondContact NH2-OE1 2.88Å
137	K	89	Confident	85.5	Confident	140 Å²	140	43.1 Å²	43.1	61%	0.609	22%	0.224	S	C	*	.	H	α-helix	trans	-63.3	-44.2	175.9	-71.1	173.5	-175.7	174.1	0	111.9	K133 D134 Y135 R139 G140 F143	K133-K137 WeakPolarHBondContact O-CG 3.43Å; K133-K137 PolarHBondContact O-N 2.95Å; D134-K137 PolarHBondContact O-N 3.4Å; Y135-K137 VanDerWaalsContact C-N 3.32Å; Y135-K137 PolarHBondContact O-N 3.17Å; K137-R139 VanDerWaalsContact C-N 3.29Å; K137-R139 PolarHBondContact O-N 3.17Å; K137-G140 PolarHBondContact O-N 2.67Å; K137-F143 HydrophobicContact CG-CZ 4.29Å
138	L	87.9	Confident	85.9	Confident	99 Å²	99	41.9 Å²	41.9	52%	0.518	22%	0.215	S	C	.	.	H	α-helix	trans	-60.4	-37.8	-180	-178.4	66.2	0	0	0	112.6	D134 Y135	D134-L138 VanDerWaalsContact O-CB 3.32Å; D134-L138 WeakPolarHBondContact O-CB 3.34Å; D134-L138 PolarHBondContact O-N 3.36Å; Y135-L138 WeakPolarHBondContact O-CB 3.41Å; Y135-L138 PolarHBondContact O-N 3.14Å; Y135-L138 VanDerWaalsContact O-N 3.16Å
139	R	88.6	Confident	86.7	Confident	103 Å²	103	39.3 Å²	39.3	39%	0.389	20%	0.2	S	C	.	.	H	α-helix	trans	-96.5	-2.8	-179.4	-65	-65.7	-171.9	-103.7	1.8	114.2	Y135 R136 K137 H141 D273	Y135-R139 HydrophobicContact CD2-CG 4.2Å; Y135-R139 HydrophobicContact CE2-CG 3.62Å; Y135-R139 PolarHBondContact O-N 2.77Å; R136-R139 PolarHBondContact O-N 2.73Å; K137-R139 VanDerWaalsContact C-N 3.29Å; K137-R139 PolarHBondContact O-N 3.17Å; R139-H141 VanDerWaalsContact C-N 3.31Å; R139-H141 WeakPolarHBondContact CB-CD2 3.47Å; R139-H141 PolarHBondContact O-N 2.94Å; R139-D273 IonicContact CZ-OD1 3.06Å; R139-D273 IonicContact CZ-OD2 3.71Å; R139-D273 IonicContact NE-OD1 2.89Å; R139-D273 PolarHBondContact NE-OD1 3.3Å; R139-D273 IonicContact NE-OD2 2.65Å; R139-D273 PolarHBondContact NE-OD2 2.51Å; R139-D273 IonicContact NH2-OD1 2.62Å; R139-D273 IonicContact NH2-OD2 3.94Å; R139-D273 PolarHBondContact NH2-OD2 2.94Å
140	G	87.8	Confident	87.2	Confident	36 Å²	36	38.8 Å²	38.8	37%	0.371	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	32	-178.4	0	0	0	0	0	114	R136 K137 K317	R136-G140 PolarHBondContact O-N 3.42Å; K137-G140 PolarHBondContact O-N 2.67Å; G140-K317 PolarHBondContact O-NZ 3.43Å; G140-K317 VanDerWaalsContact O-NZ 3.09Å
141	H	87.4	Confident	87.7	Confident	53 Å²	53	44.1 Å²	44.1	25%	0.245	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-86.8	154.2	170.5	-63.5	-54.1	0	0	0	110.9	Y135 R136 R139 F276	Y135-H141 AromaticContact CE1-CD2 3.97Å; R136-H141 HydrophobicContact CB-CB 4.45Å; R136-H141 PolarHBondContact O-N 3.18Å; R139-H141 VanDerWaalsContact C-N 3.31Å; R139-H141 WeakPolarHBondContact CB-CD2 3.47Å; R139-H141 PolarHBondContact O-N 2.94Å; H141-F276 HydrophobicContact CB-CE1 4.25Å; H141-F276 AromaticContact CE1-CD1 3.75Å; H141-F276 AromaticContact CG-CE1 3.89Å; H141-F276 AromaticContact ND1-CD1 3.85Å; H141-F276 AromaticContact NE2-CD1 3.87Å
142	N	87	Confident	87.9	Confident	50 Å²	50	47.7 Å²	47.7	27%	0.267	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-80.4	166.3	174	-70.9	0.4	0	0	0	110.5	R136 K317 T318 S321	R136-N142 WeakPolarHBondContact CD-O 3.45Å; N142-K317 HydrophobicContact CB-CB 4.5Å; N142-T318 PolarHBondContact ND2-OG1 3.31Å; N142-S321 VanDerWaalsContact O-CB 3.3Å; N142-S321 WeakPolarHBondContact O-CB 3.28Å; N142-S321 PolarHBondContact O-OG 2.73Å
143	F	88.2	Confident	88	Confident	46 Å²	46	47.2 Å²	47.2	20%	0.202	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-79.7	138.4	172.8	-57.5	-58.6	0	0	0	110.2	K133 R136 K137 A148	K133-F143 HydrophobicContact CB-CE1 3.87Å; K133-F143 HydrophobicContact CB-CZ 4.47Å; K133-F143 HydrophobicContact CG-CD1 4.26Å; K133-F143 HydrophobicContact CG-CE1 3.87Å; R136-F143 HydrophobicContact CB-CD1 4.05Å; R136-F143 HydrophobicContact CB-CE1 3.82Å; R136-F143 HydrophobicContact CG-CD1 4.1Å; R136-F143 HydrophobicContact CG-CE1 4.29Å; K137-F143 HydrophobicContact CG-CZ 4.29Å; F143-A148 HydrophobicContact CB-CB 3.91Å
144	G	85.3	Confident	88.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.			trans	-94.4	-178.7	172.5	0	0	0	0	0	111.4	L146 T147 A148 E325	G144-L146 PolarHBondContact O-N 3.15Å; G144-L146 VanDerWaalsContact O-N 3.12Å; G144-T147 PolarHBondContact N-OG1 3.13Å; G144-T147 PolarHBondContact O-N 3.15Å; G144-T147 VanDerWaalsContact O-N 3.09Å; G144-T147 PolarHBondContact O-OG1 3.34Å; G144-A148 WeakPolarHBondContact O-CB 3Å; G144-A148 PolarHBondContact O-N 3.5Å; G144-E325 VanDerWaalsContact CA-CD 3.49Å; G144-E325 WeakPolarHBondContact CA-OE2 3.36Å; G144-E325 PolarHBondContact N-OE1 2.99Å
145	L	87.2	Confident	88.2	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.063	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.5	-176.2	-173	68.7	0	0	0	114.8	W153 V156 R157 L160 N322 E325 I468	L145-W153 VanDerWaalsContact O-CD1 3.32Å; L145-V156 HydrophobicContact CB-CG1 4.49Å; L145-V156 HydrophobicContact CD1-CG1 4.18Å; L145-R157 HydrophobicContact CD1-CB 3.89Å; L145-L160 HydrophobicContact CB-CD1 4.42Å; L145-L160 HydrophobicContact CD1-CD1 4.38Å; L145-L160 HydrophobicContact CD2-CD1 3.94Å; L145-L160 HydrophobicContact CG-CD1 4.48Å; L145-N322 WeakPolarHBondContact CB-OD1 3.34Å; L145-N322 PolarHBondContact N-OD1 2.99Å; L145-E325 PolarHBondContact N-OE2 3.23Å; L145-E325 VanDerWaalsContact N-OE2 3.12Å; L145-I468 HydrophobicContact CD2-CB 3.82Å; L145-I468 HydrophobicContact CD2-CG1 4.06Å; L145-I468 HydrophobicContact CD2-CG2 3.65Å
146	L	86.8	Confident	88.1	Confident	57 Å²	57	51.8 Å²	51.8	30%	0.298	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-38.9	178.9	-62.3	174.6	0	0	0	111.4	W132 G144 E325	W132-L146 HydrophobicContact CZ3-CD1 4.2Å; G144-L146 PolarHBondContact O-N 3.15Å; G144-L146 VanDerWaalsContact O-N 3.12Å; L146-E325 WeakPolarHBondContact CA-OE2 3.44Å; L146-E325 VanDerWaalsContact CB-OE2 3.28Å; L146-E325 WeakPolarHBondContact CB-OE2 3.44Å; L146-E325 HydrophobicContact CD1-CB 4.02Å; L146-E325 HydrophobicContact CD1-CG 4.36Å; L146-E325 HydrophobicContact CG-CB 4.28Å; L146-E325 PolarHBondContact N-OE2 2.98Å
147	T	87.3	Confident	88.1	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-25.6	-173.7	50	0	0	0	0	114.2	W132 K133 G144 E325	W132-T147 HydrophobicContact CB-CG2 3.86Å; W132-T147 HydrophobicContact CE3-CG2 3.87Å; K133-T147 WeakPolarHBondContact CE-O 3.22Å; G144-T147 PolarHBondContact N-OG1 3.13Å; G144-T147 PolarHBondContact O-N 3.15Å; G144-T147 VanDerWaalsContact O-N 3.09Å; G144-T147 PolarHBondContact O-OG1 3.34Å; T147-E325 WeakPolarHBondContact CG2-OE1 3.19Å; T147-E325 PolarHBondContact N-OE2 2.97Å; T147-E325 PolarHBondContact OG1-OE1 2.92Å
148	A	88.4	Confident	88.1	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.008	25%	0.25	C	C	.	.			trans	-69.6	152	179.1	0	0	0	0	0	111.7	F143 G144 E152 W153 R465	F143-A148 HydrophobicContact CB-CB 3.91Å; G144-A148 WeakPolarHBondContact O-CB 3Å; G144-A148 PolarHBondContact O-N 3.5Å; A148-E152 HydrophobicContact CB-CG 4.18Å; A148-W153 HydrophobicContact CB-CB 4.04Å; A148-R465 PolarHBondContact O-NH2 2.88Å
149	E	89	Confident	87.9	Confident	46 Å²	46	45 Å²	45	22%	0.215	23%	0.231	C	C	.	.			trans	-137.9	166.9	179.2	-72.3	169.4	172.2	0	0	110.9	M125 K133 E151 W153	M125-E149 HydrophobicContact CE-CB 4.42Å; M125-E149 HydrophobicContact CE-CG 4.11Å; M125-E149 VanDerWaalsContact CE-OE2 3.29Å; M125-E149 WeakPolarHBondContact CE-OE2 3.46Å; M125-E149 HydrophobicContact CG-CG 4.48Å; K133-E149 IonicContact NZ-OE1 2.8Å; K133-E149 PolarHBondContact NZ-OE1 3.15Å; K133-E149 IonicContact NZ-OE2 2.75Å; K133-E149 PolarHBondContact NZ-OE2 3.13Å; E149-E151 PolarHBondContact O-N 3.3Å; E149-W153 PolarHBondContact O-N 2.82Å
150	G	88.4	Confident	87.7	Confident	27 Å²	27	40.1 Å²	40.1	28%	0.278	21%	0.213	S	C	.	.	H	α-helix	trans	62.1	-134	176.2	0	0	0	0	0	113.9	H123 Q154	H123-G150 PolarHBondContact ND1-O 2.93Å; G150-Q154 PolarHBondContact O-N 3.18Å
151	E	88.5	Confident	87.6	Confident	158 Å²	158	39.1 Å²	39.1	74%	0.738	20%	0.203	S	C	*	.	H	α-helix	trans	-70.5	-40.6	-177.9	-66.4	-174	165.8	0	0	112.7	E149 W153 Q154 E155	E149-E151 PolarHBondContact O-N 3.3Å; E151-W153 VanDerWaalsContact C-N 3.27Å; E151-W153 PolarHBondContact O-N 3.31Å; E151-Q154 PolarHBondContact O-N 3.06Å; E151-E155 PolarHBondContact O-N 3.22Å
152	E	87.3	Confident	87.4	Confident	77 Å²	77	41.3 Å²	41.3	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-56.4	-44.4	176.9	-176.6	-176.4	-165.4	0	0	110.7	A148 V156	A148-E152 HydrophobicContact CB-CG 4.18Å; E152-V156 WeakPolarHBondContact O-CG2 3.43Å; E152-V156 PolarHBondContact O-N 3.11Å
153	W	91.4	Very high	87	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.011	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-45.1	173.4	170.9	78.9	0	0	0	112.4	L145 A148 E149 E151 E155 R157 K464 R465	L145-W153 VanDerWaalsContact O-CD1 3.32Å; A148-W153 HydrophobicContact CB-CB 4.04Å; E149-W153 PolarHBondContact O-N 2.82Å; E151-W153 VanDerWaalsContact C-N 3.27Å; E151-W153 PolarHBondContact O-N 3.31Å; W153-E155 VanDerWaalsContact C-N 3.34Å; W153-E155 PolarHBondContact O-N 3.22Å; W153-R157 HydrophobicContact CD2-CB 4.34Å; W153-R157 HydrophobicContact CH2-CG 4.05Å; W153-R157 HydrophobicContact CZ2-CB 4.06Å; W153-R157 HydrophobicContact CZ2-CG 3.64Å; W153-R157 WeakPolarHBondContact O-CB 3.47Å; W153-R157 PolarHBondContact O-N 3.28Å; W153-K464 HydrophobicContact CH2-CB 3.96Å; W153-R465 HydrophobicContact CH2-CB 4.14Å; W153-R465 HydrophobicContact CH2-CG 4.37Å; W153-R465 HydrophobicContact CZ2-CB 3.72Å; W153-R465 HydrophobicContact CZ2-CG 3.54Å
154	Q	90.4	Very high	86.8	Confident	52 Å²	52	39.2 Å²	39.2	24%	0.243	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-38.4	-176.1	180	64.5	43.1	0	0	111.8	G150 E151 S158	G150-Q154 PolarHBondContact O-N 3.18Å; E151-Q154 PolarHBondContact O-N 3.06Å; Q154-S158 PolarHBondContact NE2-OG 3.45Å; Q154-S158 VanDerWaalsContact O-CB 3.25Å; Q154-S158 WeakPolarHBondContact O-CB 3.43Å; Q154-S158 PolarHBondContact O-N 2.95Å; Q154-S158 PolarHBondContact O-OG 3.35Å
155	E	87.9	Confident	86.8	Confident	119 Å²	119	41.7 Å²	41.7	56%	0.556	21%	0.214	S	C	*	.	H	α-helix	trans	-59.3	-60.8	176	-176	177	-174.3	0	0	110	E151 W153 R157 S158 L159	E151-E155 PolarHBondContact O-N 3.22Å; W153-E155 VanDerWaalsContact C-N 3.34Å; W153-E155 PolarHBondContact O-N 3.22Å; E155-R157 VanDerWaalsContact C-N 3.31Å; E155-R157 PolarHBondContact O-N 3.02Å; E155-S158 PolarHBondContact O-N 3.37Å; E155-S158 VanDerWaalsContact O-N 3.14Å; E155-L159 WeakPolarHBondContact O-CG 3.38Å; E155-L159 PolarHBondContact O-N 3.29Å; E155-L159 VanDerWaalsContact O-N 3.14Å
156	V	86.6	Confident	86.7	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-43.4	179.5	176.6	0	0	0	0	111.4	L145 E152 S158 L159 L160 T318 N322	L145-V156 HydrophobicContact CB-CG1 4.49Å; L145-V156 HydrophobicContact CD1-CG1 4.18Å; E152-V156 WeakPolarHBondContact O-CG2 3.43Å; E152-V156 PolarHBondContact O-N 3.11Å; V156-S158 PolarHBondContact O-N 3.33Å; V156-L159 PolarHBondContact O-N 3.07Å; V156-L160 HydrophobicContact CG1-CD1 3.8Å; V156-L160 HydrophobicContact CG1-CG 4.33Å; V156-L160 WeakPolarHBondContact O-CG 3.44Å; V156-L160 PolarHBondContact O-N 2.84Å; V156-T318 HydrophobicContact CG2-CG2 4.31Å; V156-N322 WeakPolarHBondContact CG1-OD1 3.23Å
157	R	90.3	Very high	86.3	Confident	21 Å²	21	49.3 Å²	49.3	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-42.6	178.6	177.6	62.8	179.9	-161.5	-0.9	112.3	L145 W153 E155 L159 G161 K464 S466 I468	L145-R157 HydrophobicContact CD1-CB 3.89Å; W153-R157 HydrophobicContact CD2-CB 4.34Å; W153-R157 HydrophobicContact CH2-CG 4.05Å; W153-R157 HydrophobicContact CZ2-CB 4.06Å; W153-R157 HydrophobicContact CZ2-CG 3.64Å; W153-R157 WeakPolarHBondContact O-CB 3.47Å; W153-R157 PolarHBondContact O-N 3.28Å; E155-R157 VanDerWaalsContact C-N 3.31Å; E155-R157 PolarHBondContact O-N 3.02Å; R157-L159 VanDerWaalsContact C-N 3.29Å; R157-L159 PolarHBondContact O-N 3.17Å; R157-G161 PolarHBondContact O-N 3.4Å; R157-K464 VanDerWaalsContact CZ-O 3.28Å; R157-K464 PolarHBondContact NE-O 2.82Å; R157-K464 VanDerWaalsContact NE-O 3.11Å; R157-K464 PolarHBondContact NH2-O 3.35Å; R157-S466 PolarHBondContact NH1-O 3.02Å; R157-S466 PolarHBondContact NH2-O 3.12Å; R157-S466 PolarHBondContact NH2-OG 3.4Å; R157-I468 VanDerWaalsContact NH1-CB 3.28Å
158	S	87.9	Confident	85.9	Confident	50 Å²	50	57.3 Å²	57.3	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-34.2	-178.7	-59.3	0	0	0	0	111.5	Q154 E155 V156 K162	Q154-S158 PolarHBondContact NE2-OG 3.45Å; Q154-S158 VanDerWaalsContact O-CB 3.25Å; Q154-S158 WeakPolarHBondContact O-CB 3.43Å; Q154-S158 PolarHBondContact O-N 2.95Å; Q154-S158 PolarHBondContact O-OG 3.35Å; E155-S158 PolarHBondContact O-N 3.37Å; E155-S158 VanDerWaalsContact O-N 3.14Å; V156-S158 PolarHBondContact O-N 3.33Å; S158-K162 WeakPolarHBondContact O-CG 3.36Å
159	L	84.3	Confident	85.4	Confident	26 Å²	26	58.3 Å²	58.3	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-57.3	175.5	-63.4	-176	0	0	0	111.1	E155 V156 R157 G161 K162 M312 L314	E155-L159 WeakPolarHBondContact O-CG 3.38Å; E155-L159 PolarHBondContact O-N 3.29Å; E155-L159 VanDerWaalsContact O-N 3.14Å; V156-L159 PolarHBondContact O-N 3.07Å; R157-L159 VanDerWaalsContact C-N 3.29Å; R157-L159 PolarHBondContact O-N 3.17Å; L159-G161 VanDerWaalsContact C-N 3.27Å; L159-G161 PolarHBondContact O-N 2.83Å; L159-K162 PolarHBondContact O-N 3.25Å; L159-M312 HydrophobicContact CB-SD 4.48Å; L159-M312 HydrophobicContact CD1-CE 4.38Å; L159-M312 HydrophobicContact CD1-SD 4.47Å; L159-M312 HydrophobicContact CD2-CE 3.25Å; L159-M312 HydrophobicContact CD2-SD 4.01Å; L159-M312 HydrophobicContact CG-CE 4.28Å; L159-L314 HydrophobicContact CD1-CD1 3.97Å; L159-L314 HydrophobicContact CD1-CD2 4.1Å; L159-L314 HydrophobicContact CD1-CG 4.28Å
160	L	84.1	Confident	84.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-60.3	-37.5	-179.8	-68.1	177.7	0	0	0	112.3	L145 V156 K162 H163 M164 L305 L309 L326 I468	L145-L160 HydrophobicContact CB-CD1 4.42Å; L145-L160 HydrophobicContact CD1-CD1 4.38Å; L145-L160 HydrophobicContact CD2-CD1 3.94Å; L145-L160 HydrophobicContact CG-CD1 4.48Å; V156-L160 HydrophobicContact CG1-CD1 3.8Å; V156-L160 HydrophobicContact CG1-CG 4.33Å; V156-L160 WeakPolarHBondContact O-CG 3.44Å; V156-L160 PolarHBondContact O-N 2.84Å; L160-K162 PolarHBondContact O-N 3.26Å; L160-H163 PolarHBondContact O-N 3.16Å; L160-H163 VanDerWaalsContact O-N 3.07Å; L160-M164 HydrophobicContact CB-SD 4.45Å; L160-M164 HydrophobicContact CD2-SD 4.4Å; L160-M164 PolarHBondContact O-N 3.19Å; L160-L305 HydrophobicContact CD2-CD1 3.76Å; L160-L305 HydrophobicContact CD2-CD2 3.83Å; L160-L305 HydrophobicContact CD2-CG 4.04Å; L160-L309 HydrophobicContact CD2-CD1 4.33Å; L160-L309 HydrophobicContact CD2-CD2 3.88Å; L160-L309 HydrophobicContact CD2-CG 4.48Å; L160-L326 HydrophobicContact CD1-CD1 4.43Å; L160-I468 HydrophobicContact CB-CD1 4.03Å; L160-I468 HydrophobicContact CB-CG1 4.13Å
161	G	85.7	Confident	84.6	Confident	15 Å²	15	59 Å²	59	16%	0.155	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-29.8	-179.7	0	0	0	0	0	113.8	R157 L159 H163 L165	R157-G161 PolarHBondContact O-N 3.4Å; L159-G161 VanDerWaalsContact C-N 3.27Å; L159-G161 PolarHBondContact O-N 2.83Å; G161-H163 VanDerWaalsContact C-N 3.27Å; G161-H163 PolarHBondContact O-N 3.23Å; G161-L165 WeakPolarHBondContact O-CB 3.5Å; G161-L165 PolarHBondContact O-N 2.58Å
162	K	83.1	Confident	84.2	Confident	99 Å²	99	53.8 Å²	53.8	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-67.1	-29.4	176.7	-70	170.9	-174.5	176	0	112.5	S158 L159 L160 R166	S158-K162 WeakPolarHBondContact O-CG 3.36Å; L159-K162 PolarHBondContact O-N 3.25Å; L160-K162 PolarHBondContact O-N 3.26Å; K162-R166 VanDerWaalsContact O-CD 3.23Å; K162-R166 WeakPolarHBondContact O-CD 3.38Å; K162-R166 WeakPolarHBondContact O-CG 3.41Å
163	H	79	Confident	84	Confident	48 Å²	48	50.7 Å²	50.7	22%	0.222	25%	0.251	C	S	.	.	H	α-helix	trans	-103	-30.6	-174.9	-69.2	-84.7	0	0	0	113.4	L160 G161 A169 L305 F308	L160-H163 PolarHBondContact O-N 3.16Å; L160-H163 VanDerWaalsContact O-N 3.07Å; G161-H163 VanDerWaalsContact C-N 3.27Å; G161-H163 PolarHBondContact O-N 3.23Å; H163-A169 WeakPolarHBondContact O-CB 3.32Å; H163-L305 HydrophobicContact CB-CD1 4.23Å; H163-F308 AromaticContact CE1-CD1 3.78Å; H163-F308 AromaticContact CE1-CG 3.88Å; H163-F308 AromaticContact ND1-CD2 3.94Å
164	M	83.6	Confident	83.7	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-102	-20.2	-174	-59.4	-177	78	0	0	114.4	L160 L305 L326 I468 I472	L160-M164 HydrophobicContact CB-SD 4.45Å; L160-M164 HydrophobicContact CD2-SD 4.4Å; L160-M164 PolarHBondContact O-N 3.19Å; M164-L305 HydrophobicContact CE-CD2 4.47Å; M164-L305 HydrophobicContact CG-CD1 4.19Å; M164-L305 HydrophobicContact SD-CD1 4.37Å; M164-L305 HydrophobicContact SD-CD2 3.78Å; M164-L326 HydrophobicContact CE-CD1 4.5Å; M164-L326 HydrophobicContact CE-CD2 4.21Å; M164-L326 HydrophobicContact SD-CD1 4.21Å; M164-L326 HydrophobicContact SD-CD2 4.36Å; M164-I468 HydrophobicContact CB-CG1 4.16Å; M164-I468 HydrophobicContact SD-CG1 3.84Å; M164-I468 HydrophobicContact SD-CG2 4.49Å; M164-I472 HydrophobicContact CB-CD1 4.25Å; M164-I472 HydrophobicContact CE-CD1 3.65Å; M164-I472 HydrophobicContact CG-CD1 4.2Å
165	L	85	Confident	83.5	Confident	52 Å²	52	55.4 Å²	55.4	27%	0.272	28%	0.278	S	S	.	.	S	Bend	trans	-105.8	-15.5	-176.3	-65	174.8	0	0	0	114.1	G161 I468	G161-L165 WeakPolarHBondContact O-CB 3.5Å; G161-L165 PolarHBondContact O-N 2.58Å; L165-I468 HydrophobicContact CD1-CD1 3.92Å; L165-I468 WeakPolarHBondContact CD2-O 3.34Å; L165-I468 HydrophobicContact CG-CD1 4.03Å
166	R	84.8	Confident	83.5	Confident	150 Å²	150	51.5 Å²	51.5	57%	0.566	26%	0.262	S	S	*	.	S	Bend	trans	-82.1	128.4	179.9	-67.9	-170.6	179.1	175.9	-5.4	110.1	K162 K168 A169 V170	K162-R166 VanDerWaalsContact O-CD 3.23Å; K162-R166 WeakPolarHBondContact O-CD 3.38Å; K162-R166 WeakPolarHBondContact O-CG 3.41Å; R166-K168 PolarHBondContact O-N 3.22Å; R166-A169 HydrophobicContact CB-CB 4.13Å; R166-A169 WeakPolarHBondContact O-CB 3.13Å; R166-A169 PolarHBondContact O-N 2.93Å; R166-V170 PolarHBondContact O-N 3.35Å
167	P	80.3	Confident	83.6	Confident	78 Å²	78	51.3 Å²	51.3	51%	0.506	26%	0.261	S	S	.	.	H	α-helix	trans	-52.3	-48.9	-178	-28.8	35.2	0	0	0	114	A169 V170 E171	P167-A169 PolarHBondContact O-N 2.79Å; P167-A169 VanDerWaalsContact O-N 3.17Å; P167-V170 PolarHBondContact O-N 2.99Å; P167-E171 PolarHBondContact O-N 3.38Å
168	K	78.4	Confident	83.7	Confident	171 Å²	171	50.8 Å²	50.8	74%	0.743	26%	0.26	S	S	*	.	H	α-helix	trans	-60.5	-26.6	178.1	-69.2	-169.8	174.1	-171.3	0	114.7	R166 V170	R166-K168 PolarHBondContact O-N 3.22Å; K168-V170 VanDerWaalsContact C-N 3.31Å
169	A	76.9	Confident	83.8	Confident	22 Å²	22	50.5 Å²	50.5	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-79.3	-22.3	178.6	0	0	0	0	0	111.5	H163 R166 P167 Y173	H163-A169 WeakPolarHBondContact O-CB 3.32Å; R166-A169 HydrophobicContact CB-CB 4.13Å; R166-A169 WeakPolarHBondContact O-CB 3.13Å; R166-A169 PolarHBondContact O-N 2.93Å; P167-A169 PolarHBondContact O-N 2.79Å; P167-A169 VanDerWaalsContact O-N 3.17Å; A169-Y173 WeakPolarHBondContact O-CE2 3.29Å
170	V	79.4	Confident	84.2	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-88.3	-30.9	-179.1	178.9	0	0	0	0	112	R166 P167 K168 V172 Y173 R471 I472 L475	R166-V170 PolarHBondContact O-N 3.35Å; P167-V170 PolarHBondContact O-N 2.99Å; K168-V170 VanDerWaalsContact C-N 3.31Å; V170-V172 PolarHBondContact O-N 2.74Å; V170-Y173 PolarHBondContact O-N 3Å; V170-R471 HydrophobicContact CG1-CB 4.41Å; V170-R471 HydrophobicContact CG2-CB 3.79Å; V170-I472 HydrophobicContact CG1-CG1 4.26Å; V170-I472 HydrophobicContact CG2-CG1 4.1Å; V170-L475 HydrophobicContact CG1-CB 4.24Å; V170-L475 HydrophobicContact CG1-CD2 3.6Å
171	E	80.7	Confident	84.6	Confident	84 Å²	84	49.2 Å²	49.2	39%	0.393	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-50.7	-29.9	170.7	-74.7	167	-168.5	0	0	112.9	P167 Y173 D174 N371	P167-E171 PolarHBondContact O-N 3.38Å; E171-Y173 PolarHBondContact O-N 2.88Å; E171-D174 WeakPolarHBondContact O-CB 3.44Å; E171-D174 VanDerWaalsContact O-CG 3.32Å; E171-D174 PolarHBondContact O-N 2.92Å; E171-N371 HydrophobicContact CG-CB 4.09Å; E171-N371 WeakPolarHBondContact CG-ND2 3.43Å; E171-N371 PolarHBondContact OE1-ND2 3.15Å
172	V	81.4	Confident	85	Confident	48 Å²	48	50.1 Å²	50.1	29%	0.291	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-64.3	-23.2	178.8	176.2	0	0	0	0	112.7	V170 R303	V170-V172 PolarHBondContact O-N 2.74Å; V172-R303 HydrophobicContact CG1-CB 3.58Å; V172-R303 HydrophobicContact CG1-CG 3.99Å
173	Y	83.1	Confident	85.4	Confident	12 Å²	12	47.8 Å²	47.8	5%	0.047	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-92.8	-0.4	-178.6	-56.6	-60	0	0	0	113.3	A169 V170 E171 D175 T176 L177 V216 R303 I472	A169-Y173 WeakPolarHBondContact O-CE2 3.29Å; V170-Y173 PolarHBondContact O-N 3Å; E171-Y173 PolarHBondContact O-N 2.88Å; Y173-D175 PolarHBondContact O-N 3.24Å; Y173-T176 PolarHBondContact O-N 3.46Å; Y173-L177 WeakPolarHBondContact O-CB 3.48Å; Y173-L177 WeakPolarHBondContact O-CG 3.48Å; Y173-L177 PolarHBondContact O-N 3.44Å; Y173-V216 HydrophobicContact CD1-CG1 4.23Å; Y173-V216 HydrophobicContact CD1-CG2 4.26Å; Y173-V216 HydrophobicContact CD2-CG1 4.45Å; Y173-V216 HydrophobicContact CE1-CG1 4.07Å; Y173-V216 HydrophobicContact CE2-CG1 4.3Å; Y173-V216 HydrophobicContact CG-CG1 4.43Å; Y173-V216 HydrophobicContact CG-CG2 4.29Å; Y173-R303 PolarHBondContact OH-O 3.03Å; Y173-I472 HydrophobicContact CE2-CD1 4.35Å
174	D	84.5	Confident	86.1	Confident	19 Å²	19	45.5 Å²	45.5	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-56.1	-51.8	-176.8	-76.6	1.8	0	0	0	112.1	E171 T176 L177 N178 N371 L475	E171-D174 WeakPolarHBondContact O-CB 3.44Å; E171-D174 VanDerWaalsContact O-CG 3.32Å; E171-D174 PolarHBondContact O-N 2.92Å; D174-T176 PolarHBondContact O-N 2.86Å; D174-L177 PolarHBondContact O-N 2.9Å; D174-N178 WeakPolarHBondContact O-CB 3.44Å; D174-N178 PolarHBondContact O-N 3.3Å; D174-N178 PolarHBondContact O-ND2 3.44Å; D174-N371 WeakPolarHBondContact OD1-CB 3.36Å; D174-N371 WeakPolarHBondContact OD2-CB 3.48Å; D174-N371 PolarHBondContact OD2-N 3.33Å; D174-L475 WeakPolarHBondContact OD1-CD2 3.48Å
175	D	86.3	Confident	86.5	Confident	136 Å²	136	45.5 Å²	45.5	73%	0.727	24%	0.237	S	C	*	.	H	α-helix	trans	-63.7	-43.1	-178.9	-67.7	-30.7	0	0	0	111.5	Y173 N178 S179	Y173-D175 PolarHBondContact O-N 3.24Å; D175-N178 PolarHBondContact O-N 2.91Å; D175-S179 PolarHBondContact O-N 2.99Å
176	T	87.8	Confident	86.8	Confident	36 Å²	36	46.2 Å²	46.2	22%	0.221	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-51.3	179.5	-57.3	0	0	0	0	110.7	Y173 D174 S179 V180	Y173-T176 PolarHBondContact O-N 3.46Å; D174-T176 PolarHBondContact O-N 2.86Å; T176-S179 WeakPolarHBondContact O-CB 3.27Å; T176-S179 PolarHBondContact O-N 3.49Å; T176-S179 PolarHBondContact O-OG 3.12Å; T176-V180 WeakPolarHBondContact O-CG2 3.33Å; T176-V180 PolarHBondContact O-N 2.94Å
177	L	90.1	Very high	87	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-40.1	179.3	-68.5	175	0	0	0	111.4	Y173 D174 S179 V180 V181 V216 L475 E476 L479	Y173-L177 WeakPolarHBondContact O-CB 3.48Å; Y173-L177 WeakPolarHBondContact O-CG 3.48Å; Y173-L177 PolarHBondContact O-N 3.44Å; D174-L177 PolarHBondContact O-N 2.9Å; L177-S179 VanDerWaalsContact C-N 3.27Å; L177-S179 PolarHBondContact O-N 3.06Å; L177-V180 PolarHBondContact O-N 3.47Å; L177-V180 VanDerWaalsContact O-N 3.14Å; L177-V181 WeakPolarHBondContact O-CG2 3.24Å; L177-V181 PolarHBondContact O-N 3.05Å; L177-V216 HydrophobicContact CD2-CG2 3.96Å; L177-V216 HydrophobicContact CG-CG2 4.45Å; L177-L475 HydrophobicContact CD1-CB 4.49Å; L177-L475 HydrophobicContact CD1-CD2 3.7Å; L177-L475 HydrophobicContact CD1-CG 3.98Å; L177-E476 HydrophobicContact CD1-CB 4.3Å; L177-E476 HydrophobicContact CD2-CB 4.39Å; L177-E476 HydrophobicContact CD2-CG 4.29Å; L177-L479 HydrophobicContact CB-CD1 3.92Å
178	N	91.1	Very high	87.5	Confident	11 Å²	11	35.9 Å²	35.9	6%	0.059	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-34.2	174.6	-86.9	-53.2	0	0	0	112.6	D174 D175 V181 S182 I368 P369 R483	D174-N178 WeakPolarHBondContact O-CB 3.44Å; D174-N178 PolarHBondContact O-N 3.3Å; D174-N178 PolarHBondContact O-ND2 3.44Å; D175-N178 PolarHBondContact O-N 2.91Å; N178-V181 PolarHBondContact O-N 3.44Å; N178-S182 PolarHBondContact O-N 3.45Å; N178-S182 PolarHBondContact O-OG 2.65Å; N178-I368 HydrophobicContact CB-CG2 3.99Å; N178-I368 VanDerWaalsContact CG-CG2 3.43Å; N178-I368 WeakPolarHBondContact OD1-CG2 3.46Å; N178-P369 PolarHBondContact ND2-O 2.89Å; N178-R483 PolarHBondContact O-NH1 3.38Å
179	S	91.2	Very high	88.1	Confident	43 Å²	43	32.3 Å²	32.3	30%	0.301	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-45.9	172.7	81.9	0	0	0	0	111.3	D175 T176 L177 V181 S182 D183 R221	D175-S179 PolarHBondContact O-N 2.99Å; T176-S179 WeakPolarHBondContact O-CB 3.27Å; T176-S179 PolarHBondContact O-N 3.49Å; T176-S179 PolarHBondContact O-OG 3.12Å; L177-S179 VanDerWaalsContact C-N 3.27Å; L177-S179 PolarHBondContact O-N 3.06Å; S179-V181 VanDerWaalsContact C-N 3.34Å; S179-V181 PolarHBondContact O-N 3.42Å; S179-S182 WeakPolarHBondContact O-CB 3.25Å; S179-S182 PolarHBondContact O-N 2.93Å; S179-S182 VanDerWaalsContact O-N 3.13Å; S179-D183 PolarHBondContact O-N 3.28Å; S179-R221 PolarHBondContact OG-NH1 3.43Å
180	V	92.4	Very high	88.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-39.8	178	-179.7	0	0	0	0	111.1	T176 L177 S182 D183 L184 F208 E211 L225	T176-V180 WeakPolarHBondContact O-CG2 3.33Å; T176-V180 PolarHBondContact O-N 2.94Å; L177-V180 PolarHBondContact O-N 3.47Å; L177-V180 VanDerWaalsContact O-N 3.14Å; V180-S182 VanDerWaalsContact C-N 3.32Å; V180-S182 PolarHBondContact O-N 3.14Å; V180-D183 PolarHBondContact O-N 3.21Å; V180-L184 PolarHBondContact O-N 3.45Å; V180-F208 HydrophobicContact CG1-CD2 3.79Å; V180-F208 HydrophobicContact CG1-CE2 3.72Å; V180-E211 HydrophobicContact CG1-CB 3.94Å; V180-E211 HydrophobicContact CG1-CG 3.8Å; V180-E211 HydrophobicContact CG2-CG 4.13Å; V180-L225 HydrophobicContact CG1-CD1 3.74Å; V180-L225 WeakPolarHBondContact O-CD1 3.43Å
181	V	92.9	Very high	88.9	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-34.5	175.6	176.8	0	0	0	0	111.9	L177 N178 S179 D183 L184 I185 F208 L479 A480 R483	L177-V181 WeakPolarHBondContact O-CG2 3.24Å; L177-V181 PolarHBondContact O-N 3.05Å; N178-V181 PolarHBondContact O-N 3.44Å; S179-V181 VanDerWaalsContact C-N 3.34Å; S179-V181 PolarHBondContact O-N 3.42Å; V181-D183 VanDerWaalsContact C-N 3.28Å; V181-D183 PolarHBondContact O-N 2.84Å; V181-L184 WeakPolarHBondContact O-CB 3.26Å; V181-L184 PolarHBondContact O-N 3.05Å; V181-I185 HydrophobicContact CG1-CD1 4.03Å; V181-I185 WeakPolarHBondContact O-CG1 3.45Å; V181-I185 PolarHBondContact O-N 3.47Å; V181-F208 HydrophobicContact CG2-CE2 3.87Å; V181-F208 HydrophobicContact CG2-CZ 3.89Å; V181-L479 HydrophobicContact CG2-CB 4.41Å; V181-A480 HydrophobicContact CG2-CB 4.05Å; V181-R483 HydrophobicContact CG1-CB 3.96Å; V181-R483 HydrophobicContact CG1-CG 4.28Å
182	S	92.8	Very high	89.2	Confident	34 Å²	34	41.5 Å²	41.5	24%	0.238	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-39.1	174.8	-61.4	0	0	0	0	111.7	N178 S179 V180 I185 S186 R483	N178-S182 PolarHBondContact O-N 3.45Å; N178-S182 PolarHBondContact O-OG 2.65Å; S179-S182 WeakPolarHBondContact O-CB 3.25Å; S179-S182 PolarHBondContact O-N 2.93Å; S179-S182 VanDerWaalsContact O-N 3.13Å; V180-S182 VanDerWaalsContact C-N 3.32Å; V180-S182 PolarHBondContact O-N 3.14Å; S182-I185 PolarHBondContact O-N 3.34Å; S182-S186 PolarHBondContact O-N 3.35Å; S182-S186 PolarHBondContact O-OG 3.21Å; S182-R483 VanDerWaalsContact N-NH1 3.18Å; S182-R483 PolarHBondContact OG-NH1 2.96Å; S182-R483 PolarHBondContact OG-NH2 3.03Å
183	D	92.2	Very high	89.4	Confident	50 Å²	50	41.6 Å²	41.6	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-72.8	-36.3	178.6	-60.6	-29.4	0	0	0	111.1	S179 V180 V181 I185 S186 K187 R221 L225	S179-D183 PolarHBondContact O-N 3.28Å; V180-D183 PolarHBondContact O-N 3.21Å; V181-D183 VanDerWaalsContact C-N 3.28Å; V181-D183 PolarHBondContact O-N 2.84Å; D183-I185 PolarHBondContact O-N 2.85Å; D183-S186 PolarHBondContact O-N 2.91Å; D183-K187 WeakPolarHBondContact O-CB 3.42Å; D183-K187 PolarHBondContact O-N 3.32Å; D183-R221 IonicContact OD2-CZ 2.88Å; D183-R221 IonicContact OD2-NH1 3.35Å; D183-R221 PolarHBondContact OD2-NH1 2.69Å; D183-R221 IonicContact OD2-NH2 3Å; D183-R221 PolarHBondContact OD2-NH2 2.88Å; D183-L225 HydrophobicContact CB-CB 4.04Å; D183-L225 HydrophobicContact CB-CD1 3.96Å
184	L	92.9	Very high	89.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-49.8	170.8	175	63.3	0	0	0	111.1	V180 V181 S186 K187 L188 F205 F208 L225 I484	V180-L184 PolarHBondContact O-N 3.45Å; V181-L184 WeakPolarHBondContact O-CB 3.26Å; V181-L184 PolarHBondContact O-N 3.05Å; L184-S186 VanDerWaalsContact C-N 3.28Å; L184-S186 PolarHBondContact O-N 3.44Å; L184-K187 WeakPolarHBondContact O-CB 3.21Å; L184-K187 PolarHBondContact O-N 3.18Å; L184-K187 VanDerWaalsContact O-N 3.17Å; L184-L188 HydrophobicContact CD1-CD1 4.33Å; L184-L188 HydrophobicContact CD1-CG 4.17Å; L184-L188 HydrophobicContact CG-CD1 4.18Å; L184-L188 HydrophobicContact CG-CG 4.42Å; L184-L188 VanDerWaalsContact O-CG 3.31Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 3.42Å; L184-F205 HydrophobicContact CD1-CD1 4.34Å; L184-F205 HydrophobicContact CD1-CE1 4.27Å; L184-F205 HydrophobicContact CD2-CE1 4.24Å; L184-F208 HydrophobicContact CB-CD2 3.83Å; L184-F208 HydrophobicContact CB-CE2 4.21Å; L184-F208 HydrophobicContact CD1-CB 4.21Å; L184-F208 HydrophobicContact CD1-CD2 4.4Å; L184-F208 HydrophobicContact CD1-CG 4.43Å; L184-F208 HydrophobicContact CD2-CD1 4.28Å; L184-F208 HydrophobicContact CD2-CD2 3.65Å; L184-F208 HydrophobicContact CD2-CE1 4.46Å; L184-F208 HydrophobicContact CD2-CE2 3.85Å; L184-F208 HydrophobicContact CD2-CG 3.88Å; L184-F208 HydrophobicContact CD2-CZ 4.27Å; L184-F208 HydrophobicContact CG-CD2 4.16Å; L184-L225 HydrophobicContact CB-CD1 4.34Å; L184-I484 HydrophobicContact CD2-CD1 4.11Å
185	I	92.6	Very high	88.9	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-42.7	179.2	-69.5	163.2	0	0	0	110.7	V181 S182 D183 K187 L188 R189 R483 E487 F488	V181-I185 HydrophobicContact CG1-CD1 4.03Å; V181-I185 WeakPolarHBondContact O-CG1 3.45Å; V181-I185 PolarHBondContact O-N 3.47Å; S182-I185 PolarHBondContact O-N 3.34Å; D183-I185 PolarHBondContact O-N 2.85Å; I185-K187 VanDerWaalsContact C-N 3.35Å; I185-K187 PolarHBondContact O-N 3.2Å; I185-L188 PolarHBondContact O-N 3.06Å; I185-R189 WeakPolarHBondContact O-CG 3.46Å; I185-R189 PolarHBondContact O-N 3.24Å; I185-R483 HydrophobicContact CD1-CB 3.61Å; I185-E487 HydrophobicContact CG2-CG 4.46Å; I185-F488 HydrophobicContact CG2-CE2 4.05Å; I185-F488 HydrophobicContact CG2-CZ 4.36Å
186	S	91.6	Very high	88.8	Confident	66 Å²	66	47.1 Å²	47.1	46%	0.462	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-41.9	177	-57.6	0	0	0	0	111.7	S182 D183 L184 R189 F190	S182-S186 PolarHBondContact O-N 3.35Å; S182-S186 PolarHBondContact O-OG 3.21Å; D183-S186 PolarHBondContact O-N 2.91Å; L184-S186 VanDerWaalsContact C-N 3.28Å; L184-S186 PolarHBondContact O-N 3.44Å; S186-R189 PolarHBondContact O-N 3.1Å; S186-F190 PolarHBondContact O-N 3Å
187	K	89.4	Confident	88.9	Confident	10 Å²	10	47.1 Å²	47.1	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-42.5	175.3	-173	66.9	165.6	-163.8	0	111.8	D183 L184 I185 R189 F190 R191 D226	D183-K187 WeakPolarHBondContact O-CB 3.42Å; D183-K187 PolarHBondContact O-N 3.32Å; L184-K187 WeakPolarHBondContact O-CB 3.21Å; L184-K187 PolarHBondContact O-N 3.18Å; L184-K187 VanDerWaalsContact O-N 3.17Å; I185-K187 VanDerWaalsContact C-N 3.35Å; I185-K187 PolarHBondContact O-N 3.2Å; K187-R189 PolarHBondContact O-N 2.91Å; K187-F190 PolarHBondContact O-N 3.28Å; K187-R191 HydrophobicContact CD-CG 4.22Å; K187-R191 HydrophobicContact CG-CG 4.3Å; K187-R191 WeakPolarHBondContact O-CB 3.43Å; K187-R191 WeakPolarHBondContact O-CG 3.34Å; K187-R191 PolarHBondContact O-N 3.22Å; K187-D226 PolarHBondContact NZ-O 2.77Å
188	L	90.4	Very high	88.9	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-44.1	176.3	-69.1	176.3	0	0	0	111.2	L184 I185 F190 R191 R192 I201 I484 F488 F517	L184-L188 HydrophobicContact CD1-CD1 4.33Å; L184-L188 HydrophobicContact CD1-CG 4.17Å; L184-L188 HydrophobicContact CG-CD1 4.18Å; L184-L188 HydrophobicContact CG-CG 4.42Å; L184-L188 VanDerWaalsContact O-CG 3.31Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 3.42Å; I185-L188 PolarHBondContact O-N 3.06Å; L188-F190 VanDerWaalsContact C-N 3.31Å; L188-F190 PolarHBondContact O-N 3.33Å; L188-R191 PolarHBondContact O-N 3.32Å; L188-R192 WeakPolarHBondContact O-CB 3.29Å; L188-R192 PolarHBondContact O-N 2.91Å; L188-R192 VanDerWaalsContact O-N 3.12Å; L188-I201 HydrophobicContact CD2-CD1 3.45Å; L188-I201 VanDerWaalsContact CD2-CD1 3.45Å; L188-I484 HydrophobicContact CD1-CD1 4.4Å; L188-I484 HydrophobicContact CD1-CG1 4.27Å; L188-F488 HydrophobicContact CB-CZ 4.5Å; L188-F517 HydrophobicContact CD1-CE1 4.14Å; L188-F517 HydrophobicContact CD2-CZ 4.42Å
189	R	90.4	Very high	88.7	Confident	97 Å²	97	50.1 Å²	50.1	37%	0.366	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-42.7	173.8	-70.6	-175.8	168.3	132	3.6	112.4	I185 S186 K187 E487 F488 E519	I185-R189 WeakPolarHBondContact O-CG 3.46Å; I185-R189 PolarHBondContact O-N 3.24Å; S186-R189 PolarHBondContact O-N 3.1Å; K187-R189 PolarHBondContact O-N 2.91Å; R189-E487 IonicContact CZ-OE2 3.4Å; R189-E487 IonicContact NH2-OE2 3.48Å; R189-E487 PolarHBondContact NH2-OE2 3.36Å; R189-F488 HydrophobicContact CG-CE1 4.16Å; R189-F488 HydrophobicContact CG-CZ 3.69Å; R189-E519 IonicContact NE-OE1 3.66Å
