A0A3Q0KTS3_SCHMA Loading...

Otopetrin-2

AlphaFold DB , UniProt , Accession A0A3Q0KTS3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	33.1	Very low	255 Å²	255	149.5 Å²	149.5	100%	1.256	82%	0.822	S	S	*	*				0	126	0	-156.5	162.4	179.4	0	0	106.8
2	G	39.1	Very low	33.2	Very low	75 Å²	75	150.4 Å²	150.4	77%	0.773	82%	0.824	S	S	*	*			trans	132.1	88.1	-168.9	0	0	0	0	0	112
3	K	30.4	Very low	33	Very low	198 Å²	198	147.2 Å²	147.2	86%	0.861	82%	0.82	S	S	*	*			trans	-77.7	132.9	169.5	-74.1	179.5	174.1	-179.8	0	108.6
4	I	34.8	Very low	33.3	Very low	155 Å²	155	147.8 Å²	147.8	80%	0.795	82%	0.82	S	S	*	*			trans	-102.7	113.9	165.7	-61.5	178.3	0	0	0	107.3
5	H	30.5	Very low	33.3	Very low	157 Å²	157	149.7 Å²	149.7	73%	0.727	82%	0.821	S	S	*	*			trans	-73.9	128.8	172.8	-105.6	-108.7	0	0	0	109.8
6	F	32.1	Very low	33.2	Very low	185 Å²	185	150.8 Å²	150.8	81%	0.811	82%	0.823	S	S	*	*			trans	-91.8	108.2	157.8	-91.9	-89.2	0	0	0	108.3	T8	F6-T8 PolarHBondContact O-N 3.35Å
7	N	30	Very low	33.3	Very low	145 Å²	145	149.9 Å²	149.9	78%	0.775	82%	0.823	S	S	*	*			trans	-81.2	106.6	168.1	-105.9	17.9	0	0	0	108.9
8	T	31.3	Very low	33.4	Very low	128 Å²	128	152.3 Å²	152.3	79%	0.785	82%	0.824	S	S	*	*			trans	-93.7	89.8	164.3	47.6	0	0	0	0	109.1	F6 V10	F6-T8 PolarHBondContact O-N 3.35Å; T8-V10 PolarHBondContact O-N 3.29Å
9	S	32.3	Very low	33.5	Very low	108 Å²	108	153.4 Å²	153.4	76%	0.755	83%	0.829	S	S	*	*			trans	-80.4	107.4	167.2	53.4	0	0	0	0	109.4
10	V	34.9	Very low	33.5	Very low	124 Å²	124	155.8 Å²	155.8	75%	0.752	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-72.5	126.5	166	178.7	0	0	0	0	107.7	T8	T8-V10 PolarHBondContact O-N 3.29Å
11	P	35.4	Very low	33.3	Very low	115 Å²	115	155.8 Å²	155.8	75%	0.747	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-80.5	137.1	166.8	31.6	-29.8	0	0	0	109.8
12	D	34.4	Very low	33.4	Very low	160 Å²	160	150.4 Å²	150.4	86%	0.856	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.5	147	-174.3	-70.1	-61.3	0	0	0	114	D14	D12-D14 PolarHBondContact O-N 2.92Å
13	S	31.3	Very low	33.2	Very low	109 Å²	109	156.4 Å²	156.4	76%	0.762	82%	0.821	S	S	*	*			trans	-82.1	103.6	171.8	54.2	0	0	0	0	110.9
14	D	36.6	Very low	33.5	Very low	155 Å²	155	150.6 Å²	150.6	83%	0.829	82%	0.817	S	S	*	*			trans	-165.1	153.9	143.7	-104.6	-29.8	0	0	0	111.2	D12	D12-D14 PolarHBondContact O-N 2.92Å
15	Q	33.7	Very low	33.7	Very low	177 Å²	177	150 Å²	150	83%	0.827	82%	0.816	S	S	*	*	S	Bend	trans	67.6	92	-172.9	-49	-174.7	16.7	0	0	116
16	I	31.6	Very low	34.3	Very low	166 Å²	166	144 Å²	144	85%	0.851	80%	0.796	S	S	*	*				-177	69.4	123.6	-85.3	150.2	0	0	0	107.4	K18	I16-K18 PolarHBondContact O-N 3.28Å
17	T	34.4	Very low	35.1	Very low	136 Å²	136	137.4 Å²	137.4	83%	0.834	78%	0.781	S	S	*	*			trans	-89	78.8	169.3	36.2	0	0	0	0	110
18	K	35.5	Very low	36.1	Very low	194 Å²	194	134.9 Å²	134.9	84%	0.843	77%	0.772	S	S	*	*			trans	179.7	72.4	159	-102.6	160.4	-174.7	-178.1	0	112.4	I16	I16-K18 PolarHBondContact O-N 3.28Å
19	N	34.3	Very low	37	Very low	172 Å²	172	135 Å²	135	92%	0.92	77%	0.768	S	S	*	*			trans	-175.6	71.3	146.9	-101	-5.1	0	0	0	109.4
20	K	33.5	Very low	38	Very low	201 Å²	201	136.8 Å²	136.8	87%	0.874	76%	0.761	S	S	*	*			trans	-92.7	115.7	159.1	-84.3	-173.4	174	-177.9	0	107.4
21	N	30.7	Very low	39.1	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	76%	0.755	S	S	*	*			trans	-171.1	125.3	144.1	-96.3	-14.5	0	0	0	110.4
22	V	33.8	Very low	40.6	Very low	142 Å²	142	133.9 Å²	133.9	86%	0.861	75%	0.745	S	S	*	*			trans	64.5	81	161.6	-163.5	0	0	0	0	117.5
23	E	34.6	Very low	41.9	Very low	200 Å²	200	129.1 Å²	129.1	94%	0.935	73%	0.728	S	S	*	*			trans	-149	134.1	141.8	-127	177.1	-174.8	0	0	110
24	G	36.9	Very low	43.6	Very low	76 Å²	76	129 Å²	129	78%	0.784	72%	0.719	S	S	*	*			trans	-87.1	158.7	-160	0	0	0	0	0	116.6	G26	G24-G26 PolarHBondContact O-N 3.06Å
25	D	39.1	Very low	45.1	Very low	143 Å²	143	124.9 Å²	124.9	77%	0.765	70%	0.702	S	S	*	*	S	Bend	trans	-68.3	39	-174.3	-167.4	23.2	0	0	0	115.7
26	G	43.8	Very low	46.7	Very low	31 Å²	31	118.6 Å²	118.6	32%	0.32	68%	0.68	S	S	.	*			trans	-87.1	-0.4	-172.6	0	0	0	0	0	115.9	G24 K30	G24-G26 PolarHBondContact O-N 3.06Å; G26-K30 VanDerWaalsContact O-CD 3.31Å; G26-K30 WeakPolarHBondContact O-CD 3.37Å; G26-K30 WeakPolarHBondContact O-CG 3.44Å
27	G	50	Low	48.4	Very low	47 Å²	47	118.6 Å²	118.6	49%	0.485	67%	0.67	S	S	.	*	H	α-helix	trans	-73	-68.4	-167.2	0	0	0	0	0	115.5
28	P	50.2	Low	50.2	Low	91 Å²	91	120 Å²	120	59%	0.591	66%	0.664	S	S	*	*	H	α-helix	trans	-70	-38.2	-167.3	25	-32.9	0	0	0	113.5	K30 V31 S32	P28-K30 PolarHBondContact O-N 3.17Å; P28-V31 PolarHBondContact O-N 3.3Å; P28-S32 PolarHBondContact O-N 2.89Å
29	L	50.2	Low	52	Low	132 Å²	132	113.7 Å²	113.7	69%	0.691	65%	0.648	S	S	*	*	H	α-helix	trans	-61.5	-41.1	-179.2	-78.7	162.1	0	0	0	112.7	V31 S32 A33	L29-V31 VanDerWaalsContact C-N 3.31Å; L29-V31 PolarHBondContact O-N 3.05Å; L29-S32 PolarHBondContact O-N 3.35Å; L29-A33 PolarHBondContact O-N 3.45Å
30	K	53.4	Low	54.1	Low	144 Å²	144	112.9 Å²	112.9	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-65.8	-31.5	178.8	-71.7	-179.2	-175.1	171.7	0	112.7	G26 P28 N34	G26-K30 VanDerWaalsContact O-CD 3.31Å; G26-K30 WeakPolarHBondContact O-CD 3.37Å; G26-K30 WeakPolarHBondContact O-CG 3.44Å; P28-K30 PolarHBondContact O-N 3.17Å; K30-N34 PolarHBondContact O-N 2.92Å; K30-N34 PolarHBondContact O-ND2 3.12Å; K30-N34 VanDerWaalsContact O-ND2 3.11Å
31	V	58.5	Low	55.9	Low	102 Å²	102	105.4 Å²	105.4	62%	0.618	61%	0.606	S	S	*	*	H	α-helix	trans	-71	-43.4	176.7	179.6	0	0	0	0	110.8	P28 L29 N34 S35	P28-V31 PolarHBondContact O-N 3.3Å; L29-V31 VanDerWaalsContact C-N 3.31Å; L29-V31 PolarHBondContact O-N 3.05Å; V31-N34 PolarHBondContact O-N 3.09Å; V31-S35 PolarHBondContact O-N 3.41Å
32	S	66.3	Low	58.2	Low	76 Å²	76	104 Å²	104	53%	0.531	59%	0.594	S	S	.	*	H	α-helix	trans	-62.8	-44.9	176.6	-172.6	0	0	0	0	112.6	P28 L29 N34 S35 A36	P28-S32 PolarHBondContact O-N 2.89Å; L29-S32 PolarHBondContact O-N 3.35Å; S32-N34 VanDerWaalsContact C-N 3.31Å; S32-N34 PolarHBondContact O-N 3.36Å; S32-S35 PolarHBondContact O-N 3.01Å; S32-S35 PolarHBondContact O-OG 3.33Å; S32-A36 WeakPolarHBondContact O-CB 3.47Å; S32-A36 PolarHBondContact O-N 2.85Å
33	A	62.2	Low	60.4	Low	61 Å²	61	102.7 Å²	102.7	50%	0.504	58%	0.581	S	S	.	*	H	α-helix	trans	-60.2	-39.7	177	0	0	0	0	0	112.6	L29 R37	L29-A33 PolarHBondContact O-N 3.45Å; A33-R37 VanDerWaalsContact O-CB 3.28Å; A33-R37 WeakPolarHBondContact O-CB 3.48Å; A33-R37 PolarHBondContact O-N 2.82Å
34	N	66.7	Low	62.6	Low	105 Å²	105	95.6 Å²	95.6	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-70.9	-38.7	178.5	-80.5	-36.7	0	0	0	113	K30 V31 S32 R37 K38	K30-N34 PolarHBondContact O-N 2.92Å; K30-N34 PolarHBondContact O-ND2 3.12Å; K30-N34 VanDerWaalsContact O-ND2 3.11Å; V31-N34 PolarHBondContact O-N 3.09Å; S32-N34 VanDerWaalsContact C-N 3.31Å; S32-N34 PolarHBondContact O-N 3.36Å; N34-R37 PolarHBondContact O-N 3.43Å; N34-K38 WeakPolarHBondContact O-CB 3.26Å; N34-K38 PolarHBondContact O-N 3.35Å
35	S	67.5	Low	64.6	Low	70 Å²	70	96.4 Å²	96.4	49%	0.49	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-44.8	175.8	70.8	0	0	0	0	111.2	V31 S32 R37 K38 A39	V31-S35 PolarHBondContact O-N 3.41Å; S32-S35 PolarHBondContact O-N 3.01Å; S32-S35 PolarHBondContact O-OG 3.33Å; S35-R37 PolarHBondContact O-N 2.8Å; S35-K38 PolarHBondContact O-N 3.44Å; S35-A39 WeakPolarHBondContact O-CB 3.45Å; S35-A39 PolarHBondContact O-N 3.01Å
36	A	68.4	Low	66.8	Low	44 Å²	44	91.9 Å²	91.9	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-41.6	175	0	0	0	0	0	112.3	S32 A39 K40	S32-A36 WeakPolarHBondContact O-CB 3.47Å; S32-A36 PolarHBondContact O-N 2.85Å; A36-A39 PolarHBondContact O-N 3.38Å; A36-K40 WeakPolarHBondContact O-CG 3.46Å; A36-K40 PolarHBondContact O-N 3.33Å
37	R	67.4	Low	68.9	Low	167 Å²	167	94.7 Å²	94.7	63%	0.63	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-39.3	175.4	-170.2	176.3	-177.6	-170	0.4	112	A33 N34 S35 N41	A33-R37 VanDerWaalsContact O-CB 3.28Å; A33-R37 WeakPolarHBondContact O-CB 3.48Å; A33-R37 PolarHBondContact O-N 2.82Å; N34-R37 PolarHBondContact O-N 3.43Å; S35-R37 PolarHBondContact O-N 2.8Å; R37-N41 WeakPolarHBondContact O-CB 3.46Å; R37-N41 VanDerWaalsContact O-CG 3.25Å; R37-N41 PolarHBondContact O-N 3.06Å; R37-N41 PolarHBondContact O-ND2 3.1Å
38	K	72.2	Confident	70.7	Confident	166 Å²	166	92.7 Å²	92.7	72%	0.722	49%	0.494	S	S	*	.	H	α-helix	trans	-65.8	-42.6	174.7	-169.1	178.9	-179.6	-175.7	0	111.5	N34 S35 N41 H42	N34-K38 WeakPolarHBondContact O-CB 3.26Å; N34-K38 PolarHBondContact O-N 3.35Å; S35-K38 PolarHBondContact O-N 3.44Å; K38-N41 PolarHBondContact O-N 3.35Å; K38-H42 PolarHBondContact O-N 3.01Å
39	A	73.2	Confident	72.4	Confident	60 Å²	60	92.3 Å²	92.3	50%	0.496	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-47.5	175.7	0	0	0	0	0	112.2	S35 A36 N41 H42 L43	S35-A39 WeakPolarHBondContact O-CB 3.45Å; S35-A39 PolarHBondContact O-N 3.01Å; A36-A39 PolarHBondContact O-N 3.38Å; A39-N41 VanDerWaalsContact C-N 3.33Å; A39-N41 PolarHBondContact O-N 3.25Å; A39-H42 PolarHBondContact O-N 3.49Å; A39-H42 VanDerWaalsContact O-N 3.12Å; A39-L43 WeakPolarHBondContact O-CB 3.05Å; A39-L43 PolarHBondContact O-N 3.39Å
40	K	76.6	Confident	74.4	Confident	155 Å²	155	92.9 Å²	92.9	67%	0.674	48%	0.483	S	S	*	.	H	α-helix	trans	-58.5	-41.3	174.8	-74	179.3	179	-177.7	0	112.3	A36 Q44	A36-K40 WeakPolarHBondContact O-CG 3.46Å; A36-K40 PolarHBondContact O-N 3.33Å; K40-Q44 PolarHBondContact O-N 3.43Å; K40-Q44 VanDerWaalsContact O-N 3.09Å
41	N	73.2	Confident	76.3	Confident	45 Å²	45	89.7 Å²	89.7	24%	0.241	47%	0.467	C	S	.	.	H	α-helix	trans	-65.2	-39.1	174.8	-73.9	-19.1	0	0	0	112.6	R37 K38 A39 R45 R197	R37-N41 WeakPolarHBondContact O-CB 3.46Å; R37-N41 VanDerWaalsContact O-CG 3.25Å; R37-N41 PolarHBondContact O-N 3.06Å; R37-N41 PolarHBondContact O-ND2 3.1Å; K38-N41 PolarHBondContact O-N 3.35Å; A39-N41 VanDerWaalsContact C-N 3.33Å; A39-N41 PolarHBondContact O-N 3.25Å; N41-R45 WeakPolarHBondContact O-CG 3.3Å; N41-R45 PolarHBondContact O-N 3.47Å; N41-R197 WeakPolarHBondContact OD1-CD 3.49Å; N41-R197 WeakPolarHBondContact OD1-CG 3.31Å
42	H	77.8	Confident	77.9	Confident	128 Å²	128	85.2 Å²	85.2	59%	0.593	44%	0.441	S	S	*	.	H	α-helix	trans	-67.6	-48.4	177.5	-169.3	-82.8	0	0	0	111.6	K38 A39 Q44 R45 V46	K38-H42 PolarHBondContact O-N 3.01Å; A39-H42 PolarHBondContact O-N 3.49Å; A39-H42 VanDerWaalsContact O-N 3.12Å; H42-Q44 VanDerWaalsContact C-N 3.32Å; H42-Q44 PolarHBondContact O-N 3.19Å; H42-R45 WeakPolarHBondContact O-CB 3.38Å; H42-R45 PolarHBondContact O-N 3.42Å; H42-R45 VanDerWaalsContact O-N 3.09Å; H42-V46 WeakPolarHBondContact O-CG2 3.42Å; H42-V46 PolarHBondContact O-N 3.34Å
43	L	80.8	Confident	79.2	Confident	113 Å²	113	88.6 Å²	88.6	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-57.1	-44.5	177.3	-179.2	61.6	0	0	0	111.4	A39 R45 V46 V47	A39-L43 WeakPolarHBondContact O-CB 3.05Å; A39-L43 PolarHBondContact O-N 3.39Å; L43-R45 PolarHBondContact O-N 3.22Å; L43-V46 WeakPolarHBondContact O-CB 3.48Å; L43-V46 PolarHBondContact O-N 3.18Å; L43-V47 WeakPolarHBondContact O-CG2 3.4Å; L43-V47 PolarHBondContact O-N 3.13Å
44	Q	80.5	Confident	80.8	Confident	52 Å²	52	90.8 Å²	90.8	24%	0.243	45%	0.449	C	S	.	.	H	α-helix	trans	-63.3	-40	175.9	179.8	160.1	-6.4	0	0	112.6	K40 H42 V46 V47 S48 R197	K40-Q44 PolarHBondContact O-N 3.43Å; K40-Q44 VanDerWaalsContact O-N 3.09Å; H42-Q44 VanDerWaalsContact C-N 3.32Å; H42-Q44 PolarHBondContact O-N 3.19Å; Q44-V46 VanDerWaalsContact C-N 3.28Å; Q44-V46 PolarHBondContact O-N 3.47Å; Q44-V47 PolarHBondContact O-N 2.91Å; Q44-S48 PolarHBondContact O-N 3.05Å; Q44-S48 PolarHBondContact O-OG 2.88Å; Q44-R197 PolarHBondContact NE2-O 3.1Å