190	F	88.1	Confident	88.6	Confident	142 Å²	142	51 Å²	51	62%	0.623	27%	0.268	S	S	*	.	H	α-helix	trans	-69.3	-39.6	-178.9	178.2	-99.3	0	0	0	113	S186 K187 L188 R192	S186-F190 PolarHBondContact O-N 3Å; K187-F190 PolarHBondContact O-N 3.28Å; L188-F190 VanDerWaalsContact C-N 3.31Å; L188-F190 PolarHBondContact O-N 3.33Å; F190-R192 VanDerWaalsContact C-N 3.33Å
191	R	86.3	Confident	88.5	Confident	94 Å²	94	51 Å²	51	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-79.6	-16.6	-177.5	-71.1	-62.7	-59.8	-111	5.9	113.9	K187 L188 V198 E204	K187-R191 HydrophobicContact CD-CG 4.22Å; K187-R191 HydrophobicContact CG-CG 4.3Å; K187-R191 WeakPolarHBondContact O-CB 3.43Å; K187-R191 WeakPolarHBondContact O-CG 3.34Å; K187-R191 PolarHBondContact O-N 3.22Å; L188-R191 PolarHBondContact O-N 3.32Å; R191-V198 HydrophobicContact CB-CG1 4.42Å; R191-E204 IonicContact CZ-OE1 3.76Å; R191-E204 IonicContact NE-OE1 3.45Å; R191-E204 IonicContact NH1-OE1 3.4Å; R191-E204 PolarHBondContact NH1-OE1 3.16Å; R191-E204 IonicContact NH2-OE1 3.55Å
192	R	86.4	Confident	88.3	Confident	65 Å²	65	51.3 Å²	51.3	25%	0.245	27%	0.27	C	S	.	.			trans	-63.7	130.9	-178.4	-167.7	177.3	68.8	179.5	-11.1	111.6	L188 F190 G196 V198 F517 E519	L188-R192 WeakPolarHBondContact O-CB 3.29Å; L188-R192 PolarHBondContact O-N 2.91Å; L188-R192 VanDerWaalsContact O-N 3.12Å; F190-R192 VanDerWaalsContact C-N 3.33Å; R192-G196 VanDerWaalsContact CG-C 3.41Å; R192-G196 WeakPolarHBondContact CG-O 3.45Å; R192-V198 HydrophobicContact CB-CG2 4.29Å; R192-F517 WeakPolarHBondContact CD-O 3.42Å; R192-F517 PolarHBondContact NH1-O 3.44Å; R192-F517 VanDerWaalsContact NH1-O 3.07Å; R192-E519 IonicContact CZ-OE1 2.84Å; R192-E519 IonicContact NH1-OE1 3.46Å; R192-E519 PolarHBondContact NH1-OE1 3.19Å; R192-E519 IonicContact NH2-OE1 3.64Å; R192-E519 PolarHBondContact NH2-OE1 3.43Å; R192-E519 IonicContact NH2-OE2 3.61Å
193	S	85	Confident	88.1	Confident	50 Å²	50	50.9 Å²	50.9	35%	0.35	27%	0.267	S	S	.	.			trans	-69.3	171	170.8	80.2	0	0	0	0	111.8	Q195 G196 L197	S193-Q195 PolarHBondContact O-N 3.14Å; S193-Q195 VanDerWaalsContact O-N 3.1Å; S193-Q195 PolarHBondContact OG-N 2.99Å; S193-G196 PolarHBondContact O-N 3.49Å; S193-L197 PolarHBondContact N-O 3.45Å; S193-L197 WeakPolarHBondContact OG-CB 3.49Å; S193-L197 PolarHBondContact OG-N 2.8Å; S193-L197 VanDerWaalsContact OG-N 3.11Å
194	S	78.8	Confident	88	Confident	131 Å²	131	48.5 Å²	48.5	92%	0.916	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.9	174.1	53.6	0	0	0	0	113.8
195	Q	79.1	Confident	88	Confident	146 Å²	146	48.5 Å²	48.5	68%	0.682	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	1.8	177.5	-66.3	179.7	-19.4	0	0	113.2	S193	S193-Q195 PolarHBondContact O-N 3.14Å; S193-Q195 VanDerWaalsContact O-N 3.1Å; S193-Q195 PolarHBondContact OG-N 2.99Å
196	G	84.1	Confident	87.9	Confident	6 Å²	6	49.3 Å²	49.3	6%	0.062	26%	0.257	C	S	.	.	S	Bend	trans	92.4	-1.7	-178.4	0	0	0	0	0	115	R192 S193 Q516 F517	R192-G196 VanDerWaalsContact CG-C 3.41Å; R192-G196 WeakPolarHBondContact CG-O 3.45Å; S193-G196 PolarHBondContact O-N 3.49Å; G196-Q516 CarbonylContact O-C 3.59Å; G196-Q516 VanDerWaalsContact O-CA 3.32Å; G196-Q516 WeakPolarHBondContact O-CA 3.48Å; G196-F517 PolarHBondContact O-N 3.48Å
197	L	89.6	Confident	87.8	Confident	37 Å²	37	47.6 Å²	47.6	19%	0.194	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132.7	-172.3	-170.6	67.9	0	0	0	112	S193 T199 N514 Q516	S193-L197 PolarHBondContact N-O 3.45Å; S193-L197 WeakPolarHBondContact OG-CB 3.49Å; S193-L197 PolarHBondContact OG-N 2.8Å; S193-L197 VanDerWaalsContact OG-N 3.11Å; L197-T199 HydrophobicContact CD2-CG2 4.24Å; L197-T199 HydrophobicContact CG-CG2 4.45Å; L197-N514 HydrophobicContact CD1-CB 4.16Å; L197-Q516 HydrophobicContact CD1-CG 3.86Å
198	V	89.1	Confident	88	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.4	166.3	-178.7	0	0	0	0	108.1	R191 R192 I201 N514 L515 F517	R191-V198 HydrophobicContact CB-CG1 4.42Å; R192-V198 HydrophobicContact CB-CG2 4.29Å; V198-I201 HydrophobicContact CB-CD1 4.29Å; V198-I201 HydrophobicContact CG1-CD1 3.72Å; V198-N514 WeakPolarHBondContact O-CA 3.38Å; V198-L515 PolarHBondContact N-O 3.35Å; V198-L515 PolarHBondContact O-N 3.39Å; V198-L515 VanDerWaalsContact O-N 3.16Å; V198-F517 HydrophobicContact CB-CD2 4.06Å; V198-F517 HydrophobicContact CB-CE2 4.1Å; V198-F517 HydrophobicContact CG2-CD2 3.69Å; V198-F517 HydrophobicContact CG2-CE2 4.13Å
199	T	88.1	Confident	88	Confident	74 Å²	74	47.1 Å²	47.1	45%	0.454	24%	0.238	S	C	.	.	S	Bend	trans	-85.9	139.5	179.2	56.9	0	0	0	0	111	L197 N514	L197-T199 HydrophobicContact CD2-CG2 4.24Å; L197-T199 HydrophobicContact CG-CG2 4.45Å; T199-N514 VanDerWaalsContact CA-OD1 3.31Å; T199-N514 WeakPolarHBondContact CA-OD1 3.47Å
200	D	88	Confident	88	Confident	63 Å²	63	42.5 Å²	42.5	34%	0.337	22%	0.221	S	C	.	.			trans	50.8	61	-178.8	-171.5	18	0	0	0	113.5	T202 S203 A512 I513 N514	D200-T202 PolarHBondContact O-N 3.47Å; D200-S203 PolarHBondContact O-N 3Å; D200-S203 PolarHBondContact O-OG 3.45Å; D200-S203 PolarHBondContact OD1-N 3.43Å; D200-S203 WeakPolarHBondContact OD2-CB 3.3Å; D200-A512 HydrophobicContact CB-CB 3.99Å; D200-I513 WeakPolarHBondContact CA-O 3.25Å; D200-I513 PolarHBondContact N-O 3.49Å; D200-N514 PolarHBondContact N-OD1 3.47Å; D200-N514 VanDerWaalsContact N-OD1 3.09Å
201	I	90.3	Very high	88.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-27.6	178.2	-162.8	66.9	0	0	0	112.1	L188 V198 S203 E204 F205 I513 L515 F517	L188-I201 HydrophobicContact CD2-CD1 3.45Å; L188-I201 VanDerWaalsContact CD2-CD1 3.45Å; V198-I201 HydrophobicContact CB-CD1 4.29Å; V198-I201 HydrophobicContact CG1-CD1 3.72Å; I201-S203 VanDerWaalsContact C-N 3.29Å; I201-S203 PolarHBondContact O-N 2.84Å; I201-E204 PolarHBondContact O-N 3.48Å; I201-E204 VanDerWaalsContact O-N 3.14Å; I201-F205 HydrophobicContact CB-CE2 4.26Å; I201-F205 HydrophobicContact CD1-CE1 4.45Å; I201-F205 HydrophobicContact CD1-CE2 4.31Å; I201-F205 HydrophobicContact CD1-CZ 3.98Å; I201-F205 HydrophobicContact CG1-CD2 3.93Å; I201-F205 HydrophobicContact CG1-CE1 4.23Å; I201-F205 HydrophobicContact CG1-CE2 3.29Å; I201-F205 HydrophobicContact CG1-CZ 3.42Å; I201-F205 VanDerWaalsContact CG1-CZ 3.42Å; I201-F205 HydrophobicContact CG2-CD2 4.38Å; I201-F205 HydrophobicContact CG2-CE2 4.04Å; I201-F205 WeakPolarHBondContact O-CD2 3.43Å; I201-F205 PolarHBondContact O-N 2.82Å; I201-I513 HydrophobicContact CG2-CB 3.92Å; I201-I513 HydrophobicContact CG2-CG2 3.72Å; I201-I513 WeakPolarHBondContact CG2-O 3.41Å; I201-I513 PolarHBondContact N-O 3.5Å; I201-L515 HydrophobicContact CG2-CD1 4.1Å; I201-L515 HydrophobicContact CG2-CG 4.48Å; I201-F517 HydrophobicContact CD1-CE2 3.69Å; I201-F517 HydrophobicContact CD1-CZ 3.78Å; I201-F517 HydrophobicContact CG1-CE2 4.3Å; I201-F517 HydrophobicContact CG1-CZ 4.21Å
202	T	88.6	Confident	88.3	Confident	7 Å²	7	31.3 Å²	31.3	4%	0.043	17%	0.174	C	C	.	.	H	α-helix	trans	-57.9	-43	178.3	-43	0	0	0	0	110.7	D200 E204 F205 Y206 P509	D200-T202 PolarHBondContact O-N 3.47Å; T202-E204 VanDerWaalsContact C-N 3.34Å; T202-E204 PolarHBondContact O-N 3.39Å; T202-F205 PolarHBondContact O-N 2.59Å; T202-Y206 HydrophobicContact CG2-CD2 4.06Å; T202-Y206 HydrophobicContact CG2-CE2 3.57Å; T202-Y206 WeakPolarHBondContact O-CD2 3.13Å; T202-Y206 PolarHBondContact O-N 3.44Å; T202-P509 HydrophobicContact CG2-CG 3.99Å
203	S	88.8	Confident	88.4	Confident	24 Å²	24	28.8 Å²	28.8	17%	0.168	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-40.3	176.5	72.8	0	0	0	0	113.1	D200 I201 F205 Y206 R207	D200-S203 PolarHBondContact O-N 3Å; D200-S203 PolarHBondContact O-OG 3.45Å; D200-S203 PolarHBondContact OD1-N 3.43Å; D200-S203 WeakPolarHBondContact OD2-CB 3.3Å; I201-S203 VanDerWaalsContact C-N 3.29Å; I201-S203 PolarHBondContact O-N 2.84Å; S203-F205 VanDerWaalsContact C-N 3.33Å; S203-Y206 WeakPolarHBondContact O-CB 3.4Å; S203-Y206 PolarHBondContact O-N 2.82Å; S203-R207 PolarHBondContact O-N 3.04Å
204	E	90.8	Very high	88.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.4	-35	177	-57.3	-59.6	174	0	0	111.2	R191 I201 T202 R207 F208	R191-E204 IonicContact CZ-OE1 3.76Å; R191-E204 IonicContact NE-OE1 3.45Å; R191-E204 IonicContact NH1-OE1 3.4Å; R191-E204 PolarHBondContact NH1-OE1 3.16Å; R191-E204 IonicContact NH2-OE1 3.55Å; I201-E204 PolarHBondContact O-N 3.48Å; I201-E204 VanDerWaalsContact O-N 3.14Å; T202-E204 VanDerWaalsContact C-N 3.34Å; T202-E204 PolarHBondContact O-N 3.39Å; E204-R207 PolarHBondContact O-N 3.25Å; E204-R207 IonicContact OE1-NH1 2.79Å; E204-R207 PolarHBondContact OE1-NH1 2.94Å; E204-R207 VanDerWaalsContact OE1-NH1 3.17Å; E204-R207 IonicContact OE2-CZ 2.73Å; E204-R207 IonicContact OE2-NH1 3.73Å; E204-R207 PolarHBondContact OE2-NH1 3.25Å; E204-F208 PolarHBondContact O-N 2.87Å
205	F	92.2	Very high	89	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-73.2	-26.5	174.2	-62.9	-37.5	0	0	0	113.9	L184 I201 T202 S203 F208 G209 S335 M338 S339 L342	L184-F205 HydrophobicContact CD1-CD1 4.34Å; L184-F205 HydrophobicContact CD1-CE1 4.27Å; L184-F205 HydrophobicContact CD2-CE1 4.24Å; I201-F205 HydrophobicContact CB-CE2 4.26Å; I201-F205 HydrophobicContact CD1-CE1 4.45Å; I201-F205 HydrophobicContact CD1-CE2 4.31Å; I201-F205 HydrophobicContact CD1-CZ 3.98Å; I201-F205 HydrophobicContact CG1-CD2 3.93Å; I201-F205 HydrophobicContact CG1-CE1 4.23Å; I201-F205 HydrophobicContact CG1-CE2 3.29Å; I201-F205 HydrophobicContact CG1-CZ 3.42Å; I201-F205 VanDerWaalsContact CG1-CZ 3.42Å; I201-F205 HydrophobicContact CG2-CD2 4.38Å; I201-F205 HydrophobicContact CG2-CE2 4.04Å; I201-F205 WeakPolarHBondContact O-CD2 3.43Å; I201-F205 PolarHBondContact O-N 2.82Å; T202-F205 PolarHBondContact O-N 2.59Å; S203-F205 VanDerWaalsContact C-N 3.33Å; F205-F208 PolarHBondContact O-N 2.83Å; F205-G209 PolarHBondContact O-N 3.16Å; F205-S335 VanDerWaalsContact O-CB 3.3Å; F205-S335 WeakPolarHBondContact O-CB 3.41Å; F205-M338 HydrophobicContact CB-CB 4.34Å; F205-M338 HydrophobicContact CD1-CB 4.18Å; F205-M338 HydrophobicContact CD2-CB 3.71Å; F205-M338 HydrophobicContact CE1-CB 4.46Å; F205-M338 HydrophobicContact CE1-CE 4.08Å; F205-M338 HydrophobicContact CE2-CB 3.98Å; F205-M338 HydrophobicContact CG-CB 3.83Å; F205-M338 HydrophobicContact CZ-CB 4.39Å; F205-M338 HydrophobicContact CZ-CE 4.32Å; F205-S339 WeakPolarHBondContact CD2-OG 3.28Å; F205-L342 HydrophobicContact CE1-CD1 4.33Å; F205-L342 HydrophobicContact CE2-CD1 3.68Å; F205-L342 HydrophobicContact CZ-CD1 3.28Å
206	Y	90.4	Very high	89.3	Confident	22 Å²	22	13.5 Å²	13.5	9%	0.086	8%	0.075	C	C	.	.	H	α-helix	trans	-62.2	-44.4	168	-81.9	-71.7	0	0	0	111.1	T202 S203 G209 L210 I237 V331 D332 S335 R504	T202-Y206 HydrophobicContact CG2-CD2 4.06Å; T202-Y206 HydrophobicContact CG2-CE2 3.57Å; T202-Y206 WeakPolarHBondContact O-CD2 3.13Å; T202-Y206 PolarHBondContact O-N 3.44Å; S203-Y206 WeakPolarHBondContact O-CB 3.4Å; S203-Y206 PolarHBondContact O-N 2.82Å; Y206-G209 PolarHBondContact O-N 3.24Å; Y206-L210 WeakPolarHBondContact O-CB 3.47Å; Y206-L210 PolarHBondContact O-N 2.95Å; Y206-I237 HydrophobicContact CD1-CG2 4.46Å; Y206-I237 HydrophobicContact CG-CG2 4.39Å; Y206-V331 HydrophobicContact CD1-CG1 4Å; Y206-D332 HydrophobicContact CE1-CB 4.1Å; Y206-D332 WeakPolarHBondContact CE1-OD1 3.1Å; Y206-S335 VanDerWaalsContact CD1-OG 3.29Å; Y206-S335 WeakPolarHBondContact CD1-OG 3.49Å; Y206-S335 VanDerWaalsContact CE1-OG 3.26Å; Y206-S335 WeakPolarHBondContact CE1-OG 3.45Å; Y206-R504 PolarHBondContact OH-NH2 3.07Å
207	R	90.7	Very high	89.3	Confident	30 Å²	30	13.2 Å²	13.2	11%	0.113	7%	0.072	C	C	.	.	H	α-helix	trans	-64.5	-41.3	175.8	-66.1	173.5	-175.1	118.3	2.2	111.7	S203 E204 L210 E211 C224 L225 E234 I237	S203-R207 PolarHBondContact O-N 3.04Å; E204-R207 PolarHBondContact O-N 3.25Å; E204-R207 IonicContact OE1-NH1 2.79Å; E204-R207 PolarHBondContact OE1-NH1 2.94Å; E204-R207 VanDerWaalsContact OE1-NH1 3.17Å; E204-R207 IonicContact OE2-CZ 2.73Å; E204-R207 IonicContact OE2-NH1 3.73Å; E204-R207 PolarHBondContact OE2-NH1 3.25Å; R207-L210 PolarHBondContact O-N 2.83Å; R207-E211 WeakPolarHBondContact O-CB 3.32Å; R207-E211 PolarHBondContact O-N 3.4Å; R207-C224 HydrophobicContact CB-CB 3.96Å; R207-C224 WeakPolarHBondContact CD-O 3.42Å; R207-C224 WeakPolarHBondContact O-CB 3.49Å; R207-L225 HydrophobicContact CB-CD2 4.2Å; R207-E234 IonicContact NH2-OE1 3.63Å; R207-E234 PolarHBondContact NH2-OE1 2.86Å; R207-E234 VanDerWaalsContact NH2-OE1 3.13Å; R207-I237 HydrophobicContact CG-CD1 4.06Å
208	F	92.1	Very high	88.7	Confident	1 Å²	1	11.4 Å²	11.4	0%	0.004	6%	0.062	C	C	.	.	H	α-helix	trans	-60.3	-51.5	174.6	174.1	-109.7	0	0	0	112.1	V180 V181 L184 E204 F205 L210 E211 G212 L225 I334 E476 A480	V180-F208 HydrophobicContact CG1-CD2 3.79Å; V180-F208 HydrophobicContact CG1-CE2 3.72Å; V181-F208 HydrophobicContact CG2-CE2 3.87Å; V181-F208 HydrophobicContact CG2-CZ 3.89Å; L184-F208 HydrophobicContact CB-CD2 3.83Å; L184-F208 HydrophobicContact CB-CE2 4.21Å; L184-F208 HydrophobicContact CD1-CB 4.21Å; L184-F208 HydrophobicContact CD1-CD2 4.4Å; L184-F208 HydrophobicContact CD1-CG 4.43Å; L184-F208 HydrophobicContact CD2-CD1 4.28Å; L184-F208 HydrophobicContact CD2-CD2 3.65Å; L184-F208 HydrophobicContact CD2-CE1 4.46Å; L184-F208 HydrophobicContact CD2-CE2 3.85Å; L184-F208 HydrophobicContact CD2-CG 3.88Å; L184-F208 HydrophobicContact CD2-CZ 4.27Å; L184-F208 HydrophobicContact CG-CD2 4.16Å; E204-F208 PolarHBondContact O-N 2.87Å; F205-F208 PolarHBondContact O-N 2.83Å; F208-L210 VanDerWaalsContact C-N 3.28Å; F208-L210 PolarHBondContact O-N 3.3Å; F208-E211 PolarHBondContact O-N 2.94Å; F208-G212 PolarHBondContact O-N 3.25Å; F208-L225 HydrophobicContact CB-CD2 4.33Å; F208-L225 HydrophobicContact CD2-CD1 4.26Å; F208-I334 HydrophobicContact CD1-CG2 4.29Å; F208-I334 HydrophobicContact CE1-CG2 4.15Å; F208-E476 HydrophobicContact CE1-CG 3.89Å; F208-E476 HydrophobicContact CZ-CG 3.86Å; F208-A480 HydrophobicContact CE1-CB 4.07Å; F208-A480 HydrophobicContact CZ-CB 3.8Å
209	G	90.8	Very high	88	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.8	-37.8	179.5	0	0	0	0	0	112.2	F205 Y206 I213	F205-G209 PolarHBondContact O-N 3.16Å; Y206-G209 PolarHBondContact O-N 3.24Å; G209-I213 WeakPolarHBondContact O-CG2 3.27Å; G209-I213 PolarHBondContact O-N 3.22Å
210	L	91.1	Very high	87.3	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.1	-45.7	174.7	-178.2	57.4	0	0	0	112.6	Y206 R207 F208 G212 S214 T233 F236 I237 L327 V331	Y206-L210 WeakPolarHBondContact O-CB 3.47Å; Y206-L210 PolarHBondContact O-N 2.95Å; R207-L210 PolarHBondContact O-N 2.83Å; F208-L210 VanDerWaalsContact C-N 3.28Å; F208-L210 PolarHBondContact O-N 3.3Å; L210-G212 VanDerWaalsContact C-N 3.35Å; L210-S214 WeakPolarHBondContact O-CB 3.5Å; L210-S214 PolarHBondContact O-N 2.71Å; L210-S214 PolarHBondContact O-OG 3.46Å; L210-T233 HydrophobicContact CD2-CG2 3.45Å; L210-T233 VanDerWaalsContact CD2-CG2 3.45Å; L210-F236 HydrophobicContact CD1-CD1 3.79Å; L210-F236 HydrophobicContact CD1-CE1 3.69Å; L210-F236 HydrophobicContact CD2-CD1 3.96Å; L210-I237 HydrophobicContact CD2-CD1 4.01Å; L210-I237 HydrophobicContact CD2-CG1 3.78Å; L210-L327 HydrophobicContact CD1-CD1 3.56Å; L210-L327 HydrophobicContact CD1-CG 4.35Å; L210-V331 HydrophobicContact CB-CG1 4.4Å; L210-V331 HydrophobicContact CB-CG2 3.96Å; L210-V331 HydrophobicContact CD1-CG2 3.72Å; L210-V331 HydrophobicContact CG-CG2 4.43Å
211	E	91.1	Very high	86.9	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.1	-41.8	177.8	-168.2	70.4	-165.3	0	0	111.2	V180 R207 F208 S215 R221 I222 G223 C224 L225	V180-E211 HydrophobicContact CG1-CB 3.94Å; V180-E211 HydrophobicContact CG1-CG 3.8Å; V180-E211 HydrophobicContact CG2-CG 4.13Å; R207-E211 WeakPolarHBondContact O-CB 3.32Å; R207-E211 PolarHBondContact O-N 3.4Å; F208-E211 PolarHBondContact O-N 2.94Å; E211-S215 VanDerWaalsContact O-CB 3.25Å; E211-S215 WeakPolarHBondContact O-CB 3.28Å; E211-S215 PolarHBondContact O-N 3.4Å; E211-S215 PolarHBondContact O-OG 3.46Å; E211-R221 WeakPolarHBondContact OE1-CA 3.1Å; E211-R221 WeakPolarHBondContact OE1-CB 3.15Å; E211-R221 IonicContact OE1-CZ 2.74Å; E211-R221 IonicContact OE1-NE 3.14Å; E211-R221 PolarHBondContact OE1-NE 3.41Å; E211-R221 IonicContact OE1-NH2 3.23Å; E211-R221 PolarHBondContact OE1-NH2 3.24Å; E211-I222 PolarHBondContact OE1-N 2.99Å; E211-I222 PolarHBondContact OE2-N 2.85Å; E211-G223 PolarHBondContact OE1-N 3.44Å; E211-G223 PolarHBondContact OE2-N 3.47Å; E211-C224 HydrophobicContact CB-CB 4.15Å; E211-C224 WeakPolarHBondContact OE2-CB 2.98Å; E211-C224 PolarHBondContact OE2-N 3.04Å; E211-C224 PolarHBondContact OE2-SG 2.75Å; E211-L225 HydrophobicContact CB-CD1 4.18Å; E211-L225 HydrophobicContact CB-CG 4.25Å; E211-L225 HydrophobicContact CG-CD1 4.09Å; E211-L225 HydrophobicContact CG-CG 4.32Å
212	G	89.5	Confident	86.5	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.3	-56	179.6	0	0	0	0	0	112.4	F208 L210 S214 S215 V216 E476	F208-G212 PolarHBondContact O-N 3.25Å; L210-G212 VanDerWaalsContact C-N 3.35Å; G212-S214 VanDerWaalsContact C-N 3.31Å; G212-S214 PolarHBondContact O-N 3.31Å; G212-S215 PolarHBondContact O-N 2.97Å; G212-V216 WeakPolarHBondContact O-CG2 2.91Å; G212-V216 PolarHBondContact O-N 2.88Å; G212-V216 VanDerWaalsContact O-N 3.08Å; G212-E476 WeakPolarHBondContact CA-OE1 3.41Å
213	I	88.9	Confident	86.1	Confident	13 Å²	13	14.7 Å²	14.7	7%	0.067	7%	0.068	C	C	.	.	H	α-helix	trans	-64.8	-36.2	179.2	-167	59.2	0	0	0	111.9	G209 V216 L217 L327 V331	G209-I213 WeakPolarHBondContact O-CG2 3.27Å; G209-I213 PolarHBondContact O-N 3.22Å; I213-V216 PolarHBondContact O-N 2.61Å; I213-L217 HydrophobicContact CD1-CD1 4.16Å; I213-L217 HydrophobicContact CD1-CG 4.12Å; I213-L217 HydrophobicContact CG1-CD1 3.67Å; I213-L217 HydrophobicContact CG1-CG 4.07Å; I213-L217 WeakPolarHBondContact O-CB 3.45Å; I213-L217 VanDerWaalsContact O-CG 3.24Å; I213-L217 WeakPolarHBondContact O-CG 3.18Å; I213-L217 PolarHBondContact O-N 2.86Å; I213-L327 HydrophobicContact CG2-CD1 3.45Å; I213-L327 VanDerWaalsContact CG2-CD1 3.45Å; I213-V331 HydrophobicContact CG2-CG2 4.17Å
214	S	88.6	Confident	85.6	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-67.4	-38.4	177.3	-63.6	0	0	0	0	112.1	L210 G212 V216 L217 F218 I222 L327	L210-S214 WeakPolarHBondContact O-CB 3.5Å; L210-S214 PolarHBondContact O-N 2.71Å; L210-S214 PolarHBondContact O-OG 3.46Å; G212-S214 VanDerWaalsContact C-N 3.31Å; G212-S214 PolarHBondContact O-N 3.31Å; S214-V216 VanDerWaalsContact C-N 3.27Å; S214-V216 PolarHBondContact O-N 3.43Å; S214-L217 PolarHBondContact O-N 3.24Å; S214-F218 WeakPolarHBondContact O-CB 3.4Å; S214-F218 WeakPolarHBondContact O-CD2 3.44Å; S214-F218 PolarHBondContact O-N 3.47Å; S214-I222 WeakPolarHBondContact OG-CD1 3.46Å; S214-L327 WeakPolarHBondContact OG-CD1 3.31Å
215	S	86.5	Confident	85.1	Confident	3 Å²	3	13.9 Å²	13.9	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-64.7	-34.1	174.5	-59.7	0	0	0	0	111.4	E211 G212 E219	E211-S215 VanDerWaalsContact O-CB 3.25Å; E211-S215 WeakPolarHBondContact O-CB 3.28Å; E211-S215 PolarHBondContact O-N 3.4Å; E211-S215 PolarHBondContact O-OG 3.46Å; G212-S215 PolarHBondContact O-N 2.97Å; S215-E219 WeakPolarHBondContact O-CA 3.41Å; S215-E219 PolarHBondContact O-N 2.99Å
216	V	85.5	Confident	84.6	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.012	8%	0.082	C	C	.	.	H	α-helix	trans	-75.3	-41.1	175.3	172.2	0	0	0	0	112.4	Y173 L177 G212 I213 S214 I472	Y173-V216 HydrophobicContact CD1-CG1 4.23Å; Y173-V216 HydrophobicContact CD1-CG2 4.26Å; Y173-V216 HydrophobicContact CD2-CG1 4.45Å; Y173-V216 HydrophobicContact CE1-CG1 4.07Å; Y173-V216 HydrophobicContact CE2-CG1 4.3Å; Y173-V216 HydrophobicContact CG-CG1 4.43Å; Y173-V216 HydrophobicContact CG-CG2 4.29Å; L177-V216 HydrophobicContact CD2-CG2 3.96Å; L177-V216 HydrophobicContact CG-CG2 4.45Å; G212-V216 WeakPolarHBondContact O-CG2 2.91Å; G212-V216 PolarHBondContact O-N 2.88Å; G212-V216 VanDerWaalsContact O-N 3.08Å; I213-V216 PolarHBondContact O-N 2.61Å; S214-V216 VanDerWaalsContact C-N 3.27Å; S214-V216 PolarHBondContact O-N 3.43Å; V216-I472 HydrophobicContact CG1-CD1 4Å; V216-I472 HydrophobicContact CG1-CG2 4.44Å; V216-I472 HydrophobicContact CG2-CG2 4.19Å
217	L	83.8	Confident	83.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-78.6	-36.6	-174.9	-70.1	176.4	0	0	0	113.2	I213 S214 Y304 L305 T306 V323 L326 L327	I213-L217 HydrophobicContact CD1-CD1 4.16Å; I213-L217 HydrophobicContact CD1-CG 4.12Å; I213-L217 HydrophobicContact CG1-CD1 3.67Å; I213-L217 HydrophobicContact CG1-CG 4.07Å; I213-L217 WeakPolarHBondContact O-CB 3.45Å; I213-L217 VanDerWaalsContact O-CG 3.24Å; I213-L217 WeakPolarHBondContact O-CG 3.18Å; I213-L217 PolarHBondContact O-N 2.86Å; S214-L217 PolarHBondContact O-N 3.24Å; L217-Y304 WeakPolarHBondContact O-CD2 3.26Å; L217-L305 HydrophobicContact CD2-CB 4.24Å; L217-L305 HydrophobicContact CD2-CD2 3.57Å; L217-T306 PolarHBondContact O-OG1 3.16Å; L217-V323 HydrophobicContact CB-CG1 4.38Å; L217-V323 HydrophobicContact CD1-CG1 4.16Å; L217-L326 HydrophobicContact CD1-CB 4.05Å; L217-L326 HydrophobicContact CD2-CB 4.09Å; L217-L326 HydrophobicContact CD2-CD1 3.94Å; L217-L327 HydrophobicContact CD1-CB 3.97Å; L217-L327 HydrophobicContact CD1-CD1 4.47Å
218	F	78.9	Confident	83.1	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-118.4	-9.8	-171.9	-48.8	-58	0	0	0	113.8	S214 S220 H282 I283 R286 V323 L327	S214-F218 WeakPolarHBondContact O-CB 3.4Å; S214-F218 WeakPolarHBondContact O-CD2 3.44Å; S214-F218 PolarHBondContact O-N 3.47Å; F218-S220 VanDerWaalsContact CB-OG 3.31Å; F218-S220 WeakPolarHBondContact CB-OG 3.46Å; F218-S220 PolarHBondContact O-N 3.08Å; F218-S220 VanDerWaalsContact O-N 3.17Å; F218-H282 HydrophobicContact CD1-CB 4.22Å; F218-H282 HydrophobicContact CD2-CB 4.22Å; F218-H282 HydrophobicContact CE1-CB 4.18Å; F218-H282 HydrophobicContact CE2-CB 4.22Å; F218-H282 HydrophobicContact CG-CB 4.24Å; F218-H282 HydrophobicContact CZ-CB 4.2Å; F218-I283 HydrophobicContact CD1-CG1 4.11Å; F218-I283 HydrophobicContact CE1-CD1 4.24Å; F218-I283 HydrophobicContact CE1-CG1 3.68Å; F218-R286 HydrophobicContact CB-CG 4.46Å; F218-R286 VanDerWaalsContact O-CD 3.27Å; F218-R286 WeakPolarHBondContact O-CD 2.86Å; F218-R286 PolarHBondContact O-NE 3.38Å; F218-R286 PolarHBondContact O-NH1 3.18Å; F218-V323 HydrophobicContact CD1-CG1 4.35Å; F218-V323 HydrophobicContact CE1-CG1 3.35Å; F218-V323 HydrophobicContact CZ-CG1 3.68Å; F218-L327 HydrophobicContact CE2-CD2 4.37Å; F218-L327 HydrophobicContact CZ-CD2 4.31Å
219	E	74.2	Confident	82.5	Confident	89 Å²	89	27.3 Å²	27.3	42%	0.416	15%	0.146	S	C	.	.	S	Bend	trans	56.7	22.6	-166.3	-155.2	173.1	-170.7	0	0	112.4	S215 R286 Y304	S215-E219 WeakPolarHBondContact O-CA 3.41Å; S215-E219 PolarHBondContact O-N 2.99Å; E219-R286 PolarHBondContact O-NH1 3.02Å; E219-R286 PolarHBondContact O-NH2 3.25Å; E219-Y304 HydrophobicContact CB-CD1 3.82Å; E219-Y304 HydrophobicContact CB-CE1 4.47Å; E219-Y304 HydrophobicContact CB-CG 4.01Å; E219-Y304 WeakPolarHBondContact OE2-CD1 3.21Å
220	S	73.1	Confident	82.2	Confident	4 Å²	4	29.6 Å²	29.6	3%	0.028	16%	0.161	C	C	.	.			trans	-112	131.9	-174.7	73.4	0	0	0	0	111.9	F218	F218-S220 VanDerWaalsContact CB-OG 3.31Å; F218-S220 WeakPolarHBondContact CB-OG 3.46Å; F218-S220 PolarHBondContact O-N 3.08Å; F218-S220 VanDerWaalsContact O-N 3.17Å
221	R	79.8	Confident	81.8	Confident	97 Å²	97	37.6 Å²	37.6	37%	0.366	20%	0.199	S	C	.	.			trans	-77.8	119.9	163.1	-54.4	-53.7	-54.7	-86.2	-21.9	108	S179 D183 E211	S179-R221 PolarHBondContact OG-NH1 3.43Å; D183-R221 IonicContact OD2-CZ 2.88Å; D183-R221 IonicContact OD2-NH1 3.35Å; D183-R221 PolarHBondContact OD2-NH1 2.69Å; D183-R221 IonicContact OD2-NH2 3Å; D183-R221 PolarHBondContact OD2-NH2 2.88Å; E211-R221 WeakPolarHBondContact OE1-CA 3.1Å; E211-R221 WeakPolarHBondContact OE1-CB 3.15Å; E211-R221 IonicContact OE1-CZ 2.74Å; E211-R221 IonicContact OE1-NE 3.14Å; E211-R221 PolarHBondContact OE1-NE 3.41Å; E211-R221 IonicContact OE1-NH2 3.23Å; E211-R221 PolarHBondContact OE1-NH2 3.24Å
222	I	80.9	Confident	81.5	Confident	19 Å²	19	43.6 Å²	43.6	10%	0.097	23%	0.227	C	C	.	.			trans	-87.6	-18.7	178.9	-60	-167.4	0	0	0	109.9	E211 S214 T233 F278	E211-I222 PolarHBondContact OE1-N 2.99Å; E211-I222 PolarHBondContact OE2-N 2.85Å; S214-I222 WeakPolarHBondContact OG-CD1 3.46Å; I222-T233 HydrophobicContact CG2-CG2 4.47Å; I222-T233 WeakPolarHBondContact CG2-OG1 3.45Å; I222-F278 HydrophobicContact CD1-CE1 3.99Å; I222-F278 HydrophobicContact CD1-CZ 3.79Å; I222-F278 HydrophobicContact CG2-CZ 4.23Å
223	G	79.8	Confident	81.1	Confident	5 Å²	5	43.6 Å²	43.6	5%	0.052	23%	0.227	C	C	.	.			trans	85.8	21.7	178.7	0	0	0	0	0	112.5	E211 L225 D226	E211-G223 PolarHBondContact OE1-N 3.44Å; E211-G223 PolarHBondContact OE2-N 3.47Å; G223-L225 PolarHBondContact O-N 3.34Å; G223-L225 VanDerWaalsContact O-N 3.15Å; G223-D226 WeakPolarHBondContact CA-OD2 3.49Å; G223-D226 WeakPolarHBondContact O-CB 3.17Å; G223-D226 PolarHBondContact O-N 3.5Å; G223-D226 VanDerWaalsContact O-N 3.15Å
224	C	79.4	Confident	80.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.4	-179.5	-46	0	0	0	0	112.3	R207 E211 T233	R207-C224 HydrophobicContact CB-CB 3.96Å; R207-C224 WeakPolarHBondContact CD-O 3.42Å; R207-C224 WeakPolarHBondContact O-CB 3.49Å; E211-C224 HydrophobicContact CB-CB 4.15Å; E211-C224 WeakPolarHBondContact OE2-CB 2.98Å; E211-C224 PolarHBondContact OE2-N 3.04Å; E211-C224 PolarHBondContact OE2-SG 2.75Å; C224-T233 HydrophobicContact CB-CG2 3.94Å; C224-T233 WeakPolarHBondContact SG-CG2 3.04Å
225	L	80.8	Confident	80.9	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.037	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	0.6	-177.7	-60.9	176	0	0	0	112.9	V180 D183 L184 R207 F208 E211 G223	V180-L225 HydrophobicContact CG1-CD1 3.74Å; V180-L225 WeakPolarHBondContact O-CD1 3.43Å; D183-L225 HydrophobicContact CB-CB 4.04Å; D183-L225 HydrophobicContact CB-CD1 3.96Å; L184-L225 HydrophobicContact CB-CD1 4.34Å; R207-L225 HydrophobicContact CB-CD2 4.2Å; F208-L225 HydrophobicContact CB-CD2 4.33Å; F208-L225 HydrophobicContact CD2-CD1 4.26Å; E211-L225 HydrophobicContact CB-CD1 4.18Å; E211-L225 HydrophobicContact CB-CG 4.25Å; E211-L225 HydrophobicContact CG-CD1 4.09Å; E211-L225 HydrophobicContact CG-CG 4.32Å; G223-L225 PolarHBondContact O-N 3.34Å; G223-L225 VanDerWaalsContact O-N 3.15Å
226	D	81.9	Confident	80.9	Confident	81 Å²	81	53.6 Å²	53.6	43%	0.433	27%	0.267	S	S	.	.	S	Bend	trans	-70.5	160.7	177.4	-70.3	-29.6	0	0	0	111.5	K187 G223 V228	K187-D226 PolarHBondContact NZ-O 2.77Å; G223-D226 WeakPolarHBondContact CA-OD2 3.49Å; G223-D226 WeakPolarHBondContact O-CB 3.17Å; G223-D226 PolarHBondContact O-N 3.5Å; G223-D226 VanDerWaalsContact O-N 3.15Å; D226-V228 PolarHBondContact O-N 2.84Å
227	P	72.6	Confident	81	Confident	95 Å²	95	54.4 Å²	54.4	62%	0.617	27%	0.271	S	S	*	.	S	Bend	trans	-57.8	-38.2	176.2	-25.9	35.2	0	0	0	112.9
228	V	76.2	Confident	81.2	Confident	125 Å²	125	60.4 Å²	60.4	76%	0.758	30%	0.299	S	S	*	.	S	Bend	trans	-108.2	113.3	175.4	-178.8	0	0	0	0	108.1	D226	D226-V228 PolarHBondContact O-N 2.84Å
229	I	79.6	Confident	81.7	Confident	33 Å²	33	61 Å²	61	17%	0.169	30%	0.303	C	S	.	.			trans	-86	133.9	-176.2	-58.8	150.2	0	0	0	108.7	E231 T233 E234	I229-E231 PolarHBondContact O-N 2.75Å; I229-T233 HydrophobicContact CG2-CG2 4.48Å; I229-E234 HydrophobicContact CB-CG 4.45Å; I229-E234 HydrophobicContact CG2-CG 3.65Å
230	P	83.8	Confident	82.4	Confident	49 Å²	49	56.7 Å²	56.7	32%	0.318	28%	0.283	S	S	.	.			trans	-63	134.3	173.7	-21.7	33.1	0	0	0	111.9	E232 T233 E234	P230-E232 PolarHBondContact O-N 3.15Å; P230-T233 WeakPolarHBondContact O-CB 3.39Å; P230-T233 PolarHBondContact O-N 3.05Å; P230-E234 PolarHBondContact O-N 3.26Å
231	E	83.9	Confident	83	Confident	168 Å²	168	58.1 Å²	58.1	79%	0.785	29%	0.29	S	S	*	.	H	α-helix	trans	-57.3	-35	179.8	-171.1	-179.5	171.7	0	0	112.2	I229 T233 E234 R235	I229-E231 PolarHBondContact O-N 2.75Å; E231-T233 PolarHBondContact O-N 3.23Å; E231-E234 PolarHBondContact O-N 3.26Å; E231-R235 WeakPolarHBondContact O-CB 3.13Å; E231-R235 PolarHBondContact O-N 3.02Å
232	E	83.4	Confident	83.4	Confident	125 Å²	125	55.5 Å²	55.5	58%	0.584	29%	0.285	S	S	*	.	H	α-helix	trans	-59.8	-35.4	177.3	-63.1	-178.1	171.3	0	0	112.6	P230 F236 Y274 F278	P230-E232 PolarHBondContact O-N 3.15Å; E232-F236 WeakPolarHBondContact O-CB 3.31Å; E232-F236 PolarHBondContact O-N 2.99Å; E232-Y274 WeakPolarHBondContact CA-OH 3.13Å; E232-Y274 PolarHBondContact O-OH 3.09Å; E232-F278 HydrophobicContact CB-CE2 4.45Å
233	T	81.6	Confident	83.8	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-72.5	-44.2	-178.9	-59.6	0	0	0	0	111.2	L210 I222 C224 I229 P230 E231 R235 F236 I237	L210-T233 HydrophobicContact CD2-CG2 3.45Å; L210-T233 VanDerWaalsContact CD2-CG2 3.45Å; I222-T233 HydrophobicContact CG2-CG2 4.47Å; I222-T233 WeakPolarHBondContact CG2-OG1 3.45Å; C224-T233 HydrophobicContact CB-CG2 3.94Å; C224-T233 WeakPolarHBondContact SG-CG2 3.04Å; I229-T233 HydrophobicContact CG2-CG2 4.48Å; P230-T233 WeakPolarHBondContact O-CB 3.39Å; P230-T233 PolarHBondContact O-N 3.05Å; E231-T233 PolarHBondContact O-N 3.23Å; T233-R235 VanDerWaalsContact C-N 3.34Å; T233-F236 WeakPolarHBondContact O-CB 3.35Å; T233-F236 PolarHBondContact O-N 2.68Å; T233-I237 WeakPolarHBondContact O-CG1 3.3Å; T233-I237 PolarHBondContact O-N 2.67Å; T233-I237 VanDerWaalsContact O-N 3.09Å
234	E	84.8	Confident	84.1	Confident	86 Å²	86	55 Å²	55	40%	0.402	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-42.2	178.4	-62.6	-157.9	140.3	0	0	111	R207 I229 P230 E231 F236 I237 E238	R207-E234 IonicContact NH2-OE1 3.63Å; R207-E234 PolarHBondContact NH2-OE1 2.86Å; R207-E234 VanDerWaalsContact NH2-OE1 3.13Å; I229-E234 HydrophobicContact CB-CG 4.45Å; I229-E234 HydrophobicContact CG2-CG 3.65Å; P230-E234 PolarHBondContact O-N 3.26Å; E231-E234 PolarHBondContact O-N 3.26Å; E234-F236 PolarHBondContact O-N 2.89Å; E234-I237 PolarHBondContact O-N 2.69Å; E234-E238 PolarHBondContact O-N 3.27Å
235	R	87.9	Confident	84.3	Confident	140 Å²	140	58 Å²	58	53%	0.528	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-33.8	174.4	-172.1	174.3	173.5	-171.1	-4.2	112.4	E231 T233 S239 Y274	E231-R235 WeakPolarHBondContact O-CB 3.13Å; E231-R235 PolarHBondContact O-N 3.02Å; T233-R235 VanDerWaalsContact C-N 3.34Å; R235-S239 VanDerWaalsContact O-CB 3.31Å; R235-S239 WeakPolarHBondContact O-CB 3.36Å; R235-S239 PolarHBondContact O-N 3.44Å; R235-S239 PolarHBondContact O-OG 3.04Å; R235-Y274 HydrophobicContact CB-CE1 3.96Å; R235-Y274 HydrophobicContact CG-CD1 4.2Å; R235-Y274 HydrophobicContact CG-CE1 3.74Å; R235-Y274 HydrophobicContact CG-CE2 4.22Å
236	F	87.7	Confident	84.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.2	-46.7	175.1	-175.1	-97.2	0	0	0	111.6	L210 E232 T233 E234 E238 S239 I240 Y274 M275 F278 L327	L210-F236 HydrophobicContact CD1-CD1 3.79Å; L210-F236 HydrophobicContact CD1-CE1 3.69Å; L210-F236 HydrophobicContact CD2-CD1 3.96Å; E232-F236 WeakPolarHBondContact O-CB 3.31Å; E232-F236 PolarHBondContact O-N 2.99Å; T233-F236 WeakPolarHBondContact O-CB 3.35Å; T233-F236 PolarHBondContact O-N 2.68Å; E234-F236 PolarHBondContact O-N 2.89Å; F236-E238 VanDerWaalsContact C-N 3.34Å; F236-E238 PolarHBondContact O-N 3.37Å; F236-S239 WeakPolarHBondContact O-CB 3.36Å; F236-S239 PolarHBondContact O-N 2.94Å; F236-I240 HydrophobicContact CD1-CD1 3.76Å; F236-I240 HydrophobicContact CD1-CG1 4.47Å; F236-I240 HydrophobicContact CE1-CD1 3.27Å; F236-I240 HydrophobicContact CE1-CG1 4.12Å; F236-I240 HydrophobicContact CZ-CD1 3.89Å; F236-I240 HydrophobicContact CZ-CG1 4.37Å; F236-I240 WeakPolarHBondContact O-CG1 3.41Å; F236-I240 PolarHBondContact O-N 3.33Å; F236-Y274 HydrophobicContact CB-CE1 3.98Å; F236-Y274 HydrophobicContact CD2-CE1 4.44Å; F236-M275 HydrophobicContact CD2-CB 4.44Å; F236-M275 HydrophobicContact CD2-CG 4.05Å; F236-M275 HydrophobicContact CE2-CB 3.78Å; F236-M275 HydrophobicContact CE2-CG 3.62Å; F236-M275 HydrophobicContact CZ-CG 4.24Å; F236-F278 HydrophobicContact CB-CD2 4.36Å; F236-F278 HydrophobicContact CB-CE2 4.37Å; F236-F278 HydrophobicContact CD1-CE1 4.41Å; F236-F278 HydrophobicContact CD2-CB 3.74Å; F236-F278 AromaticContact CD2-CD1 3.5Å; F236-F278 HydrophobicContact CD2-CD1 3.5Å; F236-F278 VanDerWaalsContact CD2-CD1 3.5Å; F236-F278 HydrophobicContact CD2-CD2 4.18Å; F236-F278 HydrophobicContact CD2-CE1 4.11Å; F236-F278 AromaticContact CD2-CG 3.53Å; F236-F278 HydrophobicContact CD2-CG 3.53Å; F236-F278 HydrophobicContact CE2-CB 4.06Å; F236-F278 AromaticContact CE2-CD1 3.6Å; F236-F278 HydrophobicContact CE2-CD1 3.6Å; F236-F278 HydrophobicContact CE2-CE1 4.31Å; F236-F278 HydrophobicContact CE2-CG 4Å; F236-F278 HydrophobicContact CG-CD1 4.03Å; F236-F278 HydrophobicContact CG-CD2 4.47Å; F236-F278 HydrophobicContact CG-CE1 4.17Å; F236-F278 HydrophobicContact CG-CG 4.17Å; F236-F278 HydrophobicContact CG-CZ 4.44Å; F236-F278 HydrophobicContact CZ-CD1 4.23Å; F236-L327 HydrophobicContact CE1-CD1 4.36Å; F236-L327 HydrophobicContact CE1-CD2 3.76Å; F236-L327 HydrophobicContact CE1-CG 3.76Å; F236-L327 HydrophobicContact CE2-CD2 3.89Å; F236-L327 HydrophobicContact CZ-CD2 3.23Å; F236-L327 HydrophobicContact CZ-CG 3.54Å
237	I	86.2	Confident	84.6	Confident	18 Å²	18	55.6 Å²	55.6	9%	0.092	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-43.9	176.1	-64.4	169.5	0	0	0	110.7	Y206 R207 L210 T233 E234 S239 I240 N241	Y206-I237 HydrophobicContact CD1-CG2 4.46Å; Y206-I237 HydrophobicContact CG-CG2 4.39Å; R207-I237 HydrophobicContact CG-CD1 4.06Å; L210-I237 HydrophobicContact CD2-CD1 4.01Å; L210-I237 HydrophobicContact CD2-CG1 3.78Å; T233-I237 WeakPolarHBondContact O-CG1 3.3Å; T233-I237 PolarHBondContact O-N 2.67Å; T233-I237 VanDerWaalsContact O-N 3.09Å; E234-I237 PolarHBondContact O-N 2.69Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 2.85Å; I237-I240 PolarHBondContact O-N 3.17Å; I237-N241 VanDerWaalsContact O-CG 3.31Å; I237-N241 PolarHBondContact O-N 3.43Å; I237-N241 VanDerWaalsContact O-N 3.08Å; I237-N241 PolarHBondContact O-ND2 3.22Å
238	E	88.4	Confident	84.9	Confident	127 Å²	127	52.2 Å²	52.2	59%	0.593	26%	0.262	S	S	*	.	H	α-helix	trans	-62.5	-40	176.3	-171.2	-179.1	-170.6	0	0	112.2	E234 F236 I240 N241 T242	E234-E238 PolarHBondContact O-N 3.27Å; F236-E238 VanDerWaalsContact C-N 3.34Å; F236-E238 PolarHBondContact O-N 3.37Å; E238-I240 VanDerWaalsContact C-N 3.35Å; E238-I240 PolarHBondContact O-N 3.34Å; E238-N241 PolarHBondContact O-N 3.08Å; E238-T242 WeakPolarHBondContact O-CB 3.48Å; E238-T242 PolarHBondContact O-N 3.09Å; E238-T242 PolarHBondContact O-OG1 3.19Å
239	S	90.6	Very high	85.1	Confident	11 Å²	11	48.9 Å²	48.9	8%	0.077	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-39.9	177.2	-61.9	0	0	0	0	111.7	R235 F236 I237 M243 Y274	R235-S239 VanDerWaalsContact O-CB 3.31Å; R235-S239 WeakPolarHBondContact O-CB 3.36Å; R235-S239 PolarHBondContact O-N 3.44Å; R235-S239 PolarHBondContact O-OG 3.04Å; F236-S239 WeakPolarHBondContact O-CB 3.36Å; F236-S239 PolarHBondContact O-N 2.94Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 2.85Å; S239-M243 WeakPolarHBondContact O-CB 3.43Å; S239-M243 PolarHBondContact O-N 2.66Å; S239-Y274 WeakPolarHBondContact OG-CD1 3.22Å
240	I	87.8	Confident	85.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-52.7	174.1	-70.7	171.7	0	0	0	110.5	F236 I237 E238 T242 M243 F244 M275 L328 V331 D332	F236-I240 HydrophobicContact CD1-CD1 3.76Å; F236-I240 HydrophobicContact CD1-CG1 4.47Å; F236-I240 HydrophobicContact CE1-CD1 3.27Å; F236-I240 HydrophobicContact CE1-CG1 4.12Å; F236-I240 HydrophobicContact CZ-CD1 3.89Å; F236-I240 HydrophobicContact CZ-CG1 4.37Å; F236-I240 WeakPolarHBondContact O-CG1 3.41Å; F236-I240 PolarHBondContact O-N 3.33Å; I237-I240 PolarHBondContact O-N 3.17Å; E238-I240 VanDerWaalsContact C-N 3.35Å; E238-I240 PolarHBondContact O-N 3.34Å; I240-T242 VanDerWaalsContact C-N 3.31Å; I240-T242 PolarHBondContact O-N 3.33Å; I240-M243 PolarHBondContact O-N 3.47Å; I240-F244 HydrophobicContact CG2-CD2 3.72Å; I240-F244 HydrophobicContact CG2-CE2 3.49Å; I240-F244 VanDerWaalsContact CG2-CE2 3.49Å; I240-F244 WeakPolarHBondContact O-CD2 3.44Å; I240-F244 PolarHBondContact O-N 2.92Å; I240-M275 HydrophobicContact CG1-SD 3.68Å; I240-L328 HydrophobicContact CB-CD1 4.12Å; I240-L328 HydrophobicContact CD1-CD1 4.28Å; I240-L328 HydrophobicContact CG1-CD1 3.74Å; I240-L328 HydrophobicContact CG2-CD1 3.54Å; I240-V331 HydrophobicContact CD1-CB 4.16Å; I240-V331 HydrophobicContact CD1-CG1 4.26Å; I240-V331 HydrophobicContact CD1-CG2 4.12Å; I240-D332 VanDerWaalsContact CG2-OD1 3.26Å; I240-D332 WeakPolarHBondContact CG2-OD1 3.44Å
241	N	86.6	Confident	84.7	Confident	34 Å²	34	47.2 Å²	47.2	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-55.8	-47.9	-178.8	-72.5	-27.9	0	0	0	111.3	I237 E238 F244 V245 R504	I237-N241 VanDerWaalsContact O-CG 3.31Å; I237-N241 PolarHBondContact O-N 3.43Å; I237-N241 VanDerWaalsContact O-N 3.08Å; I237-N241 PolarHBondContact O-ND2 3.22Å; E238-N241 PolarHBondContact O-N 3.08Å; N241-F244 PolarHBondContact O-N 3.31Å; N241-V245 WeakPolarHBondContact O-CG2 3.1Å; N241-V245 PolarHBondContact O-N 3.45Å; N241-R504 VanDerWaalsContact OD1-CZ 3.28Å; N241-R504 PolarHBondContact OD1-NH1 3.44Å; N241-R504 PolarHBondContact OD1-NH2 3.11Å
242	T	87.1	Confident	84.1	Confident	41 Å²	41	39.9 Å²	39.9	25%	0.252	20%	0.196	S	C	.	.	H	α-helix	trans	-66.6	-41.4	179.6	-57.8	0	0	0	0	111.4	E238 I240 F244 V245 M246 T267	E238-T242 WeakPolarHBondContact O-CB 3.48Å; E238-T242 PolarHBondContact O-N 3.09Å; E238-T242 PolarHBondContact O-OG1 3.19Å; I240-T242 VanDerWaalsContact C-N 3.31Å; I240-T242 PolarHBondContact O-N 3.33Å; T242-F244 VanDerWaalsContact C-N 3.35Å; T242-F244 PolarHBondContact O-N 2.98Å; T242-V245 PolarHBondContact O-N 2.92Å; T242-M246 HydrophobicContact CG2-CG 4.22Å; T242-M246 WeakPolarHBondContact O-CB 3.5Å; T242-M246 WeakPolarHBondContact O-CG 3.29Å; T242-M246 PolarHBondContact O-N 3.48Å; T242-T267 HydrophobicContact CG2-CG2 3.82Å
243	M	88.9	Confident	83.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-40.6	178.4	-178.9	-75.9	-57.1	0	0	112	W132 S239 I240 M246 T247 F268 C271 W272 M275 L328	W132-M243 HydrophobicContact CH2-CE 4.27Å; W132-M243 HydrophobicContact CH2-SD 4.36Å; W132-M243 HydrophobicContact CZ2-CE 4.03Å; W132-M243 HydrophobicContact CZ2-SD 3.6Å; S239-M243 WeakPolarHBondContact O-CB 3.43Å; S239-M243 PolarHBondContact O-N 2.66Å; I240-M243 PolarHBondContact O-N 3.47Å; M243-M246 PolarHBondContact O-N 2.74Å; M243-T247 WeakPolarHBondContact O-CB 3.3Å; M243-T247 PolarHBondContact O-N 3.41Å; M243-T247 PolarHBondContact O-OG1 3.03Å; M243-T247 PolarHBondContact SD-OG1 3.28Å; M243-F268 HydrophobicContact CG-CD2 4.16Å; M243-F268 HydrophobicContact CG-CE2 4.01Å; M243-F268 HydrophobicContact SD-CE2 4.17Å; M243-C271 HydrophobicContact CB-CB 4.08Å; M243-W272 HydrophobicContact CE-CZ2 4.14Å; M243-W272 HydrophobicContact CG-CD2 4.38Å; M243-W272 HydrophobicContact CG-CG 4.43Å; M243-W272 HydrophobicContact CG-CZ2 4.15Å; M243-W272 VanDerWaalsContact CG-NE1 3.33Å; M243-W272 HydrophobicContact SD-CZ2 3.72Å; M243-M275 HydrophobicContact CB-CE 4.04Å; M243-M275 HydrophobicContact CE-CE 4.32Å; M243-M275 HydrophobicContact CG-CE 3.77Å; M243-L328 HydrophobicContact CE-CD1 3.37Å; M243-L328 HydrophobicContact CE-CD2 3.51Å; M243-L328 HydrophobicContact CE-CG 4.06Å
244	F	86.4	Confident	83.2	Confident	15 Å²	15	37.5 Å²	37.5	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-41	176.7	-80.4	-56.5	0	0	0	113	I240 N241 T242 T247 L248 L328 D332 T505 L506	I240-F244 HydrophobicContact CG2-CD2 3.72Å; I240-F244 HydrophobicContact CG2-CE2 3.49Å; I240-F244 VanDerWaalsContact CG2-CE2 3.49Å; I240-F244 WeakPolarHBondContact O-CD2 3.44Å; I240-F244 PolarHBondContact O-N 2.92Å; N241-F244 PolarHBondContact O-N 3.31Å; T242-F244 VanDerWaalsContact C-N 3.35Å; T242-F244 PolarHBondContact O-N 2.98Å; F244-T247 PolarHBondContact O-N 2.78Å; F244-L248 PolarHBondContact O-N 2.7Å; F244-L328 HydrophobicContact CE2-CD1 3.82Å; F244-L328 HydrophobicContact CZ-CD1 3.8Å; F244-L328 HydrophobicContact CZ-CG 4.15Å; F244-D332 WeakPolarHBondContact CD2-OD2 3.41Å; F244-D332 HydrophobicContact CE2-CB 4.36Å; F244-D332 WeakPolarHBondContact CE2-OD2 3.09Å; F244-T505 HydrophobicContact CD1-CG2 3.92Å; F244-T505 HydrophobicContact CE1-CG2 4.23Å; F244-T505 PolarHBondContact O-OG1 3.38Å; F244-L506 HydrophobicContact CE2-CD1 4.27Å; F244-L506 HydrophobicContact CZ-CD1 4.17Å
245	V	83.8	Confident	82.5	Confident	63 Å²	63	37.3 Å²	37.3	38%	0.382	20%	0.197	S	C	.	.	H	α-helix	trans	-63.4	-48.4	175.2	-178.3	0	0	0	0	110.2	N241 T242 T247 L248 L249 R504	N241-V245 WeakPolarHBondContact O-CG2 3.1Å; N241-V245 PolarHBondContact O-N 3.45Å; T242-V245 PolarHBondContact O-N 2.92Å; V245-T247 VanDerWaalsContact C-N 3.26Å; V245-T247 PolarHBondContact O-N 3.03Å; V245-L248 PolarHBondContact O-N 2.93Å; V245-L249 PolarHBondContact O-N 3.1Å; V245-R504 HydrophobicContact CG2-CG 3.56Å
246	M	85.4	Confident	81.8	Confident	33 Å²	33	38.2 Å²	38.2	16%	0.163	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-29	-179.9	-66.8	-57.4	114.2	0	0	112.2	T242 M243 L249 T250 P264 T267 F268	T242-M246 HydrophobicContact CG2-CG 4.22Å; T242-M246 WeakPolarHBondContact O-CB 3.5Å; T242-M246 WeakPolarHBondContact O-CG 3.29Å; T242-M246 PolarHBondContact O-N 3.48Å; M243-M246 PolarHBondContact O-N 2.74Å; M246-L249 HydrophobicContact CE-CD2 4.45Å; M246-L249 PolarHBondContact O-N 3.03Å; M246-L249 HydrophobicContact SD-CD2 4.26Å; M246-T250 WeakPolarHBondContact O-CB 3.21Å; M246-T250 WeakPolarHBondContact O-CG2 3.07Å; M246-T250 PolarHBondContact O-N 3.21Å; M246-T250 PolarHBondContact O-OG1 3Å; M246-P264 HydrophobicContact SD-CB 4.04Å; M246-T267 HydrophobicContact CG-CG2 4.39Å; M246-F268 HydrophobicContact CB-CB 3.98Å; M246-F268 HydrophobicContact CB-CD2 4.09Å
247	T	84.6	Confident	81	Confident	4 Å²	4	40 Å²	40	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-50.5	173.8	-65.8	0	0	0	0	111.1	W132 M243 F244 V245 L249 T250 M251 F268	W132-T247 HydrophobicContact CZ2-CG2 4.41Å; W132-T247 VanDerWaalsContact NE1-CG2 3.26Å; W132-T247 PolarHBondContact NE1-OG1 2.87Å; M243-T247 WeakPolarHBondContact O-CB 3.3Å; M243-T247 PolarHBondContact O-N 3.41Å; M243-T247 PolarHBondContact O-OG1 3.03Å; M243-T247 PolarHBondContact SD-OG1 3.28Å; F244-T247 PolarHBondContact O-N 2.78Å; V245-T247 VanDerWaalsContact C-N 3.26Å; V245-T247 PolarHBondContact O-N 3.03Å; T247-L249 VanDerWaalsContact C-N 3.3Å; T247-L249 PolarHBondContact O-N 2.88Å; T247-T250 PolarHBondContact O-N 2.9Å; T247-T250 PolarHBondContact O-OG1 3.22Å; T247-T250 VanDerWaalsContact O-OG1 3.14Å; T247-M251 HydrophobicContact CG2-CG 4.34Å; T247-M251 HydrophobicContact CG2-SD 3.84Å; T247-M251 WeakPolarHBondContact O-CB 3.4Å; T247-M251 VanDerWaalsContact O-CG 3.25Å; T247-M251 WeakPolarHBondContact O-CG 3.26Å; T247-M251 PolarHBondContact O-N 2.79Å; T247-F268 WeakPolarHBondContact OG1-CE2 3.29Å
248	L	79.3	Confident	80.3	Confident	24 Å²	24	40.2 Å²	40.2	13%	0.126	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-42.8	178.1	-68	178.4	0	0	0	111.8	L77 F244 V245 A252 T505	L77-L248 HydrophobicContact CB-CD1 4.28Å; L77-L248 HydrophobicContact CD1-CB 4.02Å; L77-L248 HydrophobicContact CD2-CB 4.3Å; F244-L248 PolarHBondContact O-N 2.7Å; V245-L248 PolarHBondContact O-N 2.93Å; L248-A252 WeakPolarHBondContact O-CB 3.25Å; L248-A252 PolarHBondContact O-N 3.1Å; L248-A252 VanDerWaalsContact O-N 3.12Å; L248-T505 WeakPolarHBondContact CG-OG1 3.48Å
249	L	79.4	Confident	79.5	Confident	55 Å²	55	42.2 Å²	42.2	29%	0.288	22%	0.22	S	C	.	.	H	α-helix	trans	-66.1	-46.8	179.9	-173.4	63.3	0	0	0	111.9	V245 M246 T247 A252 M253 P264	V245-L249 PolarHBondContact O-N 3.1Å; M246-L249 HydrophobicContact CE-CD2 4.45Å; M246-L249 PolarHBondContact O-N 3.03Å; M246-L249 HydrophobicContact SD-CD2 4.26Å; T247-L249 VanDerWaalsContact C-N 3.3Å; T247-L249 PolarHBondContact O-N 2.88Å; L249-A252 PolarHBondContact O-N 3.19Å; L249-M253 HydrophobicContact CG-CE 3.96Å; L249-M253 HydrophobicContact CG-SD 4.46Å; L249-M253 WeakPolarHBondContact O-CG 3.44Å; L249-M253 PolarHBondContact O-N 3.29Å; L249-M253 VanDerWaalsContact O-N 3.14Å; L249-P264 HydrophobicContact CD2-CB 3.92Å; L249-P264 HydrophobicContact CD2-CG 4.02Å
250	T	79.2	Confident	78.8	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-69.4	-32.1	-179.9	56.4	0	0	0	0	112.8	S131 M246 T247 M253 H258 W265	S131-T250 PolarHBondContact OG-OG1 2.82Å; S131-T250 VanDerWaalsContact OG-OG1 3.12Å; M246-T250 WeakPolarHBondContact O-CB 3.21Å; M246-T250 WeakPolarHBondContact O-CG2 3.07Å; M246-T250 PolarHBondContact O-N 3.21Å; M246-T250 PolarHBondContact O-OG1 3Å; T247-T250 PolarHBondContact O-N 2.9Å; T247-T250 PolarHBondContact O-OG1 3.22Å; T247-T250 VanDerWaalsContact O-OG1 3.14Å; T250-M253 HydrophobicContact CG2-CE 4.37Å; T250-M253 PolarHBondContact O-N 2.97Å; T250-H258 PolarHBondContact O-NE2 2.81Å; T250-W265 HydrophobicContact CG2-CE3 4.22Å
251	M	75.2	Confident	78.3	Confident	44 Å²	44	54.6 Å²	54.6	22%	0.217	27%	0.274	C	S	.	.	H	α-helix	trans	-69.8	-32.8	173.5	-75.1	-176.6	66.6	0	0	112.7	L129 T247	L129-M251 HydrophobicContact CD2-SD 4.42Å; T247-M251 HydrophobicContact CG2-CG 4.34Å; T247-M251 HydrophobicContact CG2-SD 3.84Å; T247-M251 WeakPolarHBondContact O-CB 3.4Å; T247-M251 VanDerWaalsContact O-CG 3.25Å; T247-M251 WeakPolarHBondContact O-CG 3.26Å; T247-M251 PolarHBondContact O-N 2.79Å
252	A	72.8	Confident	78.1	Confident	14 Å²	14	56.5 Å²	56.5	12%	0.116	29%	0.289	C	S	.	.	H	α-helix	trans	-73.4	-31	175.7	0	0	0	0	0	112.5	F99 L248 L249	F99-A252 HydrophobicContact CE1-CB 3.65Å; F99-A252 HydrophobicContact CZ-CB 3.78Å; L248-A252 WeakPolarHBondContact O-CB 3.25Å; L248-A252 PolarHBondContact O-N 3.1Å; L248-A252 VanDerWaalsContact O-N 3.12Å; L249-A252 PolarHBondContact O-N 3.19Å
253	M	72.7	Confident	78	Confident	32 Å²	32	62.8 Å²	62.8	16%	0.158	31%	0.312	C	S	.	.	S	Bend	trans	-85.8	128.9	-178.2	-69.7	-171.6	-57.9	0	0	112.4	L249 T250 L257 H258 P264	L249-M253 HydrophobicContact CG-CE 3.96Å; L249-M253 HydrophobicContact CG-SD 4.46Å; L249-M253 WeakPolarHBondContact O-CG 3.44Å; L249-M253 PolarHBondContact O-N 3.29Å; L249-M253 VanDerWaalsContact O-N 3.14Å; T250-M253 HydrophobicContact CG2-CE 4.37Å; T250-M253 PolarHBondContact O-N 2.97Å; M253-L257 HydrophobicContact CB-CD2 4.13Å; M253-L257 HydrophobicContact CG-CD2 3.91Å; M253-L257 HydrophobicContact SD-CD2 4.05Å; M253-H258 PolarHBondContact O-NE2 3.18Å; M253-P264 HydrophobicContact CE-CB 3.99Å; M253-P264 HydrophobicContact CE-CG 4.21Å
254	P	71.7	Confident	77.8	Confident	44 Å²	44	64 Å²	64	29%	0.286	32%	0.32	S	S	.	.			trans	-58.4	146.9	170.4	-24	34.2	0	0	0	112.6	W256 L257	P254-W256 VanDerWaalsContact C-N 3.25Å; P254-W256 HydrophobicContact CB-CG 4.44Å; P254-W256 VanDerWaalsContact CB-NE1 3.32Å; P254-W256 PolarHBondContact O-N 3.17Å; P254-W256 VanDerWaalsContact O-N 3.1Å; P254-L257 VanDerWaalsContact O-CB 3.25Å; P254-L257 WeakPolarHBondContact O-CB 3.48Å; P254-L257 PolarHBondContact O-N 3.05Å
255	S	71.2	Confident	77.7	Confident	83 Å²	83	65.6 Å²	65.6	58%	0.58	33%	0.326	S	S	*	.	H	α-helix	trans	-57.7	-30.4	-173.5	-49.2	0	0	0	0	114.8	L257 H258	S255-L257 VanDerWaalsContact C-N 3.28Å; S255-L257 PolarHBondContact O-N 2.9Å; S255-H258 WeakPolarHBondContact O-CB 3.43Å; S255-H258 PolarHBondContact O-N 3.09Å
256	W	71.9	Confident	77.9	Confident	158 Å²	158	68.8 Å²	68.8	60%	0.598	34%	0.335	S	S	*	.	H	α-helix	trans	-68.1	-28.5	175.6	61.4	-98.3	0	0	0	112.5	P254 H258 Q259 L260	P254-W256 VanDerWaalsContact C-N 3.25Å; P254-W256 HydrophobicContact CB-CG 4.44Å; P254-W256 VanDerWaalsContact CB-NE1 3.32Å; P254-W256 PolarHBondContact O-N 3.17Å; P254-W256 VanDerWaalsContact O-N 3.1Å; W256-H258 VanDerWaalsContact C-N 3.25Å; W256-H258 PolarHBondContact O-N 3.28Å; W256-Q259 WeakPolarHBondContact O-CB 3.34Å; W256-Q259 PolarHBondContact O-N 2.77Å; W256-L260 HydrophobicContact CE3-CD1 3.79Å; W256-L260 HydrophobicContact CZ3-CD1 3.64Å
257	L	72	Confident	78.1	Confident	37 Å²	37	69.9 Å²	69.9	19%	0.194	34%	0.343	C	S	.	.	H	α-helix	trans	-72.1	-23.8	179.8	-164.7	66.5	0	0	0	111.5	M253 P254 S255 Q259 L260 Y261	M253-L257 HydrophobicContact CB-CD2 4.13Å; M253-L257 HydrophobicContact CG-CD2 3.91Å; M253-L257 HydrophobicContact SD-CD2 4.05Å; P254-L257 VanDerWaalsContact O-CB 3.25Å; P254-L257 WeakPolarHBondContact O-CB 3.48Å; P254-L257 PolarHBondContact O-N 3.05Å; S255-L257 VanDerWaalsContact C-N 3.28Å; S255-L257 PolarHBondContact O-N 2.9Å; L257-Q259 PolarHBondContact O-N 3.21Å; L257-L260 HydrophobicContact CD1-CD1 4.3Å; L257-L260 PolarHBondContact O-N 3.38Å; L257-Y261 HydrophobicContact CD1-CD2 3.76Å; L257-Y261 HydrophobicContact CD1-CE2 3.87Å; L257-Y261 HydrophobicContact CG-CD2 4.03Å; L257-Y261 PolarHBondContact O-N 2.98Å
258	H	71.7	Confident	78.3	Confident	23 Å²	23	69.7 Å²	69.7	11%	0.106	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-27.3	173	-59.4	-179.8	0	0	0	111.8	T250 M253 S255 W256 Y261 P262 W265	T250-H258 PolarHBondContact O-NE2 2.81Å; M253-H258 PolarHBondContact O-NE2 3.18Å; S255-H258 WeakPolarHBondContact O-CB 3.43Å; S255-H258 PolarHBondContact O-N 3.09Å; W256-H258 VanDerWaalsContact C-N 3.25Å; W256-H258 PolarHBondContact O-N 3.28Å; H258-Y261 CarbonylContact O-C 3.59Å; H258-P262 WeakPolarHBondContact O-CA 3.33Å; H258-W265 HydrophobicContact CB-CB 4.33Å; H258-W265 AromaticContact ND1-CE3 3.86Å
259	Q	70.8	Confident	78.9	Confident	170 Å²	170	68.8 Å²	68.8	79%	0.794	34%	0.337	S	S	*	.	H	α-helix	trans	-74.2	-31.3	175.3	-62.5	-176.6	-15.5	0	0	112.2	W256 L257	W256-Q259 WeakPolarHBondContact O-CB 3.34Å; W256-Q259 PolarHBondContact O-N 2.77Å; L257-Q259 PolarHBondContact O-N 3.21Å
260	L	75.4	Confident	79.5	Confident	117 Å²	117	69.9 Å²	69.9	61%	0.613	34%	0.344	S	S	*	.	H	α-helix	trans	-84.1	-36.5	179.4	-65.4	171.9	0	0	0	112.4	W256 L257 P262	W256-L260 HydrophobicContact CE3-CD1 3.79Å; W256-L260 HydrophobicContact CZ3-CD1 3.64Å; L257-L260 HydrophobicContact CD1-CD1 4.3Å; L257-L260 PolarHBondContact O-N 3.38Å; L260-P262 WeakPolarHBondContact O-CD 3.11Å
261	Y	78.9	Confident	80.1	Confident	153 Å²	153	70.4 Å²	70.4	60%	0.6	35%	0.347	S	S	*	.			trans	-120	81.6	176.4	-62.9	-80.5	0	0	0	109.8	L257 H258 K263 P264	L257-Y261 HydrophobicContact CD1-CD2 3.76Å; L257-Y261 HydrophobicContact CD1-CE2 3.87Å; L257-Y261 HydrophobicContact CG-CD2 4.03Å; L257-Y261 PolarHBondContact O-N 2.98Å; H258-Y261 CarbonylContact O-C 3.59Å; Y261-K263 VanDerWaalsContact C-N 3.3Å; Y261-K263 PolarHBondContact O-N 2.84Å; Y261-P264 WeakPolarHBondContact O-CD 3.49Å
262	P	80.9	Confident	80.9	Confident	75 Å²	75	68.3 Å²	68.3	49%	0.487	34%	0.337	S	S	.	.	H	α-helix	trans	-74.8	-15.9	-173.4	28.5	-35.7	0	0	0	113.8	H258 L260 W265 K266	H258-P262 WeakPolarHBondContact O-CA 3.33Å; L260-P262 WeakPolarHBondContact O-CD 3.11Å; P262-W265 PolarHBondContact O-N 3.09Å; P262-K266 VanDerWaalsContact O-CB 3.24Å; P262-K266 WeakPolarHBondContact O-CB 3.5Å; P262-K266 PolarHBondContact O-N 2.73Å
263	K	85.4	Confident	81.9	Confident	173 Å²	173	69.1 Å²	69.1	75%	0.752	34%	0.339	S	S	*	.	H	α-helix	trans	-58.6	-50.6	-174.1	-73	-176.4	178.7	-177.8	0	113.6	Y261 W265 K266 T267	Y261-K263 VanDerWaalsContact C-N 3.3Å; Y261-K263 PolarHBondContact O-N 2.84Å; K263-W265 PolarHBondContact O-N 3.16Å; K263-K266 PolarHBondContact O-N 3.15Å; K263-T267 WeakPolarHBondContact O-CB 3.42Å; K263-T267 PolarHBondContact O-N 3.18Å; K263-T267 PolarHBondContact O-OG1 3.36Å
264	P	84.1	Confident	82.9	Confident	24 Å²	24	68.8 Å²	68.8	16%	0.156	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-43.4	178.1	-25.7	36.9	0	0	0	113.1	M246 L249 M253 Y261 T267 F268	M246-P264 HydrophobicContact SD-CB 4.04Å; L249-P264 HydrophobicContact CD2-CB 3.92Å; L249-P264 HydrophobicContact CD2-CG 4.02Å; M253-P264 HydrophobicContact CE-CB 3.99Å; M253-P264 HydrophobicContact CE-CG 4.21Å; Y261-P264 WeakPolarHBondContact O-CD 3.49Å; P264-T267 PolarHBondContact O-N 3.04Å; P264-F268 VanDerWaalsContact O-CB 3.31Å; P264-F268 WeakPolarHBondContact O-CB 3.43Å; P264-F268 PolarHBondContact O-N 3.03Å
265	W	85.5	Confident	83.8	Confident	49 Å²	49	66.7 Å²	66.7	19%	0.186	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-40.5	178.9	178.7	-108.7	0	0	0	112.4	S131 D134 T250 H258 P262 K263 F268 C269	S131-W265 WeakPolarHBondContact O-CH2 3.47Å; D134-W265 HydrophobicContact CB-CH2 3.9Å; D134-W265 HydrophobicContact CB-CZ2 4.43Å; T250-W265 HydrophobicContact CG2-CE3 4.22Å; H258-W265 HydrophobicContact CB-CB 4.33Å; H258-W265 AromaticContact ND1-CE3 3.86Å; P262-W265 PolarHBondContact O-N 3.09Å; K263-W265 PolarHBondContact O-N 3.16Å; W265-F268 AromaticContact CE3-CD1 3.88Å; W265-F268 HydrophobicContact CE3-CD1 3.88Å; W265-F268 HydrophobicContact CE3-CE1 4.42Å; W265-F268 HydrophobicContact CH2-CD1 4.21Å; W265-F268 HydrophobicContact CH2-CE1 4.11Å; W265-F268 AromaticContact CZ3-CD1 3.64Å; W265-F268 HydrophobicContact CZ3-CD1 3.64Å; W265-F268 AromaticContact CZ3-CE1 3.73Å; W265-F268 HydrophobicContact CZ3-CE1 3.73Å; W265-F268 WeakPolarHBondContact O-CB 3.29Å; W265-F268 PolarHBondContact O-N 3.37Å; W265-C269 VanDerWaalsContact CE2-SG 3.57Å; W265-C269 PolarHBondContact O-N 2.81Å; W265-C269 PolarHBondContact O-SG 2.81Å
266	K	88.4	Confident	84.8	Confident	131 Å²	131	63.2 Å²	63.2	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-64.2	-48.1	175.9	-174.3	178.6	177.1	-177.5	0	111	P262 K263 F268 C269 D270	P262-K266 VanDerWaalsContact O-CB 3.24Å; P262-K266 WeakPolarHBondContact O-CB 3.5Å; P262-K266 PolarHBondContact O-N 2.73Å; K263-K266 PolarHBondContact O-N 3.15Å; K266-F268 VanDerWaalsContact C-N 3.27Å; K266-F268 PolarHBondContact O-N 3.09Å; K266-C269 WeakPolarHBondContact O-CB 3.46Å; K266-C269 PolarHBondContact O-N 2.85Å; K266-C269 VanDerWaalsContact O-N 3.09Å; K266-D270 WeakPolarHBondContact O-CB 3.31Å; K266-D270 PolarHBondContact O-N 2.97Å
267	T	89.3	Confident	85.8	Confident	55 Å²	55	62.1 Å²	62.1	34%	0.337	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-41.9	177.1	-50.8	0	0	0	0	111.1	T242 M246 K263 P264 D270 C271	T242-T267 HydrophobicContact CG2-CG2 3.82Å; M246-T267 HydrophobicContact CG-CG2 4.39Å; K263-T267 WeakPolarHBondContact O-CB 3.42Å; K263-T267 PolarHBondContact O-N 3.18Å; K263-T267 PolarHBondContact O-OG1 3.36Å; P264-T267 PolarHBondContact O-N 3.04Å; T267-D270 PolarHBondContact O-N 3.22Å; T267-C271 PolarHBondContact O-N 3.39Å; T267-C271 PolarHBondContact O-SG 3Å
268	F	89.4	Confident	86.6	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-48.2	173.3	176.2	-100.3	0	0	0	112.2	S131 W132 M243 M246 T247 P264 W265 K266 W272	S131-F268 WeakPolarHBondContact O-CE1 3.47Å; W132-F268 AromaticContact CD1-CE2 3.94Å; W132-F268 AromaticContact CD1-CZ 3.51Å; W132-F268 HydrophobicContact CG-CZ 4.24Å; W132-F268 AromaticContact NE1-CE2 3.86Å; W132-F268 AromaticContact NE1-CZ 3.92Å; M243-F268 HydrophobicContact CG-CD2 4.16Å; M243-F268 HydrophobicContact CG-CE2 4.01Å; M243-F268 HydrophobicContact SD-CE2 4.17Å; M246-F268 HydrophobicContact CB-CB 3.98Å; M246-F268 HydrophobicContact CB-CD2 4.09Å; T247-F268 WeakPolarHBondContact OG1-CE2 3.29Å; P264-F268 VanDerWaalsContact O-CB 3.31Å; P264-F268 WeakPolarHBondContact O-CB 3.43Å; P264-F268 PolarHBondContact O-N 3.03Å; W265-F268 AromaticContact CE3-CD1 3.88Å; W265-F268 HydrophobicContact CE3-CD1 3.88Å; W265-F268 HydrophobicContact CE3-CE1 4.42Å; W265-F268 HydrophobicContact CH2-CD1 4.21Å; W265-F268 HydrophobicContact CH2-CE1 4.11Å; W265-F268 AromaticContact CZ3-CD1 3.64Å; W265-F268 HydrophobicContact CZ3-CD1 3.64Å; W265-F268 AromaticContact CZ3-CE1 3.73Å; W265-F268 HydrophobicContact CZ3-CE1 3.73Å; W265-F268 WeakPolarHBondContact O-CB 3.29Å; W265-F268 PolarHBondContact O-N 3.37Å; K266-F268 VanDerWaalsContact C-N 3.27Å; K266-F268 PolarHBondContact O-N 3.09Å; F268-W272 AromaticContact CD1-CD1 3.97Å; F268-W272 AromaticContact CD2-CD1 3.92Å; F268-W272 AromaticContact CD2-NE1 3.88Å; F268-W272 AromaticContact CE1-CD1 3.6Å; F268-W272 AromaticContact CE1-NE1 3.74Å; F268-W272 AromaticContact CE2-CD1 3.55Å; F268-W272 AromaticContact CE2-NE1 3.1Å; F268-W272 AromaticContact CZ-CD1 3.38Å; F268-W272 AromaticContact CZ-NE1 3.01Å; F268-W272 VanDerWaalsContact O-CD1 3.28Å; F268-W272 PolarHBondContact O-N 3.32Å; F268-W272 VanDerWaalsContact O-N 3.13Å
269	C	90.4	Very high	87.5	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.034	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-45.9	176.3	-66	0	0	0	0	112.1	Y135 W265 K266 C271 W272 D273	Y135-C269 HydrophobicContact CD2-CB 4.19Å; Y135-C269 HydrophobicContact CE2-CB 4.33Å; W265-C269 VanDerWaalsContact CE2-SG 3.57Å; W265-C269 PolarHBondContact O-N 2.81Å; W265-C269 PolarHBondContact O-SG 2.81Å; K266-C269 WeakPolarHBondContact O-CB 3.46Å; K266-C269 PolarHBondContact O-N 2.85Å; K266-C269 VanDerWaalsContact O-N 3.09Å; C269-C271 VanDerWaalsContact C-N 3.33Å; C269-C271 PolarHBondContact O-N 3.23Å; C269-W272 PolarHBondContact O-N 2.85Å; C269-W272 VanDerWaalsContact O-N 3.16Å; C269-D273 WeakPolarHBondContact O-CB 3.21Å; C269-D273 VanDerWaalsContact O-CG 3.24Å; C269-D273 PolarHBondContact O-N 2.82Å
270	D	92.6	Very high	88.3	Confident	79 Å²	79	56.4 Å²	56.4	42%	0.422	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-39.6	-177.6	-65.1	-15.4	0	0	0	111.1	K266 T267 D273 Y274	K266-D270 WeakPolarHBondContact O-CB 3.31Å; K266-D270 PolarHBondContact O-N 2.97Å; T267-D270 PolarHBondContact O-N 3.22Å; D270-D273 PolarHBondContact O-N 3.38Å; D270-Y274 PolarHBondContact O-N 3.2Å
271	C	92.4	Very high	89	Confident	12 Å²	12	52.3 Å²	52.3	8%	0.081	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-42.9	174	-66.1	0	0	0	0	111.6	M243 T267 C269 M275	M243-C271 HydrophobicContact CB-CB 4.08Å; T267-C271 PolarHBondContact O-N 3.39Å; T267-C271 PolarHBondContact O-SG 3Å; C269-C271 VanDerWaalsContact C-N 3.33Å; C269-C271 PolarHBondContact O-N 3.23Å; C271-M275 WeakPolarHBondContact O-CG 3.24Å; C271-M275 PolarHBondContact O-N 3.48Å
272	W	92.1	Very high	89.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-40.7	176.5	-85.8	110.5	0	0	0	113	W132 Y135 R136 M243 F268 C269 Y274 M275 F276 T324 L328	W132-W272 HydrophobicContact CD2-CH2 4.32Å; W132-W272 AromaticContact CD2-CZ2 3.56Å; W132-W272 HydrophobicContact CD2-CZ2 3.56Å; W132-W272 AromaticContact CE2-CZ2 3.73Å; W132-W272 AromaticContact CE3-CH2 3.79Å; W132-W272 HydrophobicContact CE3-CH2 3.79Å; W132-W272 AromaticContact CE3-CZ2 3.5Å; W132-W272 HydrophobicContact CE3-CZ2 3.5Å; W132-W272 HydrophobicContact CG-CZ2 4.24Å; W132-W272 HydrophobicContact CH2-CH2 4.14Å; W132-W272 AromaticContact CH2-CZ2 3.88Å; W132-W272 HydrophobicContact CH2-CZ2 3.88Å; W132-W272 AromaticContact CZ2-CZ2 3.9Å; W132-W272 HydrophobicContact CZ2-CZ2 3.9Å; W132-W272 AromaticContact CZ3-CH2 3.69Å; W132-W272 HydrophobicContact CZ3-CH2 3.69Å; W132-W272 AromaticContact CZ3-CZ2 3.67Å; W132-W272 HydrophobicContact CZ3-CZ2 3.67Å; Y135-W272 HydrophobicContact CD1-CB 3.97Å; Y135-W272 HydrophobicContact CD1-CD2 4.42Å; Y135-W272 HydrophobicContact CD1-CG 4.03Å; Y135-W272 HydrophobicContact CD2-CB 3.97Å; Y135-W272 HydrophobicContact CD2-CG 4.48Å; Y135-W272 HydrophobicContact CE1-CB 3.53Å; Y135-W272 HydrophobicContact CE1-CD2 4.4Å; Y135-W272 HydrophobicContact CE1-CG 4Å; Y135-W272 HydrophobicContact CE2-CB 3.51Å; Y135-W272 HydrophobicContact CE2-CG 4.43Å; Y135-W272 HydrophobicContact CG-CB 4.19Å; Y135-W272 HydrophobicContact CG-CG 4.29Å; R136-W272 VanDerWaalsContact NH1-CE3 3.31Å; M243-W272 HydrophobicContact CE-CZ2 4.14Å; M243-W272 HydrophobicContact CG-CD2 4.38Å; M243-W272 HydrophobicContact CG-CG 4.43Å; M243-W272 HydrophobicContact CG-CZ2 4.15Å; M243-W272 VanDerWaalsContact CG-NE1 3.33Å; M243-W272 HydrophobicContact SD-CZ2 3.72Å; F268-W272 AromaticContact CD1-CD1 3.97Å; F268-W272 AromaticContact CD2-CD1 3.92Å; F268-W272 AromaticContact CD2-NE1 3.88Å; F268-W272 AromaticContact CE1-CD1 3.6Å; F268-W272 AromaticContact CE1-NE1 3.74Å; F268-W272 AromaticContact CE2-CD1 3.55Å; F268-W272 AromaticContact CE2-NE1 3.1Å; F268-W272 AromaticContact CZ-CD1 3.38Å; F268-W272 AromaticContact CZ-NE1 3.01Å; F268-W272 VanDerWaalsContact O-CD1 3.28Å; F268-W272 PolarHBondContact O-N 3.32Å; F268-W272 VanDerWaalsContact O-N 3.13Å; C269-W272 PolarHBondContact O-N 2.85Å; C269-W272 VanDerWaalsContact O-N 3.16Å; W272-Y274 VanDerWaalsContact C-N 3.31Å; W272-Y274 PolarHBondContact O-N 2.88Å; W272-M275 HydrophobicContact CB-CE 4.41Å; W272-M275 HydrophobicContact CD2-CE 3.48Å; W272-M275 VanDerWaalsContact CD2-CE 3.48Å; W272-M275 HydrophobicContact CE3-CE 3.4Å; W272-M275 HydrophobicContact CG-CE 3.94Å; W272-M275 HydrophobicContact CH2-CE 4.27Å; W272-M275 HydrophobicContact CZ2-CE 4.33Å; W272-M275 HydrophobicContact CZ3-CE 3.81Å; W272-M275 PolarHBondContact O-N 3.25Å; W272-F276 AromaticContact CE3-CD2 3.94Å; W272-F276 HydrophobicContact CE3-CD2 3.94Å; W272-F276 AromaticContact CE3-CE2 3.62Å; W272-F276 HydrophobicContact CE3-CE2 3.62Å; W272-F276 AromaticContact CZ3-CE2 3.86Å; W272-F276 HydrophobicContact CZ3-CE2 3.86Å; W272-F276 WeakPolarHBondContact O-CD2 3.41Å; W272-F276 PolarHBondContact O-N 3.08Å; W272-T324 HydrophobicContact CZ3-CG2 4.23Å; W272-L328 HydrophobicContact CH2-CD2 3.53Å; W272-L328 HydrophobicContact CZ2-CD2 4.12Å; W272-L328 HydrophobicContact CZ3-CD2 4.31Å
273	D	93.2	Very high	89.5	Confident	32 Å²	32	42.6 Å²	42.6	17%	0.171	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-47.4	176.8	-72.3	-20.7	0	0	0	109.6	Y135 R139 C269 D270 M275 F276 E277	Y135-D273 WeakPolarHBondContact CE2-OD1 3.39Å; Y135-D273 VanDerWaalsContact CZ-OD1 3.3Å; Y135-D273 WeakPolarHBondContact OH-CA 3.42Å; Y135-D273 PolarHBondContact OH-N 2.87Å; Y135-D273 PolarHBondContact OH-OD1 3.47Å; R139-D273 IonicContact CZ-OD1 3.06Å; R139-D273 IonicContact CZ-OD2 3.71Å; R139-D273 IonicContact NE-OD1 2.89Å; R139-D273 PolarHBondContact NE-OD1 3.3Å; R139-D273 IonicContact NE-OD2 2.65Å; R139-D273 PolarHBondContact NE-OD2 2.51Å; R139-D273 IonicContact NH2-OD1 2.62Å; R139-D273 IonicContact NH2-OD2 3.94Å; R139-D273 PolarHBondContact NH2-OD2 2.94Å; C269-D273 WeakPolarHBondContact O-CB 3.21Å; C269-D273 VanDerWaalsContact O-CG 3.24Å; C269-D273 PolarHBondContact O-N 2.82Å; D270-D273 PolarHBondContact O-N 3.38Å; D273-M275 PolarHBondContact O-N 2.89Å; D273-F276 PolarHBondContact O-N 3.19Å; D273-E277 WeakPolarHBondContact O-CB 3.33Å; D273-E277 WeakPolarHBondContact O-CG 3.06Å; D273-E277 PolarHBondContact O-N 2.73Å
274	Y	93.4	Very high	89.6	Confident	25 Å²	25	36.8 Å²	36.8	10%	0.098	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-45.3	175.7	-171.6	-102	0	0	0	112.9	E232 R235 F236 S239 D270 W272 F276 E277 F278	E232-Y274 WeakPolarHBondContact CA-OH 3.13Å; E232-Y274 PolarHBondContact O-OH 3.09Å; R235-Y274 HydrophobicContact CB-CE1 3.96Å; R235-Y274 HydrophobicContact CG-CD1 4.2Å; R235-Y274 HydrophobicContact CG-CE1 3.74Å; R235-Y274 HydrophobicContact CG-CE2 4.22Å; F236-Y274 HydrophobicContact CB-CE1 3.98Å; F236-Y274 HydrophobicContact CD2-CE1 4.44Å; S239-Y274 WeakPolarHBondContact OG-CD1 3.22Å; D270-Y274 PolarHBondContact O-N 3.2Å; W272-Y274 VanDerWaalsContact C-N 3.31Å; W272-Y274 PolarHBondContact O-N 2.88Å; Y274-F276 VanDerWaalsContact C-N 3.31Å; Y274-F276 PolarHBondContact O-N 3.21Å; Y274-E277 PolarHBondContact O-N 3.42Å; Y274-F278 WeakPolarHBondContact O-CB 3.25Å; Y274-F278 PolarHBondContact O-N 3.26Å
275	M	91.4	Very high	89.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-37.2	178.7	-71	-173.3	-67.8	0	0	112.6	F236 I240 M243 C271 W272 D273 A279 T324 L328	F236-M275 HydrophobicContact CD2-CB 4.44Å; F236-M275 HydrophobicContact CD2-CG 4.05Å; F236-M275 HydrophobicContact CE2-CB 3.78Å; F236-M275 HydrophobicContact CE2-CG 3.62Å; F236-M275 HydrophobicContact CZ-CG 4.24Å; I240-M275 HydrophobicContact CG1-SD 3.68Å; M243-M275 HydrophobicContact CB-CE 4.04Å; M243-M275 HydrophobicContact CE-CE 4.32Å; M243-M275 HydrophobicContact CG-CE 3.77Å; C271-M275 WeakPolarHBondContact O-CG 3.24Å; C271-M275 PolarHBondContact O-N 3.48Å; W272-M275 HydrophobicContact CB-CE 4.41Å; W272-M275 HydrophobicContact CD2-CE 3.48Å; W272-M275 VanDerWaalsContact CD2-CE 3.48Å; W272-M275 HydrophobicContact CE3-CE 3.4Å; W272-M275 HydrophobicContact CG-CE 3.94Å; W272-M275 HydrophobicContact CH2-CE 4.27Å; W272-M275 HydrophobicContact CZ2-CE 4.33Å; W272-M275 HydrophobicContact CZ3-CE 3.81Å; W272-M275 PolarHBondContact O-N 3.25Å; D273-M275 PolarHBondContact O-N 2.89Å; M275-A279 WeakPolarHBondContact O-CB 3.28Å; M275-A279 PolarHBondContact O-N 3.2Å; M275-A279 VanDerWaalsContact O-N 3.09Å; M275-T324 HydrophobicContact CB-CG2 4.03Å; M275-L328 HydrophobicContact SD-CD1 4.24Å
276	F	91.6	Very high	89.3	Confident	10 Å²	10	42.7 Å²	42.7	4%	0.044	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-41.7	175.7	-93.4	-101.6	0	0	0	112.2	Y135 H141 W272 D273 Y274 K280 T324	Y135-F276 HydrophobicContact CE1-CD2 4.37Å; Y135-F276 HydrophobicContact CE1-CE2 4.42Å; H141-F276 HydrophobicContact CB-CE1 4.25Å; H141-F276 AromaticContact CE1-CD1 3.75Å; H141-F276 AromaticContact CG-CE1 3.89Å; H141-F276 AromaticContact ND1-CD1 3.85Å; H141-F276 AromaticContact NE2-CD1 3.87Å; W272-F276 AromaticContact CE3-CD2 3.94Å; W272-F276 HydrophobicContact CE3-CD2 3.94Å; W272-F276 AromaticContact CE3-CE2 3.62Å; W272-F276 HydrophobicContact CE3-CE2 3.62Å; W272-F276 AromaticContact CZ3-CE2 3.86Å; W272-F276 HydrophobicContact CZ3-CE2 3.86Å; W272-F276 WeakPolarHBondContact O-CD2 3.41Å; W272-F276 PolarHBondContact O-N 3.08Å; D273-F276 PolarHBondContact O-N 3.19Å; Y274-F276 VanDerWaalsContact C-N 3.31Å; Y274-F276 PolarHBondContact O-N 3.21Å; F276-K280 WeakPolarHBondContact O-CB 3.4Å; F276-K280 PolarHBondContact O-N 3.46Å; F276-T324 HydrophobicContact CD2-CG2 3.77Å; F276-T324 HydrophobicContact CE2-CG2 3.6Å; F276-T324 HydrophobicContact CG-CG2 4.46Å; F276-T324 HydrophobicContact CZ-CG2 4.28Å
277	E	92.1	Very high	88.9	Confident	135 Å²	135	38.6 Å²	38.6	63%	0.631	19%	0.194	S	C	*	.	H	α-helix	trans	-61.9	-44.9	175.5	-75.4	178.8	174	0	0	111.4	D273 Y274 K280 G281	D273-E277 WeakPolarHBondContact O-CB 3.33Å; D273-E277 WeakPolarHBondContact O-CG 3.06Å; D273-E277 PolarHBondContact O-N 2.73Å; Y274-E277 PolarHBondContact O-N 3.42Å; E277-K280 PolarHBondContact O-N 3.36Å; E277-G281 PolarHBondContact O-N 3.11Å
278	F	90.3	Very high	88.6	Confident	12 Å²	12	39.9 Å²	39.9	5%	0.053	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-54.9	176.1	-176.1	-92.4	0	0	0	111.5	I222 E232 F236 Y274 K280 G281 H282 L327	I222-F278 HydrophobicContact CD1-CE1 3.99Å; I222-F278 HydrophobicContact CD1-CZ 3.79Å; I222-F278 HydrophobicContact CG2-CZ 4.23Å; E232-F278 HydrophobicContact CB-CE2 4.45Å; F236-F278 HydrophobicContact CB-CD2 4.36Å; F236-F278 HydrophobicContact CB-CE2 4.37Å; F236-F278 HydrophobicContact CD1-CE1 4.41Å; F236-F278 HydrophobicContact CD2-CB 3.74Å; F236-F278 AromaticContact CD2-CD1 3.5Å; F236-F278 HydrophobicContact CD2-CD1 3.5Å; F236-F278 VanDerWaalsContact CD2-CD1 3.5Å; F236-F278 HydrophobicContact CD2-CD2 4.18Å; F236-F278 HydrophobicContact CD2-CE1 4.11Å; F236-F278 AromaticContact CD2-CG 3.53Å; F236-F278 HydrophobicContact CD2-CG 3.53Å; F236-F278 HydrophobicContact CE2-CB 4.06Å; F236-F278 AromaticContact CE2-CD1 3.6Å; F236-F278 HydrophobicContact CE2-CD1 3.6Å; F236-F278 HydrophobicContact CE2-CE1 4.31Å; F236-F278 HydrophobicContact CE2-CG 4Å; F236-F278 HydrophobicContact CG-CD1 4.03Å; F236-F278 HydrophobicContact CG-CD2 4.47Å; F236-F278 HydrophobicContact CG-CE1 4.17Å; F236-F278 HydrophobicContact CG-CG 4.17Å; F236-F278 HydrophobicContact CG-CZ 4.44Å; F236-F278 HydrophobicContact CZ-CD1 4.23Å; Y274-F278 WeakPolarHBondContact O-CB 3.25Å; Y274-F278 PolarHBondContact O-N 3.26Å; F278-K280 VanDerWaalsContact C-N 3.34Å; F278-K280 PolarHBondContact O-N 2.99Å; F278-G281 PolarHBondContact O-N 3.15Å; F278-H282 AromaticContact CD1-CD2 3.84Å; F278-H282 AromaticContact CE1-CD2 3.58Å; F278-H282 AromaticContact CE1-NE2 3.73Å; F278-H282 AromaticContact CE2-CD2 3.99Å; F278-H282 AromaticContact CE2-NE2 3.46Å; F278-H282 WeakPolarHBondContact CE2-NE2 3.26Å; F278-H282 AromaticContact CZ-CD2 3.67Å; F278-H282 AromaticContact CZ-NE2 3.29Å; F278-H282 VanDerWaalsContact CZ-NE2 3.29Å; F278-H282 WeakPolarHBondContact CZ-NE2 3.47Å; F278-H282 PolarHBondContact O-CD2 3.49Å; F278-H282 VanDerWaalsContact O-CD2 3.25Å; F278-H282 PolarHBondContact O-N 3.26Å; F278-H282 VanDerWaalsContact O-N 3.14Å; F278-L327 HydrophobicContact CD1-CD2 4.02Å; F278-L327 HydrophobicContact CE1-CD2 4.09Å