45	R	79	Confident	82.1	Confident	93 Å²	93	86.8 Å²	86.8	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-39.9	175	-74.4	176.7	177.7	-169.4	-2.4	111.6	N41 H42 L43 S48 M49 V271	N41-R45 WeakPolarHBondContact O-CG 3.3Å; N41-R45 PolarHBondContact O-N 3.47Å; H42-R45 WeakPolarHBondContact O-CB 3.38Å; H42-R45 PolarHBondContact O-N 3.42Å; H42-R45 VanDerWaalsContact O-N 3.09Å; L43-R45 PolarHBondContact O-N 3.22Å; R45-S48 PolarHBondContact O-N 2.78Å; R45-M49 VanDerWaalsContact O-CG 3.28Å; R45-M49 WeakPolarHBondContact O-CG 3.27Å; R45-M49 PolarHBondContact O-N 3.49Å; R45-V271 PolarHBondContact NH2-O 2.79Å
46	V	85	Confident	83.4	Confident	48 Å²	48	86.1 Å²	86.1	29%	0.291	42%	0.415	S	S	.	.	H	α-helix	trans	-63.8	-45.9	175.3	172.7	0	0	0	0	111.5	H42 L43 Q44 S48 M49 F50	H42-V46 WeakPolarHBondContact O-CG2 3.42Å; H42-V46 PolarHBondContact O-N 3.34Å; L43-V46 WeakPolarHBondContact O-CB 3.48Å; L43-V46 PolarHBondContact O-N 3.18Å; Q44-V46 VanDerWaalsContact C-N 3.28Å; Q44-V46 PolarHBondContact O-N 3.47Å; V46-S48 PolarHBondContact O-N 3.14Å; V46-M49 WeakPolarHBondContact O-CB 3.34Å; V46-M49 PolarHBondContact O-N 3.19Å; V46-M49 VanDerWaalsContact O-N 3.15Å; V46-F50 HydrophobicContact CG1-CD2 3.79Å; V46-F50 HydrophobicContact CG1-CE2 3.55Å; V46-F50 VanDerWaalsContact O-CD2 3.3Å; V46-F50 WeakPolarHBondContact O-CD2 3.4Å; V46-F50 PolarHBondContact O-N 3.32Å
47	V	88.1	Confident	84.7	Confident	90 Å²	90	86.3 Å²	86.3	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.7	174	0	0	0	0	111.5	L43 Q44 M49 F50 Y51	L43-V47 WeakPolarHBondContact O-CG2 3.4Å; L43-V47 PolarHBondContact O-N 3.13Å; Q44-V47 PolarHBondContact O-N 2.91Å; V47-M49 VanDerWaalsContact C-N 3.3Å; V47-M49 PolarHBondContact O-N 3.41Å; V47-F50 PolarHBondContact O-N 3.41Å; V47-Y51 PolarHBondContact O-N 3.23Å
48	S	87	Confident	86	Confident	4 Å²	4	81.5 Å²	81.5	3%	0.028	40%	0.403	C	S	.	.	H	α-helix	trans	-59.8	-39.6	173.7	-57.3	0	0	0	0	112.2	Q44 R45 V46 Y51 C52 L204	Q44-S48 PolarHBondContact O-N 3.05Å; Q44-S48 PolarHBondContact O-OG 2.88Å; R45-S48 PolarHBondContact O-N 2.78Å; V46-S48 PolarHBondContact O-N 3.14Å; S48-Y51 PolarHBondContact O-N 2.89Å; S48-C52 WeakPolarHBondContact O-CB 3.2Å; S48-C52 PolarHBondContact O-N 3.11Å; S48-C52 PolarHBondContact O-SG 3.29Å; S48-C52 VanDerWaalsContact O-SG 3.37Å; S48-L204 VanDerWaalsContact CB-CD1 3.46Å
49	M	87.5	Confident	87.1	Confident	84 Å²	84	73.6 Å²	73.6	41%	0.414	37%	0.369	S	S	.	.	H	α-helix	trans	-65.8	-42.2	176.2	-74	170.3	174.4	0	0	112	R45 V46 V47 C52 F53 L204	R45-M49 VanDerWaalsContact O-CG 3.28Å; R45-M49 WeakPolarHBondContact O-CG 3.27Å; R45-M49 PolarHBondContact O-N 3.49Å; V46-M49 WeakPolarHBondContact O-CB 3.34Å; V46-M49 PolarHBondContact O-N 3.19Å; V46-M49 VanDerWaalsContact O-N 3.15Å; V47-M49 VanDerWaalsContact C-N 3.3Å; V47-M49 PolarHBondContact O-N 3.41Å; M49-C52 WeakPolarHBondContact O-CB 3.43Å; M49-C52 PolarHBondContact O-N 3.2Å; M49-F53 HydrophobicContact CB-CD2 4.49Å; M49-F53 HydrophobicContact CB-CE2 4.25Å; M49-F53 WeakPolarHBondContact O-CD2 3.45Å; M49-F53 PolarHBondContact O-N 3.28Å; M49-L204 HydrophobicContact CG-CD1 4.32Å; M49-L204 HydrophobicContact CG-CD2 4.42Å
50	F	91.7	Very high	88	Confident	143 Å²	143	73.5 Å²	73.5	63%	0.627	36%	0.36	S	S	*	.	H	α-helix	trans	-60.9	-43.9	174.8	-83.1	-67.2	0	0	0	112.6	V46 V47 C52 F53 L54	V46-F50 HydrophobicContact CG1-CD2 3.79Å; V46-F50 HydrophobicContact CG1-CE2 3.55Å; V46-F50 VanDerWaalsContact O-CD2 3.3Å; V46-F50 WeakPolarHBondContact O-CD2 3.4Å; V46-F50 PolarHBondContact O-N 3.32Å; V47-F50 PolarHBondContact O-N 3.41Å; F50-C52 VanDerWaalsContact C-N 3.33Å; F50-C52 PolarHBondContact O-N 3.38Å; F50-F53 PolarHBondContact O-N 3.18Å; F50-L54 WeakPolarHBondContact O-CB 3.31Å; F50-L54 PolarHBondContact O-N 3.37Å
51	Y	92.8	Very high	88.7	Confident	77 Å²	77	69.7 Å²	69.7	30%	0.302	35%	0.353	S	S	.	.	H	α-helix	trans	-55.4	-49.1	171.5	165.3	-98.4	0	0	0	111.4	V47 S48 F53 L54 I55 F201 H205	V47-Y51 PolarHBondContact O-N 3.23Å; S48-Y51 PolarHBondContact O-N 2.89Å; Y51-F53 PolarHBondContact O-N 3.23Å; Y51-L54 PolarHBondContact O-N 2.94Å; Y51-I55 HydrophobicContact CD2-CG1 4.11Å; Y51-I55 HydrophobicContact CE1-CG1 4.16Å; Y51-I55 HydrophobicContact CE2-CD1 3.98Å; Y51-I55 HydrophobicContact CE2-CG1 3.66Å; Y51-I55 WeakPolarHBondContact O-CG1 3.45Å; Y51-I55 PolarHBondContact O-N 3.41Å; Y51-F201 AromaticContact CD1-CE2 3.55Å; Y51-F201 HydrophobicContact CD1-CE2 3.55Å; Y51-F201 AromaticContact CD1-CZ 3.9Å; Y51-F201 HydrophobicContact CD1-CZ 3.9Å; Y51-F201 AromaticContact CE1-CE2 3.87Å; Y51-F201 HydrophobicContact CE1-CE2 3.87Å; Y51-F201 AromaticContact CE1-CZ 3.7Å; Y51-F201 HydrophobicContact CE1-CZ 3.7Å; Y51-F201 AromaticContact CG-CE2 4Å; Y51-F201 HydrophobicContact CG-CE2 4Å; Y51-F201 HydrophobicContact CG-CZ 4.45Å; Y51-H205 HydrophobicContact CE1-CB 4.49Å; Y51-H205 AromaticContact CE1-ND1 3.61Å; Y51-H205 AromaticContact CZ-ND1 3.83Å; Y51-H205 PolarHBondContact OH-CE1 3.48Å; Y51-H205 PolarHBondContact OH-ND1 3.23Å; Y51-H205 VanDerWaalsContact OH-ND1 3.16Å
52	C	92.9	Very high	89.6	Confident	8 Å²	8	69.2 Å²	69.2	5%	0.054	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-38.2	179.4	-81.1	0	0	0	0	114	S48 M49 F50 F56 L204 T208	S48-C52 WeakPolarHBondContact O-CB 3.2Å; S48-C52 PolarHBondContact O-N 3.11Å; S48-C52 PolarHBondContact O-SG 3.29Å; S48-C52 VanDerWaalsContact O-SG 3.37Å; M49-C52 WeakPolarHBondContact O-CB 3.43Å; M49-C52 PolarHBondContact O-N 3.2Å; F50-C52 VanDerWaalsContact C-N 3.33Å; F50-C52 PolarHBondContact O-N 3.38Å; C52-F56 VanDerWaalsContact O-CB 3.31Å; C52-F56 WeakPolarHBondContact O-CB 3.47Å; C52-F56 PolarHBondContact O-N 3.45Å; C52-L204 PolarHBondContact SG-O 2.97Å; C52-T208 WeakPolarHBondContact CA-OG1 3.47Å; C52-T208 WeakPolarHBondContact CB-OG1 3.23Å; C52-T208 WeakPolarHBondContact O-CG2 3.34Å; C52-T208 PolarHBondContact O-OG1 2.93Å; C52-T208 PolarHBondContact SG-OG1 2.82Å
53	F	92.8	Very high	90.2	Very high	147 Å²	147	63.3 Å²	63.3	65%	0.645	32%	0.323	S	S	*	.	H	α-helix	trans	-67.8	-40.5	173.6	-73.4	-55.6	0	0	0	112	M49 F50 Y51 F56 A57	M49-F53 HydrophobicContact CB-CD2 4.49Å; M49-F53 HydrophobicContact CB-CE2 4.25Å; M49-F53 WeakPolarHBondContact O-CD2 3.45Å; M49-F53 PolarHBondContact O-N 3.28Å; F50-F53 PolarHBondContact O-N 3.18Å; Y51-F53 PolarHBondContact O-N 3.23Å; F53-F56 PolarHBondContact O-N 3.25Å; F53-A57 VanDerWaalsContact O-CB 3.31Å; F53-A57 WeakPolarHBondContact O-CB 3.49Å; F53-A57 PolarHBondContact O-N 3.37Å
54	L	95	Very high	90.5	Very high	108 Å²	108	62.5 Å²	62.5	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-63.4	-47.9	177.1	-175.4	67.9	0	0	0	111.4	F50 Y51 F56 A57 I58	F50-L54 WeakPolarHBondContact O-CB 3.31Å; F50-L54 PolarHBondContact O-N 3.37Å; Y51-L54 PolarHBondContact O-N 2.94Å; L54-F56 VanDerWaalsContact C-N 3.35Å; L54-F56 PolarHBondContact O-N 3.47Å; L54-A57 PolarHBondContact O-N 2.79Å; L54-I58 HydrophobicContact CD1-CD1 4.32Å; L54-I58 HydrophobicContact CG-CD1 3.99Å; L54-I58 VanDerWaalsContact O-CG1 3.27Å; L54-I58 WeakPolarHBondContact O-CG1 3.32Å; L54-I58 PolarHBondContact O-N 3.44Å
55	I	95.3	Very high	90.8	Very high	20 Å²	20	67.7 Å²	67.7	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-41.6	176.4	-65.7	-65.1	0	0	0	111.2	Y51 I58 G59 F81 M85 T208	Y51-I55 HydrophobicContact CD2-CG1 4.11Å; Y51-I55 HydrophobicContact CE1-CG1 4.16Å; Y51-I55 HydrophobicContact CE2-CD1 3.98Å; Y51-I55 HydrophobicContact CE2-CG1 3.66Å; Y51-I55 WeakPolarHBondContact O-CG1 3.45Å; Y51-I55 PolarHBondContact O-N 3.41Å; I55-I58 PolarHBondContact O-N 3.41Å; I55-G59 PolarHBondContact O-N 3.31Å; I55-F81 HydrophobicContact CG2-CZ 4.23Å; I55-M85 HydrophobicContact CD1-CE 4.33Å; I55-M85 HydrophobicContact CG2-CE 4.46Å; I55-M85 HydrophobicContact CG2-SD 3.53Å; I55-M85 VanDerWaalsContact CG2-SD 3.53Å; I55-T208 HydrophobicContact CB-CG2 3.92Å; I55-T208 HydrophobicContact CG2-CG2 3.58Å
56	F	95.3	Very high	91	Very high	56 Å²	56	63.7 Å²	63.7	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-64.2	-43.4	176.1	-178	-116.4	0	0	0	112.2	C52 F53 L54 G59 L60 T208 L211	C52-F56 VanDerWaalsContact O-CB 3.31Å; C52-F56 WeakPolarHBondContact O-CB 3.47Å; C52-F56 PolarHBondContact O-N 3.45Å; F53-F56 PolarHBondContact O-N 3.25Å; L54-F56 VanDerWaalsContact C-N 3.35Å; L54-F56 PolarHBondContact O-N 3.47Å; F56-G59 PolarHBondContact O-N 3.16Å; F56-L60 VanDerWaalsContact O-CB 3.3Å; F56-L60 WeakPolarHBondContact O-CB 3.5Å; F56-L60 PolarHBondContact O-N 2.82Å; F56-T208 HydrophobicContact CB-CG2 4.15Å; F56-L211 HydrophobicContact CD2-CB 3.73Å; F56-L211 HydrophobicContact CE2-CB 3.66Å
57	A	94.9	Very high	90.6	Very high	48 Å²	48	64 Å²	64	40%	0.397	33%	0.325	S	S	.	.	H	α-helix	trans	-63.2	-41.5	177.2	0	0	0	0	0	112.5	F53 L54 S61	F53-A57 VanDerWaalsContact O-CB 3.31Å; F53-A57 WeakPolarHBondContact O-CB 3.49Å; F53-A57 PolarHBondContact O-N 3.37Å; L54-A57 PolarHBondContact O-N 2.79Å; A57-S61 VanDerWaalsContact O-CB 3.31Å; A57-S61 WeakPolarHBondContact O-CB 3.23Å; A57-S61 PolarHBondContact O-N 3.46Å; A57-S61 PolarHBondContact O-OG 2.82Å
58	I	95.3	Very high	89.6	Confident	67 Å²	67	61.9 Å²	61.9	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-48.3	174.2	-67.6	165	0	0	0	110.1	L54 I55 L60 S61 I62 F81	L54-I58 HydrophobicContact CD1-CD1 4.32Å; L54-I58 HydrophobicContact CG-CD1 3.99Å; L54-I58 VanDerWaalsContact O-CG1 3.27Å; L54-I58 WeakPolarHBondContact O-CG1 3.32Å; L54-I58 PolarHBondContact O-N 3.44Å; I55-I58 PolarHBondContact O-N 3.41Å; I58-L60 PolarHBondContact O-N 3.41Å; I58-S61 PolarHBondContact O-N 3.08Å; I58-I62 HydrophobicContact CG2-CD1 3.67Å; I58-I62 HydrophobicContact CG2-CG1 4.36Å; I58-I62 WeakPolarHBondContact O-CB 3.5Å; I58-I62 WeakPolarHBondContact O-CG1 3.32Å; I58-I62 PolarHBondContact O-N 2.91Å; I58-F81 HydrophobicContact CB-CE2 4.23Å; I58-F81 HydrophobicContact CB-CZ 4.41Å; I58-F81 HydrophobicContact CG2-CD2 3.99Å; I58-F81 HydrophobicContact CG2-CE2 3.52Å; I58-F81 HydrophobicContact CG2-CZ 4.02Å
59	G	93.6	Very high	88.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-44	178.9	0	0	0	0	0	112.8	I55 F56 T63 F81	I55-G59 PolarHBondContact O-N 3.31Å; F56-G59 PolarHBondContact O-N 3.16Å; G59-T63 WeakPolarHBondContact O-CB 3.38Å; G59-T63 PolarHBondContact O-N 2.64Å; G59-T63 PolarHBondContact O-OG1 2.9Å; G59-F81 VanDerWaalsContact CA-CE1 3.42Å
60	L	92.2	Very high	87.8	Confident	57 Å²	57	69.9 Å²	69.9	30%	0.298	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-44.3	174.7	-176	63.2	0	0	0	111.6	F56 I58 T63 L64 I219	F56-L60 VanDerWaalsContact O-CB 3.3Å; F56-L60 WeakPolarHBondContact O-CB 3.5Å; F56-L60 PolarHBondContact O-N 2.82Å; I58-L60 PolarHBondContact O-N 3.41Å; L60-T63 PolarHBondContact O-N 3.38Å; L60-L64 HydrophobicContact CD1-CD1 4.24Å; L60-L64 HydrophobicContact CD1-CG 4.35Å; L60-L64 HydrophobicContact CG-CD1 3.98Å; L60-L64 HydrophobicContact CG-CG 4.49Å; L60-L64 WeakPolarHBondContact O-CB 3.33Å; L60-L64 VanDerWaalsContact O-CG 3.31Å; L60-L64 WeakPolarHBondContact O-CG 3.33Å; L60-L64 PolarHBondContact O-N 2.78Å; L60-I219 HydrophobicContact CD1-CD1 3.92Å
61	S	92.9	Very high	87.1	Confident	76 Å²	76	64 Å²	64	53%	0.531	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-44.9	178.4	-59.1	0	0	0	0	112.2	A57 I58 T63 L64 Y65	A57-S61 VanDerWaalsContact O-CB 3.31Å; A57-S61 WeakPolarHBondContact O-CB 3.23Å; A57-S61 PolarHBondContact O-N 3.46Å; A57-S61 PolarHBondContact O-OG 2.82Å; I58-S61 PolarHBondContact O-N 3.08Å; S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 3.29Å; S61-L64 PolarHBondContact O-N 3.48Å; S61-Y65 WeakPolarHBondContact O-CB 3.49Å; S61-Y65 PolarHBondContact O-N 2.91Å
62	I	92.1	Very high	86.6	Confident	34 Å²	34	61.2 Å²	61.2	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-40.4	175.4	-68.9	171.4	0	0	0	110.3	I58 N66 F78 F81	I58-I62 HydrophobicContact CG2-CD1 3.67Å; I58-I62 HydrophobicContact CG2-CG1 4.36Å; I58-I62 WeakPolarHBondContact O-CB 3.5Å; I58-I62 WeakPolarHBondContact O-CG1 3.32Å; I58-I62 PolarHBondContact O-N 2.91Å; I62-N66 PolarHBondContact O-N 3.39Å; I62-N66 PolarHBondContact O-ND2 3.3Å; I62-F78 HydrophobicContact CG2-CB 4.07Å; I62-F78 HydrophobicContact CG2-CD2 4.04Å; I62-F81 HydrophobicContact CD1-CB 3.87Å; I62-F81 HydrophobicContact CD1-CD1 4.14Å; I62-F81 HydrophobicContact CD1-CD2 3.93Å; I62-F81 HydrophobicContact CD1-CG 3.7Å
63	T	89.8	Confident	86.1	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-48.4	176.8	-55.5	0	0	0	0	111.3	G59 L60 S61 Y65 N66 T67 Y82 D216 I219	G59-T63 WeakPolarHBondContact O-CB 3.38Å; G59-T63 PolarHBondContact O-N 2.64Å; G59-T63 PolarHBondContact O-OG1 2.9Å; L60-T63 PolarHBondContact O-N 3.38Å; S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 3.29Å; T63-Y65 PolarHBondContact O-N 3.44Å; T63-N66 PolarHBondContact O-N 2.92Å; T63-N66 VanDerWaalsContact O-N 3.16Å; T63-T67 PolarHBondContact O-OG1 3.34Å; T63-Y82 PolarHBondContact OG1-OH 3.24Å; T63-D216 HydrophobicContact CG2-CB 4.28Å; T63-I219 HydrophobicContact CG2-CB 3.76Å; T63-I219 HydrophobicContact CG2-CD1 3.47Å; T63-I219 VanDerWaalsContact CG2-CD1 3.47Å; T63-I219 HydrophobicContact CG2-CG1 4.18Å; T63-I219 HydrophobicContact CG2-CG2 3.93Å
64	L	87.1	Confident	85.5	Confident	97 Å²	97	55.7 Å²	55.7	51%	0.508	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-42.4	178.9	-73.9	169.9	0	0	0	111.8	L60 S61 N66 T67 I219	L60-L64 HydrophobicContact CD1-CD1 4.24Å; L60-L64 HydrophobicContact CD1-CG 4.35Å; L60-L64 HydrophobicContact CG-CD1 3.98Å; L60-L64 HydrophobicContact CG-CG 4.49Å; L60-L64 WeakPolarHBondContact O-CB 3.33Å; L60-L64 VanDerWaalsContact O-CG 3.31Å; L60-L64 WeakPolarHBondContact O-CG 3.33Å; L60-L64 PolarHBondContact O-N 2.78Å; S61-L64 PolarHBondContact O-N 3.48Å; L64-N66 PolarHBondContact O-N 3.01Å; L64-T67 WeakPolarHBondContact CA-OG1 3.45Å; L64-T67 VanDerWaalsContact O-CB 3.26Å; L64-T67 WeakPolarHBondContact O-CB 3.48Å; L64-T67 PolarHBondContact O-N 2.84Å; L64-T67 VanDerWaalsContact O-N 3.07Å; L64-T67 PolarHBondContact O-OG1 3.39Å; L64-I219 HydrophobicContact CD2-CD1 3.61Å; L64-I219 HydrophobicContact CD2-CG1 4.26Å; L64-I219 HydrophobicContact CG-CD1 3.86Å
65	Y	86.6	Confident	85.2	Confident	160 Å²	160	53.1 Å²	53.1	63%	0.627	29%	0.287	S	S	*	.	H	α-helix	trans	-57.8	-31.4	176.1	178	-95	0	0	0	113.5	S61 T63 T67 K70	S61-Y65 WeakPolarHBondContact O-CB 3.49Å; S61-Y65 PolarHBondContact O-N 2.91Å; T63-Y65 PolarHBondContact O-N 3.44Å; Y65-T67 VanDerWaalsContact C-N 3.34Å; Y65-K70 PolarHBondContact OH-NZ 3.36Å
66	N	82.5	Confident	84.9	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.048	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	14.9	179.6	-66.2	-61.8	0	0	0	113.7	I62 T63 L64 A72 E75	I62-N66 PolarHBondContact O-N 3.39Å; I62-N66 PolarHBondContact O-ND2 3.3Å; T63-N66 PolarHBondContact O-N 2.92Å; T63-N66 VanDerWaalsContact O-N 3.16Å; L64-N66 PolarHBondContact O-N 3.01Å; N66-A72 HydrophobicContact CB-CB 3.71Å; N66-E75 WeakPolarHBondContact OD1-CG 3.4Å
67	T	76.8	Confident	84.7	Confident	55 Å²	55	58.7 Å²	58.7	34%	0.337	33%	0.326	S	S	.	.			trans	-77.7	141.5	173.9	-46.6	0	0	0	0	110.5	T63 L64 Y65 I219	T63-T67 PolarHBondContact O-OG1 3.34Å; L64-T67 WeakPolarHBondContact CA-OG1 3.45Å; L64-T67 VanDerWaalsContact O-CB 3.26Å; L64-T67 WeakPolarHBondContact O-CB 3.48Å; L64-T67 PolarHBondContact O-N 2.84Å; L64-T67 VanDerWaalsContact O-N 3.07Å; L64-T67 PolarHBondContact O-OG1 3.39Å; Y65-T67 VanDerWaalsContact C-N 3.34Å; T67-I219 HydrophobicContact CG2-CG2 4.1Å; T67-I219 VanDerWaalsContact OG1-CG2 3.23Å; T67-I219 WeakPolarHBondContact OG1-CG2 3.43Å
68	G	67.8	Low	84.5	Confident	46 Å²	46	56.4 Å²	56.4	47%	0.474	31%	0.307	S	S	.	.	S	Bend	trans	117.3	-134.3	176.2	0	0	0	0	0	113.2	S223	G68-S223 PolarHBondContact N-OG 3.02Å; G68-S223 PolarHBondContact O-OG 3.17Å
69	E	63.6	Low	84.4	Confident	169 Å²	169	53.5 Å²	53.5	79%	0.79	29%	0.292	S	S	*	.	S	Bend	trans	-77	-22.9	-178.7	-59.6	-167.3	143	0	0	113.5
70	K	72	Confident	84.4	Confident	87 Å²	87	56.6 Å²	56.6	38%	0.378	31%	0.314	S	S	.	.	S	Bend	trans	-65.8	136.3	178.2	-69.3	-178.1	165.4	-144.1	0	110.8	Y65 A72 E75	Y65-K70 PolarHBondContact OH-NZ 3.36Å; K70-A72 PolarHBondContact O-N 2.92Å; K70-E75 VanDerWaalsContact CD-OE1 3.28Å; K70-E75 WeakPolarHBondContact CD-OE1 3.32Å; K70-E75 VanDerWaalsContact CE-OE1 3.27Å; K70-E75 WeakPolarHBondContact CE-OE1 3.24Å; K70-E75 IonicContact NZ-OE1 3.19Å; K70-E75 PolarHBondContact NZ-OE1 2.76Å
71	V	77.7	Confident	84.5	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.115	31%	0.306	C	S	.	.			trans	-86.6	107.3	167.8	178.6	0	0	0	0	107.2	E73 T74 Y160	V71-E73 HydrophobicContact CG1-CB 4.17Å; V71-E73 WeakPolarHBondContact CG1-OE2 3.45Å; V71-E73 PolarHBondContact O-N 2.84Å; V71-T74 HydrophobicContact CB-CG2 4.25Å; V71-T74 HydrophobicContact CG1-CG2 4.23Å; V71-T74 PolarHBondContact O-N 3.3Å; V71-T74 PolarHBondContact O-OG1 3.46Å; V71-Y160 HydrophobicContact CG2-CE2 4.29Å
72	A	81.5	Confident	84.6	Confident	18 Å²	18	51.7 Å²	51.7	15%	0.149	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-51.1	-34.7	-178.8	0	0	0	0	0	113.2	N66 K70 T74 E75 F78	N66-A72 HydrophobicContact CB-CB 3.71Å; K70-A72 PolarHBondContact O-N 2.92Å; A72-T74 PolarHBondContact O-N 2.91Å; A72-E75 PolarHBondContact O-N 3.04Å; A72-F78 HydrophobicContact CB-CD1 4.12Å; A72-F78 HydrophobicContact CB-CD2 3.89Å; A72-F78 HydrophobicContact CB-CE1 4.12Å; A72-F78 HydrophobicContact CB-CE2 3.9Å; A72-F78 HydrophobicContact CB-CG 4.02Å; A72-F78 HydrophobicContact CB-CZ 4.01Å; A72-F78 WeakPolarHBondContact O-CB 3.29Å; A72-F78 VanDerWaalsContact O-CD1 3.23Å; A72-F78 WeakPolarHBondContact O-CD1 3.36Å; A72-F78 WeakPolarHBondContact O-CG 3.5Å
73	E	82.7	Confident	84.7	Confident	9 Å²	9	51.2 Å²	51.2	4%	0.042	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-68.7	-11.9	178.4	-60	127.5	158.7	0	0	114.5	V71 V79 R152 I156 S166 Y169 K220	V71-E73 HydrophobicContact CG1-CB 4.17Å; V71-E73 WeakPolarHBondContact CG1-OE2 3.45Å; V71-E73 PolarHBondContact O-N 2.84Å; E73-V79 WeakPolarHBondContact O-CG2 3.36Å; E73-R152 WeakPolarHBondContact OE1-CG 3.33Å; E73-R152 IonicContact OE1-NE 3.62Å; E73-R152 PolarHBondContact OE1-NE 3.24Å; E73-R152 IonicContact OE2-CZ 3.05Å; E73-R152 VanDerWaalsContact OE2-CZ 3.24Å; E73-R152 IonicContact OE2-NE 3.87Å; E73-R152 PolarHBondContact OE2-NE 3.25Å; E73-R152 IonicContact OE2-NH2 2.67Å; E73-R152 PolarHBondContact OE2-NH2 3.42Å; E73-I156 HydrophobicContact CB-CD1 3.77Å; E73-I156 HydrophobicContact CG-CD1 3.86Å; E73-S166 VanDerWaalsContact O-CB 3.3Å; E73-S166 WeakPolarHBondContact O-CB 3.35Å; E73-S166 PolarHBondContact O-OG 2.9Å; E73-Y169 HydrophobicContact CG-CD1 4.5Å; E73-Y169 HydrophobicContact CG-CE1 3.95Å; E73-K220 IonicContact OE1-NZ 3.96Å; E73-K220 PolarHBondContact OE1-NZ 3.28Å; E73-K220 IonicContact OE2-NZ 2.73Å
74	T	81.9	Confident	85	Confident	30 Å²	30	56.1 Å²	56.1	18%	0.184	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-97.4	-8.2	173.8	58	0	0	0	0	113.6	V71 A72 Y160	V71-T74 HydrophobicContact CB-CG2 4.25Å; V71-T74 HydrophobicContact CG1-CG2 4.23Å; V71-T74 PolarHBondContact O-N 3.3Å; V71-T74 PolarHBondContact O-OG1 3.46Å; A72-T74 PolarHBondContact O-N 2.91Å; T74-Y160 HydrophobicContact CG2-CD1 4.25Å; T74-Y160 HydrophobicContact CG2-CD2 3.72Å; T74-Y160 HydrophobicContact CG2-CE1 4.32Å; T74-Y160 HydrophobicContact CG2-CE2 3.8Å; T74-Y160 HydrophobicContact CG2-CG 3.96Å
75	E	87.9	Confident	85.4	Confident	54 Å²	54	52.1 Å²	52.1	25%	0.252	28%	0.283	S	S	.	.			trans	-92.2	116.5	-175.4	-73.1	-82.9	-166.1	0	0	110.4	N66 K70 A72 S77 F78 V79	N66-E75 WeakPolarHBondContact OD1-CG 3.4Å; K70-E75 VanDerWaalsContact CD-OE1 3.28Å; K70-E75 WeakPolarHBondContact CD-OE1 3.32Å; K70-E75 VanDerWaalsContact CE-OE1 3.27Å; K70-E75 WeakPolarHBondContact CE-OE1 3.24Å; K70-E75 IonicContact NZ-OE1 3.19Å; K70-E75 PolarHBondContact NZ-OE1 2.76Å; A72-E75 PolarHBondContact O-N 3.04Å; E75-S77 VanDerWaalsContact C-N 3.26Å; E75-S77 PolarHBondContact O-N 3.33Å; E75-S77 VanDerWaalsContact O-N 3.15Å; E75-F78 HydrophobicContact CB-CB 4.44Å; E75-F78 WeakPolarHBondContact O-CB 3.35Å; E75-F78 PolarHBondContact O-N 3.11Å; E75-V79 PolarHBondContact O-N 3.41Å; E75-V79 VanDerWaalsContact O-N 3.07Å
76	N	88.6	Confident	85.8	Confident	110 Å²	110	44.5 Å²	44.5	59%	0.588	25%	0.253	S	S	*	.	H	α-helix	trans	-54.5	-40	-171.4	-74	-11.1	0	0	0	112.8	F78 V79 S80	N76-F78 VanDerWaalsContact C-N 3.33Å; N76-F78 PolarHBondContact O-N 3.28Å; N76-V79 PolarHBondContact O-N 3.3Å; N76-S80 VanDerWaalsContact O-CB 3.31Å; N76-S80 WeakPolarHBondContact O-CB 3.36Å; N76-S80 PolarHBondContact O-N 2.88Å; N76-S80 PolarHBondContact O-OG 3.4Å; N76-S80 VanDerWaalsContact O-OG 3.05Å
77	S	90.3	Very high	86.5	Confident	83 Å²	83	46 Å²	46	58%	0.58	26%	0.263	S	S	*	.	H	α-helix	trans	-60.6	-39.4	178.6	-52.6	0	0	0	0	113	E75 F81	E75-S77 VanDerWaalsContact C-N 3.26Å; E75-S77 PolarHBondContact O-N 3.33Å; E75-S77 VanDerWaalsContact O-N 3.15Å; S77-F81 VanDerWaalsContact O-CB 3.25Å; S77-F81 WeakPolarHBondContact O-CB 3.25Å; S77-F81 PolarHBondContact O-N 3.39Å
78	F	92	Very high	87.4	Confident	1 Å²	1	45 Å²	45	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-50	177.3	179.5	-85.5	0	0	0	110.8	I62 A72 E75 N76 S80 F81 Y82 Y169	I62-F78 HydrophobicContact CG2-CB 4.07Å; I62-F78 HydrophobicContact CG2-CD2 4.04Å; A72-F78 HydrophobicContact CB-CD1 4.12Å; A72-F78 HydrophobicContact CB-CD2 3.89Å; A72-F78 HydrophobicContact CB-CE1 4.12Å; A72-F78 HydrophobicContact CB-CE2 3.9Å; A72-F78 HydrophobicContact CB-CG 4.02Å; A72-F78 HydrophobicContact CB-CZ 4.01Å; A72-F78 WeakPolarHBondContact O-CB 3.29Å; A72-F78 VanDerWaalsContact O-CD1 3.23Å; A72-F78 WeakPolarHBondContact O-CD1 3.36Å; A72-F78 WeakPolarHBondContact O-CG 3.5Å; E75-F78 HydrophobicContact CB-CB 4.44Å; E75-F78 WeakPolarHBondContact O-CB 3.35Å; E75-F78 PolarHBondContact O-N 3.11Å; N76-F78 VanDerWaalsContact C-N 3.33Å; N76-F78 PolarHBondContact O-N 3.28Å; F78-S80 PolarHBondContact O-N 3Å; F78-F81 PolarHBondContact O-N 3.28Å; F78-Y82 HydrophobicContact CD1-CD2 4.29Å; F78-Y82 AromaticContact CD2-CD2 3.92Å; F78-Y82 HydrophobicContact CD2-CD2 3.92Å; F78-Y82 AromaticContact CD2-CE2 3.78Å; F78-Y82 HydrophobicContact CD2-CE2 3.78Å; F78-Y82 HydrophobicContact CE1-CD2 4.14Å; F78-Y82 AromaticContact CE2-CD2 3.76Å; F78-Y82 HydrophobicContact CE2-CD2 3.76Å; F78-Y82 AromaticContact CE2-CE2 3.4Å; F78-Y82 HydrophobicContact CE2-CE2 3.4Å; F78-Y82 VanDerWaalsContact CE2-CE2 3.4Å; F78-Y82 HydrophobicContact CG-CD2 4.18Å; F78-Y82 HydrophobicContact CG-CE2 4.49Å; F78-Y82 AromaticContact CZ-CD2 3.87Å; F78-Y82 HydrophobicContact CZ-CD2 3.87Å; F78-Y82 AromaticContact CZ-CE2 3.85Å; F78-Y82 HydrophobicContact CZ-CE2 3.85Å; F78-Y82 PolarHBondContact O-N 3.04Å; F78-Y82 VanDerWaalsContact O-N 3.07Å; F78-Y169 HydrophobicContact CE1-CE1 4.24Å; F78-Y169 HydrophobicContact CE1-CE2 4.14Å; F78-Y169 AromaticContact CE1-CZ 3.75Å
79	V	92.9	Very high	88.7	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.03	24%	0.236	C	C	.	.	H	α-helix	trans	-57.2	-49.3	180	171.7	0	0	0	0	110.9	E73 E75 N76 T83 A165	E73-V79 WeakPolarHBondContact O-CG2 3.36Å; E75-V79 PolarHBondContact O-N 3.41Å; E75-V79 VanDerWaalsContact O-N 3.07Å; N76-V79 PolarHBondContact O-N 3.3Å; V79-T83 WeakPolarHBondContact O-CB 3.33Å; V79-T83 PolarHBondContact O-N 3.26Å; V79-T83 PolarHBondContact O-OG1 2.83Å; V79-A165 HydrophobicContact CG1-CB 3.94Å; V79-A165 WeakPolarHBondContact CG1-O 3.4Å