279	A	89	Confident	88.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-42.8	179.6	0	0	0	0	0	111.8	M275 H282 I283 T324	M275-A279 WeakPolarHBondContact O-CB 3.28Å; M275-A279 PolarHBondContact O-N 3.2Å; M275-A279 VanDerWaalsContact O-N 3.09Å; A279-H282 PolarHBondContact O-N 2.9Å; A279-I283 WeakPolarHBondContact O-CB 3.33Å; A279-I283 WeakPolarHBondContact O-CD1 3.42Å; A279-I283 WeakPolarHBondContact O-CG1 3.3Å; A279-I283 PolarHBondContact O-N 3.04Å; A279-T324 WeakPolarHBondContact CB-OG1 3.48Å
280	K	89.1	Confident	87.5	Confident	98 Å²	98	42.7 Å²	42.7	43%	0.426	22%	0.223	S	C	.	.	H	α-helix	trans	-62.4	-44.4	177.3	-178	-179.3	176.6	-164	0	111.6	F276 E277 F278 H282 I283 D284 Y320	F276-K280 WeakPolarHBondContact O-CB 3.4Å; F276-K280 PolarHBondContact O-N 3.46Å; E277-K280 PolarHBondContact O-N 3.36Å; F278-K280 VanDerWaalsContact C-N 3.34Å; F278-K280 PolarHBondContact O-N 2.99Å; K280-H282 PolarHBondContact O-N 3.1Å; K280-I283 PolarHBondContact O-N 3.39Å; K280-D284 WeakPolarHBondContact CE-OD2 3.46Å; K280-D284 WeakPolarHBondContact CG-OD2 3.34Å; K280-D284 WeakPolarHBondContact O-CB 3.09Å; K280-D284 VanDerWaalsContact O-CG 3.27Å; K280-D284 PolarHBondContact O-N 3.36Å; K280-Y320 HydrophobicContact CB-CD1 4.28Å; K280-Y320 HydrophobicContact CB-CE1 4.31Å; K280-Y320 HydrophobicContact CD-CE2 4.46Å; K280-Y320 HydrophobicContact CG-CD1 4.22Å; K280-Y320 HydrophobicContact CG-CE1 3.8Å; K280-Y320 HydrophobicContact CG-CE2 4.37Å
281	G	88.6	Confident	86.9	Confident	30 Å²	30	41.5 Å²	41.5	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-56.2	-48.8	177.9	0	0	0	0	0	111.9	E277 F278 D284 Q285	E277-G281 PolarHBondContact O-N 3.11Å; F278-G281 PolarHBondContact O-N 3.15Å; G281-D284 PolarHBondContact O-N 2.95Å; G281-Q285 WeakPolarHBondContact O-CB 3.48Å; G281-Q285 WeakPolarHBondContact O-CG 3.36Å; G281-Q285 PolarHBondContact O-N 2.63Å
282	H	86.4	Confident	86.4	Confident	24 Å²	24	45.3 Å²	45.3	11%	0.111	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-38.7	177.2	-74.5	-69.5	0	0	0	113	F218 F278 A279 K280 R286	F218-H282 HydrophobicContact CD1-CB 4.22Å; F218-H282 HydrophobicContact CD2-CB 4.22Å; F218-H282 HydrophobicContact CE1-CB 4.18Å; F218-H282 HydrophobicContact CE2-CB 4.22Å; F218-H282 HydrophobicContact CG-CB 4.24Å; F218-H282 HydrophobicContact CZ-CB 4.2Å; F278-H282 AromaticContact CD1-CD2 3.84Å; F278-H282 AromaticContact CE1-CD2 3.58Å; F278-H282 AromaticContact CE1-NE2 3.73Å; F278-H282 AromaticContact CE2-CD2 3.99Å; F278-H282 AromaticContact CE2-NE2 3.46Å; F278-H282 WeakPolarHBondContact CE2-NE2 3.26Å; F278-H282 AromaticContact CZ-CD2 3.67Å; F278-H282 AromaticContact CZ-NE2 3.29Å; F278-H282 VanDerWaalsContact CZ-NE2 3.29Å; F278-H282 WeakPolarHBondContact CZ-NE2 3.47Å; F278-H282 PolarHBondContact O-CD2 3.49Å; F278-H282 VanDerWaalsContact O-CD2 3.25Å; F278-H282 PolarHBondContact O-N 3.26Å; F278-H282 VanDerWaalsContact O-N 3.14Å; A279-H282 PolarHBondContact O-N 2.9Å; K280-H282 PolarHBondContact O-N 3.1Å; H282-R286 WeakPolarHBondContact O-CB 3.22Å; H282-R286 WeakPolarHBondContact O-CG 3.13Å; H282-R286 PolarHBondContact O-N 2.92Å; H282-R286 VanDerWaalsContact O-N 3.15Å
283	I	84.9	Confident	85.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-47.2	176.3	-68.9	163.1	0	0	0	110.9	F218 A279 K280 R286 L287 T306 M316 Y320 V323	F218-I283 HydrophobicContact CD1-CG1 4.11Å; F218-I283 HydrophobicContact CE1-CD1 4.24Å; F218-I283 HydrophobicContact CE1-CG1 3.68Å; A279-I283 WeakPolarHBondContact O-CB 3.33Å; A279-I283 WeakPolarHBondContact O-CD1 3.42Å; A279-I283 WeakPolarHBondContact O-CG1 3.3Å; A279-I283 PolarHBondContact O-N 3.04Å; K280-I283 PolarHBondContact O-N 3.39Å; I283-R286 PolarHBondContact O-N 3.36Å; I283-L287 HydrophobicContact CG2-CD1 3.81Å; I283-L287 HydrophobicContact CG2-CG 4.31Å; I283-L287 WeakPolarHBondContact O-CG 3.17Å; I283-L287 PolarHBondContact O-N 3.5Å; I283-T306 HydrophobicContact CB-CG2 4.45Å; I283-T306 HydrophobicContact CG1-CG2 4.05Å; I283-T306 HydrophobicContact CG2-CG2 3.81Å; I283-M316 HydrophobicContact CG2-CE 3.98Å; I283-Y320 HydrophobicContact CB-CD1 4.23Å; I283-Y320 HydrophobicContact CB-CE1 3.92Å; I283-Y320 HydrophobicContact CD1-CD1 3.59Å; I283-Y320 HydrophobicContact CD1-CE1 4.18Å; I283-Y320 HydrophobicContact CG2-CD1 4.07Å; I283-Y320 HydrophobicContact CG2-CE1 3.56Å; I283-V323 HydrophobicContact CD1-CB 3.85Å; I283-V323 HydrophobicContact CD1-CG1 3.84Å; I283-V323 HydrophobicContact CD1-CG2 4.16Å; I283-V323 HydrophobicContact CG1-CG1 4.42Å
284	D	86.6	Confident	85	Confident	51 Å²	51	53.9 Å²	53.9	27%	0.273	28%	0.283	S	S	.	.	H	α-helix	trans	-68.4	-40.3	-176.4	-70.4	-8.3	0	0	0	111.2	K280 G281 R286 T288 Y320	K280-D284 WeakPolarHBondContact CE-OD2 3.46Å; K280-D284 WeakPolarHBondContact CG-OD2 3.34Å; K280-D284 WeakPolarHBondContact O-CB 3.09Å; K280-D284 VanDerWaalsContact O-CG 3.27Å; K280-D284 PolarHBondContact O-N 3.36Å; G281-D284 PolarHBondContact O-N 2.95Å; D284-R286 VanDerWaalsContact C-N 3.25Å; D284-R286 PolarHBondContact O-N 3.38Å; D284-T288 WeakPolarHBondContact O-CB 3.42Å; D284-T288 PolarHBondContact O-N 3.01Å; D284-T288 PolarHBondContact O-OG1 3.25Å; D284-Y320 PolarHBondContact OD1-OH 3.24Å
285	Q	85	Confident	84.3	Confident	127 Å²	127	56.8 Å²	56.8	59%	0.593	31%	0.313	S	S	*	.	H	α-helix	trans	-57.4	-41.3	172.4	-77	173.9	8.8	0	0	111.4	G281 A289	G281-Q285 WeakPolarHBondContact O-CB 3.48Å; G281-Q285 WeakPolarHBondContact O-CG 3.36Å; G281-Q285 PolarHBondContact O-N 2.63Å; Q285-A289 WeakPolarHBondContact O-CB 3.48Å; Q285-A289 PolarHBondContact O-N 3.14Å
286	R	79.7	Confident	83.8	Confident	71 Å²	71	64.2 Å²	64.2	27%	0.268	35%	0.345	S	S	.	.	H	α-helix	trans	-70.9	-48.6	-179.2	-73	-73.2	159.3	147.7	-13	112.8	F218 E219 H282 I283 D284 T288 A289 E290	F218-R286 HydrophobicContact CB-CG 4.46Å; F218-R286 VanDerWaalsContact O-CD 3.27Å; F218-R286 WeakPolarHBondContact O-CD 2.86Å; F218-R286 PolarHBondContact O-NE 3.38Å; F218-R286 PolarHBondContact O-NH1 3.18Å; E219-R286 PolarHBondContact O-NH1 3.02Å; E219-R286 PolarHBondContact O-NH2 3.25Å; H282-R286 WeakPolarHBondContact O-CB 3.22Å; H282-R286 WeakPolarHBondContact O-CG 3.13Å; H282-R286 PolarHBondContact O-N 2.92Å; H282-R286 VanDerWaalsContact O-N 3.15Å; I283-R286 PolarHBondContact O-N 3.36Å; D284-R286 VanDerWaalsContact C-N 3.25Å; D284-R286 PolarHBondContact O-N 3.38Å; R286-T288 PolarHBondContact O-N 3.47Å; R286-A289 PolarHBondContact O-N 3.45Å; R286-A289 VanDerWaalsContact O-N 3.11Å; R286-E290 WeakPolarHBondContact O-CG 3.25Å; R286-E290 PolarHBondContact O-N 3.34Å
287	L	80	Confident	82.8	Confident	44 Å²	44	67 Å²	67	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-58	-37.3	175.2	-69.2	173.3	0	0	0	111.6	I283 E290 A291 M316	I283-L287 HydrophobicContact CG2-CD1 3.81Å; I283-L287 HydrophobicContact CG2-CG 4.31Å; I283-L287 WeakPolarHBondContact O-CG 3.17Å; I283-L287 PolarHBondContact O-N 3.5Å; L287-E290 PolarHBondContact O-N 3.44Å; L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.49Å; L287-M316 HydrophobicContact CD1-CE 3.43Å; L287-M316 VanDerWaalsContact CD1-CE 3.43Å; L287-M316 HydrophobicContact CD1-SD 4.13Å
288	T	83.5	Confident	81.9	Confident	82 Å²	82	65.3 Å²	65.3	50%	0.503	37%	0.369	S	S	.	.	H	α-helix	trans	-67.6	-45.2	175.5	-55.1	0	0	0	0	111.8	D284 R286 E290 A291 N292	D284-T288 WeakPolarHBondContact O-CB 3.42Å; D284-T288 PolarHBondContact O-N 3.01Å; D284-T288 PolarHBondContact O-OG1 3.25Å; R286-T288 PolarHBondContact O-N 3.47Å; T288-E290 VanDerWaalsContact C-N 3.28Å; T288-E290 PolarHBondContact O-N 3.25Å; T288-A291 PolarHBondContact O-N 2.88Å; T288-N292 VanDerWaalsContact O-CG 3.26Å; T288-N292 PolarHBondContact O-N 2.92Å; T288-N292 PolarHBondContact O-ND2 3.21Å
289	A	80.5	Confident	80.4	Confident	45 Å²	45	74.1 Å²	74.1	37%	0.372	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-38.3	176.8	0	0	0	0	0	111.9	Q285 R286 N292 K293	Q285-A289 WeakPolarHBondContact O-CB 3.48Å; Q285-A289 PolarHBondContact O-N 3.14Å; R286-A289 PolarHBondContact O-N 3.45Å; R286-A289 VanDerWaalsContact O-N 3.11Å; A289-N292 PolarHBondContact O-N 2.88Å; A289-K293 WeakPolarHBondContact O-CG 3.27Å; A289-K293 PolarHBondContact O-N 2.96Å; A289-K293 VanDerWaalsContact O-N 3.1Å
290	E	75.6	Confident	79.1	Confident	19 Å²	19	75.9 Å²	75.9	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-67.6	-48.3	174.6	-74.4	-170.2	153.5	0	0	113	R286 L287 T288 N292 K293 I294 I300 Y304 Y307	R286-E290 WeakPolarHBondContact O-CG 3.25Å; R286-E290 PolarHBondContact O-N 3.34Å; L287-E290 PolarHBondContact O-N 3.44Å; T288-E290 VanDerWaalsContact C-N 3.28Å; T288-E290 PolarHBondContact O-N 3.25Å; E290-N292 PolarHBondContact O-N 3.39Å; E290-K293 WeakPolarHBondContact O-CA 3.46Å; E290-K293 WeakPolarHBondContact O-CB 3.2Å; E290-K293 PolarHBondContact O-N 2.98Å; E290-I294 WeakPolarHBondContact O-CG1 3.4Å; E290-I294 PolarHBondContact O-N 3.47Å; E290-I300 HydrophobicContact CB-CD1 4.05Å; E290-I300 HydrophobicContact CG-CD1 4.33Å; E290-Y304 WeakPolarHBondContact OE1-CE1 3.27Å; E290-Y304 PolarHBondContact OE1-OH 2.97Å; E290-Y304 PolarHBondContact OE2-OH 2.9Å; E290-Y307 WeakPolarHBondContact OE1-CD2 3.48Å; E290-Y307 WeakPolarHBondContact OE2-CD2 3.42Å
291	A	78.8	Confident	77.6	Confident	55 Å²	55	78.2 Å²	78.2	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-54.2	-39.5	176.1	0	0	0	0	0	111	L287 T288 A295	L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.49Å; T288-A291 PolarHBondContact O-N 2.88Å; A291-A295 WeakPolarHBondContact O-CB 3.24Å; A291-A295 PolarHBondContact O-N 3.46Å
292	N	82.4	Confident	75.9	Confident	92 Å²	92	77.2 Å²	77.2	49%	0.492	42%	0.418	S	S	.	.	H	α-helix	trans	-66.1	-37.7	174.7	-70.6	-26.4	0	0	0	113.3	T288 A289 E290 K296	T288-N292 VanDerWaalsContact O-CG 3.26Å; T288-N292 PolarHBondContact O-N 2.92Å; T288-N292 PolarHBondContact O-ND2 3.21Å; A289-N292 PolarHBondContact O-N 2.88Å; E290-N292 PolarHBondContact O-N 3.39Å; N292-K296 VanDerWaalsContact O-CG 3.29Å; N292-K296 WeakPolarHBondContact O-CG 3.31Å; N292-K296 PolarHBondContact O-N 3.29Å
293	K	78.2	Confident	74.6	Confident	109 Å²	109	82.4 Å²	82.4	47%	0.474	44%	0.437	S	S	.	.	H	α-helix	trans	-69.3	-42.1	175.5	-74.8	-175.6	177.7	-177.6	0	112.2	A289 E290 A295 K296 G297 E298	A289-K293 WeakPolarHBondContact O-CG 3.27Å; A289-K293 PolarHBondContact O-N 2.96Å; A289-K293 VanDerWaalsContact O-N 3.1Å; E290-K293 WeakPolarHBondContact O-CA 3.46Å; E290-K293 WeakPolarHBondContact O-CB 3.2Å; E290-K293 PolarHBondContact O-N 2.98Å; K293-A295 VanDerWaalsContact C-N 3.32Å; K293-A295 PolarHBondContact O-N 2.91Å; K293-K296 CarbonylContact O-C 3.58Å; K293-K296 WeakPolarHBondContact O-CA 3.35Å; K293-K296 WeakPolarHBondContact O-CB 3.35Å; K293-K296 PolarHBondContact O-N 2.99Å; K293-K296 VanDerWaalsContact O-N 3.08Å; K293-G297 PolarHBondContact O-N 3.42Å; K293-E298 HydrophobicContact CB-CB 4.31Å; K293-E298 PolarHBondContact O-N 3.46Å; K293-E298 VanDerWaalsContact O-N 3.09Å
294	I	78.3	Confident	73.6	Confident	102 Å²	102	82.6 Å²	82.6	52%	0.523	44%	0.438	S	S	.	.	H	α-helix	trans	-60.2	-45.6	174.2	-62.4	170.3	0	0	0	109.9	E290 K296 G297 I300	E290-I294 WeakPolarHBondContact O-CG1 3.4Å; E290-I294 PolarHBondContact O-N 3.47Å; I294-K296 PolarHBondContact O-N 3.11Å; I294-G297 PolarHBondContact O-N 3.09Å; I294-I300 HydrophobicContact CD1-CD1 3.39Å; I294-I300 HydrophobicContact CG1-CD1 3.22Å; I294-I300 HydrophobicContact CG1-CG1 3.97Å
295	A	78.4	Confident	72.5	Confident	87 Å²	87	80.4 Å²	80.4	72%	0.719	43%	0.426	S	S	*	.	H	α-helix	trans	-60.1	-27	177.6	0	0	0	0	0	112.6	A291 K293	A291-A295 WeakPolarHBondContact O-CB 3.24Å; A291-A295 PolarHBondContact O-N 3.46Å; K293-A295 VanDerWaalsContact C-N 3.32Å; K293-A295 PolarHBondContact O-N 2.91Å
296	K	81.4	Confident	71.5	Confident	155 Å²	155	74.4 Å²	74.4	67%	0.674	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.9	174.1	-69.9	173.1	-178.7	-175.6	0	114.1	N292 K293 I294 E298	N292-K296 VanDerWaalsContact O-CG 3.29Å; N292-K296 WeakPolarHBondContact O-CG 3.31Å; N292-K296 PolarHBondContact O-N 3.29Å; K293-K296 CarbonylContact O-C 3.58Å; K293-K296 WeakPolarHBondContact O-CA 3.35Å; K293-K296 WeakPolarHBondContact O-CB 3.35Å; K293-K296 PolarHBondContact O-N 2.99Å; K293-K296 VanDerWaalsContact O-N 3.08Å; I294-K296 PolarHBondContact O-N 3.11Å; K296-E298 VanDerWaalsContact C-N 3.28Å; K296-E298 HydrophobicContact CB-CG 4.32Å; K296-E298 PolarHBondContact O-N 3.27Å
297	G	70.6	Confident	70.7	Confident	70 Å²	70	73.2 Å²	73.2	72%	0.722	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	13.2	-178.1	0	0	0	0	0	114.3	K293 I294	K293-G297 PolarHBondContact O-N 3.42Å; I294-G297 PolarHBondContact O-N 3.09Å
298	E	72.6	Confident	70	Confident	99 Å²	99	73.9 Å²	73.9	46%	0.463	40%	0.395	S	S	.	.			trans	-77	138	176.3	-66.1	173.3	-156.4	0	0	110.1	K293 K296 I300	K293-E298 HydrophobicContact CB-CB 4.31Å; K293-E298 PolarHBondContact O-N 3.46Å; K293-E298 VanDerWaalsContact O-N 3.09Å; K296-E298 VanDerWaalsContact C-N 3.28Å; K296-E298 HydrophobicContact CB-CG 4.32Å; K296-E298 PolarHBondContact O-N 3.27Å; E298-I300 PolarHBondContact O-N 3.03Å
299	K	59.3	Low	69.1	Low	196 Å²	196	70.2 Å²	70.2	85%	0.852	37%	0.372	S	S	*	.			trans	-68.9	124.2	170.8	-79.9	-175.6	177.5	178.6	0	109	E301	K299-E301 PolarHBondContact O-N 3.21Å
300	I	61.4	Low	68.3	Low	38 Å²	38	69.7 Å²	69.7	20%	0.195	37%	0.366	C	S	.	.			trans	-73.4	110.3	169.1	-63.2	166.9	0	0	0	107.9	E290 I294 E298 G302 Y307	E290-I300 HydrophobicContact CB-CD1 4.05Å; E290-I300 HydrophobicContact CG-CD1 4.33Å; I294-I300 HydrophobicContact CD1-CD1 3.39Å; I294-I300 HydrophobicContact CG1-CD1 3.22Å; I294-I300 HydrophobicContact CG1-CG1 3.97Å; E298-I300 PolarHBondContact O-N 3.03Å; I300-G302 VanDerWaalsContact C-N 3.25Å; I300-G302 VanDerWaalsContact CG2-N 3.32Å; I300-Y307 HydrophobicContact CD1-CE2 4.17Å; I300-Y307 HydrophobicContact CG2-CD2 4.38Å; I300-Y307 HydrophobicContact CG2-CE2 4.04Å
301	E	56.5	Low	67.7	Low	147 Å²	147	74.6 Å²	74.6	69%	0.687	39%	0.389	S	S	*	.			trans	-88.4	12.4	168.6	-64.7	-165.9	167.7	0	0	112.6	K299 R303	K299-E301 PolarHBondContact O-N 3.21Å; E301-R303 WeakPolarHBondContact O-CG 3.36Å; E301-R303 PolarHBondContact O-N 3.43Å
302	G	53.6	Low	67.1	Low	9 Å²	9	76.1 Å²	76.1	9%	0.093	39%	0.387	C	S	.	.			trans	-59	109.2	-174.5	0	0	0	0	0	112.5	I300 Y307	I300-G302 VanDerWaalsContact C-N 3.25Å; I300-G302 VanDerWaalsContact CG2-N 3.32Å; G302-Y307 WeakPolarHBondContact O-CD1 3.38Å
303	R	58.4	Low	66.3	Low	132 Å²	132	74.9 Å²	74.9	50%	0.498	40%	0.396	S	S	.	.			trans	-100.8	26.5	-178.2	-43.4	-178.5	-164.6	169.9	11	112.5	V172 Y173 E301 F308	V172-R303 HydrophobicContact CG1-CB 3.58Å; V172-R303 HydrophobicContact CG1-CG 3.99Å; Y173-R303 PolarHBondContact OH-O 3.03Å; E301-R303 WeakPolarHBondContact O-CG 3.36Å; E301-R303 PolarHBondContact O-N 3.43Å; R303-F308 VanDerWaalsContact C-CE2 3.46Å; R303-F308 WeakPolarHBondContact O-CE2 3.29Å
304	Y	65.1	Low	66.2	Low	5 Å²	5	70.7 Å²	70.7	2%	0.02	38%	0.379	C	S	.	.	S	Bend	trans	-103.4	156.6	-173	64.6	-82.9	0	0	0	112.5	L217 E219 E290 T306 Y307 F308	L217-Y304 WeakPolarHBondContact O-CD2 3.26Å; E219-Y304 HydrophobicContact CB-CD1 3.82Å; E219-Y304 HydrophobicContact CB-CE1 4.47Å; E219-Y304 HydrophobicContact CB-CG 4.01Å; E219-Y304 WeakPolarHBondContact OE2-CD1 3.21Å; E290-Y304 WeakPolarHBondContact OE1-CE1 3.27Å; E290-Y304 PolarHBondContact OE1-OH 2.97Å; E290-Y304 PolarHBondContact OE2-OH 2.9Å; Y304-T306 VanDerWaalsContact C-N 3.29Å; Y304-T306 HydrophobicContact CE2-CG2 4.47Å; Y304-T306 PolarHBondContact O-N 3.16Å; Y304-Y307 PolarHBondContact O-N 2.82Å; Y304-F308 WeakPolarHBondContact O-CD2 3.48Å; Y304-F308 PolarHBondContact O-N 3.09Å
305	L	63.4	Low	66.5	Low	4 Å²	4	69.4 Å²	69.4	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-61.8	-36.8	-166.8	-167.1	66.5	0	0	0	112.8	L160 H163 M164 L217 F308 L309 L326	L160-L305 HydrophobicContact CD2-CD1 3.76Å; L160-L305 HydrophobicContact CD2-CD2 3.83Å; L160-L305 HydrophobicContact CD2-CG 4.04Å; H163-L305 HydrophobicContact CB-CD1 4.23Å; M164-L305 HydrophobicContact CE-CD2 4.47Å; M164-L305 HydrophobicContact CG-CD1 4.19Å; M164-L305 HydrophobicContact SD-CD1 4.37Å; M164-L305 HydrophobicContact SD-CD2 3.78Å; L217-L305 HydrophobicContact CD2-CB 4.24Å; L217-L305 HydrophobicContact CD2-CD2 3.57Å; L305-F308 PolarHBondContact O-N 2.95Å; L305-L309 HydrophobicContact CG-CD1 4.1Å; L305-L309 HydrophobicContact CG-CG 4.4Å; L305-L309 VanDerWaalsContact O-CG 3.23Å; L305-L309 WeakPolarHBondContact O-CG 3.44Å; L305-L309 PolarHBondContact O-N 3.29Å; L305-L326 HydrophobicContact CD2-CD1 3.39Å
306	T	62.9	Low	66.7	Low	1 Å²	1	68.5 Å²	68.5	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-66.7	-39.6	-178.4	-54.7	0	0	0	0	112.5	L217 I283 Y304 L309 S310 I319	L217-T306 PolarHBondContact O-OG1 3.16Å; I283-T306 HydrophobicContact CB-CG2 4.45Å; I283-T306 HydrophobicContact CG1-CG2 4.05Å; I283-T306 HydrophobicContact CG2-CG2 3.81Å; Y304-T306 VanDerWaalsContact C-N 3.29Å; Y304-T306 HydrophobicContact CE2-CG2 4.47Å; Y304-T306 PolarHBondContact O-N 3.16Å; T306-L309 PolarHBondContact O-N 3.37Å; T306-S310 PolarHBondContact O-N 2.79Å; T306-S310 PolarHBondContact O-OG 3.46Å; T306-I319 HydrophobicContact CG2-CG2 4.06Å
307	Y	64.8	Low	66.9	Low	47 Å²	47	66.5 Å²	66.5	18%	0.184	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-42.4	173.3	176.7	-102.5	0	0	0	111.5	E290 I300 G302 Y304 L309 S310 Q311	E290-Y307 WeakPolarHBondContact OE1-CD2 3.48Å; E290-Y307 WeakPolarHBondContact OE2-CD2 3.42Å; I300-Y307 HydrophobicContact CD1-CE2 4.17Å; I300-Y307 HydrophobicContact CG2-CD2 4.38Å; I300-Y307 HydrophobicContact CG2-CE2 4.04Å; G302-Y307 WeakPolarHBondContact O-CD1 3.38Å; Y304-Y307 PolarHBondContact O-N 2.82Å; Y307-L309 PolarHBondContact O-N 2.96Å; Y307-S310 PolarHBondContact O-N 3.49Å; Y307-S310 PolarHBondContact O-OG 3.24Å; Y307-Q311 HydrophobicContact CD1-CG 4.15Å; Y307-Q311 HydrophobicContact CD2-CG 4.31Å; Y307-Q311 HydrophobicContact CE1-CG 3.77Å; Y307-Q311 HydrophobicContact CE2-CG 3.95Å; Y307-Q311 HydrophobicContact CG-CG 4.41Å; Y307-Q311 WeakPolarHBondContact O-CB 3.48Å; Y307-Q311 VanDerWaalsContact O-CG 3.23Å; Y307-Q311 WeakPolarHBondContact O-CG 3.5Å; Y307-Q311 PolarHBondContact O-N 2.9Å; Y307-Q311 PolarHBondContact OH-NE2 3.33Å
308	F	63.7	Low	67.6	Low	57 Å²	57	63.8 Å²	63.8	25%	0.25	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-45.4	175.3	-68	-61.2	0	0	0	111.5	H163 R303 Y304 L305 S310 Q311 M312	H163-F308 AromaticContact CE1-CD1 3.78Å; H163-F308 AromaticContact CE1-CG 3.88Å; H163-F308 AromaticContact ND1-CD2 3.94Å; R303-F308 VanDerWaalsContact C-CE2 3.46Å; R303-F308 WeakPolarHBondContact O-CE2 3.29Å; Y304-F308 WeakPolarHBondContact O-CD2 3.48Å; Y304-F308 PolarHBondContact O-N 3.09Å; L305-F308 PolarHBondContact O-N 2.95Å; F308-S310 VanDerWaalsContact C-N 3.28Å; F308-S310 PolarHBondContact O-N 3.48Å; F308-Q311 PolarHBondContact O-N 3.43Å; F308-M312 WeakPolarHBondContact O-CG 3.45Å; F308-M312 PolarHBondContact O-N 2.91Å; F308-M312 VanDerWaalsContact O-N 3.15Å
309	L	64.9	Low	68.2	Low	5 Å²	5	59.1 Å²	59.1	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-36	179.5	-68.8	171.2	0	0	0	112.3	L160 L305 T306 Y307 M312 L314 I319 V323	L160-L309 HydrophobicContact CD2-CD1 4.33Å; L160-L309 HydrophobicContact CD2-CD2 3.88Å; L160-L309 HydrophobicContact CD2-CG 4.48Å; L305-L309 HydrophobicContact CG-CD1 4.1Å; L305-L309 HydrophobicContact CG-CG 4.4Å; L305-L309 VanDerWaalsContact O-CG 3.23Å; L305-L309 WeakPolarHBondContact O-CG 3.44Å; L305-L309 PolarHBondContact O-N 3.29Å; T306-L309 PolarHBondContact O-N 3.37Å; Y307-L309 PolarHBondContact O-N 2.96Å; L309-M312 PolarHBondContact O-N 3.09Å; L309-L314 HydrophobicContact CB-CD1 4.39Å; L309-L314 HydrophobicContact CD2-CD1 3.55Å; L309-I319 HydrophobicContact CB-CD1 3.93Å; L309-I319 HydrophobicContact CB-CG1 3.97Å; L309-I319 HydrophobicContact CB-CG2 4.21Å; L309-I319 HydrophobicContact CD1-CG2 4.23Å; L309-V323 HydrophobicContact CD1-CG2 4.21Å
310	S	63.4	Low	69.6	Low	34 Å²	34	51.5 Å²	51.5	24%	0.238	26%	0.264	C	S	.	.	H	α-helix	trans	-72.3	-40.5	177.3	70.5	0	0	0	0	112.4	T306 Y307 F308 M312 G313	T306-S310 PolarHBondContact O-N 2.79Å; T306-S310 PolarHBondContact O-OG 3.46Å; Y307-S310 PolarHBondContact O-N 3.49Å; Y307-S310 PolarHBondContact O-OG 3.24Å; F308-S310 VanDerWaalsContact C-N 3.28Å; F308-S310 PolarHBondContact O-N 3.48Å; S310-M312 PolarHBondContact O-N 3.37Å; S310-G313 PolarHBondContact O-N 3.06Å
311	Q	64.1	Low	70.9	Confident	123 Å²	123	49.7 Å²	49.7	58%	0.575	26%	0.255	S	S	*	.	H	α-helix	trans	-63.5	-23.8	175.5	-71.5	-69.1	-35.4	0	0	113.1	Y307 F308 G313	Y307-Q311 HydrophobicContact CD1-CG 4.15Å; Y307-Q311 HydrophobicContact CD2-CG 4.31Å; Y307-Q311 HydrophobicContact CE1-CG 3.77Å; Y307-Q311 HydrophobicContact CE2-CG 3.95Å; Y307-Q311 HydrophobicContact CG-CG 4.41Å; Y307-Q311 WeakPolarHBondContact O-CB 3.48Å; Y307-Q311 VanDerWaalsContact O-CG 3.23Å; Y307-Q311 WeakPolarHBondContact O-CG 3.5Å; Y307-Q311 PolarHBondContact O-N 2.9Å; Y307-Q311 PolarHBondContact OH-NE2 3.33Å; F308-Q311 PolarHBondContact O-N 3.43Å; Q311-G313 VanDerWaalsContact C-N 3.27Å; Q311-G313 PolarHBondContact O-N 3.2Å
312	M	64.9	Low	72.5	Confident	86 Å²	86	42.8 Å²	42.8	42%	0.424	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2.8	179.9	-67	-167.2	84.3	0	0	114.3	L159 F308 L309 S310 L314	L159-M312 HydrophobicContact CB-SD 4.48Å; L159-M312 HydrophobicContact CD1-CE 4.38Å; L159-M312 HydrophobicContact CD1-SD 4.47Å; L159-M312 HydrophobicContact CD2-CE 3.25Å; L159-M312 HydrophobicContact CD2-SD 4.01Å; L159-M312 HydrophobicContact CG-CE 4.28Å; F308-M312 WeakPolarHBondContact O-CG 3.45Å; F308-M312 PolarHBondContact O-N 2.91Å; F308-M312 VanDerWaalsContact O-N 3.15Å; L309-M312 PolarHBondContact O-N 3.09Å; S310-M312 PolarHBondContact O-N 3.37Å; M312-L314 VanDerWaalsContact C-N 3.26Å; M312-L314 PolarHBondContact O-N 2.99Å
313	G	66.9	Low	74.2	Confident	66 Å²	66	42.3 Å²	42.3	68%	0.68	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.6	16.5	177.3	0	0	0	0	0	114.2	S310 Q311	S310-G313 PolarHBondContact O-N 3.06Å; Q311-G313 VanDerWaalsContact C-N 3.27Å; Q311-G313 PolarHBondContact O-N 3.2Å
314	L	76.3	Confident	75.7	Confident	21 Å²	21	36 Å²	36	11%	0.11	20%	0.195	C	C	.	.			trans	-66.6	141.8	174.7	-72.2	173.4	0	0	0	110.3	L159 L309 M312 M316 I319	L159-L314 HydrophobicContact CD1-CD1 3.97Å; L159-L314 HydrophobicContact CD1-CD2 4.1Å; L159-L314 HydrophobicContact CD1-CG 4.28Å; L309-L314 HydrophobicContact CB-CD1 4.39Å; L309-L314 HydrophobicContact CD2-CD1 3.55Å; M312-L314 VanDerWaalsContact C-N 3.26Å; M312-L314 PolarHBondContact O-N 2.99Å; L314-M316 PolarHBondContact O-N 3.49Å; L314-I319 HydrophobicContact CB-CD1 4.4Å; L314-I319 HydrophobicContact CB-CG1 4.11Å
315	P	83.1	Confident	77	Confident	76 Å²	76	35.9 Å²	35.9	49%	0.494	19%	0.194	S	C	.	.			trans	-57	135.1	173.4	-23	32.4	0	0	0	110.8	K317 T318 I319	P315-K317 PolarHBondContact O-N 3.22Å; P315-T318 WeakPolarHBondContact O-CA 3.43Å; P315-T318 VanDerWaalsContact O-CB 3.28Å; P315-T318 WeakPolarHBondContact O-CB 3.41Å; P315-T318 PolarHBondContact O-N 2.99Å; P315-I319 PolarHBondContact O-N 2.91Å
316	M	83.9	Confident	78.3	Confident	68 Å²	68	36.3 Å²	36.3	34%	0.335	20%	0.196	S	C	.	.	H	α-helix	trans	-52	-36.5	179.5	-75.6	-55.1	-56	0	0	113.1	I283 L287 L314 T318 I319 Y320	I283-M316 HydrophobicContact CG2-CE 3.98Å; L287-M316 HydrophobicContact CD1-CE 3.43Å; L287-M316 VanDerWaalsContact CD1-CE 3.43Å; L287-M316 HydrophobicContact CD1-SD 4.13Å; L314-M316 PolarHBondContact O-N 3.49Å; M316-T318 VanDerWaalsContact C-N 3.29Å; M316-T318 PolarHBondContact O-N 3Å; M316-I319 WeakPolarHBondContact O-CB 3.26Å; M316-I319 PolarHBondContact O-N 3.29Å; M316-I319 VanDerWaalsContact O-N 3.11Å; M316-I319 HydrophobicContact SD-CD1 3.9Å; M316-Y320 HydrophobicContact CB-CE2 3.97Å; M316-Y320 HydrophobicContact CE-CD1 4.45Å; M316-Y320 HydrophobicContact CE-CE1 3.66Å; M316-Y320 HydrophobicContact CE-CE2 4.28Å; M316-Y320 WeakPolarHBondContact O-CD2 3.5Å; M316-Y320 VanDerWaalsContact O-CG 3.27Å; M316-Y320 PolarHBondContact O-N 3.3Å
317	K	85.4	Confident	79.6	Confident	113 Å²	113	36.3 Å²	36.3	49%	0.491	20%	0.196	S	C	.	.	H	α-helix	trans	-59	-37.4	174.2	-70	-170.6	173.6	-164.7	0	113.4	G140 N142 P315 S321	G140-K317 PolarHBondContact O-NZ 3.43Å; G140-K317 VanDerWaalsContact O-NZ 3.09Å; N142-K317 HydrophobicContact CB-CB 4.5Å; P315-K317 PolarHBondContact O-N 3.22Å; K317-S321 WeakPolarHBondContact O-CB 3.13Å; K317-S321 PolarHBondContact O-N 3.27Å; K317-S321 VanDerWaalsContact O-N 3.11Å; K317-S321 PolarHBondContact O-OG 3.15Å
318	T	85	Confident	80.8	Confident	13 Å²	13	34.1 Å²	34.1	8%	0.08	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-38.8	175.2	-56.7	0	0	0	0	110.6	N142 V156 P315 M316 S321 N322	N142-T318 PolarHBondContact ND2-OG1 3.31Å; V156-T318 HydrophobicContact CG2-CG2 4.31Å; P315-T318 WeakPolarHBondContact O-CA 3.43Å; P315-T318 VanDerWaalsContact O-CB 3.28Å; P315-T318 WeakPolarHBondContact O-CB 3.41Å; P315-T318 PolarHBondContact O-N 2.99Å; M316-T318 VanDerWaalsContact C-N 3.29Å; M316-T318 PolarHBondContact O-N 3Å; T318-S321 PolarHBondContact O-N 3.25Å; T318-N322 WeakPolarHBondContact CG2-ND2 3.41Å; T318-N322 WeakPolarHBondContact O-CB 3.4Å; T318-N322 PolarHBondContact O-N 3.27Å; T318-N322 PolarHBondContact O-ND2 3.29Å
319	I	85.6	Confident	82	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-52.3	176	-56.4	-176	0	0	0	110.1	T306 L309 L314 P315 M316 S321 N322 V323	T306-I319 HydrophobicContact CG2-CG2 4.06Å; L309-I319 HydrophobicContact CB-CD1 3.93Å; L309-I319 HydrophobicContact CB-CG1 3.97Å; L309-I319 HydrophobicContact CB-CG2 4.21Å; L309-I319 HydrophobicContact CD1-CG2 4.23Å; L314-I319 HydrophobicContact CB-CD1 4.4Å; L314-I319 HydrophobicContact CB-CG1 4.11Å; P315-I319 PolarHBondContact O-N 2.91Å; M316-I319 WeakPolarHBondContact O-CB 3.26Å; M316-I319 PolarHBondContact O-N 3.29Å; M316-I319 VanDerWaalsContact O-N 3.11Å; M316-I319 HydrophobicContact SD-CD1 3.9Å; I319-S321 VanDerWaalsContact C-N 3.29Å; I319-S321 PolarHBondContact O-N 3.38Å; I319-N322 PolarHBondContact O-N 3.09Å; I319-V323 HydrophobicContact CG2-CG2 4.07Å; I319-V323 WeakPolarHBondContact O-CB 3.29Å; I319-V323 VanDerWaalsContact O-CG2 3.26Å; I319-V323 WeakPolarHBondContact O-CG2 3.48Å; I319-V323 PolarHBondContact O-N 3.47Å
320	Y	88.5	Confident	83	Confident	36 Å²	36	33.6 Å²	33.6	14%	0.141	20%	0.196	C	C	.	.	H	α-helix	trans	-53.6	-47.6	176.8	-60	-43.2	0	0	0	111.4	K280 I283 D284 M316 N322 V323 T324	K280-Y320 HydrophobicContact CB-CD1 4.28Å; K280-Y320 HydrophobicContact CB-CE1 4.31Å; K280-Y320 HydrophobicContact CD-CE2 4.46Å; K280-Y320 HydrophobicContact CG-CD1 4.22Å; K280-Y320 HydrophobicContact CG-CE1 3.8Å; K280-Y320 HydrophobicContact CG-CE2 4.37Å; I283-Y320 HydrophobicContact CB-CD1 4.23Å; I283-Y320 HydrophobicContact CB-CE1 3.92Å; I283-Y320 HydrophobicContact CD1-CD1 3.59Å; I283-Y320 HydrophobicContact CD1-CE1 4.18Å; I283-Y320 HydrophobicContact CG2-CD1 4.07Å; I283-Y320 HydrophobicContact CG2-CE1 3.56Å; D284-Y320 PolarHBondContact OD1-OH 3.24Å; M316-Y320 HydrophobicContact CB-CE2 3.97Å; M316-Y320 HydrophobicContact CE-CD1 4.45Å; M316-Y320 HydrophobicContact CE-CE1 3.66Å; M316-Y320 HydrophobicContact CE-CE2 4.28Å; M316-Y320 WeakPolarHBondContact O-CD2 3.5Å; M316-Y320 VanDerWaalsContact O-CG 3.27Å; M316-Y320 PolarHBondContact O-N 3.3Å; Y320-N322 PolarHBondContact O-N 2.88Å; Y320-V323 PolarHBondContact O-N 2.96Å; Y320-T324 WeakPolarHBondContact O-CB 3.11Å; Y320-T324 PolarHBondContact O-N 3.24Å; Y320-T324 PolarHBondContact O-OG1 3Å
321	S	89.6	Confident	84.2	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-40.4	-177.2	-52	0	0	0	0	112.8	N142 K317 T318 I319 E325	N142-S321 VanDerWaalsContact O-CB 3.3Å; N142-S321 WeakPolarHBondContact O-CB 3.28Å; N142-S321 PolarHBondContact O-OG 2.73Å; K317-S321 WeakPolarHBondContact O-CB 3.13Å; K317-S321 PolarHBondContact O-N 3.27Å; K317-S321 VanDerWaalsContact O-N 3.11Å; K317-S321 PolarHBondContact O-OG 3.15Å; T318-S321 PolarHBondContact O-N 3.25Å; I319-S321 VanDerWaalsContact C-N 3.29Å; I319-S321 PolarHBondContact O-N 3.38Å; S321-E325 WeakPolarHBondContact O-CB 3.46Å; S321-E325 WeakPolarHBondContact O-CG 3.34Å; S321-E325 PolarHBondContact O-N 3.2Å
322	N	89.3	Confident	85.3	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-70.6	-43.2	178.1	-82.6	-73.3	0	0	0	112.6	L145 V156 T318 I319 Y320 E325 L326	L145-N322 WeakPolarHBondContact CB-OD1 3.34Å; L145-N322 PolarHBondContact N-OD1 2.99Å; V156-N322 WeakPolarHBondContact CG1-OD1 3.23Å; T318-N322 WeakPolarHBondContact CG2-ND2 3.41Å; T318-N322 WeakPolarHBondContact O-CB 3.4Å; T318-N322 PolarHBondContact O-N 3.27Å; T318-N322 PolarHBondContact O-ND2 3.29Å; I319-N322 PolarHBondContact O-N 3.09Å; Y320-N322 PolarHBondContact O-N 2.88Å; N322-E325 PolarHBondContact O-N 2.91Å; N322-L326 WeakPolarHBondContact O-CB 3.33Å; N322-L326 VanDerWaalsContact O-CG 3.27Å; N322-L326 WeakPolarHBondContact O-CG 3.37Å; N322-L326 PolarHBondContact O-N 2.94Å
323	V	88.9	Confident	86.5	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.9	-42.2	-178.9	176.1	0	0	0	0	110.7	L217 F218 I283 L309 I319 Y320 E325 L326 L327	L217-V323 HydrophobicContact CB-CG1 4.38Å; L217-V323 HydrophobicContact CD1-CG1 4.16Å; F218-V323 HydrophobicContact CD1-CG1 4.35Å; F218-V323 HydrophobicContact CE1-CG1 3.35Å; F218-V323 HydrophobicContact CZ-CG1 3.68Å; I283-V323 HydrophobicContact CD1-CB 3.85Å; I283-V323 HydrophobicContact CD1-CG1 3.84Å; I283-V323 HydrophobicContact CD1-CG2 4.16Å; I283-V323 HydrophobicContact CG1-CG1 4.42Å; L309-V323 HydrophobicContact CD1-CG2 4.21Å; I319-V323 HydrophobicContact CG2-CG2 4.07Å; I319-V323 WeakPolarHBondContact O-CB 3.29Å; I319-V323 VanDerWaalsContact O-CG2 3.26Å; I319-V323 WeakPolarHBondContact O-CG2 3.48Å; I319-V323 PolarHBondContact O-N 3.47Å; Y320-V323 PolarHBondContact O-N 2.96Å; V323-E325 VanDerWaalsContact C-N 3.33Å; V323-E325 PolarHBondContact O-N 3.41Å; V323-L326 PolarHBondContact O-N 2.79Å; V323-L327 VanDerWaalsContact O-CB 3.28Å; V323-L327 WeakPolarHBondContact O-CB 3.46Å; V323-L327 PolarHBondContact O-N 3.27Å
324	T	90.8	Very high	87.6	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-41.5	173.7	-53.2	0	0	0	0	112	W272 M275 F276 A279 Y320 L328	W272-T324 HydrophobicContact CZ3-CG2 4.23Å; M275-T324 HydrophobicContact CB-CG2 4.03Å; F276-T324 HydrophobicContact CD2-CG2 3.77Å; F276-T324 HydrophobicContact CE2-CG2 3.6Å; F276-T324 HydrophobicContact CG-CG2 4.46Å; F276-T324 HydrophobicContact CZ-CG2 4.28Å; A279-T324 WeakPolarHBondContact CB-OG1 3.48Å; Y320-T324 WeakPolarHBondContact O-CB 3.11Å; Y320-T324 PolarHBondContact O-N 3.24Å; Y320-T324 PolarHBondContact O-OG1 3Å; T324-L328 WeakPolarHBondContact O-CB 3.27Å; T324-L328 PolarHBondContact O-N 2.96Å
325	E	90.8	Very high	88.3	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.009	11%	0.111	C	C	.	.	H	α-helix	trans	-70.1	-34.4	178.4	-75.9	-178.5	-168.9	0	0	113.3	R136 G144 L145 L146 T147 S321 N322 V323 A329	R136-E325 IonicContact CZ-OE1 3.06Å; R136-E325 IonicContact NE-OE1 2.75Å; R136-E325 IonicContact NH2-OE1 3.35Å; R136-E325 PolarHBondContact NH2-OE1 2.88Å; G144-E325 VanDerWaalsContact CA-CD 3.49Å; G144-E325 WeakPolarHBondContact CA-OE2 3.36Å; G144-E325 PolarHBondContact N-OE1 2.99Å; L145-E325 PolarHBondContact N-OE2 3.23Å; L145-E325 VanDerWaalsContact N-OE2 3.12Å; L146-E325 WeakPolarHBondContact CA-OE2 3.44Å; L146-E325 VanDerWaalsContact CB-OE2 3.28Å; L146-E325 WeakPolarHBondContact CB-OE2 3.44Å; L146-E325 HydrophobicContact CD1-CB 4.02Å; L146-E325 HydrophobicContact CD1-CG 4.36Å; L146-E325 HydrophobicContact CG-CB 4.28Å; L146-E325 PolarHBondContact N-OE2 2.98Å; T147-E325 WeakPolarHBondContact CG2-OE1 3.19Å; T147-E325 PolarHBondContact N-OE2 2.97Å; T147-E325 PolarHBondContact OG1-OE1 2.92Å; S321-E325 WeakPolarHBondContact O-CB 3.46Å; S321-E325 WeakPolarHBondContact O-CG 3.34Å; S321-E325 PolarHBondContact O-N 3.2Å; N322-E325 PolarHBondContact O-N 2.91Å; V323-E325 VanDerWaalsContact C-N 3.33Å; V323-E325 PolarHBondContact O-N 3.41Å; E325-A329 WeakPolarHBondContact O-CB 3.45Å; E325-A329 PolarHBondContact O-N 3.45Å; E325-A329 VanDerWaalsContact O-N 3.09Å
326	L	91.1	Very high	88.6	Confident	13 Å²	13	16.3 Å²	16.3	7%	0.068	9%	0.088	C	C	.	.	H	α-helix	trans	-69.5	-42	173.8	-71.8	172.6	0	0	0	111.9	L160 M164 L217 L305 N322 V323 A329 G330 I468	L160-L326 HydrophobicContact CD1-CD1 4.43Å; M164-L326 HydrophobicContact CE-CD1 4.5Å; M164-L326 HydrophobicContact CE-CD2 4.21Å; M164-L326 HydrophobicContact SD-CD1 4.21Å; M164-L326 HydrophobicContact SD-CD2 4.36Å; L217-L326 HydrophobicContact CD1-CB 4.05Å; L217-L326 HydrophobicContact CD2-CB 4.09Å; L217-L326 HydrophobicContact CD2-CD1 3.94Å; L305-L326 HydrophobicContact CD2-CD1 3.39Å; N322-L326 WeakPolarHBondContact O-CB 3.33Å; N322-L326 VanDerWaalsContact O-CG 3.27Å; N322-L326 WeakPolarHBondContact O-CG 3.37Å; N322-L326 PolarHBondContact O-N 2.94Å; V323-L326 PolarHBondContact O-N 2.79Å; L326-A329 PolarHBondContact O-N 3.31Å; L326-G330 PolarHBondContact O-N 3.19Å; L326-I468 HydrophobicContact CD2-CG2 3.59Å