80	S	92.8	Very high	90.3	Very high	66 Å²	66	35.3 Å²	35.3	46%	0.462	20%	0.201	S	C	.	.	H	α-helix	trans	-65	-48.6	179.4	-63	0	0	0	0	112.3	N76 F78 T83 I84	N76-S80 VanDerWaalsContact O-CB 3.31Å; N76-S80 WeakPolarHBondContact O-CB 3.36Å; N76-S80 PolarHBondContact O-N 2.88Å; N76-S80 PolarHBondContact O-OG 3.4Å; N76-S80 VanDerWaalsContact O-OG 3.05Å; F78-S80 PolarHBondContact O-N 3Å; S80-T83 PolarHBondContact O-N 3.44Å; S80-I84 VanDerWaalsContact O-CG1 3.29Å; S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 3.29Å
81	F	94.9	Very high	91.5	Very high	29 Å²	29	36.1 Å²	36.1	13%	0.127	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-52.8	-178.1	176	-97.6	0	0	0	112.1	I55 I58 G59 I62 S77 F78 T83 I84 M85	I55-F81 HydrophobicContact CG2-CZ 4.23Å; I58-F81 HydrophobicContact CB-CE2 4.23Å; I58-F81 HydrophobicContact CB-CZ 4.41Å; I58-F81 HydrophobicContact CG2-CD2 3.99Å; I58-F81 HydrophobicContact CG2-CE2 3.52Å; I58-F81 HydrophobicContact CG2-CZ 4.02Å; G59-F81 VanDerWaalsContact CA-CE1 3.42Å; I62-F81 HydrophobicContact CD1-CB 3.87Å; I62-F81 HydrophobicContact CD1-CD1 4.14Å; I62-F81 HydrophobicContact CD1-CD2 3.93Å; I62-F81 HydrophobicContact CD1-CG 3.7Å; S77-F81 VanDerWaalsContact O-CB 3.25Å; S77-F81 WeakPolarHBondContact O-CB 3.25Å; S77-F81 PolarHBondContact O-N 3.39Å; F78-F81 PolarHBondContact O-N 3.28Å; F81-T83 PolarHBondContact O-N 2.85Å; F81-I84 PolarHBondContact O-N 3.41Å; F81-M85 HydrophobicContact CD1-CG 4.45Å; F81-M85 HydrophobicContact CE1-CG 4.05Å; F81-M85 HydrophobicContact CE2-CG 4.47Å; F81-M85 HydrophobicContact CZ-CG 4.07Å; F81-M85 HydrophobicContact CZ-SD 4.48Å; F81-M85 WeakPolarHBondContact O-CG 3.28Å; F81-M85 PolarHBondContact O-N 2.96Å
82	Y	94.7	Very high	92.2	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-69.1	-33.4	-179.3	-82.5	-89	0	0	0	112.8	T63 F78 I84 M85 F86 Y169 C212	T63-Y82 PolarHBondContact OG1-OH 3.24Å; F78-Y82 HydrophobicContact CD1-CD2 4.29Å; F78-Y82 AromaticContact CD2-CD2 3.92Å; F78-Y82 HydrophobicContact CD2-CD2 3.92Å; F78-Y82 AromaticContact CD2-CE2 3.78Å; F78-Y82 HydrophobicContact CD2-CE2 3.78Å; F78-Y82 HydrophobicContact CE1-CD2 4.14Å; F78-Y82 AromaticContact CE2-CD2 3.76Å; F78-Y82 HydrophobicContact CE2-CD2 3.76Å; F78-Y82 AromaticContact CE2-CE2 3.4Å; F78-Y82 HydrophobicContact CE2-CE2 3.4Å; F78-Y82 VanDerWaalsContact CE2-CE2 3.4Å; F78-Y82 HydrophobicContact CG-CD2 4.18Å; F78-Y82 HydrophobicContact CG-CE2 4.49Å; F78-Y82 AromaticContact CZ-CD2 3.87Å; F78-Y82 HydrophobicContact CZ-CD2 3.87Å; F78-Y82 AromaticContact CZ-CE2 3.85Å; F78-Y82 HydrophobicContact CZ-CE2 3.85Å; F78-Y82 PolarHBondContact O-N 3.04Å; F78-Y82 VanDerWaalsContact O-N 3.07Å; Y82-I84 PolarHBondContact O-N 2.88Å; Y82-M85 PolarHBondContact O-N 3.1Å; Y82-F86 HydrophobicContact CD1-CE1 4.2Å; Y82-F86 AromaticContact CD1-CZ 3.9Å; Y82-F86 HydrophobicContact CD1-CZ 3.9Å; Y82-F86 WeakPolarHBondContact O-CD2 3.29Å; Y82-F86 VanDerWaalsContact O-CG 3.25Å; Y82-F86 WeakPolarHBondContact O-CG 3.47Å; Y82-F86 PolarHBondContact O-N 3.27Å; Y82-Y169 VanDerWaalsContact CB-CE2 3.5Å; Y82-Y169 HydrophobicContact CG-CE2 4.19Å; Y82-C212 HydrophobicContact CE1-CB 3.93Å; Y82-C212 PolarHBondContact OH-O 2.87Å
83	T	94.8	Very high	92.8	Very high	23 Å²	23	36.2 Å²	36.2	14%	0.141	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-44.2	174.4	-59.9	0	0	0	0	111	V79 S80 F81 M85 F86 V87 F172	V79-T83 WeakPolarHBondContact O-CB 3.33Å; V79-T83 PolarHBondContact O-N 3.26Å; V79-T83 PolarHBondContact O-OG1 2.83Å; S80-T83 PolarHBondContact O-N 3.44Å; F81-T83 PolarHBondContact O-N 2.85Å; T83-M85 VanDerWaalsContact C-N 3.33Å; T83-M85 PolarHBondContact O-N 2.92Å; T83-F86 PolarHBondContact O-N 3.41Å; T83-V87 HydrophobicContact CG2-CG2 4.15Å; T83-V87 WeakPolarHBondContact O-CB 3.28Å; T83-V87 VanDerWaalsContact O-CG2 3.25Å; T83-V87 WeakPolarHBondContact O-CG2 3.28Å; T83-V87 PolarHBondContact O-N 3.19Å; T83-F172 HydrophobicContact CG2-CD2 3.74Å; T83-F172 HydrophobicContact CG2-CE2 4.27Å; T83-F172 HydrophobicContact CG2-CG 4.45Å
84	I	95.2	Very high	93.3	Very high	108 Å²	108	40.4 Å²	40.4	55%	0.554	23%	0.229	S	C	*	.	H	α-helix	trans	-61.8	-41	175.3	-66.8	164.3	0	0	0	110.9	S80 F81 Y82 S88	S80-I84 VanDerWaalsContact O-CG1 3.29Å; S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 3.29Å; F81-I84 PolarHBondContact O-N 3.41Å; Y82-I84 PolarHBondContact O-N 2.88Å; I84-S88 VanDerWaalsContact O-CB 3.26Å; I84-S88 WeakPolarHBondContact O-CB 3.34Å; I84-S88 PolarHBondContact O-N 2.83Å; I84-S88 PolarHBondContact O-OG 2.9Å
85	M	95.4	Very high	93.7	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.059	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-41.4	176.1	-71	-62.5	101.5	0	0	113	I55 F81 Y82 T83 S88 S89 V209	I55-M85 HydrophobicContact CD1-CE 4.33Å; I55-M85 HydrophobicContact CG2-CE 4.46Å; I55-M85 HydrophobicContact CG2-SD 3.53Å; I55-M85 VanDerWaalsContact CG2-SD 3.53Å; F81-M85 HydrophobicContact CD1-CG 4.45Å; F81-M85 HydrophobicContact CE1-CG 4.05Å; F81-M85 HydrophobicContact CE2-CG 4.47Å; F81-M85 HydrophobicContact CZ-CG 4.07Å; F81-M85 HydrophobicContact CZ-SD 4.48Å; F81-M85 WeakPolarHBondContact O-CG 3.28Å; F81-M85 PolarHBondContact O-N 2.96Å; Y82-M85 PolarHBondContact O-N 3.1Å; T83-M85 VanDerWaalsContact C-N 3.33Å; T83-M85 PolarHBondContact O-N 2.92Å; M85-S88 PolarHBondContact O-OG 2.83Å; M85-S88 VanDerWaalsContact O-OG 3.06Å; M85-S89 WeakPolarHBondContact O-CB 3.4Å; M85-S89 PolarHBondContact O-N 3.01Å; M85-S89 VanDerWaalsContact O-N 3.16Å; M85-S89 PolarHBondContact O-OG 2.9Å; M85-V209 HydrophobicContact CB-CG1 4.37Å; M85-V209 HydrophobicContact CB-CG2 3.94Å; M85-V209 HydrophobicContact CG-CG2 4.38Å; M85-V209 HydrophobicContact SD-CG2 3.98Å
86	F	96.7	Very high	93.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.7	-49.2	176	-59.9	-27	0	0	0	111.8	Y82 T83 S88 S89 I90 Y169 F172 K173 F176 V209 I213	Y82-F86 HydrophobicContact CD1-CE1 4.2Å; Y82-F86 AromaticContact CD1-CZ 3.9Å; Y82-F86 HydrophobicContact CD1-CZ 3.9Å; Y82-F86 WeakPolarHBondContact O-CD2 3.29Å; Y82-F86 VanDerWaalsContact O-CG 3.25Å; Y82-F86 WeakPolarHBondContact O-CG 3.47Å; Y82-F86 PolarHBondContact O-N 3.27Å; T83-F86 PolarHBondContact O-N 3.41Å; F86-S88 PolarHBondContact O-N 3.29Å; F86-S89 PolarHBondContact O-N 3.35Å; F86-I90 HydrophobicContact CB-CD1 4.37Å; F86-I90 WeakPolarHBondContact O-CB 3.49Å; F86-I90 WeakPolarHBondContact O-CD1 3.08Å; F86-I90 WeakPolarHBondContact O-CG1 3.48Å; F86-I90 PolarHBondContact O-N 3.42Å; F86-Y169 HydrophobicContact CD2-CD2 4.4Å; F86-Y169 HydrophobicContact CD2-CE2 4.44Å; F86-Y169 AromaticContact CE2-CD2 3.84Å; F86-Y169 HydrophobicContact CE2-CD2 3.84Å; F86-Y169 AromaticContact CE2-CE2 3.48Å; F86-Y169 HydrophobicContact CE2-CE2 3.48Å; F86-Y169 VanDerWaalsContact CE2-CE2 3.48Å; F86-Y169 HydrophobicContact CZ-CE2 4.1Å; F86-F172 HydrophobicContact CB-CB 4.06Å; F86-F172 HydrophobicContact CD2-CB 4.29Å; F86-K173 HydrophobicContact CD2-CB 4.01Å; F86-K173 HydrophobicContact CE2-CB 3.52Å; F86-K173 HydrophobicContact CE2-CD 4.16Å; F86-K173 HydrophobicContact CE2-CG 3.73Å; F86-K173 HydrophobicContact CZ-CB 4.17Å; F86-K173 HydrophobicContact CZ-CD 4.21Å; F86-K173 HydrophobicContact CZ-CG 3.86Å; F86-F176 HydrophobicContact CB-CB 4.23Å; F86-F176 HydrophobicContact CD1-CB 4.2Å; F86-F176 HydrophobicContact CD1-CD1 4.38Å; F86-F176 HydrophobicContact CD1-CD2 4.1Å; F86-F176 AromaticContact CD1-CG 3.97Å; F86-F176 HydrophobicContact CD1-CG 3.97Å; F86-F176 HydrophobicContact CG-CB 4.25Å; F86-F176 HydrophobicContact CG-CG 4.49Å; F86-V209 HydrophobicContact CD1-CG1 4.09Å; F86-V209 HydrophobicContact CE1-CG1 4.2Å; F86-I213 HydrophobicContact CE1-CD1 3.73Å; F86-I213 HydrophobicContact CE1-CG1 3.8Å; F86-I213 HydrophobicContact CZ-CD1 4.44Å; F86-I213 HydrophobicContact CZ-CG1 4.23Å
87	V	96.4	Very high	93.7	Very high	42 Å²	42	39.4 Å²	39.4	26%	0.255	22%	0.218	S	C	.	.	H	α-helix	trans	-58.9	-48.8	179.9	170.9	0	0	0	0	111.2	T83 S89 I90 I91 F172	T83-V87 HydrophobicContact CG2-CG2 4.15Å; T83-V87 WeakPolarHBondContact O-CB 3.28Å; T83-V87 VanDerWaalsContact O-CG2 3.25Å; T83-V87 WeakPolarHBondContact O-CG2 3.28Å; T83-V87 PolarHBondContact O-N 3.19Å; V87-S89 VanDerWaalsContact C-N 3.34Å; V87-S89 PolarHBondContact O-N 3.42Å; V87-I90 PolarHBondContact O-N 3.18Å; V87-I91 HydrophobicContact CG1-CD1 3.66Å; V87-I91 HydrophobicContact CG1-CG1 4.41Å; V87-I91 VanDerWaalsContact O-CG1 3.29Å; V87-I91 WeakPolarHBondContact O-CG1 3.48Å; V87-I91 PolarHBondContact O-N 3.42Å; V87-F172 HydrophobicContact CG2-CD1 3.64Å; V87-F172 HydrophobicContact CG2-CD2 3.98Å; V87-F172 HydrophobicContact CG2-CE1 3.65Å; V87-F172 HydrophobicContact CG2-CE2 3.97Å; V87-F172 HydrophobicContact CG2-CG 3.82Å; V87-F172 HydrophobicContact CG2-CZ 3.81Å
88	S	95.4	Very high	93.6	Very high	34 Å²	34	36.9 Å²	36.9	24%	0.238	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-43.5	176.6	55.9	0	0	0	0	112.1	I84 M85 F86 V92 H205	I84-S88 VanDerWaalsContact O-CB 3.26Å; I84-S88 WeakPolarHBondContact O-CB 3.34Å; I84-S88 PolarHBondContact O-N 2.83Å; I84-S88 PolarHBondContact O-OG 2.9Å; M85-S88 PolarHBondContact O-OG 2.83Å; M85-S88 VanDerWaalsContact O-OG 3.06Å; F86-S88 PolarHBondContact O-N 3.29Å; S88-V92 VanDerWaalsContact O-CB 3.25Å; S88-V92 WeakPolarHBondContact O-CB 3.41Å; S88-V92 WeakPolarHBondContact O-CG2 3.41Å; S88-V92 PolarHBondContact O-N 2.79Å; S88-H205 PolarHBondContact OG-NE2 2.72Å
89	S	96.1	Very high	93.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-44	176.9	-59	0	0	0	0	112.4	M85 F86 V87 V92 M93 H205	M85-S89 WeakPolarHBondContact O-CB 3.4Å; M85-S89 PolarHBondContact O-N 3.01Å; M85-S89 VanDerWaalsContact O-N 3.16Å; M85-S89 PolarHBondContact O-OG 2.9Å; F86-S89 PolarHBondContact O-N 3.35Å; V87-S89 VanDerWaalsContact C-N 3.34Å; V87-S89 PolarHBondContact O-N 3.42Å; S89-V92 PolarHBondContact O-N 3.36Å; S89-M93 VanDerWaalsContact O-CB 3.32Å; S89-M93 WeakPolarHBondContact O-CB 3.3Å; S89-M93 WeakPolarHBondContact O-CE 3.4Å; S89-M93 VanDerWaalsContact O-CG 3.22Å; S89-M93 WeakPolarHBondContact O-CG 3.49Å; S89-M93 PolarHBondContact O-N 2.95Å; S89-H205 PolarHBondContact OG-NE2 3.05Å
90	I	96.6	Very high	92.5	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-50.1	179.4	-69.4	158.5	0	0	0	110.4	F86 V87 V92 M93 I94 F172 L175 F176	F86-I90 HydrophobicContact CB-CD1 4.37Å; F86-I90 WeakPolarHBondContact O-CB 3.49Å; F86-I90 WeakPolarHBondContact O-CD1 3.08Å; F86-I90 WeakPolarHBondContact O-CG1 3.48Å; F86-I90 PolarHBondContact O-N 3.42Å; V87-I90 PolarHBondContact O-N 3.18Å; I90-V92 VanDerWaalsContact C-N 3.32Å; I90-V92 PolarHBondContact O-N 2.99Å; I90-M93 HydrophobicContact CG1-CE 4.45Å; I90-M93 PolarHBondContact O-N 3.3Å; I90-I94 HydrophobicContact CG2-CD1 3.63Å; I90-I94 HydrophobicContact CG2-CG1 4.41Å; I90-I94 WeakPolarHBondContact O-CB 3.47Å; I90-I94 VanDerWaalsContact O-CG1 3.29Å; I90-I94 WeakPolarHBondContact O-CG1 3.4Å; I90-I94 PolarHBondContact O-N 3.06Å; I90-F172 HydrophobicContact CD1-CD1 4.05Å; I90-L175 HydrophobicContact CD1-CB 4.05Å; I90-L175 HydrophobicContact CD1-CD2 4.08Å; I90-L175 HydrophobicContact CD1-CG 3.9Å; I90-L175 HydrophobicContact CG2-CD2 4.33Å; I90-L175 HydrophobicContact CG2-CG 4.43Å; I90-F176 HydrophobicContact CD1-CB 4.13Å; I90-F176 HydrophobicContact CG1-CB 4.24Å
91	I	96	Very high	92	Very high	105 Å²	105	44.3 Å²	44.3	54%	0.538	23%	0.225	S	C	.	.	H	α-helix	trans	-56.7	-48.2	177.7	-68.9	167.6	0	0	0	110.2	V87 I94 F95	V87-I91 HydrophobicContact CG1-CD1 3.66Å; V87-I91 HydrophobicContact CG1-CG1 4.41Å; V87-I91 VanDerWaalsContact O-CG1 3.29Å; V87-I91 WeakPolarHBondContact O-CG1 3.48Å; V87-I91 PolarHBondContact O-N 3.42Å; I91-I94 PolarHBondContact O-N 3.33Å; I91-F95 VanDerWaalsContact O-CB 3.27Å; I91-F95 WeakPolarHBondContact O-CB 3.48Å; I91-F95 PolarHBondContact O-N 3.27Å
92	V	93.2	Very high	91.4	Very high	39 Å²	39	49.7 Å²	49.7	24%	0.236	25%	0.25	C	S	.	.	H	α-helix	trans	-66.4	-40.3	-178.5	164.8	0	0	0	0	112.3	S88 S89 I90 T96 I202	S88-V92 VanDerWaalsContact O-CB 3.25Å; S88-V92 WeakPolarHBondContact O-CB 3.41Å; S88-V92 WeakPolarHBondContact O-CG2 3.41Å; S88-V92 PolarHBondContact O-N 2.79Å; S89-V92 PolarHBondContact O-N 3.36Å; I90-V92 VanDerWaalsContact C-N 3.32Å; I90-V92 PolarHBondContact O-N 2.99Å; V92-T96 WeakPolarHBondContact O-CB 3.42Å; V92-T96 PolarHBondContact O-N 2.74Å; V92-T96 PolarHBondContact O-OG1 3.47Å; V92-I202 HydrophobicContact CG1-CB 3.81Å; V92-I202 HydrophobicContact CG1-CD1 3.81Å; V92-I202 HydrophobicContact CG1-CG1 3.46Å; V92-I202 VanDerWaalsContact CG1-CG1 3.46Å; V92-I202 HydrophobicContact CG1-CG2 3.29Å
93	M	93.9	Very high	90.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-44.8	175.8	-75.3	-174.8	-66	0	0	111.6	S89 I90 T96 L97 F176 T179 Q180 F183 I206	S89-M93 VanDerWaalsContact O-CB 3.32Å; S89-M93 WeakPolarHBondContact O-CB 3.3Å; S89-M93 WeakPolarHBondContact O-CE 3.4Å; S89-M93 VanDerWaalsContact O-CG 3.22Å; S89-M93 WeakPolarHBondContact O-CG 3.49Å; S89-M93 PolarHBondContact O-N 2.95Å; I90-M93 HydrophobicContact CG1-CE 4.45Å; I90-M93 PolarHBondContact O-N 3.3Å; M93-T96 PolarHBondContact O-N 2.98Å; M93-L97 WeakPolarHBondContact O-CB 3.39Å; M93-L97 WeakPolarHBondContact O-CG 3.38Å; M93-L97 PolarHBondContact O-N 3.32Å; M93-F176 HydrophobicContact CE-CD2 4.02Å; M93-F176 HydrophobicContact CE-CE2 4.2Å; M93-T179 HydrophobicContact CB-CG2 3.85Å; M93-T179 HydrophobicContact CE-CG2 3.89Å; M93-T179 HydrophobicContact SD-CG2 4.46Å; M93-Q180 HydrophobicContact CE-CB 4.03Å; M93-Q180 VanDerWaalsContact SD-CA 3.55Å; M93-Q180 HydrophobicContact SD-CB 3.79Å; M93-Q180 HydrophobicContact SD-CG 4.13Å; M93-F183 HydrophobicContact CB-CB 4.42Å; M93-F183 HydrophobicContact CB-CD2 3.77Å; M93-F183 HydrophobicContact CB-CE2 4.3Å; M93-F183 HydrophobicContact CB-CG 4.24Å; M93-F183 HydrophobicContact CG-CB 4.31Å; M93-F183 HydrophobicContact CG-CD1 4.36Å; M93-F183 HydrophobicContact CG-CD2 3.73Å; M93-F183 HydrophobicContact CG-CE2 4.06Å; M93-F183 HydrophobicContact CG-CG 3.9Å; M93-F183 HydrophobicContact CG-CZ 4.5Å; M93-F183 HydrophobicContact SD-CB 3.97Å; M93-F183 HydrophobicContact SD-CD1 4.27Å; M93-F183 HydrophobicContact SD-CD2 4.44Å; M93-F183 HydrophobicContact SD-CG 4Å; M93-I206 HydrophobicContact CG-CD1 3.53Å; M93-I206 HydrophobicContact CG-CG1 4.23Å; M93-I206 HydrophobicContact SD-CD1 4.14Å
94	I	93.1	Very high	89.1	Confident	97 Å²	97	57.3 Å²	57.3	50%	0.497	28%	0.279	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.7	-68.3	171.3	0	0	0	110.6	I90 I91 T96 L97 G98 T179	I90-I94 HydrophobicContact CG2-CD1 3.63Å; I90-I94 HydrophobicContact CG2-CG1 4.41Å; I90-I94 WeakPolarHBondContact O-CB 3.47Å; I90-I94 VanDerWaalsContact O-CG1 3.29Å; I90-I94 WeakPolarHBondContact O-CG1 3.4Å; I90-I94 PolarHBondContact O-N 3.06Å; I91-I94 PolarHBondContact O-N 3.33Å; I94-T96 VanDerWaalsContact C-N 3.3Å; I94-T96 PolarHBondContact O-N 3.06Å; I94-L97 PolarHBondContact O-N 3.06Å; I94-G98 PolarHBondContact O-N 3.27Å; I94-T179 HydrophobicContact CG1-CG2 3.95Å
95	F	91.6	Very high	87.7	Confident	132 Å²	132	57.4 Å²	57.4	58%	0.579	28%	0.281	S	S	*	.	H	α-helix	trans	-58.8	-42.6	175.7	177.3	-95.3	0	0	0	111.7	I91 G98 Y99	I91-F95 VanDerWaalsContact O-CB 3.27Å; I91-F95 WeakPolarHBondContact O-CB 3.48Å; I91-F95 PolarHBondContact O-N 3.27Å; F95-G98 PolarHBondContact O-N 3.22Å; F95-Y99 VanDerWaalsContact O-CB 3.29Å; F95-Y99 WeakPolarHBondContact O-CB 3.19Å; F95-Y99 PolarHBondContact O-N 3.26Å
96	T	87.2	Confident	86.1	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.043	30%	0.297	C	S	.	.	H	α-helix	trans	-66.9	-42.3	177.7	-56.9	0	0	0	0	111.9	V92 M93 I94 Y99 V100 F183 L187 F199	V92-T96 WeakPolarHBondContact O-CB 3.42Å; V92-T96 PolarHBondContact O-N 2.74Å; V92-T96 PolarHBondContact O-OG1 3.47Å; M93-T96 PolarHBondContact O-N 2.98Å; I94-T96 VanDerWaalsContact C-N 3.3Å; I94-T96 PolarHBondContact O-N 3.06Å; T96-Y99 PolarHBondContact O-N 2.98Å; T96-V100 WeakPolarHBondContact O-CB 3.42Å; T96-V100 VanDerWaalsContact O-CG2 3.3Å; T96-V100 WeakPolarHBondContact O-CG2 3.2Å; T96-V100 PolarHBondContact O-N 2.81Å; T96-F183 HydrophobicContact CG2-CE2 3.9Å; T96-L187 HydrophobicContact CG2-CD2 4.06Å; T96-F199 HydrophobicContact CG2-CD2 4.03Å; T96-F199 HydrophobicContact CG2-CE2 3.81Å
97	L	88.3	Confident	84.2	Confident	34 Å²	34	59.5 Å²	59.5	18%	0.178	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-44.1	174.7	-79.3	164.6	0	0	0	111.5	M93 I94 V100 Y101 V182 F183 L186 L187	M93-L97 WeakPolarHBondContact O-CB 3.39Å; M93-L97 WeakPolarHBondContact O-CG 3.38Å; M93-L97 PolarHBondContact O-N 3.32Å; I94-L97 PolarHBondContact O-N 3.06Å; L97-V100 PolarHBondContact O-N 3.25Å; L97-Y101 VanDerWaalsContact O-CB 3.26Å; L97-Y101 WeakPolarHBondContact O-CB 3.16Å; L97-Y101 PolarHBondContact O-N 2.91Å; L97-V182 HydrophobicContact CD1-CG1 4.49Å; L97-F183 HydrophobicContact CD1-CB 4.25Å; L97-F183 HydrophobicContact CD1-CD2 4.32Å; L97-F183 HydrophobicContact CG-CD2 4.1Å; L97-L186 HydrophobicContact CD2-CB 4.06Å; L97-L186 HydrophobicContact CD2-CD1 3.69Å; L97-L187 HydrophobicContact CD2-CD1 3.48Å; L97-L187 VanDerWaalsContact CD2-CD1 3.48Å; L97-L187 HydrophobicContact CG-CD1 4.17Å
98	G	87.8	Confident	82.4	Confident	30 Å²	30	61.9 Å²	61.9	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-44.9	174.7	0	0	0	0	0	112.4	I94 F95 V100 Y101 Q102	I94-G98 PolarHBondContact O-N 3.27Å; F95-G98 PolarHBondContact O-N 3.22Å; G98-V100 PolarHBondContact O-N 2.88Å; G98-Y101 PolarHBondContact O-N 3.23Å; G98-Q102 WeakPolarHBondContact O-CB 3.33Å; G98-Q102 WeakPolarHBondContact O-CG 3.42Å; G98-Q102 PolarHBondContact O-N 3.49Å
99	Y	84.3	Confident	80.6	Confident	43 Å²	43	64.4 Å²	64.4	17%	0.169	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-44.9	176.1	-176.4	-98.3	0	0	0	111.9	F95 T96 H103 F123	F95-Y99 VanDerWaalsContact O-CB 3.29Å; F95-Y99 WeakPolarHBondContact O-CB 3.19Å; F95-Y99 PolarHBondContact O-N 3.26Å; T96-Y99 PolarHBondContact O-N 2.98Å; Y99-H103 AromaticContact CD2-CE1 3.52Å; Y99-H103 AromaticContact CD2-ND1 3.67Å; Y99-H103 AromaticContact CE2-CE1 3.23Å; Y99-H103 WeakPolarHBondContact CE2-CE1 3.46Å; Y99-H103 AromaticContact CE2-ND1 3.61Å; Y99-H103 AromaticContact CE2-NE2 3.74Å; Y99-H103 AromaticContact CZ-CE1 3.86Å; Y99-H103 AromaticContact CZ-ND1 3.95Å; Y99-H103 WeakPolarHBondContact O-CB 3.04Å; Y99-H103 PolarHBondContact O-N 3.18Å; Y99-H103 VanDerWaalsContact O-N 3.08Å; Y99-H103 PolarHBondContact O-ND1 3.06Å; Y99-F123 AromaticContact CD1-CE2 3.81Å; Y99-F123 HydrophobicContact CD1-CE2 3.81Å; Y99-F123 AromaticContact CD1-CZ 3.56Å; Y99-F123 HydrophobicContact CD1-CZ 3.56Å; Y99-F123 AromaticContact CE1-CE2 3.69Å; Y99-F123 HydrophobicContact CE1-CE2 3.69Å; Y99-F123 AromaticContact CE1-CZ 3.46Å; Y99-F123 HydrophobicContact CE1-CZ 3.46Å; Y99-F123 VanDerWaalsContact CE1-CZ 3.46Å
100	V	79.1	Confident	78.7	Confident	10 Å²	10	66 Å²	66	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-41.6	174.5	165.7	0	0	0	0	111.5	T96 L97 G98 R104 F123 F125 I190	T96-V100 WeakPolarHBondContact O-CB 3.42Å; T96-V100 VanDerWaalsContact O-CG2 3.3Å; T96-V100 WeakPolarHBondContact O-CG2 3.2Å; T96-V100 PolarHBondContact O-N 2.81Å; L97-V100 PolarHBondContact O-N 3.25Å; G98-V100 PolarHBondContact O-N 2.88Å; V100-R104 WeakPolarHBondContact O-CB 3.23Å; V100-R104 PolarHBondContact O-N 3.2Å; V100-F123 HydrophobicContact CB-CE2 4.47Å; V100-F123 HydrophobicContact CG2-CD2 4.38Å; V100-F123 HydrophobicContact CG2-CE1 4.13Å; V100-F123 HydrophobicContact CG2-CE2 3.9Å; V100-F123 HydrophobicContact CG2-CZ 3.75Å; V100-F125 HydrophobicContact CG1-CZ 4.34Å; V100-I190 HydrophobicContact CG1-CD1 3.53Å
101	Y	81.8	Confident	76.7	Confident	175 Å²	175	70.1 Å²	70.1	69%	0.686	35%	0.352	S	S	*	.	H	α-helix	trans	-65.2	-48.4	179	-178.4	-94.8	0	0	0	111.8	L97 G98 H103 R104	L97-Y101 VanDerWaalsContact O-CB 3.26Å; L97-Y101 WeakPolarHBondContact O-CB 3.16Å; L97-Y101 PolarHBondContact O-N 2.91Å; G98-Y101 PolarHBondContact O-N 3.23Å; Y101-H103 PolarHBondContact O-N 2.86Å; Y101-R104 VanDerWaalsContact O-CB 3.24Å; Y101-R104 WeakPolarHBondContact O-CB 3.47Å; Y101-R104 PolarHBondContact O-N 3.39Å
102	Q	82	Confident	74.8	Confident	141 Å²	141	72.9 Å²	72.9	66%	0.659	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-44.1	177.2	-73.6	173.1	-16.5	0	0	112.3	G98 R104	G98-Q102 WeakPolarHBondContact O-CB 3.33Å; G98-Q102 WeakPolarHBondContact O-CG 3.42Å; G98-Q102 PolarHBondContact O-N 3.49Å; Q102-R104 VanDerWaalsContact C-N 3.32Å; Q102-R104 PolarHBondContact O-N 2.94Å
103	H	72.7	Confident	72.9	Confident	60 Å²	60	76 Å²	76	28%	0.278	37%	0.373	S	S	.	.	H	α-helix	trans	-89.2	5.5	-177.5	-61.1	77	0	0	0	113.6	Y99 Y101 S107 A122 F123	Y99-H103 AromaticContact CD2-CE1 3.52Å; Y99-H103 AromaticContact CD2-ND1 3.67Å; Y99-H103 AromaticContact CE2-CE1 3.23Å; Y99-H103 WeakPolarHBondContact CE2-CE1 3.46Å; Y99-H103 AromaticContact CE2-ND1 3.61Å; Y99-H103 AromaticContact CE2-NE2 3.74Å; Y99-H103 AromaticContact CZ-CE1 3.86Å; Y99-H103 AromaticContact CZ-ND1 3.95Å; Y99-H103 WeakPolarHBondContact O-CB 3.04Å; Y99-H103 PolarHBondContact O-N 3.18Å; Y99-H103 VanDerWaalsContact O-N 3.08Å; Y99-H103 PolarHBondContact O-ND1 3.06Å; Y101-H103 PolarHBondContact O-N 2.86Å; H103-S107 PolarHBondContact O-N 3.07Å; H103-S107 PolarHBondContact O-OG 2.99Å; H103-A122 HydrophobicContact CB-CB 4.36Å; H103-F123 HydrophobicContact CB-CD2 4.42Å; H103-F123 HydrophobicContact CB-CE2 4.22Å
104	R	68.3	Low	70.8	Confident	125 Å²	125	77.9 Å²	77.9	47%	0.472	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-48	178.2	178.5	173.4	179.4	-174.9	-3	111.2	V100 Y101 Q102 F125	V100-R104 WeakPolarHBondContact O-CB 3.23Å; V100-R104 PolarHBondContact O-N 3.2Å; Y101-R104 VanDerWaalsContact O-CB 3.24Å; Y101-R104 WeakPolarHBondContact O-CB 3.47Å; Y101-R104 PolarHBondContact O-N 3.39Å; Q102-R104 VanDerWaalsContact C-N 3.32Å; Q102-R104 PolarHBondContact O-N 2.94Å; R104-F125 HydrophobicContact CB-CE2 4.45Å; R104-F125 HydrophobicContact CB-CZ 4.44Å; R104-F125 HydrophobicContact CG-CE2 3.87Å; R104-F125 HydrophobicContact CG-CZ 3.89Å
105	N	65.8	Low	68.6	Low	109 Å²	109	78.4 Å²	78.4	58%	0.583	39%	0.394	S	S	*	.	H	α-helix	trans	-74.7	-44.7	-176.3	-66.4	1.4	0	0	0	110.9	S107 L108 E109	N105-S107 PolarHBondContact O-N 3.16Å; N105-S107 VanDerWaalsContact O-N 3.13Å; N105-L108 CarbonylContact O-C 3.58Å; N105-L108 WeakPolarHBondContact O-CA 3.01Å; N105-L108 WeakPolarHBondContact O-CB 3.43Å; N105-L108 PolarHBondContact O-N 3.32Å; N105-E109 WeakPolarHBondContact O-CB 3.41Å; N105-E109 PolarHBondContact O-N 3.38Å
106	A	62.8	Low	66.6	Low	50 Å²	50	79.8 Å²	79.8	41%	0.413	41%	0.406	S	S	.	.	H	α-helix	trans	-54.9	-34.4	176	0	0	0	0	0	113.3	A110	A106-A110 WeakPolarHBondContact O-CB 3.5Å; A106-A110 PolarHBondContact O-N 2.86Å
107	S	56.6	Low	64.5	Low	6 Å²	6	85.1 Å²	85.1	4%	0.042	44%	0.444	C	S	.	.	H	α-helix	trans	-72.5	-27.2	176.2	-55.5	0	0	0	0	113.6	H103 N105 I111	H103-S107 PolarHBondContact O-N 3.07Å; H103-S107 PolarHBondContact O-OG 2.99Å; N105-S107 PolarHBondContact O-N 3.16Å; N105-S107 VanDerWaalsContact O-N 3.13Å; S107-I111 WeakPolarHBondContact O-CD1 3.32Å; S107-I111 WeakPolarHBondContact O-CG1 3.44Å