327	L	90.1	Very high	89	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59	-51.7	175.8	-177.9	59.5	0	0	0	110.3	L210 I213 S214 L217 F218 F236 F278 V323 A329 G330 V331	L210-L327 HydrophobicContact CD1-CD1 3.56Å; L210-L327 HydrophobicContact CD1-CG 4.35Å; I213-L327 HydrophobicContact CG2-CD1 3.45Å; I213-L327 VanDerWaalsContact CG2-CD1 3.45Å; S214-L327 WeakPolarHBondContact OG-CD1 3.31Å; L217-L327 HydrophobicContact CD1-CB 3.97Å; L217-L327 HydrophobicContact CD1-CD1 4.47Å; F218-L327 HydrophobicContact CE2-CD2 4.37Å; F218-L327 HydrophobicContact CZ-CD2 4.31Å; F236-L327 HydrophobicContact CE1-CD1 4.36Å; F236-L327 HydrophobicContact CE1-CD2 3.76Å; F236-L327 HydrophobicContact CE1-CG 3.76Å; F236-L327 HydrophobicContact CE2-CD2 3.89Å; F236-L327 HydrophobicContact CZ-CD2 3.23Å; F236-L327 HydrophobicContact CZ-CG 3.54Å; F278-L327 HydrophobicContact CD1-CD2 4.02Å; F278-L327 HydrophobicContact CE1-CD2 4.09Å; V323-L327 VanDerWaalsContact O-CB 3.28Å; V323-L327 WeakPolarHBondContact O-CB 3.46Å; V323-L327 PolarHBondContact O-N 3.27Å; L327-A329 VanDerWaalsContact C-N 3.3Å; L327-A329 PolarHBondContact O-N 3.33Å; L327-G330 PolarHBondContact O-N 3.29Å; L327-V331 VanDerWaalsContact O-CG2 3.27Å; L327-V331 WeakPolarHBondContact O-CG2 3.27Å; L327-V331 PolarHBondContact O-N 3.35Å
328	L	89.9	Confident	89.3	Confident	2 Å²	2	7.9 Å²	7.9	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-54.8	-44.1	174.7	173.5	66.7	0	0	0	112.6	W132 I240 M243 F244 W272 M275 T324	W132-L328 HydrophobicContact CH2-CD2 3.55Å; W132-L328 HydrophobicContact CZ2-CD2 4.46Å; W132-L328 HydrophobicContact CZ3-CD2 3.9Å; I240-L328 HydrophobicContact CB-CD1 4.12Å; I240-L328 HydrophobicContact CD1-CD1 4.28Å; I240-L328 HydrophobicContact CG1-CD1 3.74Å; I240-L328 HydrophobicContact CG2-CD1 3.54Å; M243-L328 HydrophobicContact CE-CD1 3.37Å; M243-L328 HydrophobicContact CE-CD2 3.51Å; M243-L328 HydrophobicContact CE-CG 4.06Å; F244-L328 HydrophobicContact CE2-CD1 3.82Å; F244-L328 HydrophobicContact CZ-CD1 3.8Å; F244-L328 HydrophobicContact CZ-CG 4.15Å; W272-L328 HydrophobicContact CH2-CD2 3.53Å; W272-L328 HydrophobicContact CZ2-CD2 4.12Å; W272-L328 HydrophobicContact CZ3-CD2 4.31Å; M275-L328 HydrophobicContact SD-CD1 4.24Å; T324-L328 WeakPolarHBondContact O-CB 3.27Å; T324-L328 PolarHBondContact O-N 2.96Å
329	A	88.6	Confident	89.6	Confident	39 Å²	39	7.3 Å²	7.3	32%	0.322	5%	0.046	S	C	.	.	H	α-helix	trans	-72	-28.2	-177.2	0	0	0	0	0	113.6	E325 L326 L327 T333	E325-A329 WeakPolarHBondContact O-CB 3.45Å; E325-A329 PolarHBondContact O-N 3.45Å; E325-A329 VanDerWaalsContact O-N 3.09Å; L326-A329 PolarHBondContact O-N 3.31Å; L327-A329 VanDerWaalsContact C-N 3.3Å; L327-A329 PolarHBondContact O-N 3.33Å; A329-T333 WeakPolarHBondContact O-CG2 3.45Å; A329-T333 PolarHBondContact O-OG1 2.82Å
330	G	87.4	Confident	89.9	Confident	12 Å²	12	7.3 Å²	7.3	12%	0.124	5%	0.046	C	C	.	.	H	α-helix	trans	-80.8	-29	-176.5	0	0	0	0	0	114.5	L326 L327 I334	L326-G330 PolarHBondContact O-N 3.19Å; L327-G330 PolarHBondContact O-N 3.29Å; G330-I334 VanDerWaalsContact O-CG1 3.3Å; G330-I334 WeakPolarHBondContact O-CG1 3.33Å
331	V	88.5	Confident	90.1	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-71.9	-67.4	-171.9	176.3	0	0	0	0	112.1	Y206 L210 I213 I240 L327 T333 S335	Y206-V331 HydrophobicContact CD1-CG1 4Å; L210-V331 HydrophobicContact CB-CG1 4.4Å; L210-V331 HydrophobicContact CB-CG2 3.96Å; L210-V331 HydrophobicContact CD1-CG2 3.72Å; L210-V331 HydrophobicContact CG-CG2 4.43Å; I213-V331 HydrophobicContact CG2-CG2 4.17Å; I240-V331 HydrophobicContact CD1-CB 4.16Å; I240-V331 HydrophobicContact CD1-CG1 4.26Å; I240-V331 HydrophobicContact CD1-CG2 4.12Å; L327-V331 VanDerWaalsContact O-CG2 3.27Å; L327-V331 WeakPolarHBondContact O-CG2 3.27Å; L327-V331 PolarHBondContact O-N 3.35Å; V331-T333 VanDerWaalsContact C-N 3.25Å; V331-T333 PolarHBondContact O-N 3.39Å; V331-S335 WeakPolarHBondContact O-CB 3.29Å; V331-S335 PolarHBondContact O-N 2.93Å; V331-S335 PolarHBondContact O-OG 3.28Å
332	D	86.4	Confident	90.3	Very high	1 Å²	1	5.6 Å²	5.6	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-66.1	-28.1	-173.2	-75.7	33.6	0	0	0	113.1	Y206 I240 F244 S335 S336 R504 L506	Y206-D332 HydrophobicContact CE1-CB 4.1Å; Y206-D332 WeakPolarHBondContact CE1-OD1 3.1Å; I240-D332 VanDerWaalsContact CG2-OD1 3.26Å; I240-D332 WeakPolarHBondContact CG2-OD1 3.44Å; F244-D332 WeakPolarHBondContact CD2-OD2 3.41Å; F244-D332 HydrophobicContact CE2-CB 4.36Å; F244-D332 WeakPolarHBondContact CE2-OD2 3.09Å; D332-S335 WeakPolarHBondContact CA-OG 3.22Å; D332-S335 PolarHBondContact O-OG 3.36Å; D332-S335 VanDerWaalsContact O-OG 3.05Å; D332-S336 VanDerWaalsContact O-CB 3.29Å; D332-S336 WeakPolarHBondContact O-CB 3.43Å; D332-S336 PolarHBondContact O-N 3.41Å; D332-S336 VanDerWaalsContact O-N 3.15Å; D332-S336 PolarHBondContact O-OG 2.81Å; D332-R504 IonicContact OD2-NH2 3.04Å; D332-R504 PolarHBondContact OD2-NH2 2.94Å; D332-L506 HydrophobicContact CB-CD1 3.5Å
333	T	89.7	Confident	90.4	Very high	37 Å²	37	6.3 Å²	6.3	23%	0.227	4%	0.042	C	C	.	.	H	α-helix	trans	-75.3	-47.6	-173.6	60.1	0	0	0	0	111.6	A329 V331 T337 V394 L506	A329-T333 WeakPolarHBondContact O-CG2 3.45Å; A329-T333 PolarHBondContact O-OG1 2.82Å; V331-T333 VanDerWaalsContact C-N 3.25Å; V331-T333 PolarHBondContact O-N 3.39Å; T333-T337 WeakPolarHBondContact O-CB 3.4Å; T333-T337 PolarHBondContact O-N 3.28Å; T333-T337 VanDerWaalsContact O-N 3.16Å; T333-T337 PolarHBondContact O-OG1 2.88Å; T333-V394 HydrophobicContact CG2-CG1 3.85Å; T333-L506 HydrophobicContact CG2-CD1 4.17Å
334	I	91.2	Very high	90.5	Very high	4 Å²	4	6.5 Å²	6.5	2%	0.021	4%	0.043	C	C	.	.	H	α-helix	trans	-65.9	-43	176.4	-60.5	-64.4	0	0	0	110.3	F208 G330 S336 T337 M338 A473 E476 L477	F208-I334 HydrophobicContact CD1-CG2 4.29Å; F208-I334 HydrophobicContact CE1-CG2 4.15Å; G330-I334 VanDerWaalsContact O-CG1 3.3Å; G330-I334 WeakPolarHBondContact O-CG1 3.33Å; I334-S336 PolarHBondContact O-N 3.39Å; I334-T337 WeakPolarHBondContact O-CB 3.38Å; I334-T337 PolarHBondContact O-N 3.09Å; I334-M338 HydrophobicContact CG2-CG 4.27Å; I334-M338 WeakPolarHBondContact O-CG 3.44Å; I334-M338 PolarHBondContact O-N 3.39Å; I334-A473 HydrophobicContact CD1-CB 3.54Å; I334-E476 HydrophobicContact CG2-CG 4.38Å; I334-L477 HydrophobicContact CD1-CD1 4.34Å; I334-L477 HydrophobicContact CD1-CD2 4.35Å; I334-L477 HydrophobicContact CD1-CG 4.08Å; I334-L477 HydrophobicContact CG2-CD2 4.08Å
335	S	91	Very high	90.6	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-61.6	-47.8	-177.6	67.9	0	0	0	0	112.6	F205 Y206 V331 D332 T337 M338 S339	F205-S335 VanDerWaalsContact O-CB 3.3Å; F205-S335 WeakPolarHBondContact O-CB 3.41Å; Y206-S335 VanDerWaalsContact CD1-OG 3.29Å; Y206-S335 WeakPolarHBondContact CD1-OG 3.49Å; Y206-S335 VanDerWaalsContact CE1-OG 3.26Å; Y206-S335 WeakPolarHBondContact CE1-OG 3.45Å; V331-S335 WeakPolarHBondContact O-CB 3.29Å; V331-S335 PolarHBondContact O-N 2.93Å; V331-S335 PolarHBondContact O-OG 3.28Å; D332-S335 WeakPolarHBondContact CA-OG 3.22Å; D332-S335 PolarHBondContact O-OG 3.36Å; D332-S335 VanDerWaalsContact O-OG 3.05Å; S335-T337 VanDerWaalsContact C-N 3.31Å; S335-T337 PolarHBondContact O-N 2.88Å; S335-M338 PolarHBondContact O-N 3.26Å; S335-S339 WeakPolarHBondContact O-CB 3.37Å; S335-S339 PolarHBondContact O-N 2.93Å; S335-S339 PolarHBondContact O-OG 2.59Å
336	S	90	Very high	90.7	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.6	-41.2	177.5	-57.7	0	0	0	0	111.2	D332 I334 S339 W340	D332-S336 VanDerWaalsContact O-CB 3.29Å; D332-S336 WeakPolarHBondContact O-CB 3.43Å; D332-S336 PolarHBondContact O-N 3.41Å; D332-S336 VanDerWaalsContact O-N 3.15Å; D332-S336 PolarHBondContact O-OG 2.81Å; I334-S336 PolarHBondContact O-N 3.39Å; S336-S339 PolarHBondContact O-N 2.82Å; S336-W340 PolarHBondContact O-N 2.82Å
337	T	91	Very high	90.6	Very high	5 Å²	5	12 Å²	12	3%	0.031	6%	0.064	C	C	.	.	H	α-helix	trans	-61.7	-50.8	178.7	-56.5	0	0	0	0	112.4	T333 I334 S335 S339 W340 T341 L388 L477	T333-T337 WeakPolarHBondContact O-CB 3.4Å; T333-T337 PolarHBondContact O-N 3.28Å; T333-T337 VanDerWaalsContact O-N 3.16Å; T333-T337 PolarHBondContact O-OG1 2.88Å; I334-T337 WeakPolarHBondContact O-CB 3.38Å; I334-T337 PolarHBondContact O-N 3.09Å; S335-T337 VanDerWaalsContact C-N 3.31Å; S335-T337 PolarHBondContact O-N 2.88Å; T337-S339 VanDerWaalsContact C-N 3.28Å; T337-S339 PolarHBondContact O-N 3.4Å; T337-W340 PolarHBondContact O-N 2.73Å; T337-T341 WeakPolarHBondContact O-CB 3.2Å; T337-T341 PolarHBondContact O-N 3.12Å; T337-T341 PolarHBondContact O-OG1 3.35Å; T337-L388 HydrophobicContact CG2-CB 4.17Å; T337-L388 HydrophobicContact CG2-CD1 3.17Å; T337-L388 HydrophobicContact CG2-CG 4.27Å; T337-L388 WeakPolarHBondContact OG1-CD1 3.43Å; T337-L477 HydrophobicContact CG2-CD1 3.62Å; T337-L477 HydrophobicContact CG2-CD2 3.54Å; T337-L477 HydrophobicContact CG2-CG 4.22Å
338	M	92.2	Very high	90.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.3	-44.4	179.3	-77	-66.1	-66.1	0	0	110.6	F205 I334 S335 T341 L342 L477 A480 L481 I484	F205-M338 HydrophobicContact CB-CB 4.34Å; F205-M338 HydrophobicContact CD1-CB 4.18Å; F205-M338 HydrophobicContact CD2-CB 3.71Å; F205-M338 HydrophobicContact CE1-CB 4.46Å; F205-M338 HydrophobicContact CE1-CE 4.08Å; F205-M338 HydrophobicContact CE2-CB 3.98Å; F205-M338 HydrophobicContact CG-CB 3.83Å; F205-M338 HydrophobicContact CZ-CB 4.39Å; F205-M338 HydrophobicContact CZ-CE 4.32Å; I334-M338 HydrophobicContact CG2-CG 4.27Å; I334-M338 WeakPolarHBondContact O-CG 3.44Å; I334-M338 PolarHBondContact O-N 3.39Å; S335-M338 PolarHBondContact O-N 3.26Å; M338-T341 PolarHBondContact O-N 3Å; M338-L342 HydrophobicContact CE-CD1 4.29Å; M338-L342 WeakPolarHBondContact O-CB 3.23Å; M338-L342 WeakPolarHBondContact O-CG 3.1Å; M338-L342 PolarHBondContact O-N 3.41Å; M338-L477 HydrophobicContact CG-CD2 3.62Å; M338-L477 HydrophobicContact SD-CD2 3.65Å; M338-A480 HydrophobicContact CE-CB 3.7Å; M338-A480 HydrophobicContact SD-CB 4.05Å; M338-L481 HydrophobicContact CE-CD2 4Å; M338-L481 HydrophobicContact CE-CG 4.29Å; M338-L481 HydrophobicContact SD-CD2 3.96Å; M338-L481 HydrophobicContact SD-CG 3.88Å; M338-I484 HydrophobicContact CE-CD1 3.64Å
339	S	92.1	Very high	90.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.5	-53	179.5	-53.8	0	0	0	0	111.8	F205 S335 S336 T337 Y343	F205-S339 WeakPolarHBondContact CD2-OG 3.28Å; S335-S339 WeakPolarHBondContact O-CB 3.37Å; S335-S339 PolarHBondContact O-N 2.93Å; S335-S339 PolarHBondContact O-OG 2.59Å; S336-S339 PolarHBondContact O-N 2.82Å; T337-S339 VanDerWaalsContact C-N 3.28Å; T337-S339 PolarHBondContact O-N 3.4Å; S339-Y343 VanDerWaalsContact O-CB 3.23Å; S339-Y343 WeakPolarHBondContact O-CB 3.45Å; S339-Y343 PolarHBondContact O-N 2.93Å
340	W	91.8	Very high	91	Very high	1 Å²	1	20.3 Å²	20.3	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-68.1	-37.3	-179.3	-73	119.7	0	0	0	113.1	S336 T337 Y343 E344 Y392 V499 P501 P509	S336-W340 PolarHBondContact O-N 2.82Å; T337-W340 PolarHBondContact O-N 2.73Å; W340-Y343 HydrophobicContact CE3-CD1 4.05Å; W340-Y343 HydrophobicContact CZ3-CD1 4.11Å; W340-Y343 HydrophobicContact CZ3-CE1 4.3Å; W340-Y343 PolarHBondContact O-N 3.41Å; W340-E344 PolarHBondContact O-N 3.06Å; W340-Y392 HydrophobicContact CB-CD2 3.85Å; W340-Y392 HydrophobicContact CB-CG 4.03Å; W340-Y392 AromaticContact CD2-CD1 3.6Å; W340-Y392 HydrophobicContact CD2-CD1 3.6Å; W340-Y392 AromaticContact CD2-CD2 3.9Å; W340-Y392 HydrophobicContact CD2-CD2 3.9Å; W340-Y392 HydrophobicContact CD2-CE1 4.01Å; W340-Y392 HydrophobicContact CD2-CE2 4.28Å; W340-Y392 AromaticContact CD2-CG 3.53Å; W340-Y392 HydrophobicContact CD2-CG 3.53Å; W340-Y392 AromaticContact CE2-CD1 3.75Å; W340-Y392 AromaticContact CE3-CD1 3.66Å; W340-Y392 HydrophobicContact CE3-CD1 3.66Å; W340-Y392 AromaticContact CE3-CD2 3.83Å; W340-Y392 HydrophobicContact CE3-CD2 3.83Å; W340-Y392 AromaticContact CE3-CE1 3.54Å; W340-Y392 HydrophobicContact CE3-CE1 3.54Å; W340-Y392 AromaticContact CE3-CE2 3.72Å; W340-Y392 HydrophobicContact CE3-CE2 3.72Å; W340-Y392 AromaticContact CE3-CG 3.8Å; W340-Y392 HydrophobicContact CE3-CG 3.8Å; W340-Y392 AromaticContact CE3-CZ 3.57Å; W340-Y392 HydrophobicContact CG-CD1 4.19Å; W340-Y392 AromaticContact CG-CD2 3.93Å; W340-Y392 HydrophobicContact CG-CD2 3.93Å; W340-Y392 AromaticContact CG-CG 3.64Å; W340-Y392 HydrophobicContact CG-CG 3.64Å; W340-Y392 HydrophobicContact CH2-CD1 4.04Å; W340-Y392 AromaticContact CH2-CE1 3.78Å; W340-Y392 HydrophobicContact CH2-CE1 3.78Å; W340-Y392 AromaticContact CZ2-CD1 3.96Å; W340-Y392 HydrophobicContact CZ2-CD1 3.96Å; W340-Y392 HydrophobicContact CZ2-CE1 4.19Å; W340-Y392 AromaticContact CZ3-CD1 3.89Å; W340-Y392 HydrophobicContact CZ3-CD1 3.89Å; W340-Y392 AromaticContact CZ3-CE1 3.43Å; W340-Y392 HydrophobicContact CZ3-CE1 3.43Å; W340-Y392 VanDerWaalsContact CZ3-CE1 3.43Å; W340-Y392 HydrophobicContact CZ3-CE2 4.29Å; W340-Y392 HydrophobicContact CZ3-CG 4.48Å; W340-Y392 AromaticContact CZ3-CZ 3.66Å; W340-V499 HydrophobicContact CH2-CG1 4.07Å; W340-P501 HydrophobicContact CH2-CB 4.32Å; W340-P501 HydrophobicContact CZ2-CB 3.97Å; W340-P509 HydrophobicContact CH2-CB 4.22Å; W340-P509 HydrophobicContact CZ2-CB 3.87Å
341	T	92.6	Very high	91.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.6	-46.9	178.9	-54.5	0	0	0	0	110.7	T337 M338 E344 L345 T383 A387 L481	T337-T341 WeakPolarHBondContact O-CB 3.2Å; T337-T341 PolarHBondContact O-N 3.12Å; T337-T341 PolarHBondContact O-OG1 3.35Å; M338-T341 PolarHBondContact O-N 3Å; T341-E344 PolarHBondContact O-N 3.43Å; T341-L345 HydrophobicContact CG2-CD1 4.04Å; T341-L345 HydrophobicContact CG2-CG 4.49Å; T341-L345 WeakPolarHBondContact O-CB 3.36Å; T341-L345 VanDerWaalsContact O-CG 3.23Å; T341-L345 WeakPolarHBondContact O-CG 3.35Å; T341-L345 PolarHBondContact O-N 3.44Å; T341-T383 HydrophobicContact CG2-CG2 4.33Å; T341-A387 HydrophobicContact CG2-CB 4.3Å; T341-L481 HydrophobicContact CG2-CD1 3.84Å; T341-L481 HydrophobicContact CG2-CD2 4.06Å
342	L	92.6	Very high	91.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-70.9	-33.7	177.9	-69.8	173.8	0	0	0	112.7	F205 M338 L345 S346 L481 I484 V490 L515	F205-L342 HydrophobicContact CE1-CD1 4.33Å; F205-L342 HydrophobicContact CE2-CD1 3.68Å; F205-L342 HydrophobicContact CZ-CD1 3.28Å; M338-L342 HydrophobicContact CE-CD1 4.29Å; M338-L342 WeakPolarHBondContact O-CB 3.23Å; M338-L342 WeakPolarHBondContact O-CG 3.1Å; M338-L342 PolarHBondContact O-N 3.41Å; L342-L345 HydrophobicContact CD2-CD1 4.44Å; L342-L345 PolarHBondContact O-N 3.46Å; L342-S346 WeakPolarHBondContact O-CB 3.48Å; L342-S346 PolarHBondContact O-N 3.46Å; L342-L481 HydrophobicContact CD2-CD2 3.79Å; L342-L481 HydrophobicContact CG-CD2 4.01Å; L342-I484 HydrophobicContact CD1-CD1 4.33Å; L342-I484 HydrophobicContact CD2-CG2 4.16Å; L342-V490 HydrophobicContact CD2-CG2 4.26Å; L342-L515 HydrophobicContact CB-CD1 3.78Å
343	Y	91.9	Very high	91.9	Very high	16 Å²	16	23.5 Å²	23.5	6%	0.063	12%	0.115	C	C	.	.	H	α-helix	trans	-58.7	-48.2	172.5	178.7	-99.5	0	0	0	111.4	S339 W340 S346 V499 I513	S339-Y343 VanDerWaalsContact O-CB 3.23Å; S339-Y343 WeakPolarHBondContact O-CB 3.45Å; S339-Y343 PolarHBondContact O-N 2.93Å; W340-Y343 HydrophobicContact CE3-CD1 4.05Å; W340-Y343 HydrophobicContact CZ3-CD1 4.11Å; W340-Y343 HydrophobicContact CZ3-CE1 4.3Å; W340-Y343 PolarHBondContact O-N 3.41Å; Y343-S346 PolarHBondContact O-N 2.81Å; Y343-S346 PolarHBondContact O-OG 3.16Å; Y343-V499 HydrophobicContact CE2-CB 4.27Å; Y343-V499 HydrophobicContact CE2-CG2 4.15Å; Y343-V499 PolarHBondContact OH-N 3.22Å; Y343-V499 VanDerWaalsContact OH-N 3.12Å; Y343-I513 HydrophobicContact CD2-CG2 4.04Å
344	E	91.6	Very high	92.1	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.023	12%	0.116	C	C	.	.	H	α-helix	trans	-69.2	-39.3	177.1	-71.7	-54.4	138.2	0	0	112.9	W340 T341 S346 R347 H348 L391 Y392 F440	W340-E344 PolarHBondContact O-N 3.06Å; T341-E344 PolarHBondContact O-N 3.43Å; E344-S346 VanDerWaalsContact C-N 3.26Å; E344-S346 PolarHBondContact O-N 3.25Å; E344-R347 PolarHBondContact O-N 3.13Å; E344-R347 VanDerWaalsContact O-N 3.1Å; E344-R347 IonicContact OE1-NH1 3.88Å; E344-R347 PolarHBondContact OE1-NH1 2.9Å; E344-R347 IonicContact OE2-NH1 3.85Å; E344-H348 PolarHBondContact O-N 2.75Å; E344-H348 PolarHBondContact O-ND1 2.93Å; E344-H348 IonicContact OE2-CE1 3.78Å; E344-H348 PolarHBondContact OE2-CE1 2.82Å; E344-H348 IonicContact OE2-ND1 3.55Å; E344-L391 HydrophobicContact CG-CD1 4.48Å; E344-Y392 HydrophobicContact CG-CE2 3.81Å; E344-Y392 PolarHBondContact OE1-OH 2.82Å; E344-Y392 VanDerWaalsContact OE1-OH 3.12Å; E344-F440 HydrophobicContact CB-CD1 4.23Å; E344-F440 HydrophobicContact CB-CD2 4.08Å; E344-F440 HydrophobicContact CB-CE1 4.25Å; E344-F440 HydrophobicContact CB-CE2 4.13Å; E344-F440 HydrophobicContact CB-CG 4.12Å; E344-F440 HydrophobicContact CB-CZ 4.2Å; E344-F440 HydrophobicContact CG-CD2 4.26Å; E344-F440 HydrophobicContact CG-CG 4.44Å
345	L	92.4	Very high	92.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-30.6	175.6	-72.6	176.5	0	0	0	113.2	T341 L342 R347 H348 I351 Q352 L355 T383 F440 L485	T341-L345 HydrophobicContact CG2-CD1 4.04Å; T341-L345 HydrophobicContact CG2-CG 4.49Å; T341-L345 WeakPolarHBondContact O-CB 3.36Å; T341-L345 VanDerWaalsContact O-CG 3.23Å; T341-L345 WeakPolarHBondContact O-CG 3.35Å; T341-L345 PolarHBondContact O-N 3.44Å; L342-L345 HydrophobicContact CD2-CD1 4.44Å; L342-L345 PolarHBondContact O-N 3.46Å; L345-R347 PolarHBondContact O-N 3.31Å; L345-H348 CarbonylContact O-C 3.53Å; L345-H348 PolarHBondContact O-N 3.41Å; L345-I351 HydrophobicContact CD2-CG2 3.88Å; L345-Q352 PolarHBondContact O-NE2 3.06Å; L345-L355 HydrophobicContact CD1-CD1 4.12Å; L345-L355 HydrophobicContact CD2-CD1 3.47Å; L345-L355 VanDerWaalsContact CD2-CD1 3.47Å; L345-L355 HydrophobicContact CG-CD1 4.45Å; L345-T383 HydrophobicContact CD1-CG2 4.34Å; L345-T383 HydrophobicContact CD2-CG2 3.81Å; L345-T383 HydrophobicContact CG-CG2 4.27Å; L345-F440 HydrophobicContact CD2-CE1 4.4Å; L345-L485 HydrophobicContact CD1-CD1 4.39Å; L345-L485 HydrophobicContact CD1-CD2 4.41Å
346	S	91.8	Very high	92.3	Very high	7 Å²	7	25.4 Å²	25.4	5%	0.049	12%	0.124	C	C	.	.	H	α-helix	trans	-66.4	-27.5	175.3	80.5	0	0	0	0	112.5	L342 Y343 E344 V490 P492	L342-S346 WeakPolarHBondContact O-CB 3.48Å; L342-S346 PolarHBondContact O-N 3.46Å; Y343-S346 PolarHBondContact O-N 2.81Å; Y343-S346 PolarHBondContact O-OG 3.16Å; E344-S346 VanDerWaalsContact C-N 3.26Å; E344-S346 PolarHBondContact O-N 3.25Å; S346-V490 WeakPolarHBondContact CA-O 3.27Å; S346-P492 WeakPolarHBondContact O-CD 3.26Å
347	R	90.6	Very high	92.5	Very high	123 Å²	123	30.4 Å²	30.4	46%	0.464	15%	0.148	S	C	.	.	H	α-helix	trans	-89.8	-12.7	-179.1	-63.5	169.9	66.9	-158.3	1.1	113.1	E344 L345	E344-R347 PolarHBondContact O-N 3.13Å; E344-R347 VanDerWaalsContact O-N 3.1Å; E344-R347 IonicContact OE1-NH1 3.88Å; E344-R347 PolarHBondContact OE1-NH1 2.9Å; E344-R347 IonicContact OE2-NH1 3.85Å; L345-R347 PolarHBondContact O-N 3.31Å
348	H	92.4	Very high	92.6	Very high	39 Å²	39	31.7 Å²	31.7	18%	0.181	15%	0.154	C	C	.	.			trans	-128.2	72.3	-176.2	-59.6	89.7	0	0	0	110.6	E344 L345 E350 I351 Q352 F440	E344-H348 PolarHBondContact O-N 2.75Å; E344-H348 PolarHBondContact O-ND1 2.93Å; E344-H348 IonicContact OE2-CE1 3.78Å; E344-H348 PolarHBondContact OE2-CE1 2.82Å; E344-H348 IonicContact OE2-ND1 3.55Å; L345-H348 CarbonylContact O-C 3.53Å; L345-H348 PolarHBondContact O-N 3.41Å; H348-E350 WeakPolarHBondContact CB-OE1 3.37Å; H348-E350 IonicContact CD2-OE1 3.16Å; H348-E350 IonicContact CG-OE1 2.83Å; H348-E350 PolarHBondContact O-N 3.35Å; H348-I351 HydrophobicContact CB-CB 4.2Å; H348-I351 HydrophobicContact CB-CD1 3.82Å; H348-I351 HydrophobicContact CB-CG1 4.17Å; H348-I351 PolarHBondContact O-N 2.82Å; H348-I351 VanDerWaalsContact O-N 3.12Å; H348-Q352 PolarHBondContact O-N 3.49Å; H348-Q352 VanDerWaalsContact O-N 3.12Å; H348-F440 HydrophobicContact CB-CD1 4.38Å; H348-F440 AromaticContact CE1-CD1 3.87Å; H348-F440 AromaticContact CG-CD1 3.85Å; H348-F440 AromaticContact ND1-CD1 3.54Å
349	P	91.1	Very high	92.6	Very high	63 Å²	63	31.7 Å²	31.7	41%	0.409	15%	0.154	S	C	.	.	H	α-helix	trans	-57.9	-33.1	-176.7	23.9	-34	0	0	0	112.7	I351 Q352 D353	P349-I351 VanDerWaalsContact C-N 3.33Å; P349-I351 PolarHBondContact O-N 3.32Å; P349-Q352 WeakPolarHBondContact O-CB 3.35Å; P349-Q352 PolarHBondContact O-N 3.47Å; P349-D353 PolarHBondContact O-N 3.26Å
350	E	93.5	Very high	92.6	Very high	113 Å²	113	34.9 Å²	34.9	53%	0.528	17%	0.17	S	C	.	.	H	α-helix	trans	-62.3	-37.9	177.7	66.9	-70	163.5	0	0	113.2	H348 A354	H348-E350 WeakPolarHBondContact CB-OE1 3.37Å; H348-E350 IonicContact CD2-OE1 3.16Å; H348-E350 IonicContact CG-OE1 2.83Å; H348-E350 PolarHBondContact O-N 3.35Å; E350-A354 WeakPolarHBondContact O-CB 3.4Å; E350-A354 PolarHBondContact O-N 2.97Å
351	I	92.9	Very high	92.6	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.046	20%	0.199	C	C	.	.	H	α-helix	trans	-73.8	-39.6	175.8	-63	172.8	0	0	0	109.5	L345 H348 P349 D353 A354 L355 F440 P442	L345-I351 HydrophobicContact CD2-CG2 3.88Å; H348-I351 HydrophobicContact CB-CB 4.2Å; H348-I351 HydrophobicContact CB-CD1 3.82Å; H348-I351 HydrophobicContact CB-CG1 4.17Å; H348-I351 PolarHBondContact O-N 2.82Å; H348-I351 VanDerWaalsContact O-N 3.12Å; P349-I351 VanDerWaalsContact C-N 3.33Å; P349-I351 PolarHBondContact O-N 3.32Å; I351-D353 PolarHBondContact O-N 3.02Å; I351-A354 PolarHBondContact O-N 3.25Å; I351-L355 HydrophobicContact CG2-CD1 3.98Å; I351-L355 HydrophobicContact CG2-CG 4.42Å; I351-L355 WeakPolarHBondContact O-CB 3.45Å; I351-L355 WeakPolarHBondContact O-CG 3.34Å; I351-L355 PolarHBondContact O-N 3.31Å; I351-F440 HydrophobicContact CD1-CD1 3.69Å; I351-F440 HydrophobicContact CD1-CE1 3.68Å; I351-F440 HydrophobicContact CG2-CE1 4.27Å; I351-P442 HydrophobicContact CD1-CG 4.03Å; I351-P442 HydrophobicContact CG2-CG 4.03Å
352	Q	93.8	Very high	92.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-44.9	178.6	-163.7	-173.4	138.9	0	0	111.9	L345 H348 P349 L355 R356 L485 V490	L345-Q352 PolarHBondContact O-NE2 3.06Å; H348-Q352 PolarHBondContact O-N 3.49Å; H348-Q352 VanDerWaalsContact O-N 3.12Å; P349-Q352 WeakPolarHBondContact O-CB 3.35Å; P349-Q352 PolarHBondContact O-N 3.47Å; Q352-L355 PolarHBondContact O-N 3.41Å; Q352-R356 PolarHBondContact O-N 2.98Å; Q352-L485 HydrophobicContact CG-CD2 3.55Å; Q352-V490 PolarHBondContact NE2-O 3.47Å
353	D	93.6	Very high	92.3	Very high	69 Å²	69	40.4 Å²	40.4	37%	0.369	20%	0.204	S	C	.	.	H	α-helix	trans	-68	-41.2	177.6	-73.4	-29.4	0	0	0	111.8	P349 I351 L355 R356 E357 R520	P349-D353 PolarHBondContact O-N 3.26Å; I351-D353 PolarHBondContact O-N 3.02Å; D353-L355 VanDerWaalsContact C-N 3.33Å; D353-L355 PolarHBondContact O-N 3.29Å; D353-R356 PolarHBondContact O-N 2.87Å; D353-E357 WeakPolarHBondContact O-CG 3.18Å; D353-E357 PolarHBondContact O-N 3.21Å; D353-R520 IonicContact OD1-CZ 3.57Å; D353-R520 IonicContact OD1-NH1 2.8Å; D353-R520 PolarHBondContact OD1-NH1 3.25Å; D353-R520 IonicContact OD1-NH2 3.75Å; D353-R520 PolarHBondContact OD1-NH2 3.36Å
354	A	94.3	Very high	91.9	Very high	29 Å²	29	47.2 Å²	47.2	24%	0.24	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-40.4	175.1	0	0	0	0	0	112.6	E350 I351 E357 E358 L379	E350-A354 WeakPolarHBondContact O-CB 3.4Å; E350-A354 PolarHBondContact O-N 2.97Å; I351-A354 PolarHBondContact O-N 3.25Å; A354-E357 PolarHBondContact O-N 3.01Å; A354-E358 PolarHBondContact O-N 3.18Å; A354-L379 HydrophobicContact CB-CD2 3.83Å
355	L	93.6	Very high	91.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-41.3	174.3	-78.1	166.8	0	0	0	112	L345 I351 Q352 D353 E358 V359 L379 M380 T383 L485	L345-L355 HydrophobicContact CD1-CD1 4.12Å; L345-L355 HydrophobicContact CD2-CD1 3.47Å; L345-L355 VanDerWaalsContact CD2-CD1 3.47Å; L345-L355 HydrophobicContact CG-CD1 4.45Å; I351-L355 HydrophobicContact CG2-CD1 3.98Å; I351-L355 HydrophobicContact CG2-CG 4.42Å; I351-L355 WeakPolarHBondContact O-CB 3.45Å; I351-L355 WeakPolarHBondContact O-CG 3.34Å; I351-L355 PolarHBondContact O-N 3.31Å; Q352-L355 PolarHBondContact O-N 3.41Å; D353-L355 VanDerWaalsContact C-N 3.33Å; D353-L355 PolarHBondContact O-N 3.29Å; L355-E358 WeakPolarHBondContact O-CB 3.4Å; L355-E358 PolarHBondContact O-N 3.36Å; L355-V359 VanDerWaalsContact O-CG2 3.28Å; L355-V359 WeakPolarHBondContact O-CG2 3.41Å; L355-V359 PolarHBondContact O-N 3.11Å; L355-L379 HydrophobicContact CD2-CB 4.02Å; L355-L379 HydrophobicContact CD2-CD2 3.96Å; L355-L379 HydrophobicContact CD2-CG 3.6Å; L355-L379 HydrophobicContact CG-CD2 4.02Å; L355-L379 HydrophobicContact CG-CG 4.11Å; L355-M380 VanDerWaalsContact CD2-CA 3.48Å; L355-M380 HydrophobicContact CD2-CB 4.15Å; L355-M380 HydrophobicContact CD2-CE 4.3Å; L355-M380 HydrophobicContact CD2-SD 4.4Å; L355-T383 HydrophobicContact CD1-CG2 3.7Å; L355-L485 HydrophobicContact CB-CD1 3.8Å; L355-L485 HydrophobicContact CD1-CD1 4.15Å
356	R	92.4	Very high	90.9	Very high	52 Å²	52	55.9 Å²	55.9	20%	0.196	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-44.5	177.3	-177.1	-179.7	174.6	-89.4	2.3	111.3	Q352 D353 E358 V359 L360 L485	Q352-R356 PolarHBondContact O-N 2.98Å; D353-R356 PolarHBondContact O-N 2.87Å; R356-E358 VanDerWaalsContact C-N 3.31Å; R356-E358 PolarHBondContact O-N 2.8Å; R356-V359 PolarHBondContact O-N 3.46Å; R356-L360 HydrophobicContact CG-CD1 4.15Å; R356-L360 HydrophobicContact CG-CG 4.38Å; R356-L360 WeakPolarHBondContact O-CG 3.17Å; R356-L360 PolarHBondContact O-N 2.91Å; R356-L485 WeakPolarHBondContact CD-O 3.36Å
357	E	93.4	Very high	90.2	Very high	106 Å²	106	64.7 Å²	64.7	50%	0.495	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-39.4	175.9	-70.9	-57.3	133.5	0	0	112	D353 A354 L360 T361	D353-E357 WeakPolarHBondContact O-CG 3.18Å; D353-E357 PolarHBondContact O-N 3.21Å; A354-E357 PolarHBondContact O-N 3.01Å; E357-L360 PolarHBondContact O-N 2.85Å; E357-T361 WeakPolarHBondContact O-CB 3.47Å; E357-T361 PolarHBondContact O-N 3.38Å; E357-T361 PolarHBondContact O-OG1 3.07Å
358	E	94.2	Very high	90	Very high	32 Å²	32	62.9 Å²	62.9	15%	0.15	32%	0.324	C	S	.	.	H	α-helix	trans	-58.6	-48.9	171.7	179.4	178.5	-103.8	0	0	111.1	A354 L355 R356 L360 T361 V362 M377 P378 L379 M380	A354-E358 PolarHBondContact O-N 3.18Å; L355-E358 WeakPolarHBondContact O-CB 3.4Å; L355-E358 PolarHBondContact O-N 3.36Å; R356-E358 VanDerWaalsContact C-N 3.31Å; R356-E358 PolarHBondContact O-N 2.8Å; E358-L360 PolarHBondContact O-N 3.19Å; E358-T361 PolarHBondContact O-N 2.88Å; E358-V362 WeakPolarHBondContact O-CG2 3.2Å; E358-V362 PolarHBondContact O-N 2.98Å; E358-M377 HydrophobicContact CG-CB 4.49Å; E358-M377 HydrophobicContact CG-CG 4.45Å; E358-M377 WeakPolarHBondContact OE2-CA 3.01Å; E358-M377 WeakPolarHBondContact OE2-CB 3.4Å; E358-P378 WeakPolarHBondContact OE1-CD 3.24Å; E358-P378 WeakPolarHBondContact OE1-CG 3.33Å; E358-L379 VanDerWaalsContact CD-CB 3.5Å; E358-L379 WeakPolarHBondContact OE1-CB 3.48Å; E358-L379 PolarHBondContact OE1-N 2.85Å; E358-L379 WeakPolarHBondContact OE2-CB 3.34Å; E358-L379 PolarHBondContact OE2-N 2.76Å; E358-M380 PolarHBondContact OE2-N 3.05Å
359	V	92.3	Very high	89.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-44.7	-179.3	171.4	0	0	0	0	111.5	L355 R356 T361 V362 L363 M377 M380 M486	L355-V359 VanDerWaalsContact O-CG2 3.28Å; L355-V359 WeakPolarHBondContact O-CG2 3.41Å; L355-V359 PolarHBondContact O-N 3.11Å; R356-V359 PolarHBondContact O-N 3.46Å; V359-T361 VanDerWaalsContact C-N 3.34Å; V359-T361 PolarHBondContact O-N 3.29Å; V359-V362 PolarHBondContact O-N 2.88Å; V359-L363 HydrophobicContact CG1-CD1 3.55Å; V359-L363 HydrophobicContact CG1-CG 4.4Å; V359-L363 WeakPolarHBondContact O-CB 3.45Å; V359-L363 VanDerWaalsContact O-CG 3.29Å; V359-L363 WeakPolarHBondContact O-CG 3.13Å; V359-L363 PolarHBondContact O-N 3.24Å; V359-M377 HydrophobicContact CB-CE 4.46Å; V359-M377 HydrophobicContact CG1-CE 4.32Å; V359-M377 HydrophobicContact CG2-CE 4.18Å; V359-M377 HydrophobicContact CG2-SD 4.1Å; V359-M380 HydrophobicContact CG2-CE 4.07Å; V359-M486 HydrophobicContact CG1-CE 4.37Å; V359-M486 HydrophobicContact CG1-CG 3.72Å; V359-M486 HydrophobicContact CG1-SD 3.89Å
360	L	90.9	Very high	89.4	Confident	67 Å²	67	60 Å²	60	35%	0.351	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.6	-71.6	175.2	0	0	0	112.1	R356 E357 E358 E364	R356-L360 HydrophobicContact CG-CD1 4.15Å; R356-L360 HydrophobicContact CG-CG 4.38Å; R356-L360 WeakPolarHBondContact O-CG 3.17Å; R356-L360 PolarHBondContact O-N 2.91Å; E357-L360 PolarHBondContact O-N 2.85Å; E358-L360 PolarHBondContact O-N 3.19Å; L360-E364 PolarHBondContact O-N 3.38Å
361	T	92.1	Very high	88.9	Confident	100 Å²	100	56.2 Å²	56.2	61%	0.613	29%	0.29	S	S	*	.	H	α-helix	trans	-64.8	-43.8	178.6	-58.8	0	0	0	0	111.4	E357 E358 V359 E364	E357-T361 WeakPolarHBondContact O-CB 3.47Å; E357-T361 PolarHBondContact O-N 3.38Å; E357-T361 PolarHBondContact O-OG1 3.07Å; E358-T361 PolarHBondContact O-N 2.88Å; V359-T361 VanDerWaalsContact C-N 3.34Å; V359-T361 PolarHBondContact O-N 3.29Å; T361-E364 WeakPolarHBondContact O-CG 3.39Å
362	V	91.3	Very high	88.5	Confident	15 Å²	15	59.7 Å²	59.7	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-70.5	-36	-178.4	171.9	0	0	0	0	112.2	E358 V359 D373 R376 M377	E358-V362 WeakPolarHBondContact O-CG2 3.2Å; E358-V362 PolarHBondContact O-N 2.98Å; V359-V362 PolarHBondContact O-N 2.88Å; V362-D373 HydrophobicContact CG1-CB 3.72Å; V362-R376 HydrophobicContact CG1-CB 4.08Å; V362-R376 HydrophobicContact CG2-CB 4.2Å; V362-R376 PolarHBondContact O-NH2 2.93Å; V362-R376 VanDerWaalsContact O-NH2 3.12Å; V362-M377 HydrophobicContact CB-CE 4.06Å; V362-M377 HydrophobicContact CB-CG 4.45Å; V362-M377 HydrophobicContact CG1-CE 3.87Å; V362-M377 HydrophobicContact CG1-CG 4.39Å; V362-M377 HydrophobicContact CG2-CG 4.11Å
363	L	87.3	Confident	88.2	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-78.2	-19.9	-176.5	-74.9	171.9	0	0	0	113.9	V359 G365 R366 P369 M486	V359-L363 HydrophobicContact CG1-CD1 3.55Å; V359-L363 HydrophobicContact CG1-CG 4.4Å; V359-L363 WeakPolarHBondContact O-CB 3.45Å; V359-L363 VanDerWaalsContact O-CG 3.29Å; V359-L363 WeakPolarHBondContact O-CG 3.13Å; V359-L363 PolarHBondContact O-N 3.24Å; L363-G365 PolarHBondContact O-N 3.39Å; L363-G365 VanDerWaalsContact O-N 3.1Å; L363-R366 HydrophobicContact CB-CB 4.44Å; L363-R366 WeakPolarHBondContact CB-O 3.49Å; L363-R366 HydrophobicContact CD2-CB 4.29Å; L363-R366 WeakPolarHBondContact O-CB 3.35Å; L363-R366 PolarHBondContact O-N 2.95Å; L363-P369 HydrophobicContact CD2-CB 3.91Å; L363-M486 HydrophobicContact CD1-CE 3.63Å; L363-M486 HydrophobicContact CD1-SD 3.26Å; L363-M486 WeakPolarHBondContact CD1-SD 3.33Å
364	E	85.5	Confident	87.8	Confident	159 Å²	159	56.5 Å²	56.5	74%	0.743	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	37.8	176.9	-60.5	176.7	-161.7	0	0	112.8	L360 T361	L360-E364 PolarHBondContact O-N 3.38Å; T361-E364 WeakPolarHBondContact O-CG 3.39Å
365	G	77.3	Confident	87.4	Confident	78 Å²	78	58 Å²	58	80%	0.804	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	-2.7	-179.6	0	0	0	0	0	115.9	L363	L363-G365 PolarHBondContact O-N 3.39Å; L363-G365 VanDerWaalsContact O-N 3.1Å
366	R	84.3	Confident	87.1	Confident	109 Å²	109	63.6 Å²	63.6	41%	0.411	33%	0.328	S	S	.	.			trans	-73.7	152.6	167.8	-67.1	-173.1	-67	146	-5.6	111.3	L363 D370 D373	L363-R366 HydrophobicContact CB-CB 4.44Å; L363-R366 WeakPolarHBondContact CB-O 3.49Å; L363-R366 HydrophobicContact CD2-CB 4.29Å; L363-R366 WeakPolarHBondContact O-CB 3.35Å; L363-R366 PolarHBondContact O-N 2.95Å; R366-D370 IonicContact CZ-OD2 2.85Å; R366-D370 IonicContact NH1-OD2 2.63Å; R366-D370 PolarHBondContact NH1-OD2 2.75Å; R366-D370 IonicContact NH2-OD2 2.78Å; R366-D373 IonicContact CZ-OD1 3.37Å; R366-D373 IonicContact CZ-OD2 3.85Å; R366-D373 VanDerWaalsContact CZ-OD2 3.23Å; R366-D373 IonicContact NH1-OD2 3.85Å; R366-D373 PolarHBondContact NH1-OD2 3.12Å; R366-D373 VanDerWaalsContact NH1-OD2 3.14Å; R366-D373 IonicContact NH2-OD1 3.99Å; R366-D373 PolarHBondContact NH2-OD1 3.46Å; R366-D373 IonicContact NH2-OD2 3.16Å; R366-D373 PolarHBondContact NH2-OD2 3.12Å
367	R	78.1	Confident	87	Confident	192 Å²	192	61.1 Å²	61.1	73%	0.725	32%	0.319	S	S	*	.	S	Bend	trans	-98.9	-17.6	178.1	-66.3	-170.9	-179.9	-161	-0.8	114.4	M486	R367-M486 VanDerWaalsContact O-CE 3.23Å; R367-M486 WeakPolarHBondContact O-CE 3.29Å
368	I	85.3	Confident	87	Confident	86 Å²	86	59.1 Å²	59.1	44%	0.441	32%	0.315	S	S	.	.	S	Bend	trans	-120.7	113.7	-173.9	-59.7	176.5	0	0	0	107.6	N178	N178-I368 HydrophobicContact CB-CG2 3.99Å; N178-I368 VanDerWaalsContact CG-CG2 3.43Å; N178-I368 WeakPolarHBondContact OD1-CG2 3.46Å
369	P	86.5	Confident	86.9	Confident	1 Å²	1	58 Å²	58	1%	0.006	31%	0.31	C	S	.	.			trans	-71.8	147	173.3	25.4	-27.2	0	0	0	111.5	N178 L363 D373 L479 R483	N178-P369 PolarHBondContact ND2-O 2.89Å; L363-P369 HydrophobicContact CD2-CB 3.91Å; P369-D373 HydrophobicContact CB-CB 4.28Å; P369-L479 HydrophobicContact CB-CD2 3.99Å; P369-L479 HydrophobicContact CG-CD2 3.75Å; P369-L479 VanDerWaalsContact O-CD2 3.27Å; P369-L479 WeakPolarHBondContact O-CD2 3.46Å; P369-R483 HydrophobicContact CG-CG 4.05Å