108	L	58.3	Low	61.9	Low	93 Å²	93	86 Å²	86	49%	0.487	46%	0.457	S	S	.	.	H	α-helix	trans	-83.3	-43.1	174	-69.4	169.9	0	0	0	111.1	N105 A110 I111 E112	N105-L108 CarbonylContact O-C 3.58Å; N105-L108 WeakPolarHBondContact O-CA 3.01Å; N105-L108 WeakPolarHBondContact O-CB 3.43Å; N105-L108 PolarHBondContact O-N 3.32Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.47Å; L108-I111 WeakPolarHBondContact O-CA 3.43Å; L108-I111 WeakPolarHBondContact O-CB 3.24Å; L108-I111 PolarHBondContact O-N 2.9Å; L108-E112 PolarHBondContact O-N 3.19Å
109	E	57.8	Low	59.4	Low	86 Å²	86	90 Å²	90	40%	0.402	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-37.8	179.2	-174.4	176.1	-175.1	0	0	112	N105 I111 E112 K113	N105-E109 WeakPolarHBondContact O-CB 3.41Å; N105-E109 PolarHBondContact O-N 3.38Å; E109-I111 VanDerWaalsContact C-N 3.28Å; E109-I111 PolarHBondContact O-N 3.13Å; E109-E112 PolarHBondContact O-N 2.94Å; E109-K113 HydrophobicContact CG-CD 3.81Å; E109-K113 HydrophobicContact CG-CG 4.21Å; E109-K113 WeakPolarHBondContact O-CB 3.29Å; E109-K113 WeakPolarHBondContact O-CG 3.39Å; E109-K113 PolarHBondContact O-N 2.85Å; E109-K113 VanDerWaalsContact OE1-CE 3.23Å; E109-K113 WeakPolarHBondContact OE1-CE 3.41Å; E109-K113 IonicContact OE1-NZ 2.64Å; E109-K113 PolarHBondContact OE1-NZ 3.4Å
110	A	54.7	Low	57.4	Low	33 Å²	33	96.1 Å²	96.1	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-31.7	171.8	0	0	0	0	0	113.2	A106 L108	A106-A110 WeakPolarHBondContact O-CB 3.5Å; A106-A110 PolarHBondContact O-N 2.86Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.47Å
111	I	55.4	Low	55.7	Low	97 Å²	97	99 Å²	99	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-75.5	-41.3	174.9	-63.4	168.6	0	0	0	110	S107 L108 E109	S107-I111 WeakPolarHBondContact O-CD1 3.32Å; S107-I111 WeakPolarHBondContact O-CG1 3.44Å; L108-I111 WeakPolarHBondContact O-CA 3.43Å; L108-I111 WeakPolarHBondContact O-CB 3.24Å; L108-I111 PolarHBondContact O-N 2.9Å; E109-I111 VanDerWaalsContact C-N 3.28Å; E109-I111 PolarHBondContact O-N 3.13Å
112	E	55.5	Low	54.2	Low	163 Å²	163	91 Å²	91	76%	0.762	48%	0.484	S	S	*	.	H	α-helix	trans	-73.8	-40.8	-176.6	-170.8	169.9	-170.9	0	0	113.3	L108 E109 G114	L108-E112 PolarHBondContact O-N 3.19Å; E109-E112 PolarHBondContact O-N 2.94Å; E112-G114 VanDerWaalsContact C-N 3.33Å; E112-G114 PolarHBondContact O-N 2.91Å
113	K	54.8	Low	52.6	Low	104 Å²	104	84.7 Å²	84.7	45%	0.452	45%	0.454	S	S	.	.	H	α-helix	trans	-77	-16.8	179.7	-70	-175.2	170.9	174.8	0	114.1	E109 E115 K669	E109-K113 HydrophobicContact CG-CD 3.81Å; E109-K113 HydrophobicContact CG-CG 4.21Å; E109-K113 WeakPolarHBondContact O-CB 3.29Å; E109-K113 WeakPolarHBondContact O-CG 3.39Å; E109-K113 PolarHBondContact O-N 2.85Å; E109-K113 VanDerWaalsContact OE1-CE 3.23Å; E109-K113 WeakPolarHBondContact OE1-CE 3.41Å; E109-K113 IonicContact OE1-NZ 2.64Å; E109-K113 PolarHBondContact OE1-NZ 3.4Å; K113-E115 HydrophobicContact CB-CG 4.47Å; K113-K669 PolarHBondContact O-NZ 2.85Å
114	G	49.4	Very low	51.1	Low	41 Å²	41	82.2 Å²	82.2	42%	0.423	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	21.7	177.3	0	0	0	0	0	114.8	E112 L116	E112-G114 VanDerWaalsContact C-N 3.33Å; E112-G114 PolarHBondContact O-N 2.91Å; G114-L116 WeakPolarHBondContact O-CD1 2.84Å; G114-L116 PolarHBondContact O-N 3.37Å
115	E	46.3	Very low	50.2	Low	107 Å²	107	79.9 Å²	79.9	50%	0.5	44%	0.437	S	S	.	.			trans	-89.2	88.8	-175.9	-75.1	170	-164.3	0	0	111.5	K113 S117 A118	K113-E115 HydrophobicContact CB-CG 4.47Å; E115-S117 PolarHBondContact O-N 2.87Å; E115-S117 VanDerWaalsContact O-N 3.08Å; E115-A118 PolarHBondContact O-N 3.19Å
116	L	49.9	Very low	49.4	Very low	161 Å²	161	79.7 Å²	79.7	84%	0.843	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.4	177.7	-80.9	83.9	0	0	0	114.2	G114	G114-L116 WeakPolarHBondContact O-CD1 2.84Å; G114-L116 PolarHBondContact O-N 3.37Å
117	S	42.7	Very low	48.7	Very low	119 Å²	119	77.6 Å²	77.6	83%	0.832	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.8	-175.6	-56.7	0	0	0	0	114.5	E115 P119	E115-S117 PolarHBondContact O-N 2.87Å; E115-S117 VanDerWaalsContact O-N 3.08Å; S117-P119 WeakPolarHBondContact O-CD 3.47Å
118	A	33.4	Very low	48.4	Very low	54 Å²	54	80 Å²	80	45%	0.446	42%	0.422	S	S	.	.	S	Bend	trans	-68.9	124.3	175.4	0	0	0	0	0	110.1	E115 R120	E115-A118 PolarHBondContact O-N 3.19Å; A118-R120 PolarHBondContact O-N 3.43Å
119	P	36.3	Very low	48.4	Very low	112 Å²	112	79.6 Å²	79.6	73%	0.727	42%	0.42	S	S	*	.	S	Bend	trans	-69.9	100	-177	27.6	-33.8	0	0	0	110.7	S117	S117-P119 WeakPolarHBondContact O-CD 3.47Å
120	R	41.1	Very low	48.6	Very low	172 Å²	172	75.9 Å²	75.9	65%	0.649	40%	0.403	S	S	*	.			trans	92.2	110.8	162.5	-43.2	135.9	-178.7	-169.5	6.5	115.6	A118 A122 V194	A118-R120 PolarHBondContact O-N 3.43Å; R120-A122 PolarHBondContact O-N 3.06Å; R120-V194 HydrophobicContact CB-CG2 3.21Å; R120-V194 HydrophobicContact CG-CG2 3.66Å
121	I	45.3	Very low	49.3	Very low	70 Å²	70	76 Å²	76	36%	0.359	40%	0.4	S	S	.	.			trans	-49.2	108.4	144	-58.8	168	0	0	0	106.7	L193	I121-L193 HydrophobicContact CB-CD1 4.31Å; I121-L193 HydrophobicContact CG2-CD1 3.97Å
122	A	49.5	Very low	50.2	Low	8 Å²	8	77.3 Å²	77.3	7%	0.066	41%	0.407	C	S	.	.			trans	-70.9	-41.5	-172.4	0	0	0	0	0	111.3	H103 R120 L193 V194	H103-A122 HydrophobicContact CB-CB 4.36Å; R120-A122 PolarHBondContact O-N 3.06Å; A122-L193 PolarHBondContact O-N 2.91Å; A122-V194 HydrophobicContact CB-CG2 4.29Å
123	F	47.4	Very low	51.3	Low	8 Å²	8	74 Å²	74	4%	0.035	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	140.1	-171.1	-61.5	-60.2	0	0	0	111.4	Y99 V100 H103 I190 V191 I192	Y99-F123 AromaticContact CD1-CE2 3.81Å; Y99-F123 HydrophobicContact CD1-CE2 3.81Å; Y99-F123 AromaticContact CD1-CZ 3.56Å; Y99-F123 HydrophobicContact CD1-CZ 3.56Å; Y99-F123 AromaticContact CE1-CE2 3.69Å; Y99-F123 HydrophobicContact CE1-CE2 3.69Å; Y99-F123 AromaticContact CE1-CZ 3.46Å; Y99-F123 HydrophobicContact CE1-CZ 3.46Å; Y99-F123 VanDerWaalsContact CE1-CZ 3.46Å; V100-F123 HydrophobicContact CB-CE2 4.47Å; V100-F123 HydrophobicContact CG2-CD2 4.38Å; V100-F123 HydrophobicContact CG2-CE1 4.13Å; V100-F123 HydrophobicContact CG2-CE2 3.9Å; V100-F123 HydrophobicContact CG2-CZ 3.75Å; H103-F123 HydrophobicContact CB-CD2 4.42Å; H103-F123 HydrophobicContact CB-CE2 4.22Å; F123-I190 HydrophobicContact CB-CG2 3.97Å; F123-I190 HydrophobicContact CD1-CG2 3.62Å; F123-I190 HydrophobicContact CE1-CG2 4.45Å; F123-I190 HydrophobicContact CG-CG2 3.98Å; F123-V191 WeakPolarHBondContact CA-O 3.46Å; F123-I192 HydrophobicContact CD1-CB 4.11Å; F123-I192 HydrophobicContact CD1-CD1 4.02Å; F123-I192 HydrophobicContact CD1-CG1 3.67Å; F123-I192 HydrophobicContact CD1-CG2 4.3Å; F123-I192 HydrophobicContact CE1-CB 3.83Å; F123-I192 HydrophobicContact CE1-CD1 3.42Å; F123-I192 VanDerWaalsContact CE1-CD1 3.42Å; F123-I192 HydrophobicContact CE1-CG1 3.47Å; F123-I192 VanDerWaalsContact CE1-CG1 3.47Å; F123-I192 HydrophobicContact CE1-CG2 3.61Å; F123-I192 HydrophobicContact CZ-CD1 4.32Å
124	S	41.6	Very low	52.4	Low	9 Å²	9	69.1 Å²	69.1	6%	0.063	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.6	159.9	170	0	0	0	0	109.1	R126 I190 V191 Q276	S124-R126 PolarHBondContact O-N 2.98Å; S124-R126 PolarHBondContact OG-N 3.38Å; S124-R126 VanDerWaalsContact OG-N 3.15Å; S124-I190 WeakPolarHBondContact O-CA 3.31Å; S124-V191 PolarHBondContact N-O 2.98Å; S124-V191 VanDerWaalsContact N-O 3.1Å; S124-V191 PolarHBondContact O-N 3.13Å; S124-Q276 PolarHBondContact OG-O 3.27Å
125	F	50.1	Low	54.2	Low	75 Å²	75	69.6 Å²	69.6	33%	0.329	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	17.8	171	-80	-88.6	0	0	0	113	V100 R104 R189 I190	V100-F125 HydrophobicContact CG1-CZ 4.34Å; R104-F125 HydrophobicContact CB-CE2 4.45Å; R104-F125 HydrophobicContact CB-CZ 4.44Å; R104-F125 HydrophobicContact CG-CE2 3.87Å; R104-F125 HydrophobicContact CG-CZ 3.89Å; F125-R189 CarbonylContact C-O 3.59Å; F125-R189 VanDerWaalsContact O-CB 3.28Å; F125-R189 WeakPolarHBondContact O-CB 3.5Å; F125-I190 HydrophobicContact CD1-CD1 4.01Å; F125-I190 HydrophobicContact CD1-CG1 3.93Å; F125-I190 HydrophobicContact CE1-CD1 3.48Å; F125-I190 VanDerWaalsContact CE1-CD1 3.48Å; F125-I190 HydrophobicContact CE1-CG1 3.93Å; F125-I190 HydrophobicContact CZ-CD1 3.96Å
126	R	49.8	Very low	56.1	Low	106 Å²	106	71 Å²	71	40%	0.4	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	26.8	-174.3	-63.8	-168.4	170.5	118	-14.9	114.3	S124 R189 E278 C279 Q280	S124-R126 PolarHBondContact O-N 2.98Å; S124-R126 PolarHBondContact OG-N 3.38Å; S124-R126 VanDerWaalsContact OG-N 3.15Å; R126-R189 PolarHBondContact N-O 3.06Å; R126-E278 WeakPolarHBondContact CD-O 3.44Å; R126-C279 PolarHBondContact NH1-SG 3.32Å; R126-Q280 PolarHBondContact NH2-O 3.48Å
127	G	46.3	Very low	57.8	Low	5 Å²	5	63.3 Å²	63.3	5%	0.052	32%	0.32	C	S	.	.	S	Bend	trans	-60.8	150.9	162.1	0	0	0	0	0	111.5	D129 R189	G127-D129 PolarHBondContact O-N 3.46Å; G127-R189 WeakPolarHBondContact CA-O 3.45Å; G127-R189 PolarHBondContact N-O 2.54Å
128	E	51.6	Low	60.1	Low	57 Å²	57	57.8 Å²	57.8	27%	0.266	28%	0.282	S	S	.	.			trans	-50.8	131.4	-177	167.3	-168.3	-145.2	0	0	112	V130 R270 N366	E128-V130 PolarHBondContact O-N 2.66Å; E128-R270 PolarHBondContact O-NH1 3.5Å; E128-R270 PolarHBondContact O-NH2 3.02Å; E128-R270 VanDerWaalsContact O-NH2 3.16Å; E128-R270 IonicContact OE2-CZ 3.57Å; E128-R270 IonicContact OE2-NH2 3.73Å; E128-R270 PolarHBondContact OE2-NH2 2.72Å; E128-N366 PolarHBondContact OE1-ND2 3.43Å; E128-N366 PolarHBondContact OE1-OD1 3.48Å
129	D	57.8	Low	62.9	Low	84 Å²	84	56.5 Å²	56.5	45%	0.449	27%	0.274	S	S	.	.			trans	-60.6	112.1	-176.5	-100.1	-33.5	0	0	0	112.7	G127 N131 R135 H188 R189	G127-D129 PolarHBondContact O-N 3.46Å; D129-N131 PolarHBondContact O-N 3.05Å; D129-R135 IonicContact OD1-NH2 3.51Å; D129-R135 PolarHBondContact OD1-NH2 3.48Å; D129-H188 IonicContact OD1-CD2 3.97Å; D129-H188 IonicContact OD1-NE2 2.78Å; D129-R189 IonicContact OD1-CZ 3.23Å; D129-R189 IonicContact OD1-NE 3.48Å; D129-R189 PolarHBondContact OD1-NE 3.09Å; D129-R189 IonicContact OD1-NH2 3.81Å; D129-R189 PolarHBondContact OD1-NH2 2.83Å; D129-R189 IonicContact OD2-CZ 2.71Å; D129-R189 IonicContact OD2-NE 2.96Å; D129-R189 IonicContact OD2-NH2 3.72Å; D129-R189 PolarHBondContact OD2-NH2 3.26Å
130	V	62.1	Low	65.6	Low	8 Å²	8	53.5 Å²	53.5	5%	0.048	25%	0.251	C	S	.	.			trans	-57.1	126.1	159.8	173.3	0	0	0	0	107.5	E128 L134 R135 H188 V263	E128-V130 PolarHBondContact O-N 2.66Å; V130-L134 HydrophobicContact CG1-CB 4.07Å; V130-L134 HydrophobicContact CG1-CD2 3.89Å; V130-L134 HydrophobicContact CG1-CG 4.37Å; V130-R135 HydrophobicContact CG1-CG 4.33Å; V130-R135 VanDerWaalsContact O-CZ 3.24Å; V130-R135 PolarHBondContact O-NE 3.22Å; V130-R135 PolarHBondContact O-NH2 3.5Å; V130-H188 HydrophobicContact CB-CB 3.9Å; V130-H188 HydrophobicContact CG2-CB 3.79Å; V130-V263 HydrophobicContact CG1-CG2 4.45Å; V130-V263 HydrophobicContact CG2-CG1 4.39Å
131	N	69.6	Low	68	Low	37 Å²	37	45.4 Å²	45.4	20%	0.198	22%	0.221	C	C	.	.			trans	-60.8	147.6	-167.4	-146.7	-56.7	0	0	0	112.7	D129 Y133 L134 R135 I515	D129-N131 PolarHBondContact O-N 3.05Å; N131-Y133 PolarHBondContact O-N 3Å; N131-L134 PolarHBondContact O-N 3.22Å; N131-R135 PolarHBondContact O-N 3.49Å; N131-R135 VanDerWaalsContact O-N 3.1Å; N131-I515 HydrophobicContact CB-CD1 4.1Å; N131-I515 WeakPolarHBondContact ND2-CD1 3.49Å; N131-I515 VanDerWaalsContact ND2-CG1 3.28Å; N131-I515 WeakPolarHBondContact ND2-CG1 3.44Å
132	L	75.1	Confident	70.4	Confident	124 Å²	124	42.2 Å²	42.2	65%	0.649	21%	0.205	S	C	*	.	H	α-helix	trans	-55.5	-40.7	179.5	-179.3	65.1	0	0	0	111.4	L134 R135 F136	L132-L134 PolarHBondContact O-N 3.22Å; L132-R135 WeakPolarHBondContact O-CB 3.41Å; L132-R135 PolarHBondContact O-N 2.93Å; L132-F136 PolarHBondContact O-N 2.88Å