370	D	84.4	Confident	86.8	Confident	41 Å²	41	58 Å²	58	22%	0.219	31%	0.31	C	S	.	.			trans	-109.1	174.5	168.7	62.1	50	0	0	0	111.6	R366 T372 D373 V374	R366-D370 IonicContact CZ-OD2 2.85Å; R366-D370 IonicContact NH1-OD2 2.63Å; R366-D370 PolarHBondContact NH1-OD2 2.75Å; R366-D370 IonicContact NH2-OD2 2.78Å; D370-T372 PolarHBondContact O-N 3.33Å; D370-T372 VanDerWaalsContact OD1-CA 3.29Å; D370-T372 WeakPolarHBondContact OD1-CA 3.49Å; D370-T372 WeakPolarHBondContact OD1-CB 3.33Å; D370-T372 PolarHBondContact OD1-N 3.3Å; D370-T372 PolarHBondContact OD1-OG1 3.48Å; D370-D373 VanDerWaalsContact CG-OD2 3.23Å; D370-D373 PolarHBondContact N-OD2 3.46Å; D370-D373 WeakPolarHBondContact O-CB 3.31Å; D370-D373 PolarHBondContact O-N 2.9Å; D370-D373 VanDerWaalsContact O-N 3.16Å; D370-D373 PolarHBondContact OD1-N 2.99Å; D370-V374 WeakPolarHBondContact O-CG2 3.44Å; D370-V374 PolarHBondContact O-N 2.91Å; D370-V374 VanDerWaalsContact O-N 3.07Å
371	N	82.6	Confident	86.9	Confident	33 Å²	33	58.2 Å²	58.2	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-29.5	178.2	175.7	56.5	0	0	0	113.3	E171 D174 A375 L475	E171-N371 HydrophobicContact CG-CB 4.09Å; E171-N371 WeakPolarHBondContact CG-ND2 3.43Å; E171-N371 PolarHBondContact OE1-ND2 3.15Å; D174-N371 WeakPolarHBondContact OD1-CB 3.36Å; D174-N371 WeakPolarHBondContact OD2-CB 3.48Å; D174-N371 PolarHBondContact OD2-N 3.33Å; N371-A375 PolarHBondContact O-N 3.31Å; N371-L475 HydrophobicContact CB-CD1 4.08Å
372	T	85.4	Confident	86.8	Confident	81 Å²	81	53.8 Å²	53.8	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-73.5	-32.1	178.3	74.8	0	0	0	0	112	D370 A375	D370-T372 PolarHBondContact O-N 3.33Å; D370-T372 VanDerWaalsContact OD1-CA 3.29Å; D370-T372 WeakPolarHBondContact OD1-CA 3.49Å; D370-T372 WeakPolarHBondContact OD1-CB 3.33Å; D370-T372 PolarHBondContact OD1-N 3.3Å; D370-T372 PolarHBondContact OD1-OG1 3.48Å; T372-A375 WeakPolarHBondContact O-CB 3.35Å; T372-A375 PolarHBondContact O-N 3.34Å
373	D	87	Confident	86.8	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-48.9	172	-63	-37.1	0	0	0	111.3	V362 R366 P369 D370 A375 R376 M377	V362-D373 HydrophobicContact CG1-CB 3.72Å; R366-D373 IonicContact CZ-OD1 3.37Å; R366-D373 IonicContact CZ-OD2 3.85Å; R366-D373 VanDerWaalsContact CZ-OD2 3.23Å; R366-D373 IonicContact NH1-OD2 3.85Å; R366-D373 PolarHBondContact NH1-OD2 3.12Å; R366-D373 VanDerWaalsContact NH1-OD2 3.14Å; R366-D373 IonicContact NH2-OD1 3.99Å; R366-D373 PolarHBondContact NH2-OD1 3.46Å; R366-D373 IonicContact NH2-OD2 3.16Å; R366-D373 PolarHBondContact NH2-OD2 3.12Å; P369-D373 HydrophobicContact CB-CB 4.28Å; D370-D373 VanDerWaalsContact CG-OD2 3.23Å; D370-D373 PolarHBondContact N-OD2 3.46Å; D370-D373 WeakPolarHBondContact O-CB 3.31Å; D370-D373 PolarHBondContact O-N 2.9Å; D370-D373 VanDerWaalsContact O-N 3.16Å; D370-D373 PolarHBondContact OD1-N 2.99Å; D373-A375 PolarHBondContact O-N 2.76Å; D373-A375 VanDerWaalsContact O-N 3.17Å; D373-R376 CarbonylContact O-C 3.59Å; D373-R376 WeakPolarHBondContact O-CA 3.39Å; D373-R376 WeakPolarHBondContact O-CB 3.23Å; D373-R376 PolarHBondContact O-N 3.49Å; D373-R376 IonicContact OD1-CZ 2.72Å; D373-R376 IonicContact OD1-NH2 3.32Å; D373-R376 PolarHBondContact OD1-NH2 2.89Å; D373-M377 HydrophobicContact CB-CE 4.18Å; D373-M377 WeakPolarHBondContact O-CG 3.27Å; D373-M377 PolarHBondContact O-N 3.29Å
374	V	84.9	Confident	86.9	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-33.5	176	170.1	0	0	0	0	111.1	D370 R376 M377 K381 L475 Y478 L479	D370-V374 WeakPolarHBondContact O-CG2 3.44Å; D370-V374 PolarHBondContact O-N 2.91Å; D370-V374 VanDerWaalsContact O-N 3.07Å; V374-R376 PolarHBondContact O-N 2.88Å; V374-M377 PolarHBondContact O-N 2.95Å; V374-K381 WeakPolarHBondContact O-CE 3.32Å; V374-K381 PolarHBondContact O-NZ 2.86Å; V374-L475 HydrophobicContact CG2-CD1 4.48Å; V374-Y478 VanDerWaalsContact CG1-CB 3.48Å; V374-Y478 HydrophobicContact CG1-CD2 3.23Å; V374-Y478 HydrophobicContact CG1-CE2 4.23Å; V374-Y478 HydrophobicContact CG1-CG 3.69Å; V374-L479 HydrophobicContact CG2-CD2 3.91Å; V374-L479 HydrophobicContact CG2-CG 4.48Å
375	A	85.9	Confident	87	Confident	59 Å²	59	49.7 Å²	49.7	49%	0.488	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-32.4	174	0	0	0	0	0	112.8	N371 T372 D373 K381	N371-A375 PolarHBondContact O-N 3.31Å; T372-A375 WeakPolarHBondContact O-CB 3.35Å; T372-A375 PolarHBondContact O-N 3.34Å; D373-A375 PolarHBondContact O-N 2.76Å; D373-A375 VanDerWaalsContact O-N 3.17Å; A375-K381 PolarHBondContact O-NZ 3.39Å
376	R	88.1	Confident	87.5	Confident	119 Å²	119	46 Å²	46	45%	0.449	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.4	-177.6	-62.2	-175.1	-68.8	159.2	4.1	114.7	V362 D373 V374 P378	V362-R376 HydrophobicContact CG1-CB 4.08Å; V362-R376 HydrophobicContact CG2-CB 4.2Å; V362-R376 PolarHBondContact O-NH2 2.93Å; V362-R376 VanDerWaalsContact O-NH2 3.12Å; D373-R376 CarbonylContact O-C 3.59Å; D373-R376 WeakPolarHBondContact O-CA 3.39Å; D373-R376 WeakPolarHBondContact O-CB 3.23Å; D373-R376 PolarHBondContact O-N 3.49Å; D373-R376 IonicContact OD1-CZ 2.72Å; D373-R376 IonicContact OD1-NH2 3.32Å; D373-R376 PolarHBondContact OD1-NH2 2.89Å; V374-R376 PolarHBondContact O-N 2.88Å; R376-P378 VanDerWaalsContact C-CD 3.44Å; R376-P378 WeakPolarHBondContact O-CD 3.39Å
377	M	91.4	Very high	87.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.			trans	-105.6	79.8	179.3	-63.9	172.6	-175.5	0	0	112.2	E358 V359 V362 D373 V374 M380 K381	E358-M377 HydrophobicContact CG-CB 4.49Å; E358-M377 HydrophobicContact CG-CG 4.45Å; E358-M377 WeakPolarHBondContact OE2-CA 3.01Å; E358-M377 WeakPolarHBondContact OE2-CB 3.4Å; V359-M377 HydrophobicContact CB-CE 4.46Å; V359-M377 HydrophobicContact CG1-CE 4.32Å; V359-M377 HydrophobicContact CG2-CE 4.18Å; V359-M377 HydrophobicContact CG2-SD 4.1Å; V362-M377 HydrophobicContact CB-CE 4.06Å; V362-M377 HydrophobicContact CB-CG 4.45Å; V362-M377 HydrophobicContact CG1-CE 3.87Å; V362-M377 HydrophobicContact CG1-CG 4.39Å; V362-M377 HydrophobicContact CG2-CG 4.11Å; D373-M377 HydrophobicContact CB-CE 4.18Å; D373-M377 WeakPolarHBondContact O-CG 3.27Å; D373-M377 PolarHBondContact O-N 3.29Å; V374-M377 PolarHBondContact O-N 2.95Å; M377-M380 HydrophobicContact CB-CB 3.8Å; M377-K381 WeakPolarHBondContact O-CG 3.45Å; M377-K381 PolarHBondContact O-N 3.11Å
378	P	92.1	Very high	87.1	Confident	63 Å²	63	32.2 Å²	32.2	41%	0.409	17%	0.171	S	C	.	.	H	α-helix	trans	-70.3	-34.4	-178.5	30.3	-38.1	0	0	0	113.8	E358 R376 K381 A382 F446	E358-P378 WeakPolarHBondContact OE1-CD 3.24Å; E358-P378 WeakPolarHBondContact OE1-CG 3.33Å; R376-P378 VanDerWaalsContact C-CD 3.44Å; R376-P378 WeakPolarHBondContact O-CD 3.39Å; P378-K381 PolarHBondContact O-N 2.74Å; P378-A382 WeakPolarHBondContact O-CB 3.4Å; P378-A382 PolarHBondContact O-N 3.43Å; P378-F446 HydrophobicContact CB-CE1 3.78Å; P378-F446 HydrophobicContact CB-CZ 4.21Å; P378-F446 HydrophobicContact CG-CE1 4.14Å
379	L	92.1	Very high	86.1	Confident	10 Å²	10	28.4 Å²	28.4	5%	0.052	15%	0.152	C	C	.	.	H	α-helix	trans	-68.3	-42	178	-174.5	63.4	0	0	0	110.4	A354 L355 E358 K381 A382 T383 P442 Y443 F446	A354-L379 HydrophobicContact CB-CD2 3.83Å; L355-L379 HydrophobicContact CD2-CB 4.02Å; L355-L379 HydrophobicContact CD2-CD2 3.96Å; L355-L379 HydrophobicContact CD2-CG 3.6Å; L355-L379 HydrophobicContact CG-CD2 4.02Å; L355-L379 HydrophobicContact CG-CG 4.11Å; E358-L379 VanDerWaalsContact CD-CB 3.5Å; E358-L379 WeakPolarHBondContact OE1-CB 3.48Å; E358-L379 PolarHBondContact OE1-N 2.85Å; E358-L379 WeakPolarHBondContact OE2-CB 3.34Å; E358-L379 PolarHBondContact OE2-N 2.76Å; L379-K381 VanDerWaalsContact C-N 3.31Å; L379-K381 PolarHBondContact O-N 3.45Å; L379-A382 WeakPolarHBondContact O-CB 3.41Å; L379-A382 PolarHBondContact O-N 2.98Å; L379-A382 VanDerWaalsContact O-N 3.11Å; L379-T383 WeakPolarHBondContact O-CB 3.33Å; L379-T383 PolarHBondContact O-N 3.24Å; L379-T383 PolarHBondContact O-OG1 3.42Å; L379-P442 HydrophobicContact CD1-CB 4.42Å; L379-Y443 HydrophobicContact CD1-CD1 4.22Å; L379-Y443 HydrophobicContact CD1-CE1 3.81Å; L379-F446 HydrophobicContact CB-CZ 4.07Å; L379-F446 HydrophobicContact CD1-CE2 3.74Å; L379-F446 HydrophobicContact CD1-CZ 4.08Å
380	M	91.6	Very high	85.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-54.8	-46.8	172.9	-176.8	61.4	72.6	0	0	112.1	L355 E358 V359 M377 A382 T383 V384 Y478 L481 L485	L355-M380 VanDerWaalsContact CD2-CA 3.48Å; L355-M380 HydrophobicContact CD2-CB 4.15Å; L355-M380 HydrophobicContact CD2-CE 4.3Å; L355-M380 HydrophobicContact CD2-SD 4.4Å; E358-M380 PolarHBondContact OE2-N 3.05Å; V359-M380 HydrophobicContact CG2-CE 4.07Å; M377-M380 HydrophobicContact CB-CB 3.8Å; M380-A382 VanDerWaalsContact C-N 3.34Å; M380-A382 PolarHBondContact O-N 3.3Å; M380-T383 PolarHBondContact O-N 2.89Å; M380-V384 WeakPolarHBondContact O-CG2 3.46Å; M380-V384 PolarHBondContact O-N 2.91Å; M380-V384 HydrophobicContact SD-CG2 4.49Å; M380-Y478 HydrophobicContact CG-CD1 3.61Å; M380-Y478 HydrophobicContact CG-CE1 4.25Å; M380-Y478 HydrophobicContact CG-CG 4.34Å; M380-L481 HydrophobicContact CE-CB 3.97Å; M380-L481 HydrophobicContact SD-CB 3.77Å; M380-L481 HydrophobicContact SD-CD1 3.96Å; M380-L485 HydrophobicContact CE-CD1 3.98Å
381	K	91	Very high	85.8	Confident	71 Å²	71	26.6 Å²	26.6	31%	0.309	14%	0.142	S	C	.	.	H	α-helix	trans	-62.8	-41.2	176.7	-69.9	168.1	-179.7	172.3	0	112	V374 A375 M377 P378 L379 K385 Y478	V374-K381 WeakPolarHBondContact O-CE 3.32Å; V374-K381 PolarHBondContact O-NZ 2.86Å; A375-K381 PolarHBondContact O-NZ 3.39Å; M377-K381 WeakPolarHBondContact O-CG 3.45Å; M377-K381 PolarHBondContact O-N 3.11Å; P378-K381 PolarHBondContact O-N 2.74Å; L379-K381 VanDerWaalsContact C-N 3.31Å; L379-K381 PolarHBondContact O-N 3.45Å; K381-K385 WeakPolarHBondContact O-CB 3.46Å; K381-K385 PolarHBondContact O-N 3.44Å; K381-Y478 HydrophobicContact CG-CE1 4.1Å; K381-Y478 HydrophobicContact CG-CE2 3.99Å
382	A	90.9	Very high	86	Confident	6 Å²	6	26.2 Å²	26.2	5%	0.05	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-41.6	177.5	0	0	0	0	0	111.9	P378 L379 M380 K385 E386 P442 W445 F446	P378-A382 WeakPolarHBondContact O-CB 3.4Å; P378-A382 PolarHBondContact O-N 3.43Å; L379-A382 WeakPolarHBondContact O-CB 3.41Å; L379-A382 PolarHBondContact O-N 2.98Å; L379-A382 VanDerWaalsContact O-N 3.11Å; M380-A382 VanDerWaalsContact C-N 3.34Å; M380-A382 PolarHBondContact O-N 3.3Å; A382-K385 PolarHBondContact O-N 2.95Å; A382-E386 WeakPolarHBondContact O-CB 3.28Å; A382-E386 PolarHBondContact O-N 3.42Å; A382-P442 HydrophobicContact CB-CB 4.4Å; A382-W445 HydrophobicContact CB-CB 3.94Å; A382-W445 HydrophobicContact CB-CG 4.38Å; A382-F446 HydrophobicContact CB-CE2 3.87Å; A382-F446 HydrophobicContact CB-CZ 4.32Å
383	T	91.5	Very high	86	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-50.8	177.9	-64.3	0	0	0	0	111.6	T341 L345 L355 L379 M380 K385 E386 A387 F440	T341-T383 HydrophobicContact CG2-CG2 4.33Å; L345-T383 HydrophobicContact CD1-CG2 4.34Å; L345-T383 HydrophobicContact CD2-CG2 3.81Å; L345-T383 HydrophobicContact CG-CG2 4.27Å; L355-T383 HydrophobicContact CD1-CG2 3.7Å; L379-T383 WeakPolarHBondContact O-CB 3.33Å; L379-T383 PolarHBondContact O-N 3.24Å; L379-T383 PolarHBondContact O-OG1 3.42Å; M380-T383 PolarHBondContact O-N 2.89Å; T383-K385 VanDerWaalsContact C-N 3.26Å; T383-K385 PolarHBondContact O-N 3.11Å; T383-E386 PolarHBondContact O-N 3.18Å; T383-A387 WeakPolarHBondContact O-CB 3.2Å; T383-A387 PolarHBondContact O-N 3.35Å; T383-F440 HydrophobicContact CG2-CZ 3.86Å
384	V	89.1	Confident	86	Confident	5 Å²	5	23.2 Å²	23.2	3%	0.03	12%	0.12	C	C	.	.	H	α-helix	trans	-60.9	-41.1	175.3	174.1	0	0	0	0	109.7	M380 E386 A387 L388 L477 Y478 L481	M380-V384 WeakPolarHBondContact O-CG2 3.46Å; M380-V384 PolarHBondContact O-N 2.91Å; M380-V384 HydrophobicContact SD-CG2 4.49Å; V384-E386 PolarHBondContact O-N 3.12Å; V384-A387 PolarHBondContact O-N 3.14Å; V384-L388 HydrophobicContact CG1-CB 4.3Å; V384-L388 WeakPolarHBondContact O-CA 3.45Å; V384-L388 WeakPolarHBondContact O-CB 3.13Å; V384-L388 PolarHBondContact O-N 3.12Å; V384-L477 HydrophobicContact CG1-CD1 4.24Å; V384-Y478 HydrophobicContact CB-CE1 3.81Å; V384-Y478 HydrophobicContact CG1-CE1 4.2Å; V384-Y478 HydrophobicContact CG2-CD1 3.96Å; V384-Y478 HydrophobicContact CG2-CE1 3.63Å; V384-L481 HydrophobicContact CG2-CD1 3.46Å; V384-L481 VanDerWaalsContact CG2-CD1 3.46Å
385	K	88.3	Confident	86.1	Confident	84 Å²	84	25.6 Å²	25.6	37%	0.365	13%	0.132	S	C	.	.	H	α-helix	trans	-61.8	-42.6	177.3	-166.5	178.8	-179.1	-165.8	0	112	K381 A382 T383 S389 W445	K381-K385 WeakPolarHBondContact O-CB 3.46Å; K381-K385 PolarHBondContact O-N 3.44Å; A382-K385 PolarHBondContact O-N 2.95Å; T383-K385 VanDerWaalsContact C-N 3.26Å; T383-K385 PolarHBondContact O-N 3.11Å; K385-S389 WeakPolarHBondContact CA-OG 3.23Å; K385-S389 VanDerWaalsContact O-CA 3.26Å; K385-S389 WeakPolarHBondContact O-CA 3.43Å; K385-S389 WeakPolarHBondContact O-CB 3.48Å; K385-S389 PolarHBondContact O-N 2.93Å; K385-S389 PolarHBondContact O-OG 3.4Å; K385-W445 HydrophobicContact CD-CD2 3.63Å; K385-W445 HydrophobicContact CD-CE3 3.7Å; K385-W445 HydrophobicContact CD-CG 4.22Å; K385-W445 HydrophobicContact CD-CH2 4.05Å; K385-W445 HydrophobicContact CD-CZ2 4.02Å; K385-W445 HydrophobicContact CD-CZ3 3.92Å; K385-W445 VanDerWaalsContact CE-CE3 3.49Å; K385-W445 VanDerWaalsContact CE-CH2 3.49Å; K385-W445 HydrophobicContact CG-CD2 4.16Å; K385-W445 HydrophobicContact CG-CH2 4.18Å; K385-W445 HydrophobicContact CG-CZ2 3.81Å
386	E	88.3	Confident	86.1	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-48.7	177.7	-172.5	69	174.8	0	0	112.2	A382 T383 V384 R390 L391 F440 H441 P442 R444 W445	A382-E386 WeakPolarHBondContact O-CB 3.28Å; A382-E386 PolarHBondContact O-N 3.42Å; T383-E386 PolarHBondContact O-N 3.18Å; V384-E386 PolarHBondContact O-N 3.12Å; E386-R390 VanDerWaalsContact O-CB 3.31Å; E386-R390 WeakPolarHBondContact O-CB 3.24Å; E386-R390 PolarHBondContact O-N 3.41Å; E386-R390 IonicContact OE1-CZ 2.83Å; E386-R390 IonicContact OE1-NE 3.79Å; E386-R390 PolarHBondContact OE1-NE 2.81Å; E386-R390 IonicContact OE1-NH2 3.42Å; E386-R390 PolarHBondContact OE1-NH2 3.09Å; E386-R390 VanDerWaalsContact OE1-NH2 3.16Å; E386-R390 WeakPolarHBondContact OE2-CD 3.47Å; E386-R390 IonicContact OE2-NE 3.58Å; E386-R390 PolarHBondContact OE2-NE 2.97Å; E386-R390 VanDerWaalsContact OE2-NE 3.16Å; E386-L391 PolarHBondContact O-N 2.61Å; E386-F440 HydrophobicContact CB-CD2 4.26Å; E386-F440 HydrophobicContact CB-CE2 3.88Å; E386-F440 HydrophobicContact CG-CD2 3.55Å; E386-F440 HydrophobicContact CG-CE2 3.69Å; E386-F440 HydrophobicContact CG-CG 4.46Å; E386-H441 PolarHBondContact OE1-N 2.99Å; E386-P442 HydrophobicContact CB-CG 4.38Å; E386-P442 HydrophobicContact CG-CG 4.49Å; E386-R444 IonicContact OE1-CZ 2.75Å; E386-R444 IonicContact OE1-NE 3.71Å; E386-R444 PolarHBondContact OE1-NE 3.34Å; E386-R444 IonicContact OE1-NH2 3.9Å; E386-R444 VanDerWaalsContact OE2-CD 3.28Å; E386-R444 WeakPolarHBondContact OE2-CD 3.01Å; E386-R444 IonicContact OE2-NE 3.72Å; E386-R444 PolarHBondContact OE2-NE 3.05Å; E386-W445 PolarHBondContact OE2-NE1 3.47Å
387	A	81.9	Confident	86	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-67.1	-56.2	-179.4	0	0	0	0	0	111.9	T341 T383 V384 Y392 F440	T341-A387 HydrophobicContact CG2-CB 4.3Å; T383-A387 WeakPolarHBondContact O-CB 3.2Å; T383-A387 PolarHBondContact O-N 3.35Å; V384-A387 PolarHBondContact O-N 3.14Å; A387-Y392 PolarHBondContact O-N 2.95Å; A387-F440 HydrophobicContact CB-CE2 3.98Å
388	L	70	Confident	85.8	Confident	13 Å²	13	19.4 Å²	19.4	7%	0.068	11%	0.105	C	C	.	.	I	π-helix	trans	-72.4	-43.5	-175.9	177.8	121.1	0	0	0	112.7	T337 V384 Y392 P393 V394 P459 F460	T337-L388 HydrophobicContact CG2-CB 4.17Å; T337-L388 HydrophobicContact CG2-CD1 3.17Å; T337-L388 HydrophobicContact CG2-CG 4.27Å; T337-L388 WeakPolarHBondContact OG1-CD1 3.43Å; V384-L388 HydrophobicContact CG1-CB 4.3Å; V384-L388 WeakPolarHBondContact O-CA 3.45Å; V384-L388 WeakPolarHBondContact O-CB 3.13Å; V384-L388 PolarHBondContact O-N 3.12Å; L388-Y392 CarbonylContact O-C 3.49Å; L388-P393 WeakPolarHBondContact O-CA 3.5Å; L388-V394 HydrophobicContact CD1-CG2 4.28Å; L388-P459 HydrophobicContact CD2-CB 3.4Å; L388-P459 VanDerWaalsContact CD2-CB 3.4Å; L388-P459 HydrophobicContact CD2-CG 3.93Å; L388-P459 HydrophobicContact CG-CB 4.46Å; L388-F460 HydrophobicContact CD2-CE2 4.16Å; L388-F460 HydrophobicContact CD2-CZ 4.21Å
389	S	64.9	Low	85.6	Confident	6 Å²	6	17.5 Å²	17.5	4%	0.042	9%	0.094	C	C	.	.	I	π-helix	trans	-96.7	-15.4	-162.8	-36.1	0	0	0	0	113.2	K385 S457 P459	K385-S389 WeakPolarHBondContact CA-OG 3.23Å; K385-S389 VanDerWaalsContact O-CA 3.26Å; K385-S389 WeakPolarHBondContact O-CA 3.43Å; K385-S389 WeakPolarHBondContact O-CB 3.48Å; K385-S389 PolarHBondContact O-N 2.93Å; K385-S389 PolarHBondContact O-OG 3.4Å; S389-S457 WeakPolarHBondContact CB-OG 3.28Å; S389-S457 PolarHBondContact O-OG 3.16Å; S389-P459 VanDerWaalsContact OG-CG 3.25Å; S389-P459 WeakPolarHBondContact OG-CG 3.47Å
390	R	80.6	Confident	85.5	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.092	C	C	.	.	I	π-helix	trans	-120.6	-63.1	-171.4	-149.5	-169.1	62.3	63.9	-2.1	112.1	E386 S428 R429 F434 P437 D439	E386-R390 VanDerWaalsContact O-CB 3.31Å; E386-R390 WeakPolarHBondContact O-CB 3.24Å; E386-R390 PolarHBondContact O-N 3.41Å; E386-R390 IonicContact OE1-CZ 2.83Å; E386-R390 IonicContact OE1-NE 3.79Å; E386-R390 PolarHBondContact OE1-NE 2.81Å; E386-R390 IonicContact OE1-NH2 3.42Å; E386-R390 PolarHBondContact OE1-NH2 3.09Å; E386-R390 VanDerWaalsContact OE1-NH2 3.16Å; E386-R390 WeakPolarHBondContact OE2-CD 3.47Å; E386-R390 IonicContact OE2-NE 3.58Å; E386-R390 PolarHBondContact OE2-NE 2.97Å; E386-R390 VanDerWaalsContact OE2-NE 3.16Å; R390-S428 WeakPolarHBondContact CG-O 3.13Å; R390-S428 PolarHBondContact NH1-O 2.82Å; R390-S428 WeakPolarHBondContact O-CB 3.31Å; R390-S428 PolarHBondContact O-OG 3.21Å; R390-R429 PolarHBondContact O-NH1 3.41Å; R390-F434 HydrophobicContact CG-CD1 4.49Å; R390-F434 HydrophobicContact CG-CE1 4.4Å; R390-F434 HydrophobicContact CG-CE2 4.44Å; R390-F434 HydrophobicContact CG-CZ 4.38Å; R390-P437 PolarHBondContact NH1-O 3.14Å; R390-P437 PolarHBondContact NH2-O 2.92Å; R390-D439 PolarHBondContact NH2-O 3.22Å
391	L	83.6	Confident	85.4	Confident	4 Å²	4	18.3 Å²	18.3	2%	0.021	10%	0.099	C	C	.	.	I	π-helix	trans	-75.1	-49	-178	-69.8	179.3	0	0	0	111.9	E344 E386 P393 R429 F440	E344-L391 HydrophobicContact CG-CD1 4.48Å; E386-L391 PolarHBondContact O-N 2.61Å; L391-P393 VanDerWaalsContact C-CD 3.44Å; L391-P393 VanDerWaalsContact O-CD 3.3Å; L391-P393 WeakPolarHBondContact O-CD 3.04Å; L391-R429 PolarHBondContact O-NH1 2.82Å; L391-R429 PolarHBondContact O-NH2 3.37Å; L391-F440 HydrophobicContact CD1-CB 3.88Å; L391-F440 HydrophobicContact CD1-CD2 3.81Å; L391-F440 HydrophobicContact CD1-CG 4.33Å
392	Y	87.8	Confident	85.2	Confident	25 Å²	25	15.6 Å²	15.6	10%	0.098	9%	0.088	C	C	.	.	S	Bend	trans	-125.3	65.7	-173.1	-54.7	-76	0	0	0	111.9	W340 E344 A387 L388 V394 P501	W340-Y392 HydrophobicContact CB-CD2 3.85Å; W340-Y392 HydrophobicContact CB-CG 4.03Å; W340-Y392 AromaticContact CD2-CD1 3.6Å; W340-Y392 HydrophobicContact CD2-CD1 3.6Å; W340-Y392 AromaticContact CD2-CD2 3.9Å; W340-Y392 HydrophobicContact CD2-CD2 3.9Å; W340-Y392 HydrophobicContact CD2-CE1 4.01Å; W340-Y392 HydrophobicContact CD2-CE2 4.28Å; W340-Y392 AromaticContact CD2-CG 3.53Å; W340-Y392 HydrophobicContact CD2-CG 3.53Å; W340-Y392 AromaticContact CE2-CD1 3.75Å; W340-Y392 AromaticContact CE3-CD1 3.66Å; W340-Y392 HydrophobicContact CE3-CD1 3.66Å; W340-Y392 AromaticContact CE3-CD2 3.83Å; W340-Y392 HydrophobicContact CE3-CD2 3.83Å; W340-Y392 AromaticContact CE3-CE1 3.54Å; W340-Y392 HydrophobicContact CE3-CE1 3.54Å; W340-Y392 AromaticContact CE3-CE2 3.72Å; W340-Y392 HydrophobicContact CE3-CE2 3.72Å; W340-Y392 AromaticContact CE3-CG 3.8Å; W340-Y392 HydrophobicContact CE3-CG 3.8Å; W340-Y392 AromaticContact CE3-CZ 3.57Å; W340-Y392 HydrophobicContact CG-CD1 4.19Å; W340-Y392 AromaticContact CG-CD2 3.93Å; W340-Y392 HydrophobicContact CG-CD2 3.93Å; W340-Y392 AromaticContact CG-CG 3.64Å; W340-Y392 HydrophobicContact CG-CG 3.64Å; W340-Y392 HydrophobicContact CH2-CD1 4.04Å; W340-Y392 AromaticContact CH2-CE1 3.78Å; W340-Y392 HydrophobicContact CH2-CE1 3.78Å; W340-Y392 AromaticContact CZ2-CD1 3.96Å; W340-Y392 HydrophobicContact CZ2-CD1 3.96Å; W340-Y392 HydrophobicContact CZ2-CE1 4.19Å; W340-Y392 AromaticContact CZ3-CD1 3.89Å; W340-Y392 HydrophobicContact CZ3-CD1 3.89Å; W340-Y392 AromaticContact CZ3-CE1 3.43Å; W340-Y392 HydrophobicContact CZ3-CE1 3.43Å; W340-Y392 VanDerWaalsContact CZ3-CE1 3.43Å; W340-Y392 HydrophobicContact CZ3-CE2 4.29Å; W340-Y392 HydrophobicContact CZ3-CG 4.48Å; W340-Y392 AromaticContact CZ3-CZ 3.66Å; E344-Y392 HydrophobicContact CG-CE2 3.81Å; E344-Y392 PolarHBondContact OE1-OH 2.82Å; E344-Y392 VanDerWaalsContact OE1-OH 3.12Å; A387-Y392 PolarHBondContact O-N 2.95Å; L388-Y392 CarbonylContact O-C 3.49Å; Y392-V394 PolarHBondContact O-N 3.34Å; Y392-P501 HydrophobicContact CD1-CB 4.4Å; Y392-P501 HydrophobicContact CE1-CG 4.5Å
393	P	85.7	Confident	84.8	Confident	4 Å²	4	17.3 Å²	17.3	3%	0.026	10%	0.099	C	C	.	.			trans	-63.1	110.5	177.4	29.1	-34.4	0	0	0	110.3	L388 L391 I395 F425 L507	L388-P393 WeakPolarHBondContact O-CA 3.5Å; L391-P393 VanDerWaalsContact C-CD 3.44Å; L391-P393 VanDerWaalsContact O-CD 3.3Å; L391-P393 WeakPolarHBondContact O-CD 3.04Å; P393-I395 CarbonylContact O-C 3.54Å; P393-I395 PolarHBondContact O-N 3.37Å; P393-I395 VanDerWaalsContact O-N 3.09Å; P393-F425 HydrophobicContact CG-CB 4.21Å; P393-F425 HydrophobicContact CG-CD2 3.65Å; P393-F425 HydrophobicContact CG-CG 4.4Å; P393-L507 WeakPolarHBondContact O-CB 3.41Å
394	V	86.8	Confident	84.4	Confident	13 Å²	13	22.7 Å²	22.7	8%	0.079	12%	0.124	C	C	.	.	S	Bend	trans	-50.2	-37.5	178.2	176.8	0	0	0	0	111.3	T333 L388 Y392 P396 L506 L507	T333-V394 HydrophobicContact CG2-CG1 3.85Å; L388-V394 HydrophobicContact CD1-CG2 4.28Å; Y392-V394 PolarHBondContact O-N 3.34Å; V394-P396 WeakPolarHBondContact O-CD 3.34Å; V394-L506 HydrophobicContact CG1-CB 4.34Å; V394-L506 HydrophobicContact CG1-CD1 4.43Å; V394-L506 HydrophobicContact CG1-CD2 4.21Å; V394-L506 CarbonylContact O-C 3.35Å; V394-L506 VanDerWaalsContact O-CA 3.25Å; V394-L506 WeakPolarHBondContact O-CA 3.42Å; V394-L507 PolarHBondContact O-N 3.37Å
395	I	87.1	Confident	84.3	Confident	55 Å²	55	27.3 Å²	27.3	28%	0.282	14%	0.144	S	C	.	.	S	Bend	trans	-108.4	99.6	169.8	-60.3	175.3	0	0	0	107.4	P393 A397 Q424 L506	P393-I395 CarbonylContact O-C 3.54Å; P393-I395 PolarHBondContact O-N 3.37Å; P393-I395 VanDerWaalsContact O-N 3.09Å; I395-A397 WeakPolarHBondContact CG2-O 3.48Å; I395-A397 PolarHBondContact O-N 3.06Å; I395-Q424 PolarHBondContact O-OE1 3.47Å; I395-L506 HydrophobicContact CG1-CD2 3.87Å
396	P	84.6	Confident	84.4	Confident	8 Å²	8	27.2 Å²	27.2	5%	0.052	15%	0.148	C	C	.	.	S	Bend	trans	-72.6	-17.2	-175.2	27.8	-34.9	0	0	0	113.1	H81 Q84 V394 Q424 F425 T503	H81-P396 HydrophobicContact CB-CB 4Å; Q84-P396 PolarHBondContact NE2-O 3.18Å; Q84-P396 PolarHBondContact OE1-O 2.75Å; V394-P396 WeakPolarHBondContact O-CD 3.34Å; P396-Q424 PolarHBondContact O-N 2.75Å; P396-F425 HydrophobicContact CB-CB 3.94Å; P396-F425 PolarHBondContact O-N 3.3Å; P396-T503 HydrophobicContact CG-CG2 4.5Å
397	A	86.1	Confident	84.4	Confident	33 Å²	33	27.4 Å²	27.4	27%	0.273	15%	0.148	S	C	.	.			trans	-147.4	134.7	178.9	0	0	0	0	0	111.1	Q84 I395 T421 L422	Q84-A397 VanDerWaalsContact NE2-CB 3.33Å; I395-A397 WeakPolarHBondContact CG2-O 3.48Å; I395-A397 PolarHBondContact O-N 3.06Å; A397-T421 HydrophobicContact CB-CG2 3.45Å; A397-T421 VanDerWaalsContact CB-CG2 3.45Å; A397-L422 CarbonylContact C-O 3.4Å; A397-L422 VanDerWaalsContact CA-O 3.28Å; A397-L422 WeakPolarHBondContact CA-O 3.46Å
398	N	87.1	Confident	84.8	Confident	8 Å²	8	32.6 Å²	32.6	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.3	176.4	-101.4	-74.2	0	0	0	110.3	L422 Q424	N398-L422 HydrophobicContact CB-CB 4.29Å; N398-L422 HydrophobicContact CB-CD1 4.35Å; N398-L422 PolarHBondContact N-O 2.88Å; N398-L422 WeakPolarHBondContact O-CB 3.46Å; N398-L422 WeakPolarHBondContact O-CG 3.3Å; N398-L422 PolarHBondContact O-N 3.14Å; N398-Q424 PolarHBondContact ND2-NE2 3.37Å; N398-Q424 PolarHBondContact ND2-OE1 2.83Å
399	A	89.1	Confident	85.6	Confident	23 Å²	23	32 Å²	32	19%	0.19	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	146.7	-179.9	0	0	0	0	0	112.5	R126 L419 I420	R126-A399 WeakPolarHBondContact CA-O 3.43Å; R126-A399 CarbonylContact O-C 3.54Å; R126-A399 VanDerWaalsContact O-CB 3.28Å; R126-A399 WeakPolarHBondContact O-CB 3.14Å; A399-L419 HydrophobicContact CB-CD1 4Å; A399-I420 CarbonylContact C-O 3.51Å; A399-I420 WeakPolarHBondContact CA-O 3.24Å
400	R	89.5	Confident	86.5	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.2	169.9	-69.1	-59.2	-175.5	-87	-2.1	111.4	L117 E120 M125 R126 I420 L422 V462	L117-R400 HydrophobicContact CD2-CG 4.33Å; E120-R400 WeakPolarHBondContact OE1-CD 3.28Å; E120-R400 IonicContact OE1-CZ 3.46Å; E120-R400 IonicContact OE1-NE 2.77Å; E120-R400 PolarHBondContact OE1-NE 2.94Å; E120-R400 IonicContact OE1-NH2 3.22Å; M125-R400 CarbonylContact O-C 3.55Å; M125-R400 WeakPolarHBondContact O-CA 3.2Å; R126-R400 CarbonylContact O-C 3.56Å; R126-R400 PolarHBondContact O-N 2.62Å; R400-I420 PolarHBondContact N-O 2.94Å; R400-I420 PolarHBondContact O-N 2.65Å; R400-L422 HydrophobicContact CG-CD1 4.12Å; R400-V462 PolarHBondContact NH2-O 3.41Å
401	V	89.2	Confident	86.7	Confident	23 Å²	23	34.8 Å²	34.8	14%	0.139	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125	168.9	179.8	0	0	0	0	107.5	M125 L419	M125-V401 HydrophobicContact CB-CB 4.13Å; M125-V401 PolarHBondContact O-N 3.35Å; V401-L419 HydrophobicContact CG2-CB 4.48Å; V401-L419 HydrophobicContact CG2-CD1 3.56Å
402	I	86.4	Confident	86.9	Confident	13 Å²	13	36 Å²	36	7%	0.067	20%	0.204	C	C	.	.			trans	-102.9	107.8	175.5	-56.5	-168.5	0	0	0	107.8	V116 Q119 K405 I407 K416 N417	V116-I402 HydrophobicContact CG1-CD1 4.47Å; Q119-I402 HydrophobicContact CB-CD1 4.44Å; I402-K405 HydrophobicContact CG2-CG 4.4Å; I402-I407 HydrophobicContact CB-CG2 4.42Å; I402-I407 HydrophobicContact CD1-CD1 3.59Å; I402-I407 HydrophobicContact CD1-CG1 4.47Å; I402-I407 HydrophobicContact CD1-CG2 3.7Å; I402-I407 HydrophobicContact CG1-CD1 4.43Å; I402-I407 HydrophobicContact CG2-CG2 3.95Å; I402-K416 CarbonylContact O-C 3.5Å; I402-K416 VanDerWaalsContact O-CA 3.28Å; I402-K416 WeakPolarHBondContact O-CA 3.32Å; I402-N417 PolarHBondContact O-N 2.65Å
403	S	82.8	Confident	87.1	Confident	42 Å²	42	37.9 Å²	37.9	29%	0.294	22%	0.216	S	C	.	.			trans	-95.4	-20.9	-173.1	51.6	0	0	0	0	114	N417	S403-N417 VanDerWaalsContact CA-OD1 3.25Å; S403-N417 WeakPolarHBondContact CA-OD1 3.48Å; S403-N417 WeakPolarHBondContact CB-OD1 3.25Å
404	E	82.6	Confident	87.3	Confident	113 Å²	113	37.8 Å²	37.8	53%	0.528	22%	0.215	S	C	.	.	S	Bend	trans	-81	-36.6	-171.5	-63.9	174.9	-168.6	0	0	112.9	G121 Q122	G121-E404 WeakPolarHBondContact CA-OE1 3.42Å; G121-E404 WeakPolarHBondContact CA-OE2 3.33Å; Q122-E404 PolarHBondContact N-OE1 2.89Å
405	K	87.4	Confident	87.5	Confident	103 Å²	103	39.8 Å²	39.8	45%	0.448	23%	0.228	S	C	.	.	S	Bend	trans	-153.3	159.8	-173.4	65.2	-178.5	-177.7	-178.1	0	112.5	I402 I407	I402-K405 HydrophobicContact CG2-CG 4.4Å; K405-I407 HydrophobicContact CG-CG2 4.36Å
406	D	90.1	Very high	87.6	Confident	82 Å²	82	42.5 Å²	42.5	44%	0.439	24%	0.238	S	C	.	.			trans	-71	146.5	166.4	-57.3	-12.5	0	0	0	109	L413 I414 P415 K416	D406-L413 HydrophobicContact CB-CD1 4.06Å; D406-I414 WeakPolarHBondContact CA-O 3.34Å; D406-P415 WeakPolarHBondContact OD1-CA 3.19Å; D406-K416 PolarHBondContact OD1-N 3.31Å
407	I	89.8	Confident	87.8	Confident	3 Å²	3	47 Å²	47	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.8	-177.4	65.2	171.6	0	0	0	111.3	Q119 I402 K405 V409 I414 I420	Q119-I407 HydrophobicContact CB-CG2 4.08Å; I402-I407 HydrophobicContact CB-CG2 4.42Å; I402-I407 HydrophobicContact CD1-CD1 3.59Å; I402-I407 HydrophobicContact CD1-CG1 4.47Å; I402-I407 HydrophobicContact CD1-CG2 3.7Å; I402-I407 HydrophobicContact CG1-CD1 4.43Å; I402-I407 HydrophobicContact CG2-CG2 3.95Å; K405-I407 HydrophobicContact CG-CG2 4.36Å; I407-V409 HydrophobicContact CD1-CG2 3.65Å; I407-V409 HydrophobicContact CG1-CG2 4.04Å; I407-I414 HydrophobicContact CD1-CB 4.48Å; I407-I414 HydrophobicContact CD1-CD1 4.42Å; I407-I414 HydrophobicContact CG1-CB 3.86Å; I407-I414 HydrophobicContact CG1-CG2 4.49Å; I407-I414 PolarHBondContact N-O 2.86Å; I407-I414 PolarHBondContact O-N 3Å; I407-I420 HydrophobicContact CD1-CD1 3.37Å
408	E	90	Very high	87.9	Confident	110 Å²	110	46.3 Å²	46.3	51%	0.514	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.6	169.9	-167.6	178.8	167.3	0	0	109.4	Q115 Q119 Y412	Q115-E408 PolarHBondContact NE2-O 3.21Å; Q119-E408 PolarHBondContact NE2-O 3.47Å; E408-Y412 WeakPolarHBondContact CA-O 3.42Å
409	V	87.2	Confident	88.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	119.4	177.8	-176.7	0	0	0	0	108.7	V107 L112 V116 I407 G411 Y412 I414	V107-V409 HydrophobicContact CG2-CG1 4.42Å; L112-V409 HydrophobicContact CB-CG1 4.06Å; L112-V409 HydrophobicContact CD2-CG1 4.4Å; V116-V409 HydrophobicContact CG2-CB 4.47Å; V116-V409 HydrophobicContact CG2-CG1 3.98Å; V116-V409 HydrophobicContact CG2-CG2 3.6Å; I407-V409 HydrophobicContact CD1-CG2 3.65Å; I407-V409 HydrophobicContact CG1-CG2 4.04Å; V409-G411 PolarHBondContact O-N 3.21Å; V409-G411 VanDerWaalsContact O-N 3.17Å; V409-Y412 PolarHBondContact N-O 3.49Å; V409-Y412 PolarHBondContact O-N 2.98Å; V409-I414 HydrophobicContact CB-CD1 3.92Å; V409-I414 HydrophobicContact CG2-CD1 3.83Å
410	G	82.3	Confident	88.2	Confident	37 Å²	37	46.3 Å²	46.3	38%	0.381	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	29.2	176.3	0	0	0	0	0	114.5	Y412	G410-Y412 VanDerWaalsContact C-N 3.33Å; G410-Y412 WeakPolarHBondContact O-CD2 3.37Å
411	G	84.9	Confident	88.3	Confident	28 Å²	28	47.1 Å²	47.1	29%	0.289	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	8.6	-176.3	0	0	0	0	0	115	V409	V409-G411 PolarHBondContact O-N 3.21Å; V409-G411 VanDerWaalsContact O-N 3.17Å
412	Y	88.6	Confident	88.4	Confident	29 Å²	29	46.2 Å²	46.2	11%	0.114	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.4	172.4	-65.7	-89.7	0	0	0	111.2	R54 D58 M59 E408 V409 G410	R54-Y412 HydrophobicContact CB-CD1 3.48Å; R54-Y412 VanDerWaalsContact CB-CD1 3.48Å; R54-Y412 HydrophobicContact CB-CE1 3.6Å; R54-Y412 HydrophobicContact CB-CG 4.22Å; R54-Y412 HydrophobicContact CG-CE1 4.34Å; R54-Y412 CarbonylContact O-C 3.17Å; R54-Y412 VanDerWaalsContact O-CA 3.3Å; R54-Y412 WeakPolarHBondContact O-CA 3.47Å; D58-Y412 HydrophobicContact CB-CE1 4.32Å; M59-Y412 HydrophobicContact CB-CD1 4.29Å; M59-Y412 HydrophobicContact CB-CE1 4.19Å; M59-Y412 HydrophobicContact CE-CD1 4.19Å; M59-Y412 HydrophobicContact CE-CD2 4.47Å; M59-Y412 HydrophobicContact CE-CG 3.94Å; E408-Y412 WeakPolarHBondContact CA-O 3.42Å; V409-Y412 PolarHBondContact N-O 3.49Å; V409-Y412 PolarHBondContact O-N 2.98Å; G410-Y412 VanDerWaalsContact C-N 3.33Å; G410-Y412 WeakPolarHBondContact O-CD2 3.37Å
413	L	91.3	Very high	88.7	Confident	65 Å²	65	45.6 Å²	45.6	34%	0.34	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	113.1	170.2	-174.6	70	0	0	0	109.7	V53 R54 D406	V53-L413 HydrophobicContact CG1-CB 3.51Å; V53-L413 HydrophobicContact CG1-CD2 4.09Å; V53-L413 HydrophobicContact CG1-CG 4.37Å; R54-L413 PolarHBondContact O-N 3.26Å; D406-L413 HydrophobicContact CB-CD1 4.06Å
414	I	91.1	Very high	88.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.7	177.1	-56.3	175	0	0	0	108.1	V105 D406 I407 V409 T418 I420	V105-I414 HydrophobicContact CG1-CD1 3.94Å; D406-I414 WeakPolarHBondContact CA-O 3.34Å; I407-I414 HydrophobicContact CD1-CB 4.48Å; I407-I414 HydrophobicContact CD1-CD1 4.42Å; I407-I414 HydrophobicContact CG1-CB 3.86Å; I407-I414 HydrophobicContact CG1-CG2 4.49Å; I407-I414 PolarHBondContact N-O 2.86Å; I407-I414 PolarHBondContact O-N 3Å; V409-I414 HydrophobicContact CB-CD1 3.92Å; V409-I414 HydrophobicContact CG2-CD1 3.83Å; I414-T418 HydrophobicContact CG2-CG2 3.78Å; I414-I420 HydrophobicContact CD1-CD1 4.23Å; I414-I420 HydrophobicContact CG2-CD1 4.38Å
415	P	89.9	Confident	89.2	Confident	55 Å²	55	39 Å²	39	36%	0.357	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-61.6	151.7	176.3	-22.4	34	0	0	0	112.7	L56 D406 T418	L56-P415 HydrophobicContact CD1-CG 3.79Å; D406-P415 WeakPolarHBondContact OD1-CA 3.19Å; P415-T418 VanDerWaalsContact O-CB 3.29Å; P415-T418 WeakPolarHBondContact O-CB 3.44Å; P415-T418 PolarHBondContact O-N 3.39Å; P415-T418 PolarHBondContact O-OG1 3.3Å
416	K	90.3	Very high	89.3	Confident	113 Å²	113	34.4 Å²	34.4	49%	0.491	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	152.9	171.4	69.7	-177.5	-179.1	-178.9	0	112	I402 D406 T418	I402-K416 CarbonylContact O-C 3.5Å; I402-K416 VanDerWaalsContact O-CA 3.28Å; I402-K416 WeakPolarHBondContact O-CA 3.32Å; D406-K416 PolarHBondContact OD1-N 3.31Å; K416-T418 PolarHBondContact O-N 3.5Å
417	N	87.6	Confident	89.2	Confident	103 Å²	103	30.5 Å²	30.5	55%	0.551	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	12.1	-175.6	-57.5	-42.5	0	0	0	115.3	I402 S403	I402-N417 PolarHBondContact O-N 2.65Å; S403-N417 VanDerWaalsContact CA-OD1 3.25Å; S403-N417 WeakPolarHBondContact CA-OD1 3.48Å; S403-N417 WeakPolarHBondContact CB-OD1 3.25Å
418	T	89.1	Confident	89	Confident	18 Å²	18	30.4 Å²	30.4	11%	0.11	17%	0.171	C	C	.	.			trans	-77.8	136.6	170.1	-54.3	0	0	0	0	110.3	L56 V105 I414 P415 K416	L56-T418 HydrophobicContact CD1-CG2 4.5Å; V105-T418 HydrophobicContact CG2-CG2 3.79Å; I414-T418 HydrophobicContact CG2-CG2 3.78Å; P415-T418 VanDerWaalsContact O-CB 3.29Å; P415-T418 WeakPolarHBondContact O-CB 3.44Å; P415-T418 PolarHBondContact O-N 3.39Å; P415-T418 PolarHBondContact O-OG1 3.3Å; K416-T418 PolarHBondContact O-N 3.5Å
419	L	90.6	Very high	88.9	Confident	29 Å²	29	26.8 Å²	26.8	15%	0.152	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	124.4	174.2	-175.1	65	0	0	0	110.1	I102 T104 V105 R126 A399 V401	I102-L419 HydrophobicContact CG2-CD2 3.75Å; T104-L419 CarbonylContact C-O 3.56Å; T104-L419 WeakPolarHBondContact CA-O 3.31Å; T104-L419 HydrophobicContact CG2-CD2 4.24Å; T104-L419 HydrophobicContact CG2-CG 4.16Å; V105-L419 PolarHBondContact N-O 3.14Å; R126-L419 WeakPolarHBondContact O-CD1 3.21Å; A399-L419 HydrophobicContact CB-CD1 4Å; V401-L419 HydrophobicContact CG2-CB 4.48Å; V401-L419 HydrophobicContact CG2-CD1 3.56Å
420	I	92	Very high	88.9	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.9	179.1	-56.2	171.8	0	0	0	108.8	V105 V107 V116 A399 R400 I407 I414 L422	V105-I420 HydrophobicContact CB-CG1 4.49Å; V105-I420 CarbonylContact O-C 3.58Å; V105-I420 VanDerWaalsContact O-CA 3.26Å; V105-I420 WeakPolarHBondContact O-CA 3.33Å; V107-I420 HydrophobicContact CG2-CG2 3.79Å; V116-I420 HydrophobicContact CG1-CD1 4.17Å; V116-I420 HydrophobicContact CG1-CG2 4.33Å; V116-I420 HydrophobicContact CG2-CG2 4.32Å; A399-I420 CarbonylContact C-O 3.51Å; A399-I420 WeakPolarHBondContact CA-O 3.24Å; R400-I420 PolarHBondContact N-O 2.94Å; R400-I420 PolarHBondContact O-N 2.65Å; I407-I420 HydrophobicContact CD1-CD1 3.37Å; I414-I420 HydrophobicContact CD1-CD1 4.23Å; I414-I420 HydrophobicContact CG2-CD1 4.38Å; I420-L422 HydrophobicContact CG2-CD2 4.09Å
421	T	91.5	Very high	89	Confident	20 Å²	20	31.4 Å²	31.4	12%	0.123	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113.3	174.9	-67.5	0	0	0	0	110.5	T104 V105 H106 V107 A397 C423	T104-T421 WeakPolarHBondContact CG2-OG1 3.38Å; V105-T421 PolarHBondContact O-N 2.92Å; H106-T421 WeakPolarHBondContact CA-O 3.47Å; V107-T421 PolarHBondContact N-O 3.44Å; A397-T421 HydrophobicContact CB-CG2 3.45Å; A397-T421 VanDerWaalsContact CB-CG2 3.45Å; T421-C423 PolarHBondContact O-N 3.1Å
422	L	91.8	Very high	89	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	107.6	172.9	-47.1	175.6	0	0	0	108.1	I113 V116 L117 A397 N398 R400 I420 Q424	I113-L422 HydrophobicContact CB-CD2 4.48Å; I113-L422 HydrophobicContact CD1-CB 4.37Å; I113-L422 HydrophobicContact CG1-CB 4.32Å; I113-L422 HydrophobicContact CG1-CD2 4.06Å; I113-L422 HydrophobicContact CG2-CD1 4.23Å; I113-L422 HydrophobicContact CG2-CD2 4.29Å; V116-L422 HydrophobicContact CB-CD2 4.34Å; V116-L422 HydrophobicContact CG1-CD2 4.19Å; L117-L422 HydrophobicContact CD1-CD1 4.42Å; L117-L422 HydrophobicContact CD2-CD1 3.94Å; L117-L422 HydrophobicContact CG-CD1 4.28Å; A397-L422 CarbonylContact C-O 3.4Å; A397-L422 VanDerWaalsContact CA-O 3.28Å; A397-L422 WeakPolarHBondContact CA-O 3.46Å; N398-L422 HydrophobicContact CB-CB 4.29Å; N398-L422 HydrophobicContact CB-CD1 4.35Å; N398-L422 PolarHBondContact N-O 2.88Å; N398-L422 WeakPolarHBondContact O-CB 3.46Å; N398-L422 WeakPolarHBondContact O-CG 3.3Å; N398-L422 PolarHBondContact O-N 3.14Å; R400-L422 HydrophobicContact CG-CD1 4.12Å; I420-L422 HydrophobicContact CG2-CD2 4.09Å; L422-Q424 PolarHBondContact O-N 2.78Å
423	C	91	Very high	88.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.			trans	-83.1	76.9	-171.5	-65.6	0	0	0	0	111.3	Q84 W95 V107 A108 T421 F425 A426 T427	Q84-C423 HydrophobicContact CB-CB 4.29Å; Q84-C423 HydrophobicContact CG-CB 4.22Å; Q84-C423 VanDerWaalsContact OE1-C 3.28Å; Q84-C423 VanDerWaalsContact OE1-CB 3.22Å; W95-C423 HydrophobicContact CH2-CB 4.48Å; V107-C423 PolarHBondContact O-N 3.12Å; A108-C423 HydrophobicContact CB-CB 3.83Å; T421-C423 PolarHBondContact O-N 3.1Å; C423-F425 VanDerWaalsContact C-N 3.33Å; C423-F425 PolarHBondContact O-N 2.76Å; C423-A426 HydrophobicContact CB-CB 4.24Å; C423-A426 PolarHBondContact O-N 3.33Å; C423-T427 WeakPolarHBondContact O-CG2 3.27Å; C423-T427 PolarHBondContact O-N 3.38Å; C423-T427 VanDerWaalsContact O-N 3.09Å
424	Q	87.6	Confident	88.4	Confident	10 Å²	10	31.5 Å²	31.5	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-33.7	-174.4	-66.5	-178.8	-33.6	0	0	113.2	I395 P396 N398 L422 A426 T427 S428 V458	I395-Q424 PolarHBondContact O-OE1 3.47Å; P396-Q424 PolarHBondContact O-N 2.75Å; N398-Q424 PolarHBondContact ND2-NE2 3.37Å; N398-Q424 PolarHBondContact ND2-OE1 2.83Å; L422-Q424 PolarHBondContact O-N 2.78Å; Q424-A426 VanDerWaalsContact C-N 3.28Å; Q424-A426 PolarHBondContact O-N 3.22Å; Q424-T427 WeakPolarHBondContact CA-OG1 3.46Å; Q424-T427 PolarHBondContact O-N 3.5Å; Q424-T427 PolarHBondContact O-OG1 2.87Å; Q424-T427 VanDerWaalsContact O-OG1 3.11Å; Q424-S428 WeakPolarHBondContact O-CB 3.39Å; Q424-S428 PolarHBondContact O-N 2.85Å; Q424-S428 PolarHBondContact O-OG 2.72Å; Q424-V458 HydrophobicContact CG-CG2 4.24Å; Q424-V458 PolarHBondContact NE2-O 2.72Å
425	F	88.9	Confident	88.1	Confident	7 Å²	7	38.1 Å²	38.1	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-34.1	177.6	-173.4	-92.3	0	0	0	112.1	H81 L85 P393 P396 C423 S428 R429 L507	H81-F425 HydrophobicContact CB-CB 4.48Å; H81-F425 HydrophobicContact CB-CD1 4Å; H81-F425 HydrophobicContact CB-CD2 4.11Å; H81-F425 HydrophobicContact CB-CE1 4.25Å; H81-F425 HydrophobicContact CB-CE2 4.35Å; H81-F425 HydrophobicContact CB-CG 3.94Å; H81-F425 HydrophobicContact CB-CZ 4.43Å; H81-F425 AromaticContact CD2-CE1 3.73Å; H81-F425 AromaticContact CD2-CE2 3.89Å; H81-F425 AromaticContact CD2-CZ 3.48Å; H81-F425 VanDerWaalsContact CD2-CZ 3.48Å; H81-F425 WeakPolarHBondContact CD2-CZ 3.46Å; H81-F425 WeakPolarHBondContact O-CD1 3.38Å; L85-F425 HydrophobicContact CD1-CD1 4.35Å; L85-F425 HydrophobicContact CD1-CE1 3.74Å; L85-F425 HydrophobicContact CD2-CD1 4.41Å; L85-F425 HydrophobicContact CG-CD1 4.15Å; L85-F425 HydrophobicContact CG-CE1 4.05Å; P393-F425 HydrophobicContact CG-CB 4.21Å; P393-F425 HydrophobicContact CG-CD2 3.65Å; P393-F425 HydrophobicContact CG-CG 4.4Å; P396-F425 HydrophobicContact CB-CB 3.94Å; P396-F425 PolarHBondContact O-N 3.3Å; C423-F425 VanDerWaalsContact C-N 3.33Å; C423-F425 PolarHBondContact O-N 2.76Å; F425-S428 PolarHBondContact O-OG 2.76Å; F425-R429 VanDerWaalsContact CZ-CZ 3.41Å; F425-L507 HydrophobicContact CD2-CD2 4.33Å; F425-L507 HydrophobicContact CE2-CD2 4.11Å
426	A	89.2	Confident	87.8	Confident	6 Å²	6	40.8 Å²	40.8	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-74.6	-45.4	174	0	0	0	0	0	111.9	Q84 L85 V88 A108 C423 Q424 S428 R429 D430	Q84-A426 HydrophobicContact CB-CB 4.05Å; L85-A426 HydrophobicContact CD2-CB 4.12Å; V88-A426 HydrophobicContact CG2-CB 3.99Å; A108-A426 HydrophobicContact CB-CB 4.09Å; C423-A426 HydrophobicContact CB-CB 4.24Å; C423-A426 PolarHBondContact O-N 3.33Å; Q424-A426 VanDerWaalsContact C-N 3.28Å; Q424-A426 PolarHBondContact O-N 3.22Å; A426-S428 PolarHBondContact O-N 3.43Å; A426-R429 CarbonylContact O-C 3.49Å; A426-R429 PolarHBondContact O-N 3.09Å; A426-R429 VanDerWaalsContact O-N 3.09Å; A426-D430 PolarHBondContact O-N 2.97Å
427	T	87.9	Confident	87.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-29.7	-178.7	64.5	0	0	0	0	112.8	A108 P110 I113 C423 Q424 R429 A456	A108-T427 VanDerWaalsContact O-CG2 3.29Å; A108-T427 WeakPolarHBondContact O-CG2 3.42Å; P110-T427 HydrophobicContact CG-CG2 4.49Å; I113-T427 HydrophobicContact CD1-CG2 3.46Å; I113-T427 VanDerWaalsContact CD1-CG2 3.46Å; C423-T427 WeakPolarHBondContact O-CG2 3.27Å; C423-T427 PolarHBondContact O-N 3.38Å; C423-T427 VanDerWaalsContact O-N 3.09Å; Q424-T427 WeakPolarHBondContact CA-OG1 3.46Å; Q424-T427 PolarHBondContact O-N 3.5Å; Q424-T427 PolarHBondContact O-OG1 2.87Å; Q424-T427 VanDerWaalsContact O-OG1 3.11Å; T427-R429 VanDerWaalsContact C-N 3.25Å; T427-R429 PolarHBondContact O-N 3.23Å; T427-A456 PolarHBondContact OG1-O 3.37Å
428	S	86.4	Confident	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.007	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.3	177.5	71.7	0	0	0	0	114.1	R390 Q424 F425 A426 F434	R390-S428 WeakPolarHBondContact CG-O 3.13Å; R390-S428 PolarHBondContact NH1-O 2.82Å; R390-S428 WeakPolarHBondContact O-CB 3.31Å; R390-S428 PolarHBondContact O-OG 3.21Å; Q424-S428 WeakPolarHBondContact O-CB 3.39Å; Q424-S428 PolarHBondContact O-N 2.85Å; Q424-S428 PolarHBondContact O-OG 2.72Å; F425-S428 PolarHBondContact O-OG 2.76Å; A426-S428 PolarHBondContact O-N 3.43Å; S428-F434 WeakPolarHBondContact O-CD2 3.3Å
429	R	87.9	Confident	87.2	Confident	34 Å²	34	40.6 Å²	40.6	13%	0.128	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	9.2	179.6	-75.8	179.5	163.8	71.2	0.7	113.5	L85 R390 L391 F425 A426 T427 P431 P437 D438	L85-R429 HydrophobicContact CD2-CB 4.27Å; R390-R429 PolarHBondContact O-NH1 3.41Å; L391-R429 PolarHBondContact O-NH1 2.82Å; L391-R429 PolarHBondContact O-NH2 3.37Å; F425-R429 VanDerWaalsContact CZ-CZ 3.41Å; A426-R429 CarbonylContact O-C 3.49Å; A426-R429 PolarHBondContact O-N 3.09Å; A426-R429 VanDerWaalsContact O-N 3.09Å; T427-R429 VanDerWaalsContact C-N 3.25Å; T427-R429 PolarHBondContact O-N 3.23Å; R429-P431 VanDerWaalsContact O-CD 3.24Å; R429-P431 WeakPolarHBondContact O-CD 3.05Å; R429-P437 HydrophobicContact CB-CB 4.44Å; R429-P437 WeakPolarHBondContact O-CB 3.24Å; R429-P437 WeakPolarHBondContact O-CG 3.26Å; R429-D438 IonicContact NE-OD1 3.5Å
430	D	86.3	Confident	87.1	Confident	44 Å²	44	39.8 Å²	39.8	24%	0.235	23%	0.226	C	C	.	.			trans	-71.6	114.9	177.5	-173.1	-10	0	0	0	109.9	A426 A432 V433 F434	A426-D430 PolarHBondContact O-N 2.97Å; D430-A432 PolarHBondContact O-N 2.98Å; D430-A432 VanDerWaalsContact OD1-CB 3.27Å; D430-A432 WeakPolarHBondContact OD1-CB 3.25Å; D430-A432 PolarHBondContact OD1-N 2.76Å; D430-V433 HydrophobicContact CB-CB 4.42Å; D430-V433 HydrophobicContact CB-CG2 4.13Å; D430-V433 PolarHBondContact O-N 3.28Å; D430-F434 PolarHBondContact O-N 3.01Å
431	P	85.7	Confident	87	Confident	91 Å²	91	43.8 Å²	43.8	59%	0.591	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.9	178.3	28	-35.8	0	0	0	113.2	R429 V433 F434 P437	R429-P431 VanDerWaalsContact O-CD 3.24Å; R429-P431 WeakPolarHBondContact O-CD 3.05Å; P431-V433 VanDerWaalsContact C-N 3.26Å; P431-F434 WeakPolarHBondContact CA-O 3.12Å; P431-P437 HydrophobicContact CB-CG 4.26Å
432	A	84.7	Confident	86.8	Confident	91 Å²	91	42.8 Å²	42.8	75%	0.752	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-24.9	174.2	0	0	0	0	0	112.2	D430	D430-A432 PolarHBondContact O-N 2.98Å; D430-A432 VanDerWaalsContact OD1-CB 3.27Å; D430-A432 WeakPolarHBondContact OD1-CB 3.25Å; D430-A432 PolarHBondContact OD1-N 2.76Å
433	V	83.1	Confident	86.6	Confident	32 Å²	32	47.4 Å²	47.4	19%	0.194	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-45.8	178.6	-174	0	0	0	0	111.3	P110 D430 P431 H452 A456	P110-V433 HydrophobicContact CG-CG2 4.05Å; D430-V433 HydrophobicContact CB-CB 4.42Å; D430-V433 HydrophobicContact CB-CG2 4.13Å; D430-V433 PolarHBondContact O-N 3.28Å; P431-V433 VanDerWaalsContact C-N 3.26Å; V433-H452 HydrophobicContact CG1-CB 4.34Å; V433-H452 PolarHBondContact O-CD2 3.12Å; V433-A456 HydrophobicContact CB-CB 4.5Å; V433-A456 HydrophobicContact CG1-CB 3.62Å
434	F	84.6	Confident	86.4	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	26%	0.258	C	S	.	.	S	Bend	trans	-117.1	111.4	-177.5	-62.9	-79.7	0	0	0	110.2	R390 S428 D430 P431 N436 P437 W445 H452 A456	R390-F434 HydrophobicContact CG-CD1 4.49Å; R390-F434 HydrophobicContact CG-CE1 4.4Å; R390-F434 HydrophobicContact CG-CE2 4.44Å; R390-F434 HydrophobicContact CG-CZ 4.38Å; S428-F434 WeakPolarHBondContact O-CD2 3.3Å; D430-F434 PolarHBondContact O-N 3.01Å; P431-F434 WeakPolarHBondContact CA-O 3.12Å; F434-N436 PolarHBondContact O-N 3.05Å; F434-P437 WeakPolarHBondContact O-CD 3.36Å; F434-W445 AromaticContact CE1-CH2 3.85Å; F434-W445 HydrophobicContact CE1-CH2 3.85Å; F434-W445 HydrophobicContact CE1-CZ2 4.32Å; F434-W445 HydrophobicContact CE1-CZ3 4.38Å; F434-W445 HydrophobicContact CZ-CH2 4.15Å; F434-H452 AromaticContact CD1-CD2 3.13Å; F434-H452 WeakPolarHBondContact CD1-CD2 3.17Å; F434-H452 AromaticContact CD1-NE2 3.39Å; F434-H452 WeakPolarHBondContact CD1-NE2 3.37Å; F434-H452 HydrophobicContact CE1-CB 4.15Å; F434-H452 AromaticContact CE1-CD2 3.22Å; F434-H452 WeakPolarHBondContact CE1-CD2 3.36Å; F434-H452 AromaticContact CE1-CG 3.76Å; F434-H452 AromaticContact CE1-NE2 3.78Å; F434-H452 AromaticContact CG-CD2 3.97Å; F434-H452 HydrophobicContact CZ-CB 4.44Å; F434-A456 HydrophobicContact CE2-CB 3.8Å; F434-A456 HydrophobicContact CZ-CB 4.1Å
435	Q	83.4	Confident	86.3	Confident	140 Å²	140	49.9 Å²	49.9	65%	0.654	27%	0.265	S	S	*	.	S	Bend	trans	-63.7	134.2	172.2	-63.7	-177.2	6.4	0	0	110.3	R444	Q435-R444 PolarHBondContact O-NH1 2.85Å; Q435-R444 PolarHBondContact O-NH2 3Å
436	N	83.4	Confident	86	Confident	110 Å²	110	53.8 Å²	53.8	59%	0.588	28%	0.282	S	S	*	.	S	Bend	trans	48.7	71	-171.9	-61.6	-20	0	0	0	112.2	F434 D438 D439 R444	F434-N436 PolarHBondContact O-N 3.05Å; N436-D438 PolarHBondContact O-N 3.17Å; N436-D439 HydrophobicContact CB-CB 4.26Å; N436-D439 WeakPolarHBondContact CB-OD2 3.32Å; N436-D439 PolarHBondContact O-N 2.95Å; N436-R444 PolarHBondContact O-NH2 3.19Å
437	P	83.4	Confident	85.2	Confident	19 Å²	19	57.4 Å²	57.4	12%	0.123	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.8	-171.9	27.2	-34.2	0	0	0	113.7	R390 R429 P431 F434	R390-P437 PolarHBondContact NH1-O 3.14Å; R390-P437 PolarHBondContact NH2-O 2.92Å; R429-P437 HydrophobicContact CB-CB 4.44Å; R429-P437 WeakPolarHBondContact O-CB 3.24Å; R429-P437 WeakPolarHBondContact O-CG 3.26Å; P431-P437 HydrophobicContact CB-CG 4.26Å; F434-P437 WeakPolarHBondContact O-CD 3.36Å
438	D	85.1	Confident	84	Confident	117 Å²	117	66.5 Å²	66.5	63%	0.626	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.2	178.3	-63.6	-50.2	0	0	0	113	R429 N436	R429-D438 IonicContact NE-OD1 3.5Å; N436-D438 PolarHBondContact O-N 3.17Å
439	D	87	Confident	82.6	Confident	94 Å²	94	74.4 Å²	74.4	50%	0.503	38%	0.382	S	S	.	.	S	Bend	trans	-89.9	135.4	-177.6	-66.2	-15.4	0	0	0	112.2	R390 N436 H441 R444	R390-D439 PolarHBondContact NH2-O 3.22Å; N436-D439 HydrophobicContact CB-CB 4.26Å; N436-D439 WeakPolarHBondContact CB-OD2 3.32Å; N436-D439 PolarHBondContact O-N 2.95Å; D439-H441 PolarHBondContact O-N 3Å; D439-R444 PolarHBondContact O-NH2 3.13Å
440	F	88.9	Confident	81.3	Confident	13 Å²	13	76 Å²	76	6%	0.057	39%	0.392	C	S	.	.			trans	-78.3	104.3	174.8	-178.8	-110.2	0	0	0	110.7	E344 L345 H348 I351 T383 E386 A387 L391 P442	E344-F440 HydrophobicContact CB-CD1 4.23Å; E344-F440 HydrophobicContact CB-CD2 4.08Å; E344-F440 HydrophobicContact CB-CE1 4.25Å; E344-F440 HydrophobicContact CB-CE2 4.13Å; E344-F440 HydrophobicContact CB-CG 4.12Å; E344-F440 HydrophobicContact CB-CZ 4.2Å; E344-F440 HydrophobicContact CG-CD2 4.26Å; E344-F440 HydrophobicContact CG-CG 4.44Å; L345-F440 HydrophobicContact CD2-CE1 4.4Å; H348-F440 HydrophobicContact CB-CD1 4.38Å; H348-F440 AromaticContact CE1-CD1 3.87Å; H348-F440 AromaticContact CG-CD1 3.85Å; H348-F440 AromaticContact ND1-CD1 3.54Å; I351-F440 HydrophobicContact CD1-CD1 3.69Å; I351-F440 HydrophobicContact CD1-CE1 3.68Å; I351-F440 HydrophobicContact CG2-CE1 4.27Å; T383-F440 HydrophobicContact CG2-CZ 3.86Å; E386-F440 HydrophobicContact CB-CD2 4.26Å; E386-F440 HydrophobicContact CB-CE2 3.88Å; E386-F440 HydrophobicContact CG-CD2 3.55Å; E386-F440 HydrophobicContact CG-CE2 3.69Å; E386-F440 HydrophobicContact CG-CG 4.46Å; A387-F440 HydrophobicContact CB-CE2 3.98Å; L391-F440 HydrophobicContact CD1-CB 3.88Å; L391-F440 HydrophobicContact CD1-CD2 3.81Å; L391-F440 HydrophobicContact CD1-CG 4.33Å; F440-P442 HydrophobicContact CD1-CG 4.34Å; F440-P442 HydrophobicContact CE1-CG 3.71Å; F440-P442 HydrophobicContact CE2-CG 4.14Å; F440-P442 HydrophobicContact CZ-CG 3.6Å
441	H	88.4	Confident	80	Confident	85 Å²	85	78.2 Å²	78.2	39%	0.394	42%	0.416	S	S	.	.			trans	-138.1	86.2	-177.9	-173.2	-93.7	0	0	0	111.9	E386 D439 Y443 R444	E386-H441 PolarHBondContact OE1-N 2.99Å; D439-H441 PolarHBondContact O-N 3Å; H441-Y443 PolarHBondContact O-N 2.71Å; H441-R444 PolarHBondContact ND1-N 3.07Å; H441-R444 VanDerWaalsContact O-CG 3.23Å; H441-R444 WeakPolarHBondContact O-CG 3.34Å; H441-R444 PolarHBondContact O-N 2.86Å; H441-R444 PolarHBondContact O-NE 2.81Å
442	P	88.7	Confident	79.3	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-58.5	-29.1	-179.5	-27.6	37.4	0	0	0	114.2	I351 L379 A382 E386 F440 R444 W445	I351-P442 HydrophobicContact CD1-CG 4.03Å; I351-P442 HydrophobicContact CG2-CG 4.03Å; L379-P442 HydrophobicContact CD1-CB 4.42Å; A382-P442 HydrophobicContact CB-CB 4.4Å; E386-P442 HydrophobicContact CB-CG 4.38Å; E386-P442 HydrophobicContact CG-CG 4.49Å; F440-P442 HydrophobicContact CD1-CG 4.34Å; F440-P442 HydrophobicContact CE1-CG 3.71Å; F440-P442 HydrophobicContact CE2-CG 4.14Å; F440-P442 HydrophobicContact CZ-CG 3.6Å; P442-R444 PolarHBondContact O-N 3.12Å; P442-W445 VanDerWaalsContact O-CD1 3.3Å; P442-W445 PolarHBondContact O-N 3.3Å
443	Y	87.7	Confident	79	Confident	100 Å²	100	73.7 Å²	73.7	39%	0.392	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-63.9	-16.6	-176.9	-65.6	-79.2	0	0	0	113.7	L379 H441 W445 F446	L379-Y443 HydrophobicContact CD1-CD1 4.22Å; L379-Y443 HydrophobicContact CD1-CE1 3.81Å; H441-Y443 PolarHBondContact O-N 2.71Å; Y443-W445 PolarHBondContact O-N 3.45Å; Y443-W445 VanDerWaalsContact O-N 3.13Å; Y443-F446 HydrophobicContact CD1-CD2 4.26Å; Y443-F446 HydrophobicContact CD1-CE2 4.2Å; Y443-F446 PolarHBondContact O-N 2.84Å; Y443-F446 VanDerWaalsContact O-N 3.15Å
444	R	86.2	Confident	78.9	Confident	9 Å²	9	77 Å²	77	3%	0.034	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-60.5	-23.3	176.5	75.8	179.2	65.2	-110.4	13.3	113.5	E386 Q435 N436 D439 H441 P442 F446	E386-R444 IonicContact OE1-CZ 2.75Å; E386-R444 IonicContact OE1-NE 3.71Å; E386-R444 PolarHBondContact OE1-NE 3.34Å; E386-R444 IonicContact OE1-NH2 3.9Å; E386-R444 VanDerWaalsContact OE2-CD 3.28Å; E386-R444 WeakPolarHBondContact OE2-CD 3.01Å; E386-R444 IonicContact OE2-NE 3.72Å; E386-R444 PolarHBondContact OE2-NE 3.05Å; Q435-R444 PolarHBondContact O-NH1 2.85Å; Q435-R444 PolarHBondContact O-NH2 3Å; N436-R444 PolarHBondContact O-NH2 3.19Å; D439-R444 PolarHBondContact O-NH2 3.13Å; H441-R444 PolarHBondContact ND1-N 3.07Å; H441-R444 VanDerWaalsContact O-CG 3.23Å; H441-R444 WeakPolarHBondContact O-CG 3.34Å; H441-R444 PolarHBondContact O-N 2.86Å; H441-R444 PolarHBondContact O-NE 2.81Å; P442-R444 PolarHBondContact O-N 3.12Å; R444-F446 VanDerWaalsContact C-N 3.32Å; R444-F446 PolarHBondContact O-N 2.94Å
445	W	85.7	Confident	78.7	Confident	53 Å²	53	78.9 Å²	78.9	20%	0.201	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-81.6	-8.7	-178.4	-60.5	106.7	0	0	0	114	A382 K385 E386 F434 P442 Y443	A382-W445 HydrophobicContact CB-CB 3.94Å; A382-W445 HydrophobicContact CB-CG 4.38Å; K385-W445 HydrophobicContact CD-CD2 3.63Å; K385-W445 HydrophobicContact CD-CE3 3.7Å; K385-W445 HydrophobicContact CD-CG 4.22Å; K385-W445 HydrophobicContact CD-CH2 4.05Å; K385-W445 HydrophobicContact CD-CZ2 4.02Å; K385-W445 HydrophobicContact CD-CZ3 3.92Å; K385-W445 VanDerWaalsContact CE-CE3 3.49Å; K385-W445 VanDerWaalsContact CE-CH2 3.49Å; K385-W445 HydrophobicContact CG-CD2 4.16Å; K385-W445 HydrophobicContact CG-CH2 4.18Å; K385-W445 HydrophobicContact CG-CZ2 3.81Å; E386-W445 PolarHBondContact OE2-NE1 3.47Å; F434-W445 AromaticContact CE1-CH2 3.85Å; F434-W445 HydrophobicContact CE1-CH2 3.85Å; F434-W445 HydrophobicContact CE1-CZ2 4.32Å; F434-W445 HydrophobicContact CE1-CZ3 4.38Å; F434-W445 HydrophobicContact CZ-CH2 4.15Å; P442-W445 VanDerWaalsContact O-CD1 3.3Å; P442-W445 PolarHBondContact O-N 3.3Å; Y443-W445 PolarHBondContact O-N 3.45Å; Y443-W445 VanDerWaalsContact O-N 3.13Å
446	F	83	Confident	78.7	Confident	90 Å²	90	72.2 Å²	72.2	40%	0.395	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-30.3	176.3	-67.5	-87.5	0	0	0	112.9	P378 L379 A382 Y443 R444 K448	P378-F446 HydrophobicContact CB-CE1 3.78Å; P378-F446 HydrophobicContact CB-CZ 4.21Å; P378-F446 HydrophobicContact CG-CE1 4.14Å; L379-F446 HydrophobicContact CB-CZ 4.07Å; L379-F446 HydrophobicContact CD1-CE2 3.74Å; L379-F446 HydrophobicContact CD1-CZ 4.08Å; A382-F446 HydrophobicContact CB-CE2 3.87Å; A382-F446 HydrophobicContact CB-CZ 4.32Å; Y443-F446 HydrophobicContact CD1-CD2 4.26Å; Y443-F446 HydrophobicContact CD1-CE2 4.2Å; Y443-F446 PolarHBondContact O-N 2.84Å; Y443-F446 VanDerWaalsContact O-N 3.15Å; R444-F446 VanDerWaalsContact C-N 3.32Å; R444-F446 PolarHBondContact O-N 2.94Å; F446-K448 PolarHBondContact O-N 2.92Å; F446-K448 VanDerWaalsContact O-N 3.14Å
447	N	71.6	Confident	78.6	Confident	81 Å²	81	67.6 Å²	67.6	43%	0.433	35%	0.346	S	S	.	.			trans	-71	108	-178	-73.7	-10.7	0	0	0	109.9	D449 E450	N447-D449 PolarHBondContact O-N 3.3Å; N447-E450 HydrophobicContact CB-CB 4.11Å; N447-E450 HydrophobicContact CB-CG 4.26Å; N447-E450 PolarHBondContact ND2-OE1 3.26Å
448	K	63.4	Low	78.5	Confident	191 Å²	191	67.5 Å²	67.5	83%	0.83	34%	0.344	S	S	*	.	S	Bend	trans	-70.6	-23.6	173.6	-69.1	-177.1	-179.6	175.8	0	112.6	F446	F446-K448 PolarHBondContact O-N 2.92Å; F446-K448 VanDerWaalsContact O-N 3.14Å
449	D	55.5	Low	78.2	Confident	167 Å²	167	63.4 Å²	63.4	89%	0.893	32%	0.324	S	S	*	.	S	Bend	trans	-78.3	-25	-178.8	-59.6	-37.4	0	0	0	112.2	N447 A451	N447-D449 PolarHBondContact O-N 3.3Å; D449-A451 PolarHBondContact O-N 3.47Å; D449-A451 VanDerWaalsContact O-N 3.1Å
450	E	60.6	Low	78.2	Confident	69 Å²	69	60.8 Å²	60.8	32%	0.322	31%	0.309	S	S	.	.	S	Bend	trans	-83	67.1	163	-72.2	170.5	-141.5	0	0	108.7	N447 H452	N447-E450 HydrophobicContact CB-CB 4.11Å; N447-E450 HydrophobicContact CB-CG 4.26Å; N447-E450 PolarHBondContact ND2-OE1 3.26Å; E450-H452 PolarHBondContact O-CE1 3.48Å; E450-H452 PolarHBondContact O-N 3.22Å; E450-H452 PolarHBondContact O-ND1 3.09Å; E450-H452 IonicContact OE2-CE1 3.94Å
451	A	59	Low	78.1	Confident	90 Å²	90	61 Å²	61	74%	0.744	31%	0.314	S	S	*	.			trans	-69.2	79.8	178.8	0	0	0	0	0	110.5	D449	D449-A451 PolarHBondContact O-N 3.47Å; D449-A451 VanDerWaalsContact O-N 3.1Å
452	H	72.7	Confident	77.9	Confident	33 Å²	33	58.9 Å²	58.9	15%	0.153	31%	0.307	C	S	.	.			trans	-58.9	139.1	171.6	-57	90.1	0	0	0	109.3	V433 F434 E450	V433-H452 HydrophobicContact CG1-CB 4.34Å; V433-H452 PolarHBondContact O-CD2 3.12Å; F434-H452 AromaticContact CD1-CD2 3.13Å; F434-H452 WeakPolarHBondContact CD1-CD2 3.17Å; F434-H452 AromaticContact CD1-NE2 3.39Å; F434-H452 WeakPolarHBondContact CD1-NE2 3.37Å; F434-H452 HydrophobicContact CE1-CB 4.15Å; F434-H452 AromaticContact CE1-CD2 3.22Å; F434-H452 WeakPolarHBondContact CE1-CD2 3.36Å; F434-H452 AromaticContact CE1-CG 3.76Å; F434-H452 AromaticContact CE1-NE2 3.78Å; F434-H452 AromaticContact CG-CD2 3.97Å; F434-H452 HydrophobicContact CZ-CB 4.44Å; E450-H452 PolarHBondContact O-CE1 3.48Å; E450-H452 PolarHBondContact O-N 3.22Å; E450-H452 PolarHBondContact O-ND1 3.09Å; E450-H452 IonicContact OE2-CE1 3.94Å
453	H	76.8	Confident	77.7	Confident	54 Å²	54	60.8 Å²	60.8	25%	0.25	33%	0.326	C	S	.	.			trans	-58.4	127.4	178.9	-165	-84.4	0	0	0	109.8	P110 E114 Y455 A456	P110-H453 HydrophobicContact CB-CB 3.78Å; P110-H453 VanDerWaalsContact CB-ND1 3.33Å; P110-H453 WeakPolarHBondContact CB-ND1 3.4Å; P110-H453 HydrophobicContact CG-CB 4.41Å; P110-H453 PolarHBondContact O-CE1 3.03Å; P110-H453 VanDerWaalsContact O-CE1 3.26Å; E114-H453 IonicContact OE2-CE1 3.92Å; E114-H453 IonicContact OE2-NE2 2.67Å; H453-Y455 AromaticContact CE1-CD2 3.63Å; H453-Y455 AromaticContact ND1-CD2 3.89Å; H453-Y455 PolarHBondContact ND1-N 2.91Å; H453-Y455 PolarHBondContact O-N 2.88Å; H453-A456 HydrophobicContact CB-CB 4.25Å; H453-A456 VanDerWaalsContact O-CB 3.27Å; H453-A456 WeakPolarHBondContact O-CB 3.2Å; H453-A456 PolarHBondContact O-N 3.1Å
454	P	80.8	Confident	77.6	Confident	101 Å²	101	61 Å²	61	66%	0.656	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.8	-173.9	-27.8	34.8	0	0	0	114.5	V458	P454-V458 WeakPolarHBondContact O-CG1 3.1Å
455	Y	82.4	Confident	77.7	Confident	40 Å²	40	61 Å²	61	16%	0.157	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.2	179	-65.3	-91.6	0	0	0	114.6	I113 E114 L117 H453 S457 V462	I113-Y455 HydrophobicContact CG2-CD1 4.29Å; E114-Y455 HydrophobicContact CB-CD1 4.41Å; E114-Y455 HydrophobicContact CB-CD2 3.63Å; E114-Y455 HydrophobicContact CB-CE2 3.78Å; E114-Y455 HydrophobicContact CB-CG 3.96Å; E114-Y455 VanDerWaalsContact CD-CE2 3.44Å; E114-Y455 HydrophobicContact CG-CD2 3.91Å; E114-Y455 HydrophobicContact CG-CE2 3.52Å; E114-Y455 WeakPolarHBondContact OE1-CE2 3.42Å; L117-Y455 HydrophobicContact CB-CE1 4.34Å; L117-Y455 HydrophobicContact CD1-CD1 3.52Å; L117-Y455 HydrophobicContact CD1-CE1 3.48Å; L117-Y455 VanDerWaalsContact CD1-CE1 3.48Å; H453-Y455 AromaticContact CE1-CD2 3.63Å; H453-Y455 AromaticContact ND1-CD2 3.89Å; H453-Y455 PolarHBondContact ND1-N 2.91Å; H453-Y455 PolarHBondContact O-N 2.88Å; Y455-S457 VanDerWaalsContact C-N 3.34Å; Y455-V462 HydrophobicContact CD1-CG2 4.2Å; Y455-V462 HydrophobicContact CE1-CB 4.16Å; Y455-V462 HydrophobicContact CE1-CG1 3.78Å; Y455-V462 HydrophobicContact CE1-CG2 4.06Å
456	A	81.6	Confident	78	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-28.2	177.9	0	0	0	0	0	112.7	P110 T427 V433 F434 H453	P110-A456 HydrophobicContact CB-CB 4.1Å; P110-A456 HydrophobicContact CG-CB 3.75Å; T427-A456 PolarHBondContact OG1-O 3.37Å; V433-A456 HydrophobicContact CB-CB 4.5Å; V433-A456 HydrophobicContact CG1-CB 3.62Å; F434-A456 HydrophobicContact CE2-CB 3.8Å; F434-A456 HydrophobicContact CZ-CB 4.1Å; H453-A456 HydrophobicContact CB-CB 4.25Å; H453-A456 VanDerWaalsContact O-CB 3.27Å; H453-A456 WeakPolarHBondContact O-CB 3.2Å; H453-A456 PolarHBondContact O-N 3.1Å
457	S	81.1	Confident	78.4	Confident	14 Å²	14	57.6 Å²	57.6	10%	0.098	32%	0.324	C	S	.	.			trans	-135.3	104.7	174.7	-177.2	0	0	0	0	110.5	S389 Y455	S389-S457 WeakPolarHBondContact CB-OG 3.28Å; S389-S457 PolarHBondContact O-OG 3.16Å; Y455-S457 VanDerWaalsContact C-N 3.34Å
458	V	82.8	Confident	79.4	Confident	16 Å²	16	54.5 Å²	54.5	10%	0.097	31%	0.307	C	S	.	.			trans	-134.6	65.7	-173.4	-78.6	0	0	0	0	110.6	Q424 P454 F460 G461 V462	Q424-V458 HydrophobicContact CG-CG2 4.24Å; Q424-V458 PolarHBondContact NE2-O 2.72Å; P454-V458 WeakPolarHBondContact O-CG1 3.1Å; V458-F460 VanDerWaalsContact C-N 3.31Å; V458-F460 PolarHBondContact O-N 3.3Å; V458-G461 WeakPolarHBondContact O-CA 3.5Å; V458-G461 PolarHBondContact O-N 3.18Å; V458-V462 HydrophobicContact CB-CG2 3.93Å; V458-V462 HydrophobicContact CG1-CG2 3.33Å
459	P	78.8	Confident	80.6	Confident	31 Å²	31	46.1 Å²	46.1	20%	0.201	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.8	-169.2	28.3	-38.9	0	0	0	113.2	L388 S389 G461	L388-P459 HydrophobicContact CD2-CB 3.4Å; L388-P459 VanDerWaalsContact CD2-CB 3.4Å; L388-P459 HydrophobicContact CD2-CG 3.93Å; L388-P459 HydrophobicContact CG-CB 4.46Å; S389-P459 VanDerWaalsContact OG-CG 3.25Å; S389-P459 WeakPolarHBondContact OG-CG 3.47Å; P459-G461 VanDerWaalsContact C-N 3.31Å
460	F	87.1	Confident	82.3	Confident	40 Å²	40	43 Å²	43	18%	0.175	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.2	177.9	-64.7	-71.3	0	0	0	112.4	L388 V458 S466 C467 R470 A473 E474	L388-F460 HydrophobicContact CD2-CE2 4.16Å; L388-F460 HydrophobicContact CD2-CZ 4.21Å; V458-F460 VanDerWaalsContact C-N 3.31Å; V458-F460 PolarHBondContact O-N 3.3Å; F460-S466 CarbonylContact O-C 3.57Å; F460-S466 WeakPolarHBondContact O-CA 3.1Å; F460-C467 HydrophobicContact CB-CB 3.86Å; F460-C467 HydrophobicContact CD1-CB 3.74Å; F460-C467 HydrophobicContact CG-CB 4.29Å; F460-C467 PolarHBondContact O-N 3.37Å; F460-R470 HydrophobicContact CB-CB 4.38Å; F460-R470 HydrophobicContact CB-CG 4.19Å; F460-R470 HydrophobicContact CD1-CB 3.92Å; F460-R470 HydrophobicContact CD1-CG 3.93Å; F460-R470 HydrophobicContact CD2-CG 3.77Å; F460-R470 HydrophobicContact CE1-CB 4.36Å; F460-R470 HydrophobicContact CE1-CG 4.23Å; F460-R470 HydrophobicContact CE2-CG 4.1Å; F460-R470 HydrophobicContact CG-CB 4.06Å; F460-R470 HydrophobicContact CG-CG 3.69Å; F460-R470 HydrophobicContact CZ-CG 4.31Å; F460-A473 HydrophobicContact CE1-CB 4.31Å; F460-E474 HydrophobicContact CE2-CG 4.2Å; F460-E474 HydrophobicContact CZ-CG 4.22Å
461	G	85.4	Confident	83.7	Confident	16 Å²	16	44.2 Å²	44.2	17%	0.165	25%	0.253	C	S	.	.			trans	65.9	177	-170	0	0	0	0	0	113.4	V458 P459	V458-G461 WeakPolarHBondContact O-CA 3.5Å; V458-G461 PolarHBondContact O-N 3.18Å; P459-G461 VanDerWaalsContact C-N 3.31Å
462	V	85	Confident	85.2	Confident	42 Å²	42	40.1 Å²	40.1	26%	0.255	22%	0.219	S	C	.	.	S	Bend	trans	-125	158.2	-179	-179.5	0	0	0	0	110	L117 R400 Y455 V458	L117-V462 HydrophobicContact CD1-CB 4.18Å; R400-V462 PolarHBondContact NH2-O 3.41Å; Y455-V462 HydrophobicContact CD1-CG2 4.2Å; Y455-V462 HydrophobicContact CE1-CB 4.16Å; Y455-V462 HydrophobicContact CE1-CG1 3.78Å; Y455-V462 HydrophobicContact CE1-CG2 4.06Å; V458-V462 HydrophobicContact CB-CG2 3.93Å; V458-V462 HydrophobicContact CG1-CG2 3.33Å
463	G	85.4	Confident	86.1	Confident	39 Å²	39	39.2 Å²	39.2	40%	0.402	22%	0.217	S	C	.	.	S	Bend	trans	87.5	-166.3	173.5	0	0	0	0	0	113.7	R465 S466	G463-R465 PolarHBondContact O-N 3.36Å; G463-S466 WeakPolarHBondContact O-CB 3.14Å; G463-S466 PolarHBondContact O-N 2.91Å; G463-S466 PolarHBondContact O-OG 3.2Å
464	K	85.2	Confident	86.8	Confident	106 Å²	106	37.7 Å²	37.7	46%	0.461	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.5	-176.6	-61.9	-178	-175	175.5	0	112.7	Q122 P124 W153 R157	Q122-K464 PolarHBondContact O-NZ 3.17Å; P124-K464 HydrophobicContact CG-CB 4.48Å; W153-K464 HydrophobicContact CH2-CB 3.96Å; R157-K464 VanDerWaalsContact CZ-O 3.28Å; R157-K464 PolarHBondContact NE-O 2.82Å; R157-K464 VanDerWaalsContact NE-O 3.11Å; R157-K464 PolarHBondContact NH2-O 3.35Å
465	R	88.5	Confident	87.3	Confident	9 Å²	9	33 Å²	33	3%	0.034	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	26.1	-180	-152	155.1	-176.6	170.2	3.8	113	P124 R126 A148 W153 G463	P124-R465 HydrophobicContact CB-CB 4.27Å; P124-R465 WeakPolarHBondContact O-CD 3.37Å; P124-R465 PolarHBondContact O-NH1 2.97Å; R126-R465 PolarHBondContact NH2-O 2.91Å; A148-R465 PolarHBondContact O-NH2 2.88Å; W153-R465 HydrophobicContact CH2-CB 4.14Å; W153-R465 HydrophobicContact CH2-CG 4.37Å; W153-R465 HydrophobicContact CZ2-CB 3.72Å; W153-R465 HydrophobicContact CZ2-CG 3.54Å; G463-R465 PolarHBondContact O-N 3.36Å
466	S	90.8	Very high	87.7	Confident	29 Å²	29	31.4 Å²	31.4	20%	0.203	17%	0.173	C	C	.	.	S	Bend	trans	-62.4	164.6	165.3	59.9	0	0	0	0	111.8	R157 F460 G463 I468	R157-S466 PolarHBondContact NH1-O 3.02Å; R157-S466 PolarHBondContact NH2-O 3.12Å; R157-S466 PolarHBondContact NH2-OG 3.4Å; F460-S466 CarbonylContact O-C 3.57Å; F460-S466 WeakPolarHBondContact O-CA 3.1Å; G463-S466 WeakPolarHBondContact O-CB 3.14Å; G463-S466 PolarHBondContact O-N 2.91Å; G463-S466 PolarHBondContact O-OG 3.2Å; S466-I468 PolarHBondContact O-N 3.42Å
467	C	92.3	Very high	88.3	Confident	42 Å²	42	31.5 Å²	31.5	28%	0.284	17%	0.174	S	C	.	.			trans	-54.3	125.1	-179.1	-176.1	0	0	0	0	111.4	F460 G469 R470	F460-C467 HydrophobicContact CB-CB 3.86Å; F460-C467 HydrophobicContact CD1-CB 3.74Å; F460-C467 HydrophobicContact CG-CB 4.29Å; F460-C467 PolarHBondContact O-N 3.37Å; C467-G469 PolarHBondContact SG-N 3.34Å; C467-R470 HydrophobicContact CB-CB 4.25Å
468	I	91.3	Very high	88.8	Confident	15 Å²	15	31.7 Å²	31.7	8%	0.077	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-35.4	178	-166.6	65	0	0	0	111.7	L145 R157 L160 M164 L165 L326 S466 R470	L145-I468 HydrophobicContact CD2-CB 3.82Å; L145-I468 HydrophobicContact CD2-CG1 4.06Å; L145-I468 HydrophobicContact CD2-CG2 3.65Å; R157-I468 VanDerWaalsContact NH1-CB 3.28Å; L160-I468 HydrophobicContact CB-CD1 4.03Å; L160-I468 HydrophobicContact CB-CG1 4.13Å; M164-I468 HydrophobicContact CB-CG1 4.16Å; M164-I468 HydrophobicContact SD-CG1 3.84Å; M164-I468 HydrophobicContact SD-CG2 4.49Å; L165-I468 HydrophobicContact CD1-CD1 3.92Å; L165-I468 WeakPolarHBondContact CD2-O 3.34Å; L165-I468 HydrophobicContact CG-CD1 4.03Å; L326-I468 HydrophobicContact CD2-CG2 3.59Å; S466-I468 PolarHBondContact O-N 3.42Å; I468-R470 VanDerWaalsContact C-N 3.3Å; I468-R470 PolarHBondContact O-N 3.04Å
469	G	90.2	Very high	89.3	Confident	16 Å²	16	31 Å²	31	17%	0.165	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.4	-177.2	0	0	0	0	0	113.6	C467 R471 I472 A473	C467-G469 PolarHBondContact SG-N 3.34Å; G469-R471 VanDerWaalsContact C-N 3.28Å; G469-R471 PolarHBondContact O-N 2.96Å; G469-R471 VanDerWaalsContact O-N 3.15Å; G469-I472 PolarHBondContact O-N 3.4Å; G469-I472 VanDerWaalsContact O-N 3.16Å; G469-A473 VanDerWaalsContact O-CB 3.3Å; G469-A473 WeakPolarHBondContact O-CB 3.48Å; G469-A473 PolarHBondContact O-N 3.32Å
470	R	91.1	Very high	90	Very high	101 Å²	101	29.5 Å²	29.5	38%	0.381	16%	0.158	S	C	.	.	H	α-helix	trans	-48.5	-48.2	-173.3	172.8	178.9	172.3	-173.2	-0.9	112.8	F460 C467 I468 E474	F460-R470 HydrophobicContact CB-CB 4.38Å; F460-R470 HydrophobicContact CB-CG 4.19Å; F460-R470 HydrophobicContact CD1-CB 3.92Å; F460-R470 HydrophobicContact CD1-CG 3.93Å; F460-R470 HydrophobicContact CD2-CG 3.77Å; F460-R470 HydrophobicContact CE1-CB 4.36Å; F460-R470 HydrophobicContact CE1-CG 4.23Å; F460-R470 HydrophobicContact CE2-CG 4.1Å; F460-R470 HydrophobicContact CG-CB 4.06Å; F460-R470 HydrophobicContact CG-CG 3.69Å; F460-R470 HydrophobicContact CZ-CG 4.31Å; C467-R470 HydrophobicContact CB-CB 4.25Å; I468-R470 VanDerWaalsContact C-N 3.3Å; I468-R470 PolarHBondContact O-N 3.04Å; R470-E474 HydrophobicContact CG-CG 4.37Å; R470-E474 IonicContact CZ-OE1 3.74Å; R470-E474 IonicContact NE-OE1 3.89Å; R470-E474 PolarHBondContact NE-OE1 2.84Å; R470-E474 IonicContact NE-OE2 3.96Å; R470-E474 IonicContact NH2-OE1 3.66Å; R470-E474 PolarHBondContact NH2-OE1 2.89Å; R470-E474 VanDerWaalsContact O-CB 3.28Å; R470-E474 WeakPolarHBondContact O-CB 3.46Å; R470-E474 VanDerWaalsContact O-CG 3.26Å; R470-E474 WeakPolarHBondContact O-CG 3.3Å; R470-E474 PolarHBondContact O-N 2.78Å