133	Y	78.4	Confident	72.6	Confident	94 Å²	94	44.4 Å²	44.4	37%	0.369	22%	0.223	S	C	.	.	H	α-helix	trans	-60.4	-40.7	175.8	-65.5	-75.2	0	0	0	112.9	N131 F136 G137 Y507 V511 A514 I515	N131-Y133 PolarHBondContact O-N 3Å; Y133-F136 PolarHBondContact O-N 3.45Å; Y133-G137 PolarHBondContact O-N 3.32Å; Y133-Y507 PolarHBondContact O-OH 3.35Å; Y133-V511 VanDerWaalsContact CB-CG1 3.49Å; Y133-V511 HydrophobicContact CG-CG1 4.23Å; Y133-A514 HydrophobicContact CE1-CB 3.99Å; Y133-A514 HydrophobicContact CE2-CB 4.05Å; Y133-I515 HydrophobicContact CD2-CG1 3.8Å; Y133-I515 HydrophobicContact CE2-CG1 4.2Å
134	L	78.1	Confident	74.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-35.4	178.8	-160.9	66.8	0	0	0	111.4	V130 N131 L132 G137 I138 I259 V263 L367	V130-L134 HydrophobicContact CG1-CB 4.07Å; V130-L134 HydrophobicContact CG1-CD2 3.89Å; V130-L134 HydrophobicContact CG1-CG 4.37Å; N131-L134 PolarHBondContact O-N 3.22Å; L132-L134 PolarHBondContact O-N 3.22Å; L134-G137 PolarHBondContact O-N 3.06Å; L134-I138 WeakPolarHBondContact O-CG1 3.43Å; L134-I138 PolarHBondContact O-N 3.45Å; L134-I259 HydrophobicContact CD1-CG2 3.8Å; L134-I259 HydrophobicContact CG-CG2 4.09Å; L134-V263 HydrophobicContact CD2-CG2 3.53Å; L134-V263 HydrophobicContact CG-CG2 4.3Å; L134-L367 HydrophobicContact CD2-CD2 3.74Å
135	R	85.8	Confident	77.3	Confident	50 Å²	50	45.4 Å²	45.4	19%	0.189	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-44.5	171.8	-63.5	-179.5	-142	-174.4	-0.7	111.9	D129 V130 N131 L132 G137 I138 G139 L185 H188	D129-R135 IonicContact OD1-NH2 3.51Å; D129-R135 PolarHBondContact OD1-NH2 3.48Å; V130-R135 HydrophobicContact CG1-CG 4.33Å; V130-R135 VanDerWaalsContact O-CZ 3.24Å; V130-R135 PolarHBondContact O-NE 3.22Å; V130-R135 PolarHBondContact O-NH2 3.5Å; N131-R135 PolarHBondContact O-N 3.49Å; N131-R135 VanDerWaalsContact O-N 3.1Å; L132-R135 WeakPolarHBondContact O-CB 3.41Å; L132-R135 PolarHBondContact O-N 2.93Å; R135-G137 VanDerWaalsContact C-N 3.32Å; R135-I138 PolarHBondContact O-N 3.06Å; R135-G139 PolarHBondContact O-N 2.92Å; R135-G139 VanDerWaalsContact O-N 3.09Å; R135-L185 HydrophobicContact CB-CD2 3.57Å; R135-L185 HydrophobicContact CG-CD2 3.91Å; R135-H188 PolarHBondContact NH1-CE1 2.71Å; R135-H188 PolarHBondContact NH1-NE2 3.41Å; R135-H188 PolarHBondContact NH2-CD2 3.25Å; R135-H188 VanDerWaalsContact NH2-CD2 3.28Å; R135-H188 PolarHBondContact NH2-NE2 3.1Å
136	F	86.6	Confident	79.4	Confident	136 Å²	136	44 Å²	44	60%	0.596	22%	0.223	S	C	*	.	H	α-helix	trans	-60.6	-42.9	174.1	-178.4	-95.9	0	0	0	111.2	L132 Y133 G139 L140	L132-F136 PolarHBondContact O-N 2.88Å; Y133-F136 PolarHBondContact O-N 3.45Å; F136-G139 PolarHBondContact O-N 3.08Å; F136-L140 HydrophobicContact CE1-CB 4.5Å; F136-L140 HydrophobicContact CE1-CD2 4.13Å; F136-L140 WeakPolarHBondContact O-CB 3.4Å; F136-L140 PolarHBondContact O-N 3.41Å
137	G	86.3	Confident	81.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.4	-51.9	172.5	0	0	0	0	0	113.2	Y133 L134 R135 G139 L140 F141 Y507	Y133-G137 PolarHBondContact O-N 3.32Å; L134-G137 PolarHBondContact O-N 3.06Å; R135-G137 VanDerWaalsContact C-N 3.32Å; G137-G139 VanDerWaalsContact C-N 3.3Å; G137-G139 PolarHBondContact O-N 3.15Å; G137-L140 PolarHBondContact O-N 2.84Å; G137-F141 WeakPolarHBondContact O-CD2 3.33Å; G137-F141 PolarHBondContact O-N 3.35Å; G137-Y507 WeakPolarHBondContact CA-OH 3.3Å; G137-Y507 PolarHBondContact N-OH 3.17Å
138	I	91	Very high	83.7	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-54.9	-47.3	177	-64.3	165	0	0	0	110.6	L134 R135 A142 T181 L184 Y256 I259 V263	L134-I138 WeakPolarHBondContact O-CG1 3.43Å; L134-I138 PolarHBondContact O-N 3.45Å; R135-I138 PolarHBondContact O-N 3.06Å; I138-A142 WeakPolarHBondContact O-CB 3.47Å; I138-A142 PolarHBondContact O-N 3.25Å; I138-T181 HydrophobicContact CG2-CG2 4.05Å; I138-L184 HydrophobicContact CD1-CB 4.34Å; I138-L184 HydrophobicContact CD1-CD1 4.37Å; I138-L184 HydrophobicContact CG2-CD1 4.34Å; I138-Y256 HydrophobicContact CG2-CE2 3.85Å; I138-I259 HydrophobicContact CD1-CG2 4.29Å; I138-I259 HydrophobicContact CG1-CG2 3.56Å; I138-V263 HydrophobicContact CD1-CG2 4.18Å
139	G	92.1	Very high	85.7	Confident	28 Å²	28	39.4 Å²	39.4	29%	0.289	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-45	178.5	0	0	0	0	0	113.5	R135 F136 G137 A143	R135-G139 PolarHBondContact O-N 2.92Å; R135-G139 VanDerWaalsContact O-N 3.09Å; F136-G139 PolarHBondContact O-N 3.08Å; G137-G139 VanDerWaalsContact C-N 3.3Å; G137-G139 PolarHBondContact O-N 3.15Å; G139-A143 PolarHBondContact O-N 3.25Å
140	L	91.5	Very high	87.3	Confident	48 Å²	48	37.6 Å²	37.6	25%	0.251	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-51.9	179.5	-177.9	67	0	0	0	111.7	F136 G137 A142 A143 M144 W462	F136-L140 HydrophobicContact CE1-CB 4.5Å; F136-L140 HydrophobicContact CE1-CD2 4.13Å; F136-L140 WeakPolarHBondContact O-CB 3.4Å; F136-L140 PolarHBondContact O-N 3.41Å; G137-L140 PolarHBondContact O-N 2.84Å; L140-A142 VanDerWaalsContact C-N 3.33Å; L140-A142 PolarHBondContact O-N 3Å; L140-A143 PolarHBondContact O-N 3.3Å; L140-M144 HydrophobicContact CD1-CE 3.88Å; L140-M144 HydrophobicContact CD2-CE 4.34Å; L140-M144 HydrophobicContact CG-CE 3.95Å; L140-M144 WeakPolarHBondContact O-CG 3.32Å; L140-M144 PolarHBondContact O-N 3Å; L140-W462 HydrophobicContact CD2-CH2 4.25Å
141	F	93.1	Very high	88.7	Confident	2 Å²	2	38 Å²	38	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-70.6	-29.2	-179	-68.6	-65.4	0	0	0	112.5	G137 M144 S145 A252 E255 Y256 I259 W462 Y507	G137-F141 WeakPolarHBondContact O-CD2 3.33Å; G137-F141 PolarHBondContact O-N 3.35Å; F141-M144 HydrophobicContact CD1-SD 4.49Å; F141-S145 VanDerWaalsContact O-CB 3.25Å; F141-S145 WeakPolarHBondContact O-CB 3.41Å; F141-S145 PolarHBondContact O-N 3.46Å; F141-S145 PolarHBondContact O-OG 3.38Å; F141-A252 HydrophobicContact CD1-CB 4.11Å; F141-E255 HydrophobicContact CD1-CB 3.88Å; F141-E255 HydrophobicContact CE1-CB 3.74Å; F141-E255 HydrophobicContact CE1-CG 4.38Å; F141-E255 WeakPolarHBondContact CE1-OE2 3.11Å; F141-E255 HydrophobicContact CG-CB 4.36Å; F141-E255 HydrophobicContact CZ-CB 4.14Å; F141-E255 VanDerWaalsContact CZ-OE2 3.29Å; F141-E255 WeakPolarHBondContact CZ-OE2 3.49Å; F141-Y256 HydrophobicContact CB-CD2 4.16Å; F141-Y256 HydrophobicContact CB-CG 4.5Å; F141-I259 HydrophobicContact CD2-CD1 3.49Å; F141-I259 VanDerWaalsContact CD2-CD1 3.49Å; F141-I259 HydrophobicContact CE2-CD1 3.56Å; F141-W462 HydrophobicContact CE1-CH2 4.49Å; F141-W462 AromaticContact CE1-CZ2 3.58Å; F141-W462 HydrophobicContact CE1-CZ2 3.58Å; F141-W462 AromaticContact CZ-CE2 3.98Å; F141-W462 HydrophobicContact CZ-CH2 4.36Å; F141-W462 AromaticContact CZ-CZ2 3.53Å; F141-W462 HydrophobicContact CZ-CZ2 3.53Å; F141-Y507 HydrophobicContact CE2-CD1 4.1Å; F141-Y507 HydrophobicContact CE2-CD2 4.38Å; F141-Y507 AromaticContact CE2-CE1 3.99Å; F141-Y507 HydrophobicContact CE2-CE1 3.99Å; F141-Y507 HydrophobicContact CE2-CE2 4.28Å; F141-Y507 HydrophobicContact CE2-CG 4.3Å; F141-Y507 HydrophobicContact CZ-CD2 4.32Å; F141-Y507 HydrophobicContact CZ-CG 4.3Å
142	A	95.2	Very high	89.7	Confident	4 Å²	4	38.4 Å²	38.4	3%	0.033	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-49.4	169.3	0	0	0	0	0	111.4	I138 L140 M144 S145 I146 T181 Y256	I138-A142 WeakPolarHBondContact O-CB 3.47Å; I138-A142 PolarHBondContact O-N 3.25Å; L140-A142 VanDerWaalsContact C-N 3.33Å; L140-A142 PolarHBondContact O-N 3Å; A142-M144 PolarHBondContact O-N 3.09Å; A142-S145 PolarHBondContact O-N 2.82Å; A142-S145 VanDerWaalsContact O-N 3.15Å; A142-I146 WeakPolarHBondContact O-CD1 3.24Å; A142-I146 VanDerWaalsContact O-CG1 3.26Å; A142-I146 WeakPolarHBondContact O-CG1 3.49Å; A142-I146 PolarHBondContact O-N 2.87Å; A142-T181 HydrophobicContact CB-CG2 4.13Å; A142-T181 WeakPolarHBondContact CB-OG1 3.36Å; A142-Y256 HydrophobicContact CB-CD2 3.99Å; A142-Y256 HydrophobicContact CB-CE2 3.65Å
143	A	95.2	Very high	90.4	Very high	53 Å²	53	34 Å²	34	44%	0.438	19%	0.186	S	C	.	.	H	α-helix	trans	-58.6	-46.5	179	0	0	0	0	0	111.5	G139 L140 S145 I146 V147	G139-A143 PolarHBondContact O-N 3.25Å; L140-A143 PolarHBondContact O-N 3.3Å; A143-S145 PolarHBondContact O-N 3.05Å; A143-I146 PolarHBondContact O-N 2.85Å; A143-V147 WeakPolarHBondContact O-CG2 3.43Å; A143-V147 PolarHBondContact O-N 2.86Å
144	M	92.8	Very high	90.9	Very high	39 Å²	39	35.8 Å²	35.8	19%	0.192	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-40.2	174.7	-68.3	-176.1	-174.9	0	0	112.9	L140 F141 A142 V147 H148 F249 A252	L140-M144 HydrophobicContact CD1-CE 3.88Å; L140-M144 HydrophobicContact CD2-CE 4.34Å; L140-M144 HydrophobicContact CG-CE 3.95Å; L140-M144 WeakPolarHBondContact O-CG 3.32Å; L140-M144 PolarHBondContact O-N 3Å; F141-M144 HydrophobicContact CD1-SD 4.49Å; A142-M144 PolarHBondContact O-N 3.09Å; M144-V147 PolarHBondContact O-N 3.12Å; M144-H148 PolarHBondContact O-N 3.38Å; M144-F249 HydrophobicContact CB-CD1 3.89Å; M144-F249 HydrophobicContact CB-CE1 4.47Å; M144-F249 HydrophobicContact CG-CD1 3.91Å; M144-F249 HydrophobicContact CG-CE1 4.05Å; M144-F249 HydrophobicContact SD-CD1 4.43Å; M144-A252 HydrophobicContact CB-CB 3.33Å; M144-A252 HydrophobicContact CG-CB 4.26Å; M144-A252 HydrophobicContact SD-CB 3.93Å
145	S	94	Very high	91.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-34.3	177.5	-62.3	0	0	0	0	112.9	F141 A142 A143 S149 A252 V253	F141-S145 VanDerWaalsContact O-CB 3.25Å; F141-S145 WeakPolarHBondContact O-CB 3.41Å; F141-S145 PolarHBondContact O-N 3.46Å; F141-S145 PolarHBondContact O-OG 3.38Å; A142-S145 PolarHBondContact O-N 2.82Å; A142-S145 VanDerWaalsContact O-N 3.15Å; A143-S145 PolarHBondContact O-N 3.05Å; S145-S149 WeakPolarHBondContact O-CB 3.34Å; S145-S149 PolarHBondContact O-N 3.26Å; S145-S149 PolarHBondContact O-OG 3.43Å; S145-A252 PolarHBondContact OG-O 2.84Å; S145-V253 WeakPolarHBondContact OG-CA 3.45Å
146	I	95.4	Very high	91.2	Very high	44 Å²	44	33.7 Å²	33.7	23%	0.226	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-45.3	172.3	-69.4	161.8	0	0	0	109.9	A142 A143 S149 A150 I174 F177 I178	A142-I146 WeakPolarHBondContact O-CD1 3.24Å; A142-I146 VanDerWaalsContact O-CG1 3.26Å; A142-I146 WeakPolarHBondContact O-CG1 3.49Å; A142-I146 PolarHBondContact O-N 2.87Å; A143-I146 PolarHBondContact O-N 2.85Å; I146-S149 PolarHBondContact O-N 3.46Å; I146-A150 WeakPolarHBondContact O-CB 3.27Å; I146-A150 PolarHBondContact O-N 3.41Å; I146-I174 HydrophobicContact CG2-CG2 4.09Å; I146-F177 HydrophobicContact CD1-CB 4.24Å; I146-F177 HydrophobicContact CG1-CB 3.84Å; I146-I178 HydrophobicContact CD1-CD1 4.48Å; I146-I178 HydrophobicContact CD1-CG1 3.67Å
147	V	94.1	Very high	91.2	Very high	60 Å²	60	29.2 Å²	29.2	36%	0.364	17%	0.173	S	C	.	.	H	α-helix	trans	-59.8	-48.1	174.9	174.1	0	0	0	0	110.9	A143 M144 S149 A150 T151 F249	A143-V147 WeakPolarHBondContact O-CG2 3.43Å; A143-V147 PolarHBondContact O-N 2.86Å; M144-V147 PolarHBondContact O-N 3.12Å; V147-S149 VanDerWaalsContact C-N 3.29Å; V147-S149 PolarHBondContact O-N 3.25Å; V147-A150 PolarHBondContact O-N 3.06Å; V147-T151 HydrophobicContact CG1-CG2 4.32Å; V147-T151 WeakPolarHBondContact O-CG2 3.4Å; V147-T151 PolarHBondContact O-N 2.96Å; V147-T151 PolarHBondContact O-OG1 3.13Å; V147-F249 HydrophobicContact CB-CD2 4.38Å; V147-F249 HydrophobicContact CG1-CD2 3.58Å; V147-F249 HydrophobicContact CG1-CE2 3.55Å; V147-F249 HydrophobicContact CG1-CG 4.26Å; V147-F249 HydrophobicContact CG1-CZ 4.19Å