471	R	90.2	Very high	90.3	Very high	95 Å²	95	27.6 Å²	27.6	36%	0.358	15%	0.15	S	C	.	.	H	α-helix	trans	-72.1	-38.8	-174.5	-65.5	-56	-168.5	-177.9	7.8	112.7	V170 G469 E474 L475	V170-R471 HydrophobicContact CG1-CB 4.41Å; V170-R471 HydrophobicContact CG2-CB 3.79Å; G469-R471 VanDerWaalsContact C-N 3.28Å; G469-R471 PolarHBondContact O-N 2.96Å; G469-R471 VanDerWaalsContact O-N 3.15Å; R471-E474 WeakPolarHBondContact CD-OE2 3.45Å; R471-E474 IonicContact CZ-OE2 3.1Å; R471-E474 IonicContact NH1-OE2 2.62Å; R471-E474 PolarHBondContact NH1-OE2 3.34Å; R471-L475 WeakPolarHBondContact O-CB 3.48Å; R471-L475 PolarHBondContact O-N 3.37Å
472	I	90.1	Very high	90.7	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-67.2	-45.1	176.9	-58.4	177.4	0	0	0	109.2	M164 V170 Y173 V216 G469 L475 E476	M164-I472 HydrophobicContact CB-CD1 4.25Å; M164-I472 HydrophobicContact CE-CD1 3.65Å; M164-I472 HydrophobicContact CG-CD1 4.2Å; V170-I472 HydrophobicContact CG1-CG1 4.26Å; V170-I472 HydrophobicContact CG2-CG1 4.1Å; Y173-I472 HydrophobicContact CE2-CD1 4.35Å; V216-I472 HydrophobicContact CG1-CD1 4Å; V216-I472 HydrophobicContact CG1-CG2 4.44Å; V216-I472 HydrophobicContact CG2-CG2 4.19Å; G469-I472 PolarHBondContact O-N 3.4Å; G469-I472 VanDerWaalsContact O-N 3.16Å; I472-L475 PolarHBondContact O-N 3.2Å; I472-E476 VanDerWaalsContact O-CB 3.31Å; I472-E476 WeakPolarHBondContact O-CB 3.28Å; I472-E476 PolarHBondContact O-N 3.38Å
473	A	91	Very high	91.1	Very high	14 Å²	14	25.8 Å²	25.8	12%	0.116	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-48.8	175.2	0	0	0	0	0	112.4	I334 F460 G469 L475 E476 L477	I334-A473 HydrophobicContact CD1-CB 3.54Å; F460-A473 HydrophobicContact CE1-CB 4.31Å; G469-A473 VanDerWaalsContact O-CB 3.3Å; G469-A473 WeakPolarHBondContact O-CB 3.48Å; G469-A473 PolarHBondContact O-N 3.32Å; A473-L475 PolarHBondContact O-N 2.98Å; A473-E476 PolarHBondContact O-N 3.32Å; A473-L477 WeakPolarHBondContact O-CB 3.31Å; A473-L477 WeakPolarHBondContact O-CD1 3.46Å; A473-L477 WeakPolarHBondContact O-CG 3.34Å; A473-L477 PolarHBondContact O-N 2.89Å
474	E	91.2	Very high	91.5	Very high	22 Å²	22	23.9 Å²	23.9	10%	0.103	11%	0.114	C	C	.	.	H	α-helix	trans	-54.9	-51.2	174.7	-82.2	173.5	172.7	0	0	110.4	F460 R470 R471 L477 Y478	F460-E474 HydrophobicContact CE2-CG 4.2Å; F460-E474 HydrophobicContact CZ-CG 4.22Å; R470-E474 HydrophobicContact CG-CG 4.37Å; R470-E474 IonicContact CZ-OE1 3.74Å; R470-E474 IonicContact NE-OE1 3.89Å; R470-E474 PolarHBondContact NE-OE1 2.84Å; R470-E474 IonicContact NE-OE2 3.96Å; R470-E474 IonicContact NH2-OE1 3.66Å; R470-E474 PolarHBondContact NH2-OE1 2.89Å; R470-E474 VanDerWaalsContact O-CB 3.28Å; R470-E474 WeakPolarHBondContact O-CB 3.46Å; R470-E474 VanDerWaalsContact O-CG 3.26Å; R470-E474 WeakPolarHBondContact O-CG 3.3Å; R470-E474 PolarHBondContact O-N 2.78Å; R471-E474 WeakPolarHBondContact CD-OE2 3.45Å; R471-E474 IonicContact CZ-OE2 3.1Å; R471-E474 IonicContact NH1-OE2 2.62Å; R471-E474 PolarHBondContact NH1-OE2 3.34Å; E474-L477 PolarHBondContact O-N 2.75Å; E474-Y478 VanDerWaalsContact C-CD2 3.49Å; E474-Y478 HydrophobicContact CB-CD2 4.21Å; E474-Y478 HydrophobicContact CB-CE2 3.65Å; E474-Y478 HydrophobicContact CG-CE2 4.1Å; E474-Y478 WeakPolarHBondContact O-CB 3.42Å; E474-Y478 WeakPolarHBondContact O-CD2 3.34Å; E474-Y478 WeakPolarHBondContact O-CE2 3.25Å; E474-Y478 PolarHBondContact O-N 2.76Å
475	L	91	Very high	91.8	Very high	3 Å²	3	18.9 Å²	18.9	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-59.6	-51.1	179.6	179.8	65.1	0	0	0	112.1	V170 D174 L177 N371 V374 R471 I472 A473 L477 Y478 L479	V170-L475 HydrophobicContact CG1-CB 4.24Å; V170-L475 HydrophobicContact CG1-CD2 3.6Å; D174-L475 WeakPolarHBondContact OD1-CD2 3.48Å; L177-L475 HydrophobicContact CD1-CB 4.49Å; L177-L475 HydrophobicContact CD1-CD2 3.7Å; L177-L475 HydrophobicContact CD1-CG 3.98Å; N371-L475 HydrophobicContact CB-CD1 4.08Å; V374-L475 HydrophobicContact CG2-CD1 4.48Å; R471-L475 WeakPolarHBondContact O-CB 3.48Å; R471-L475 PolarHBondContact O-N 3.37Å; I472-L475 PolarHBondContact O-N 3.2Å; A473-L475 PolarHBondContact O-N 2.98Å; L475-L477 VanDerWaalsContact C-N 3.34Å; L475-L477 PolarHBondContact O-N 2.8Å; L475-Y478 PolarHBondContact O-N 3.19Å; L475-L479 HydrophobicContact CD1-CD1 3.79Å; L475-L479 HydrophobicContact CD1-CD2 4.3Å; L475-L479 HydrophobicContact CD1-CG 3.87Å; L475-L479 HydrophobicContact CD2-CD1 4.43Å; L475-L479 HydrophobicContact CG-CD1 3.78Å; L475-L479 HydrophobicContact CG-CG 4.22Å; L475-L479 WeakPolarHBondContact O-CB 3.32Å; L475-L479 VanDerWaalsContact O-CG 3.26Å; L475-L479 WeakPolarHBondContact O-CG 3.39Å; L475-L479 PolarHBondContact O-N 3.37Å
476	E	91.9	Very high	91.9	Very high	5 Å²	5	19.6 Å²	19.6	2%	0.023	10%	0.097	C	C	.	.	H	α-helix	trans	-57.3	-45.7	-179.6	-177.4	173.4	-162.3	0	0	112	L177 F208 G212 I334 I472 A473 A480	L177-E476 HydrophobicContact CD1-CB 4.3Å; L177-E476 HydrophobicContact CD2-CB 4.39Å; L177-E476 HydrophobicContact CD2-CG 4.29Å; F208-E476 HydrophobicContact CE1-CG 3.89Å; F208-E476 HydrophobicContact CZ-CG 3.86Å; G212-E476 WeakPolarHBondContact CA-OE1 3.41Å; I334-E476 HydrophobicContact CG2-CG 4.38Å; I472-E476 VanDerWaalsContact O-CB 3.31Å; I472-E476 WeakPolarHBondContact O-CB 3.28Å; I472-E476 PolarHBondContact O-N 3.38Å; A473-E476 PolarHBondContact O-N 3.32Å; E476-A480 VanDerWaalsContact O-CB 3.25Å; E476-A480 WeakPolarHBondContact O-CB 3.33Å; E476-A480 PolarHBondContact O-N 3.43Å
477	L	92.9	Very high	91.9	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-62.7	-47.4	176.8	-69.2	168.1	0	0	0	111.8	I334 T337 M338 V384 A473 E474 L475 A480 L481	I334-L477 HydrophobicContact CD1-CD1 4.34Å; I334-L477 HydrophobicContact CD1-CD2 4.35Å; I334-L477 HydrophobicContact CD1-CG 4.08Å; I334-L477 HydrophobicContact CG2-CD2 4.08Å; T337-L477 HydrophobicContact CG2-CD1 3.62Å; T337-L477 HydrophobicContact CG2-CD2 3.54Å; T337-L477 HydrophobicContact CG2-CG 4.22Å; M338-L477 HydrophobicContact CG-CD2 3.62Å; M338-L477 HydrophobicContact SD-CD2 3.65Å; V384-L477 HydrophobicContact CG1-CD1 4.24Å; A473-L477 WeakPolarHBondContact O-CB 3.31Å; A473-L477 WeakPolarHBondContact O-CD1 3.46Å; A473-L477 WeakPolarHBondContact O-CG 3.34Å; A473-L477 PolarHBondContact O-N 2.89Å; E474-L477 PolarHBondContact O-N 2.75Å; L475-L477 VanDerWaalsContact C-N 3.34Å; L475-L477 PolarHBondContact O-N 2.8Å; L477-A480 PolarHBondContact O-N 3.45Å; L477-L481 WeakPolarHBondContact O-CB 3.35Å; L477-L481 VanDerWaalsContact O-CG 3.24Å; L477-L481 WeakPolarHBondContact O-CG 3.37Å; L477-L481 PolarHBondContact O-N 3.44Å
478	Y	93.3	Very high	91.9	Very high	19 Å²	19	18.3 Å²	18.3	8%	0.075	8%	0.083	C	C	.	.	H	α-helix	trans	-68.1	-40.6	-177	-60.8	-37.2	0	0	0	112.2	V374 M380 K381 V384 E474 L475 S482	V374-Y478 VanDerWaalsContact CG1-CB 3.48Å; V374-Y478 HydrophobicContact CG1-CD2 3.23Å; V374-Y478 HydrophobicContact CG1-CE2 4.23Å; V374-Y478 HydrophobicContact CG1-CG 3.69Å; M380-Y478 HydrophobicContact CG-CD1 3.61Å; M380-Y478 HydrophobicContact CG-CE1 4.25Å; M380-Y478 HydrophobicContact CG-CG 4.34Å; K381-Y478 HydrophobicContact CG-CE1 4.1Å; K381-Y478 HydrophobicContact CG-CE2 3.99Å; V384-Y478 HydrophobicContact CB-CE1 3.81Å; V384-Y478 HydrophobicContact CG1-CE1 4.2Å; V384-Y478 HydrophobicContact CG2-CD1 3.96Å; V384-Y478 HydrophobicContact CG2-CE1 3.63Å; E474-Y478 VanDerWaalsContact C-CD2 3.49Å; E474-Y478 HydrophobicContact CB-CD2 4.21Å; E474-Y478 HydrophobicContact CB-CE2 3.65Å; E474-Y478 HydrophobicContact CG-CE2 4.1Å; E474-Y478 WeakPolarHBondContact O-CB 3.42Å; E474-Y478 WeakPolarHBondContact O-CD2 3.34Å; E474-Y478 WeakPolarHBondContact O-CE2 3.25Å; E474-Y478 PolarHBondContact O-N 2.76Å; L475-Y478 PolarHBondContact O-N 3.19Å; Y478-S482 WeakPolarHBondContact O-CB 3.4Å; Y478-S482 PolarHBondContact O-N 3Å; Y478-S482 PolarHBondContact O-OG 2.85Å
479	L	92.8	Very high	92	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-45.7	175.3	-67.5	177	0	0	0	111.2	L177 V181 P369 V374 L475 R483	L177-L479 HydrophobicContact CB-CD1 3.92Å; V181-L479 HydrophobicContact CG2-CB 4.41Å; P369-L479 HydrophobicContact CB-CD2 3.99Å; P369-L479 HydrophobicContact CG-CD2 3.75Å; P369-L479 VanDerWaalsContact O-CD2 3.27Å; P369-L479 WeakPolarHBondContact O-CD2 3.46Å; V374-L479 HydrophobicContact CG2-CD2 3.91Å; V374-L479 HydrophobicContact CG2-CG 4.48Å; L475-L479 HydrophobicContact CD1-CD1 3.79Å; L475-L479 HydrophobicContact CD1-CD2 4.3Å; L475-L479 HydrophobicContact CD1-CG 3.87Å; L475-L479 HydrophobicContact CD2-CD1 4.43Å; L475-L479 HydrophobicContact CG-CD1 3.78Å; L475-L479 HydrophobicContact CG-CG 4.22Å; L475-L479 WeakPolarHBondContact O-CB 3.32Å; L475-L479 VanDerWaalsContact O-CG 3.26Å; L475-L479 WeakPolarHBondContact O-CG 3.39Å; L475-L479 PolarHBondContact O-N 3.37Å; L479-R483 WeakPolarHBondContact O-CG 3.48Å; L479-R483 PolarHBondContact O-N 2.79Å
480	A	93.8	Very high	92.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.1	-52.1	179.5	0	0	0	0	0	112	V181 F208 M338 E476 L477 S482 R483 I484	V181-A480 HydrophobicContact CG2-CB 4.05Å; F208-A480 HydrophobicContact CE1-CB 4.07Å; F208-A480 HydrophobicContact CZ-CB 3.8Å; M338-A480 HydrophobicContact CE-CB 3.7Å; M338-A480 HydrophobicContact SD-CB 4.05Å; E476-A480 VanDerWaalsContact O-CB 3.25Å; E476-A480 WeakPolarHBondContact O-CB 3.33Å; E476-A480 PolarHBondContact O-N 3.43Å; L477-A480 PolarHBondContact O-N 3.45Å; A480-S482 PolarHBondContact O-N 2.84Å; A480-R483 PolarHBondContact O-N 2.93Å; A480-I484 WeakPolarHBondContact O-CB 3.46Å; A480-I484 WeakPolarHBondContact O-CD1 3.45Å; A480-I484 VanDerWaalsContact O-CG1 3.3Å; A480-I484 WeakPolarHBondContact O-CG1 3.4Å; A480-I484 PolarHBondContact O-N 3.49Å
481	L	93.6	Very high	92.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.8	-44.5	-179.1	-70.1	169.5	0	0	0	111.8	M338 T341 L342 M380 V384 L477 R483 I484 L485	M338-L481 HydrophobicContact CE-CD2 4Å; M338-L481 HydrophobicContact CE-CG 4.29Å; M338-L481 HydrophobicContact SD-CD2 3.96Å; M338-L481 HydrophobicContact SD-CG 3.88Å; T341-L481 HydrophobicContact CG2-CD1 3.84Å; T341-L481 HydrophobicContact CG2-CD2 4.06Å; L342-L481 HydrophobicContact CD2-CD2 3.79Å; L342-L481 HydrophobicContact CG-CD2 4.01Å; M380-L481 HydrophobicContact CE-CB 3.97Å; M380-L481 HydrophobicContact SD-CB 3.77Å; M380-L481 HydrophobicContact SD-CD1 3.96Å; V384-L481 HydrophobicContact CG2-CD1 3.46Å; V384-L481 VanDerWaalsContact CG2-CD1 3.46Å; L477-L481 WeakPolarHBondContact O-CB 3.35Å; L477-L481 VanDerWaalsContact O-CG 3.24Å; L477-L481 WeakPolarHBondContact O-CG 3.37Å; L477-L481 PolarHBondContact O-N 3.44Å; L481-R483 VanDerWaalsContact C-N 3.3Å; L481-R483 PolarHBondContact O-N 3.44Å; L481-I484 PolarHBondContact O-N 3.15Å; L481-L485 WeakPolarHBondContact O-CB 3.36Å; L481-L485 VanDerWaalsContact O-CG 3.26Å; L481-L485 WeakPolarHBondContact O-CG 3.38Å; L481-L485 PolarHBondContact O-N 3.17Å
482	S	93.2	Very high	92.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.9	-44.4	179.3	-59.5	0	0	0	0	111.5	Y478 A480 M486	Y478-S482 WeakPolarHBondContact O-CB 3.4Å; Y478-S482 PolarHBondContact O-N 3Å; Y478-S482 PolarHBondContact O-OG 2.85Å; A480-S482 PolarHBondContact O-N 2.84Å; S482-M486 WeakPolarHBondContact O-CG 3.47Å; S482-M486 PolarHBondContact O-N 3.5Å; S482-M486 VanDerWaalsContact O-N 3.16Å
483	R	92.8	Very high	92.1	Very high	20 Å²	20	17 Å²	17	8%	0.075	9%	0.086	C	C	.	.	H	α-helix	trans	-75.8	-35	-179.2	-64.2	-176.9	59.9	-166.6	0.2	113.2	N178 V181 S182 I185 P369 L479 A480 L481 M486 E487	N178-R483 PolarHBondContact O-NH1 3.38Å; V181-R483 HydrophobicContact CG1-CB 3.96Å; V181-R483 HydrophobicContact CG1-CG 4.28Å; S182-R483 VanDerWaalsContact N-NH1 3.18Å; S182-R483 PolarHBondContact OG-NH1 2.96Å; S182-R483 PolarHBondContact OG-NH2 3.03Å; I185-R483 HydrophobicContact CD1-CB 3.61Å; P369-R483 HydrophobicContact CG-CG 4.05Å; L479-R483 WeakPolarHBondContact O-CG 3.48Å; L479-R483 PolarHBondContact O-N 2.79Å; A480-R483 PolarHBondContact O-N 2.93Å; L481-R483 VanDerWaalsContact C-N 3.3Å; L481-R483 PolarHBondContact O-N 3.44Å; R483-M486 HydrophobicContact CB-CE 4.25Å; R483-M486 HydrophobicContact CG-CE 3.83Å; R483-M486 PolarHBondContact O-N 2.77Å; R483-E487 WeakPolarHBondContact O-CG 3.07Å; R483-E487 PolarHBondContact O-N 2.78Å
484	I	93.6	Very high	91.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.3	-47	173	-73.4	161.2	0	0	0	110.4	L184 L188 M338 L342 A480 L481 M486 E487 F488 V490 F517	L184-I484 HydrophobicContact CD2-CD1 4.11Å; L188-I484 HydrophobicContact CD1-CD1 4.4Å; L188-I484 HydrophobicContact CD1-CG1 4.27Å; M338-I484 HydrophobicContact CE-CD1 3.64Å; L342-I484 HydrophobicContact CD1-CD1 4.33Å; L342-I484 HydrophobicContact CD2-CG2 4.16Å; A480-I484 WeakPolarHBondContact O-CB 3.46Å; A480-I484 WeakPolarHBondContact O-CD1 3.45Å; A480-I484 VanDerWaalsContact O-CG1 3.3Å; A480-I484 WeakPolarHBondContact O-CG1 3.4Å; A480-I484 PolarHBondContact O-N 3.49Å; L481-I484 PolarHBondContact O-N 3.15Å; I484-M486 VanDerWaalsContact C-N 3.28Å; I484-M486 PolarHBondContact O-N 2.7Å; I484-E487 PolarHBondContact O-N 3.09Å; I484-F488 HydrophobicContact CG2-CD2 4.48Å; I484-F488 WeakPolarHBondContact O-CB 3.2Å; I484-F488 PolarHBondContact O-N 3.29Å; I484-V490 HydrophobicContact CG2-CG2 4.14Å; I484-F517 HydrophobicContact CG2-CE1 4.04Å
485	L	92.2	Very high	90.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-22.8	-179.1	-66.1	179.2	0	0	0	113.8	L345 Q352 L355 R356 M380 L481	L345-L485 HydrophobicContact CD1-CD1 4.39Å; L345-L485 HydrophobicContact CD1-CD2 4.41Å; Q352-L485 HydrophobicContact CG-CD2 3.55Å; L355-L485 HydrophobicContact CB-CD1 3.8Å; L355-L485 HydrophobicContact CD1-CD1 4.15Å; R356-L485 WeakPolarHBondContact CD-O 3.36Å; M380-L485 HydrophobicContact CE-CD1 3.98Å; L481-L485 WeakPolarHBondContact O-CB 3.36Å; L481-L485 VanDerWaalsContact O-CG 3.26Å; L481-L485 WeakPolarHBondContact O-CG 3.38Å; L481-L485 PolarHBondContact O-N 3.17Å
486	M	91.1	Very high	90.2	Very high	24 Å²	24	29.1 Å²	29.1	12%	0.118	16%	0.164	C	C	.	.	H	α-helix	trans	-72.4	-44.4	171.9	-79.9	-167.9	-67.5	0	0	112.3	V359 L363 R367 S482 R483 I484	V359-M486 HydrophobicContact CG1-CE 4.37Å; V359-M486 HydrophobicContact CG1-CG 3.72Å; V359-M486 HydrophobicContact CG1-SD 3.89Å; L363-M486 HydrophobicContact CD1-CE 3.63Å; L363-M486 HydrophobicContact CD1-SD 3.26Å; L363-M486 WeakPolarHBondContact CD1-SD 3.33Å; R367-M486 VanDerWaalsContact O-CE 3.23Å; R367-M486 WeakPolarHBondContact O-CE 3.29Å; S482-M486 WeakPolarHBondContact O-CG 3.47Å; S482-M486 PolarHBondContact O-N 3.5Å; S482-M486 VanDerWaalsContact O-N 3.16Å; R483-M486 HydrophobicContact CB-CE 4.25Å; R483-M486 HydrophobicContact CG-CE 3.83Å; R483-M486 PolarHBondContact O-N 2.77Å; I484-M486 VanDerWaalsContact C-N 3.28Å; I484-M486 PolarHBondContact O-N 2.7Å
487	E	90.8	Very high	89.5	Confident	43 Å²	43	33 Å²	33	20%	0.201	19%	0.185	C	C	.	.	H	α-helix	trans	-90.5	-23.5	-171.1	-59.4	-77.9	171.5	0	0	112.6	I185 R189 R483 I484 R520	I185-E487 HydrophobicContact CG2-CG 4.46Å; R189-E487 IonicContact CZ-OE2 3.4Å; R189-E487 IonicContact NH2-OE2 3.48Å; R189-E487 PolarHBondContact NH2-OE2 3.36Å; R483-E487 WeakPolarHBondContact O-CG 3.07Å; R483-E487 PolarHBondContact O-N 2.78Å; I484-E487 PolarHBondContact O-N 3.09Å; E487-R520 PolarHBondContact O-N 3.39Å
488	F	92.6	Very high	88.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.3	-174.6	-54	-76.1	0	0	0	113.4	I185 L188 R189 I484 F517 V518 E519	I185-F488 HydrophobicContact CG2-CE2 4.05Å; I185-F488 HydrophobicContact CG2-CZ 4.36Å; L188-F488 HydrophobicContact CB-CZ 4.5Å; R189-F488 HydrophobicContact CG-CE1 4.16Å; R189-F488 HydrophobicContact CG-CZ 3.69Å; I484-F488 HydrophobicContact CG2-CD2 4.48Å; I484-F488 WeakPolarHBondContact O-CB 3.2Å; I484-F488 PolarHBondContact O-N 3.29Å; F488-F517 HydrophobicContact CB-CB 4.34Å; F488-F517 HydrophobicContact CB-CD1 3.99Å; F488-F517 HydrophobicContact CD1-CB 3.9Å; F488-F517 HydrophobicContact CD2-CD1 4.18Å; F488-F517 HydrophobicContact CE1-CB 4.44Å; F488-F517 HydrophobicContact CG-CB 4.15Å; F488-F517 HydrophobicContact CG-CD1 4.01Å; F488-V518 CarbonylContact C-O 3.48Å; F488-V518 VanDerWaalsContact CA-O 3.24Å; F488-V518 WeakPolarHBondContact CA-O 3.42Å; F488-E519 HydrophobicContact CD1-CG 4.18Å; F488-E519 HydrophobicContact CE1-CG 3.97Å
489	E	93.4	Very high	88.5	Confident	53 Å²	53	36.4 Å²	36.4	25%	0.248	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.8	155	-174.2	-177.6	-173.7	0	0	108.7	K491 V518 R520	E489-K491 VanDerWaalsContact CD-NZ 3.34Å; E489-K491 HydrophobicContact CG-CG 4.46Å; E489-K491 WeakPolarHBondContact OE1-CE 3.36Å; E489-K491 IonicContact OE1-NZ 3.3Å; E489-K491 PolarHBondContact OE1-NZ 2.97Å; E489-K491 WeakPolarHBondContact OE2-CE 3.24Å; E489-K491 IonicContact OE2-NZ 2.89Å; E489-K491 PolarHBondContact OE2-NZ 3.09Å; E489-V518 HydrophobicContact CB-CB 4.24Å; E489-V518 PolarHBondContact N-O 3.33Å; E489-V518 PolarHBondContact O-N 2.78Å; E489-R520 HydrophobicContact CB-CG 4.07Å; E489-R520 VanDerWaalsContact CB-NE 3.32Å
490	V	92.8	Very high	88.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.5	179.8	-173	0	0	0	0	109.6	L342 S346 Q352 I484 L515 Q516 F517	L342-V490 HydrophobicContact CD2-CG2 4.26Å; S346-V490 WeakPolarHBondContact CA-O 3.27Å; Q352-V490 PolarHBondContact NE2-O 3.47Å; I484-V490 HydrophobicContact CG2-CG2 4.14Å; V490-L515 HydrophobicContact CG1-CB 4.18Å; V490-L515 HydrophobicContact CG1-CD1 4.08Å; V490-L515 HydrophobicContact CG1-CD2 4.43Å; V490-L515 HydrophobicContact CG1-CG 4.46Å; V490-Q516 CarbonylContact C-O 3.51Å; V490-Q516 VanDerWaalsContact CA-O 3.29Å; V490-Q516 WeakPolarHBondContact CA-O 3.47Å; V490-F517 HydrophobicContact CG2-CD1 3.93Å; V490-F517 HydrophobicContact CG2-CE1 3.83Å
491	K	91.8	Very high	87.9	Confident	74 Å²	74	43.1 Å²	43.1	32%	0.322	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153	178.8	-73.4	179.3	-169.7	170.1	0	110.6	E489 Q516 V518	E489-K491 VanDerWaalsContact CD-NZ 3.34Å; E489-K491 HydrophobicContact CG-CG 4.46Å; E489-K491 WeakPolarHBondContact OE1-CE 3.36Å; E489-K491 IonicContact OE1-NZ 3.3Å; E489-K491 PolarHBondContact OE1-NZ 2.97Å; E489-K491 WeakPolarHBondContact OE2-CE 3.24Å; E489-K491 IonicContact OE2-NZ 2.89Å; E489-K491 PolarHBondContact OE2-NZ 3.09Å; K491-Q516 HydrophobicContact CB-CB 3.83Å; K491-Q516 PolarHBondContact N-O 3.26Å; K491-Q516 PolarHBondContact O-N 3.35Å; K491-V518 HydrophobicContact CD-CG2 4.18Å
492	P	90.8	Very high	87.6	Confident	58 Å²	58	45.4 Å²	45.4	38%	0.377	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	168.4	-177.7	30.2	-32	0	0	0	110.5	S346 Q516	S346-P492 WeakPolarHBondContact O-CD 3.26Å; P492-Q516 PolarHBondContact O-NE2 3.09Å
493	D	87.3	Confident	87.2	Confident	19 Å²	19	45.7 Å²	45.7	10%	0.102	26%	0.256	C	S	.	.			trans	-52.9	127.2	171.8	-169.1	-19.8	0	0	0	110.3	E495 G496 N514	D493-E495 PolarHBondContact O-N 2.72Å; D493-E495 VanDerWaalsContact O-N 3.11Å; D493-E495 WeakPolarHBondContact OD1-CB 3.43Å; D493-E495 PolarHBondContact OD1-N 3.42Å; D493-G496 PolarHBondContact O-N 2.96Å; D493-N514 HydrophobicContact CB-CB 4.24Å; D493-N514 WeakPolarHBondContact OD2-CB 3.37Å; D493-N514 PolarHBondContact OD2-ND2 3.29Å
494	P	79.1	Confident	86.5	Confident	83 Å²	83	46.8 Å²	46.8	54%	0.539	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-27.7	174	-17.8	23.3	0	0	0	113.5	G496 Q516	P494-G496 PolarHBondContact O-N 2.71Å; P494-Q516 HydrophobicContact CG-CG 4.24Å; P494-Q516 VanDerWaalsContact CG-NE2 3.27Å
495	E	79	Confident	85.9	Confident	144 Å²	144	49 Å²	49	67%	0.673	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-13.1	-180	-62.5	-171	172.5	0	0	113.2	D493 N497	D493-E495 PolarHBondContact O-N 2.72Å; D493-E495 VanDerWaalsContact O-N 3.11Å; D493-E495 WeakPolarHBondContact OD1-CB 3.43Å; D493-E495 PolarHBondContact OD1-N 3.42Å; E495-N497 VanDerWaalsContact C-N 3.27Å; E495-N497 WeakPolarHBondContact CB-ND2 3.35Å; E495-N497 PolarHBondContact O-N 3.4Å; E495-N497 PolarHBondContact OE2-ND2 3.13Å
496	G	75.6	Confident	85.6	Confident	65 Å²	65	49.7 Å²	49.7	67%	0.67	28%	0.278	S	S	*	.			trans	69.6	20.4	177.3	0	0	0	0	0	114.5	D493 P494 S498	D493-G496 PolarHBondContact O-N 2.96Å; P494-G496 PolarHBondContact O-N 2.71Å; G496-S498 PolarHBondContact O-N 3.47Å
497	N	76.3	Confident	85.4	Confident	86 Å²	86	48.6 Å²	48.6	46%	0.46	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-67.4	118.9	-179.6	-67.1	-44.9	0	0	0	111.2	E495	E495-N497 VanDerWaalsContact C-N 3.27Å; E495-N497 WeakPolarHBondContact CB-ND2 3.35Å; E495-N497 PolarHBondContact O-N 3.4Å; E495-N497 PolarHBondContact OE2-ND2 3.13Å
498	S	82.4	Confident	85.2	Confident	83 Å²	83	46.8 Å²	46.8	58%	0.58	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-79.4	124.7	172.8	-178	0	0	0	0	110.7	G496	G496-S498 PolarHBondContact O-N 3.47Å
499	V	84.6	Confident	85	Confident	10 Å²	10	47.6 Å²	47.6	6%	0.061	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-92.6	130.2	177.7	-175.9	0	0	0	0	110.4	W340 Y343 P509 I513	W340-V499 HydrophobicContact CH2-CG1 4.07Å; Y343-V499 HydrophobicContact CE2-CB 4.27Å; Y343-V499 HydrophobicContact CE2-CG2 4.15Å; Y343-V499 PolarHBondContact OH-N 3.22Å; Y343-V499 VanDerWaalsContact OH-N 3.12Å; V499-P509 HydrophobicContact CG1-CB 3.58Å; V499-I513 HydrophobicContact CB-CG1 4.22Å; V499-I513 HydrophobicContact CG1-CG1 3.99Å; V499-I513 HydrophobicContact CG2-CG1 3.93Å
500	K	86.1	Confident	84.6	Confident	116 Å²	116	48.7 Å²	48.7	50%	0.504	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-98.6	151.1	176.7	-68	-177.7	-178.2	179.3	0	111	E510	K500-E510 VanDerWaalsContact O-CB 3.29Å; K500-E510 WeakPolarHBondContact O-CB 3.3Å; K500-E510 PolarHBondContact O-N 3.31Å
501	P	87.1	Confident	84.2	Confident	25 Å²	25	53.3 Å²	53.3	16%	0.162	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148.2	173.1	31.8	-33.9	0	0	0	111.8	H81 W340 Y392 L507 V508	H81-P501 PolarHBondContact CE1-O 3.12Å; W340-P501 HydrophobicContact CH2-CB 4.32Å; W340-P501 HydrophobicContact CZ2-CB 3.97Å; Y392-P501 HydrophobicContact CD1-CB 4.4Å; Y392-P501 HydrophobicContact CE1-CG 4.5Å; P501-L507 HydrophobicContact CB-CD1 3.87Å; P501-L507 HydrophobicContact CB-CD2 4.04Å; P501-L507 HydrophobicContact CB-CG 3.85Å; P501-V508 CarbonylContact C-O 3.46Å; P501-V508 WeakPolarHBondContact CA-O 3.41Å
502	M	87.4	Confident	84	Confident	48 Å²	48	52.3 Å²	52.3	24%	0.236	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.2	175.1	-176	-178.4	72.3	0	0	109.1	S78 L507 V508 E510	S78-M502 CarbonylContact O-C 3.59Å; S78-M502 WeakPolarHBondContact O-CG 3.37Å; M502-L507 WeakPolarHBondContact O-CA 3.43Å; M502-V508 HydrophobicContact CE-CG2 4.13Å; M502-V508 PolarHBondContact N-O 2.92Å; M502-V508 WeakPolarHBondContact O-CG2 3.28Å; M502-V508 PolarHBondContact O-N 3.08Å; M502-V508 VanDerWaalsContact O-O 3.1Å; M502-E510 HydrophobicContact CB-CB 4.04Å; M502-E510 HydrophobicContact CB-CG 4.48Å; M502-E510 HydrophobicContact SD-CG 4.5Å
503	T	83.7	Confident	83.8	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.043	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.3	176.2	-57.6	0	0	0	0	111.5	S78 L80 H81 P396 L506	S78-T503 VanDerWaalsContact CA-O 3.29Å; S78-T503 WeakPolarHBondContact CA-O 3.48Å; S78-T503 PolarHBondContact O-N 3.33Å; L80-T503 HydrophobicContact CB-CG2 4.16Å; L80-T503 HydrophobicContact CD1-CG2 4.32Å; H81-T503 PolarHBondContact ND1-OG1 2.94Å; P396-T503 HydrophobicContact CG-CG2 4.5Å; T503-L506 CarbonylContact C-O 3.6Å; T503-L506 WeakPolarHBondContact CA-O 3.29Å
504	R	79.8	Confident	84	Confident	43 Å²	43	50.4 Å²	50.4	16%	0.162	29%	0.291	C	S	.	.	S	Bend	trans	-127.6	59	170.7	-170	-175.1	66.2	-177.2	-1.8	108.8	Y206 N241 V245 D332 L506 V508	Y206-R504 PolarHBondContact OH-NH2 3.07Å; N241-R504 VanDerWaalsContact OD1-CZ 3.28Å; N241-R504 PolarHBondContact OD1-NH1 3.44Å; N241-R504 PolarHBondContact OD1-NH2 3.11Å; V245-R504 HydrophobicContact CG2-CG 3.56Å; D332-R504 IonicContact OD2-NH2 3.04Å; D332-R504 PolarHBondContact OD2-NH2 2.94Å; R504-L506 PolarHBondContact N-O 3.36Å; R504-L506 PolarHBondContact O-N 3.45Å; R504-V508 HydrophobicContact CB-CG2 4.24Å
505	T	80.9	Confident	84.6	Confident	46 Å²	46	46.5 Å²	46.5	28%	0.282	27%	0.266	S	S	.	.	S	Bend	trans	71.4	-46.9	-160	-51.8	0	0	0	0	112.5	F244 L248	F244-T505 HydrophobicContact CD1-CG2 3.92Å; F244-T505 HydrophobicContact CE1-CG2 4.23Å; F244-T505 PolarHBondContact O-OG1 3.38Å; L248-T505 WeakPolarHBondContact CG-OG1 3.48Å
506	L	85.7	Confident	85.1	Confident	16 Å²	16	41.5 Å²	41.5	8%	0.084	24%	0.242	C	C	.	.	S	Bend	trans	-102.8	160.3	170.7	-56.4	177.2	0	0	0	110.5	F244 D332 T333 V394 I395 T503 R504 V508	F244-L506 HydrophobicContact CE2-CD1 4.27Å; F244-L506 HydrophobicContact CZ-CD1 4.17Å; D332-L506 HydrophobicContact CB-CD1 3.5Å; T333-L506 HydrophobicContact CG2-CD1 4.17Å; V394-L506 HydrophobicContact CG1-CB 4.34Å; V394-L506 HydrophobicContact CG1-CD1 4.43Å; V394-L506 HydrophobicContact CG1-CD2 4.21Å; V394-L506 CarbonylContact O-C 3.35Å; V394-L506 VanDerWaalsContact O-CA 3.25Å; V394-L506 WeakPolarHBondContact O-CA 3.42Å; I395-L506 HydrophobicContact CG1-CD2 3.87Å; T503-L506 CarbonylContact C-O 3.6Å; T503-L506 WeakPolarHBondContact CA-O 3.29Å; R504-L506 PolarHBondContact N-O 3.36Å; R504-L506 PolarHBondContact O-N 3.45Å; L506-V508 PolarHBondContact O-N 3.38Å
507	L	86.6	Confident	85.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	111.4	173.4	-159.4	75	0	0	0	109.7	H81 P393 V394 F425 P501 M502	H81-L507 HydrophobicContact CB-CD1 4.07Å; P393-L507 WeakPolarHBondContact O-CB 3.41Å; V394-L507 PolarHBondContact O-N 3.37Å; F425-L507 HydrophobicContact CD2-CD2 4.33Å; F425-L507 HydrophobicContact CE2-CD2 4.11Å; P501-L507 HydrophobicContact CB-CD1 3.87Å; P501-L507 HydrophobicContact CB-CD2 4.04Å; P501-L507 HydrophobicContact CB-CG 3.85Å; M502-L507 WeakPolarHBondContact O-CA 3.43Å
508	V	87	Confident	86.6	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.036	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	159.6	-177.7	-62.4	0	0	0	0	109.8	P501 M502 R504 L506	P501-V508 CarbonylContact C-O 3.46Å; P501-V508 WeakPolarHBondContact CA-O 3.41Å; M502-V508 HydrophobicContact CE-CG2 4.13Å; M502-V508 PolarHBondContact N-O 2.92Å; M502-V508 WeakPolarHBondContact O-CG2 3.28Å; M502-V508 PolarHBondContact O-N 3.08Å; M502-V508 VanDerWaalsContact O-O 3.1Å; R504-V508 HydrophobicContact CB-CG2 4.24Å; L506-V508 PolarHBondContact O-N 3.38Å
509	P	87.2	Confident	86.9	Confident	16 Å²	16	37.3 Å²	37.3	10%	0.104	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.7	171	27.9	-35.3	0	0	0	111.6	T202 W340 V499 N511 I513	T202-P509 HydrophobicContact CG2-CG 3.99Å; W340-P509 HydrophobicContact CH2-CB 4.22Å; W340-P509 HydrophobicContact CZ2-CB 3.87Å; V499-P509 HydrophobicContact CG1-CB 3.58Å; P509-N511 WeakPolarHBondContact CB-O 3.18Å; P509-I513 HydrophobicContact CB-CD1 3.77Å; P509-I513 HydrophobicContact CB-CG1 4.08Å; P509-I513 HydrophobicContact CG-CD1 3.93Å; P509-I513 HydrophobicContact CG-CG1 4.44Å
510	E	85.1	Confident	86.9	Confident	76 Å²	76	42.7 Å²	42.7	36%	0.355	22%	0.216	S	C	.	.	S	Bend	trans	-69	-37.7	177	-174.1	175.6	-159	0	0	111.4	R79 K500 M502	R79-E510 IonicContact NH2-OE1 2.95Å; K500-E510 VanDerWaalsContact O-CB 3.29Å; K500-E510 WeakPolarHBondContact O-CB 3.3Å; K500-E510 PolarHBondContact O-N 3.31Å; M502-E510 HydrophobicContact CB-CB 4.04Å; M502-E510 HydrophobicContact CB-CG 4.48Å; M502-E510 HydrophobicContact SD-CG 4.5Å
511	N	85.2	Confident	86.9	Confident	98 Å²	98	39.1 Å²	39.1	52%	0.524	20%	0.202	S	C	.	.	S	Bend	trans	-120	160.5	180	-64.2	-41.5	0	0	0	110.6	P509 I513	P509-N511 WeakPolarHBondContact CB-O 3.18Å; N511-I513 PolarHBondContact O-N 3.2Å
512	A	86.8	Confident	86.9	Confident	54 Å²	54	39.8 Å²	39.8	45%	0.446	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-56.6	135.6	173.7	0	0	0	0	0	110.9	D200	D200-A512 HydrophobicContact CB-CB 3.99Å
513	I	87.4	Confident	86.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-92.4	119.2	173.3	-67.8	166.9	0	0	0	107.5	D200 I201 Y343 V499 P509 N511 L515	D200-I513 WeakPolarHBondContact CA-O 3.25Å; D200-I513 PolarHBondContact N-O 3.49Å; I201-I513 HydrophobicContact CG2-CB 3.92Å; I201-I513 HydrophobicContact CG2-CG2 3.72Å; I201-I513 WeakPolarHBondContact CG2-O 3.41Å; I201-I513 PolarHBondContact N-O 3.5Å; Y343-I513 HydrophobicContact CD2-CG2 4.04Å; V499-I513 HydrophobicContact CB-CG1 4.22Å; V499-I513 HydrophobicContact CG1-CG1 3.99Å; V499-I513 HydrophobicContact CG2-CG1 3.93Å; P509-I513 HydrophobicContact CB-CD1 3.77Å; P509-I513 HydrophobicContact CB-CG1 4.08Å; P509-I513 HydrophobicContact CG-CD1 3.93Å; P509-I513 HydrophobicContact CG-CG1 4.44Å; N511-I513 PolarHBondContact O-N 3.2Å; I513-L515 HydrophobicContact CG2-CD1 4.14Å; I513-L515 HydrophobicContact CG2-CD2 4.16Å; I513-L515 HydrophobicContact CG2-CG 3.84Å
514	N	91	Very high	87.1	Confident	35 Å²	35	41.2 Å²	41.2	19%	0.187	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-103.7	133.8	172.1	-51.3	-43.3	0	0	0	108.8	L197 V198 T199 D200 D493	L197-N514 HydrophobicContact CD1-CB 4.16Å; V198-N514 WeakPolarHBondContact O-CA 3.38Å; T199-N514 VanDerWaalsContact CA-OD1 3.31Å; T199-N514 WeakPolarHBondContact CA-OD1 3.47Å; D200-N514 PolarHBondContact N-OD1 3.47Å; D200-N514 VanDerWaalsContact N-OD1 3.09Å; D493-N514 HydrophobicContact CB-CB 4.24Å; D493-N514 WeakPolarHBondContact OD2-CB 3.37Å; D493-N514 PolarHBondContact OD2-ND2 3.29Å
515	L	91	Very high	87.5	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146.9	179.6	-64.8	174.5	0	0	0	110.2	V198 I201 L342 V490 I513 F517	V198-L515 PolarHBondContact N-O 3.35Å; V198-L515 PolarHBondContact O-N 3.39Å; V198-L515 VanDerWaalsContact O-N 3.16Å; I201-L515 HydrophobicContact CG2-CD1 4.1Å; I201-L515 HydrophobicContact CG2-CG 4.48Å; L342-L515 HydrophobicContact CB-CD1 3.78Å; V490-L515 HydrophobicContact CG1-CB 4.18Å; V490-L515 HydrophobicContact CG1-CD1 4.08Å; V490-L515 HydrophobicContact CG1-CD2 4.43Å; V490-L515 HydrophobicContact CG1-CG 4.46Å; I513-L515 HydrophobicContact CG2-CD1 4.14Å; I513-L515 HydrophobicContact CG2-CD2 4.16Å; I513-L515 HydrophobicContact CG2-CG 3.84Å; L515-F517 HydrophobicContact CB-CD2 4.39Å; L515-F517 HydrophobicContact CB-CE2 3.77Å; L515-F517 HydrophobicContact CB-CZ 4.36Å
516	Q	91.1	Very high	88	Confident	39 Å²	39	40.8 Å²	40.8	18%	0.182	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.6	173.4	-71.8	177.5	73.8	0	0	109.8	G196 L197 V490 K491 P492 P494	G196-Q516 CarbonylContact O-C 3.59Å; G196-Q516 VanDerWaalsContact O-CA 3.32Å; G196-Q516 WeakPolarHBondContact O-CA 3.48Å; L197-Q516 HydrophobicContact CD1-CG 3.86Å; V490-Q516 CarbonylContact C-O 3.51Å; V490-Q516 VanDerWaalsContact CA-O 3.29Å; V490-Q516 WeakPolarHBondContact CA-O 3.47Å; K491-Q516 HydrophobicContact CB-CB 3.83Å; K491-Q516 PolarHBondContact N-O 3.26Å; K491-Q516 PolarHBondContact O-N 3.35Å; P492-Q516 PolarHBondContact O-NE2 3.09Å; P494-Q516 HydrophobicContact CG-CG 4.24Å; P494-Q516 VanDerWaalsContact CG-NE2 3.27Å
517	F	92.1	Very high	88.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	93.4	177.7	-70.1	-96.3	0	0	0	109.9	L188 R192 G196 V198 I201 I484 F488 V490 L515	L188-F517 HydrophobicContact CD1-CE1 4.14Å; L188-F517 HydrophobicContact CD2-CZ 4.42Å; R192-F517 WeakPolarHBondContact CD-O 3.42Å; R192-F517 PolarHBondContact NH1-O 3.44Å; R192-F517 VanDerWaalsContact NH1-O 3.07Å; G196-F517 PolarHBondContact O-N 3.48Å; V198-F517 HydrophobicContact CB-CD2 4.06Å; V198-F517 HydrophobicContact CB-CE2 4.1Å; V198-F517 HydrophobicContact CG2-CD2 3.69Å; V198-F517 HydrophobicContact CG2-CE2 4.13Å; I201-F517 HydrophobicContact CD1-CE2 3.69Å; I201-F517 HydrophobicContact CD1-CZ 3.78Å; I201-F517 HydrophobicContact CG1-CE2 4.3Å; I201-F517 HydrophobicContact CG1-CZ 4.21Å; I484-F517 HydrophobicContact CG2-CE1 4.04Å; F488-F517 HydrophobicContact CB-CB 4.34Å; F488-F517 HydrophobicContact CB-CD1 3.99Å; F488-F517 HydrophobicContact CD1-CB 3.9Å; F488-F517 HydrophobicContact CD2-CD1 4.18Å; F488-F517 HydrophobicContact CE1-CB 4.44Å; F488-F517 HydrophobicContact CG-CB 4.15Å; F488-F517 HydrophobicContact CG-CD1 4.01Å; V490-F517 HydrophobicContact CG2-CD1 3.93Å; V490-F517 HydrophobicContact CG2-CE1 3.83Å; L515-F517 HydrophobicContact CB-CD2 4.39Å; L515-F517 HydrophobicContact CB-CE2 3.77Å; L515-F517 HydrophobicContact CB-CZ 4.36Å
518	V	90.6	Very high	88.2	Confident	49 Å²	49	45.8 Å²	45.8	30%	0.297	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.7	178.4	-175.5	0	0	0	0	108.9	F488 E489 K491	F488-V518 CarbonylContact C-O 3.48Å; F488-V518 VanDerWaalsContact CA-O 3.24Å; F488-V518 WeakPolarHBondContact CA-O 3.42Å; E489-V518 HydrophobicContact CB-CB 4.24Å; E489-V518 PolarHBondContact N-O 3.33Å; E489-V518 PolarHBondContact O-N 2.78Å; K491-V518 HydrophobicContact CD-CG2 4.18Å
519	E	88.9	Confident	88.3	Confident	98 Å²	98	49.2 Å²	49.2	46%	0.458	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	141.2	178.4	-98.2	165.1	-152.7	0	0	111.5	R189 R192 F488	R189-E519 IonicContact NE-OE1 3.66Å; R192-E519 IonicContact CZ-OE1 2.84Å; R192-E519 IonicContact NH1-OE1 3.46Å; R192-E519 PolarHBondContact NH1-OE1 3.19Å; R192-E519 IonicContact NH2-OE1 3.64Å; R192-E519 PolarHBondContact NH2-OE1 3.43Å; R192-E519 IonicContact NH2-OE2 3.61Å; F488-E519 HydrophobicContact CD1-CG 4.18Å; F488-E519 HydrophobicContact CE1-CG 3.97Å
520	R	83.9	Confident	88.4	Confident	123 Å²	123	52.2 Å²	52.2	46%	0.464	27%	0.266	S	S	.	.			trans	-107	0	176.9	-71.3	-168.3	-174.9	-140.6	4	112.9	D353 E487 E489	D353-R520 IonicContact OD1-CZ 3.57Å; D353-R520 IonicContact OD1-NH1 2.8Å; D353-R520 PolarHBondContact OD1-NH1 3.25Å; D353-R520 IonicContact OD1-NH2 3.75Å; D353-R520 PolarHBondContact OD1-NH2 3.36Å; E487-R520 PolarHBondContact O-N 3.39Å; E489-R520 HydrophobicContact CB-CG 4.07Å; E489-R520 VanDerWaalsContact CB-NE 3.32Å

Retrieved 520 of 520 residues in 104.3 ms (Link to these results)

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