148	H	92.7	Very high	91.2	Very high	8 Å²	8	34 Å²	34	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-55.2	-44	174.2	175.8	79.1	0	0	0	112.4	M144 T151 R152 T246 F249 V253	M144-H148 PolarHBondContact O-N 3.38Å; H148-T151 PolarHBondContact O-OG1 2.96Å; H148-R152 VanDerWaalsContact O-CB 3.25Å; H148-R152 WeakPolarHBondContact O-CB 3.49Å; H148-R152 PolarHBondContact O-N 3.18Å; H148-T246 PolarHBondContact CE1-O 3.09Å; H148-T246 PolarHBondContact ND1-O 3.37Å; H148-F249 HydrophobicContact CB-CB 3.79Å; H148-V253 HydrophobicContact CB-CG2 4.4Å
149	S	92.4	Very high	90.8	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-68	-39.1	-180	-58	0	0	0	0	111.6	S145 I146 V147 R152 C153 I170	S145-S149 WeakPolarHBondContact O-CB 3.34Å; S145-S149 PolarHBondContact O-N 3.26Å; S145-S149 PolarHBondContact O-OG 3.43Å; I146-S149 PolarHBondContact O-N 3.46Å; V147-S149 VanDerWaalsContact C-N 3.29Å; V147-S149 PolarHBondContact O-N 3.25Å; S149-R152 PolarHBondContact O-N 3.44Å; S149-C153 PolarHBondContact O-N 2.82Å; S149-I170 WeakPolarHBondContact O-CG2 3.48Å
150	A	92.8	Very high	90.4	Very high	46 Å²	46	38.2 Å²	38.2	38%	0.38	20%	0.204	S	C	.	.	H	α-helix	trans	-68.7	-43.6	177.3	0	0	0	0	0	112.5	I146 V147 R152 C153 Y154 I174	I146-A150 WeakPolarHBondContact O-CB 3.27Å; I146-A150 PolarHBondContact O-N 3.41Å; V147-A150 PolarHBondContact O-N 3.06Å; A150-R152 VanDerWaalsContact C-N 3.3Å; A150-R152 PolarHBondContact O-N 3.03Å; A150-C153 VanDerWaalsContact O-CB 3.3Å; A150-C153 WeakPolarHBondContact O-CB 3.4Å; A150-C153 PolarHBondContact O-N 3.1Å; A150-Y154 PolarHBondContact O-N 3.34Å; A150-Y154 VanDerWaalsContact O-N 3.15Å; A150-I174 HydrophobicContact CB-CD1 4.45Å
151	T	91.5	Very high	89.7	Confident	18 Å²	18	40.9 Å²	40.9	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-38.5	174.8	64.2	0	0	0	0	110.8	V147 H148 C153 Y154 E155 L243 A245 T246	V147-T151 HydrophobicContact CG1-CG2 4.32Å; V147-T151 WeakPolarHBondContact O-CG2 3.4Å; V147-T151 PolarHBondContact O-N 2.96Å; V147-T151 PolarHBondContact O-OG1 3.13Å; H148-T151 PolarHBondContact O-OG1 2.96Å; T151-C153 VanDerWaalsContact C-N 3.34Å; T151-C153 PolarHBondContact O-N 2.96Å; T151-Y154 WeakPolarHBondContact O-CB 3.13Å; T151-Y154 PolarHBondContact O-N 2.78Å; T151-E155 WeakPolarHBondContact O-CG 3.3Å; T151-E155 PolarHBondContact O-N 3.31Å; T151-E155 VanDerWaalsContact O-N 3.09Å; T151-L243 HydrophobicContact CG2-CD2 3.68Å; T151-A245 HydrophobicContact CG2-CB 4.35Å; T151-T246 VanDerWaalsContact CB-OG1 3.31Å; T151-T246 WeakPolarHBondContact CB-OG1 3.29Å; T151-T246 PolarHBondContact OG1-OG1 2.84Å
152	R	88.9	Confident	88.9	Confident	45 Å²	45	48.6 Å²	48.6	17%	0.17	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-34.9	174.5	-171.8	55.2	-180	164.7	9.4	112.8	E73 H148 S149 A150 E155 I156 T246	E73-R152 WeakPolarHBondContact OE1-CG 3.33Å; E73-R152 IonicContact OE1-NE 3.62Å; E73-R152 PolarHBondContact OE1-NE 3.24Å; E73-R152 IonicContact OE2-CZ 3.05Å; E73-R152 VanDerWaalsContact OE2-CZ 3.24Å; E73-R152 IonicContact OE2-NE 3.87Å; E73-R152 PolarHBondContact OE2-NE 3.25Å; E73-R152 IonicContact OE2-NH2 2.67Å; E73-R152 PolarHBondContact OE2-NH2 3.42Å; H148-R152 VanDerWaalsContact O-CB 3.25Å; H148-R152 WeakPolarHBondContact O-CB 3.49Å; H148-R152 PolarHBondContact O-N 3.18Å; S149-R152 PolarHBondContact O-N 3.44Å; A150-R152 VanDerWaalsContact C-N 3.3Å; A150-R152 PolarHBondContact O-N 3.03Å; R152-E155 WeakPolarHBondContact CD-OE2 3.37Å; R152-E155 IonicContact CZ-OE2 2.78Å; R152-E155 IonicContact NE-OE2 3.67Å; R152-E155 IonicContact NH1-OE2 2.71Å; R152-E155 PolarHBondContact NH1-OE2 2.87Å; R152-E155 PolarHBondContact O-N 2.98Å; R152-I156 HydrophobicContact CG-CD1 3.81Å; R152-I156 WeakPolarHBondContact O-CD1 3.45Å; R152-I156 WeakPolarHBondContact O-CG1 3.28Å; R152-I156 PolarHBondContact O-N 3.24Å; R152-I156 VanDerWaalsContact O-N 3.07Å; R152-T246 HydrophobicContact CB-CG2 4.41Å
153	C	89.5	Confident	88.1	Confident	31 Å²	31	52 Å²	52	21%	0.209	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-46.8	171.7	-163	0	0	0	0	111.7	S149 A150 T151 I156 A157 I170	S149-C153 PolarHBondContact O-N 2.82Å; A150-C153 VanDerWaalsContact O-CB 3.3Å; A150-C153 WeakPolarHBondContact O-CB 3.4Å; A150-C153 PolarHBondContact O-N 3.1Å; T151-C153 VanDerWaalsContact C-N 3.34Å; T151-C153 PolarHBondContact O-N 2.96Å; C153-I156 PolarHBondContact O-N 3Å; C153-A157 WeakPolarHBondContact O-CB 3.5Å; C153-A157 PolarHBondContact O-N 3.44Å; C153-I170 HydrophobicContact CB-CD1 4.13Å; C153-I170 HydrophobicContact CB-CG2 3.84Å
154	Y	89	Confident	87.5	Confident	131 Å²	131	52.4 Å²	52.4	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-44.5	177.5	178	-92.6	0	0	0	112.2	A150 T151 I156 K158	A150-Y154 PolarHBondContact O-N 3.34Å; A150-Y154 VanDerWaalsContact O-N 3.15Å; T151-Y154 WeakPolarHBondContact O-CB 3.13Å; T151-Y154 PolarHBondContact O-N 2.78Å; Y154-I156 VanDerWaalsContact C-N 3.35Å; Y154-I156 PolarHBondContact O-N 3.1Å; Y154-K158 HydrophobicContact CE1-CD 3.88Å; Y154-K158 VanDerWaalsContact O-CB 3.27Å; Y154-K158 WeakPolarHBondContact O-CB 3.22Å; Y154-K158 PolarHBondContact O-N 2.83Å; Y154-K158 VanDerWaalsContact O-N 3.11Å; Y154-K158 PolarHBondContact OH-NZ 3.48Å
155	E	87	Confident	87.3	Confident	5 Å²	5	52.6 Å²	52.6	2%	0.023	29%	0.29	C	S	.	.	H	α-helix	trans	-58.4	-44.4	176.7	-69.4	174.7	179.6	0	0	112.4	T151 R152 K159 Y241 L243 T246	T151-E155 WeakPolarHBondContact O-CG 3.3Å; T151-E155 PolarHBondContact O-N 3.31Å; T151-E155 VanDerWaalsContact O-N 3.09Å; R152-E155 WeakPolarHBondContact CD-OE2 3.37Å; R152-E155 IonicContact CZ-OE2 2.78Å; R152-E155 IonicContact NE-OE2 3.67Å; R152-E155 IonicContact NH1-OE2 2.71Å; R152-E155 PolarHBondContact NH1-OE2 2.87Å; R152-E155 PolarHBondContact O-N 2.98Å; E155-K159 VanDerWaalsContact O-CB 3.29Å; E155-K159 WeakPolarHBondContact O-CB 3.49Å; E155-K159 PolarHBondContact O-N 3.09Å; E155-Y241 WeakPolarHBondContact CG-O 3.41Å; E155-L243 PolarHBondContact OE1-N 2.71Å; E155-T246 WeakPolarHBondContact OE1-CB 3.28Å; E155-T246 PolarHBondContact OE1-OG1 3.27Å
156	I	85.2	Confident	87	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-73.4	-47.2	-177.5	-68.3	160	0	0	0	111	E73 R152 C153 Y154 K158 K159 Y160 I170	E73-I156 HydrophobicContact CB-CD1 3.77Å; E73-I156 HydrophobicContact CG-CD1 3.86Å; R152-I156 HydrophobicContact CG-CD1 3.81Å; R152-I156 WeakPolarHBondContact O-CD1 3.45Å; R152-I156 WeakPolarHBondContact O-CG1 3.28Å; R152-I156 PolarHBondContact O-N 3.24Å; R152-I156 VanDerWaalsContact O-N 3.07Å; C153-I156 PolarHBondContact O-N 3Å; Y154-I156 VanDerWaalsContact C-N 3.35Å; Y154-I156 PolarHBondContact O-N 3.1Å; I156-K158 PolarHBondContact O-N 3.27Å; I156-K159 PolarHBondContact O-N 2.91Å; I156-K159 VanDerWaalsContact O-N 3.14Å; I156-Y160 WeakPolarHBondContact O-CA 3.26Å; I156-Y160 PolarHBondContact O-N 3.2Å; I156-I170 HydrophobicContact CD1-CD1 3.56Å
157	A	86.4	Confident	86.7	Confident	41 Å²	41	54 Å²	54	34%	0.339	30%	0.297	S	S	.	.	H	α-helix	trans	-57.8	-34.2	178	0	0	0	0	0	112.1	C153 P161 I167	C153-A157 WeakPolarHBondContact O-CB 3.5Å; C153-A157 PolarHBondContact O-N 3.44Å; A157-P161 WeakPolarHBondContact O-CA 3.49Å; A157-I167 HydrophobicContact CB-CD1 4.47Å
158	K	86.1	Confident	86.5	Confident	101 Å²	101	55.3 Å²	55.3	44%	0.439	30%	0.302	S	S	.	.	H	α-helix	trans	-81.3	-29.9	178.3	-163.6	171.2	-173.7	-179.5	0	114	Y154 I156 Y241	Y154-K158 HydrophobicContact CE1-CD 3.88Å; Y154-K158 VanDerWaalsContact O-CB 3.27Å; Y154-K158 WeakPolarHBondContact O-CB 3.22Å; Y154-K158 PolarHBondContact O-N 2.83Å; Y154-K158 VanDerWaalsContact O-N 3.11Å; Y154-K158 PolarHBondContact OH-NZ 3.48Å; I156-K158 PolarHBondContact O-N 3.27Å; K158-Y241 HydrophobicContact CD-CD1 3.56Å; K158-Y241 HydrophobicContact CD-CE1 4Å; K158-Y241 HydrophobicContact CD-CG 4.37Å; K158-Y241 HydrophobicContact CG-CD1 3.77Å; K158-Y241 HydrophobicContact CG-CE1 3.94Å; K158-Y241 HydrophobicContact CG-CG 4.34Å
159	K	82.7	Confident	86.6	Confident	60 Å²	60	55 Å²	55	26%	0.261	30%	0.3	S	S	.	.	H	α-helix	trans	-87.9	-30.5	178.9	-167.8	178.3	179.4	-156.1	0	113.1	E155 I156 H238 Y241	E155-K159 VanDerWaalsContact O-CB 3.29Å; E155-K159 WeakPolarHBondContact O-CB 3.49Å; E155-K159 PolarHBondContact O-N 3.09Å; I156-K159 PolarHBondContact O-N 2.91Å; I156-K159 VanDerWaalsContact O-N 3.14Å; K159-H238 PolarHBondContact NZ-CE1 3.49Å; K159-H238 VanDerWaalsContact NZ-CE1 3.33Å; K159-H238 PolarHBondContact NZ-NE2 2.87Å; K159-Y241 HydrophobicContact CB-CD2 4.33Å; K159-Y241 HydrophobicContact CG-CD2 4.45Å
160	Y	83.2	Confident	86.6	Confident	60 Å²	60	55 Å²	55	24%	0.235	30%	0.3	C	S	.	.			trans	-138.7	64.6	-170.7	-59.4	-69.8	0	0	0	111.5	V71 T74 I156 L162 H163	V71-Y160 HydrophobicContact CG2-CE2 4.29Å; T74-Y160 HydrophobicContact CG2-CD1 4.25Å; T74-Y160 HydrophobicContact CG2-CD2 3.72Å; T74-Y160 HydrophobicContact CG2-CE1 4.32Å; T74-Y160 HydrophobicContact CG2-CE2 3.8Å; T74-Y160 HydrophobicContact CG2-CG 3.96Å; I156-Y160 WeakPolarHBondContact O-CA 3.26Å; I156-Y160 PolarHBondContact O-N 3.2Å; Y160-L162 PolarHBondContact O-N 3.13Å; Y160-H163 PolarHBondContact O-N 2.77Å
161	P	77.4	Confident	86.6	Confident	104 Å²	104	58.8 Å²	58.8	68%	0.675	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-21.6	-170.4	24.7	-35.4	0	0	0	114.8	A157	A157-P161 WeakPolarHBondContact O-CA 3.49Å
162	L	75.6	Confident	86.8	Confident	164 Å²	164	60.4 Å²	60.4	86%	0.859	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.6	179.3	-69.6	164.6	0	0	0	114	Y160 A164	Y160-L162 PolarHBondContact O-N 3.13Å; L162-A164 PolarHBondContact O-N 3.29Å; L162-A164 VanDerWaalsContact O-N 3.15Å
163	H	78.8	Confident	87.1	Confident	75 Å²	75	58.8 Å²	58.8	35%	0.347	31%	0.308	S	S	.	.			trans	-91.2	66.8	-176.3	-73	-100.4	0	0	0	112.5	Y160 A165 S166	Y160-H163 PolarHBondContact O-N 2.77Å; H163-A165 PolarHBondContact O-N 3.1Å; H163-S166 WeakPolarHBondContact O-CB 3.37Å; H163-S166 PolarHBondContact O-N 3.39Å; H163-S166 VanDerWaalsContact O-N 3.1Å
164	A	82.7	Confident	87.5	Confident	62 Å²	62	59.2 Å²	59.2	51%	0.512	31%	0.308	S	S	.	.	H	α-helix	trans	-56.2	-33.9	179	0	0	0	0	0	113.6	L162 S166 I167 I168	L162-A164 PolarHBondContact O-N 3.29Å; L162-A164 VanDerWaalsContact O-N 3.15Å; A164-S166 VanDerWaalsContact C-N 3.27Å; A164-S166 PolarHBondContact O-N 2.85Å; A164-I167 WeakPolarHBondContact O-CB 3.25Å; A164-I167 PolarHBondContact O-N 3.33Å; A164-I167 VanDerWaalsContact O-N 3.12Å; A164-I168 PolarHBondContact O-N 2.94Å; A164-I168 VanDerWaalsContact O-N 3.16Å
165	A	87.4	Confident	87.8	Confident	43 Å²	43	55.5 Å²	55.5	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-59.9	-35.3	177.9	0	0	0	0	0	112.9	V79 H163 I167 I168 Y169	V79-A165 HydrophobicContact CG1-CB 3.94Å; V79-A165 WeakPolarHBondContact CG1-O 3.4Å; H163-A165 PolarHBondContact O-N 3.1Å; A165-I167 VanDerWaalsContact C-N 3.34Å; A165-I167 PolarHBondContact O-N 2.99Å; A165-I168 PolarHBondContact O-N 3.49Å; A165-Y169 PolarHBondContact O-N 3.35Å
166	S	87.4	Confident	88.3	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.014	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-36.8	176.7	-49.1	0	0	0	0	112	E73 H163 A164 Y169 I170	E73-S166 VanDerWaalsContact O-CB 3.3Å; E73-S166 WeakPolarHBondContact O-CB 3.35Å; E73-S166 PolarHBondContact O-OG 2.9Å; H163-S166 WeakPolarHBondContact O-CB 3.37Å; H163-S166 PolarHBondContact O-N 3.39Å; H163-S166 VanDerWaalsContact O-N 3.1Å; A164-S166 VanDerWaalsContact C-N 3.27Å; A164-S166 PolarHBondContact O-N 2.85Å; S166-Y169 PolarHBondContact O-N 3.39Å; S166-I170 WeakPolarHBondContact O-CD1 3.42Å; S166-I170 VanDerWaalsContact O-CG1 3.3Å; S166-I170 WeakPolarHBondContact O-CG1 3.24Å; S166-I170 PolarHBondContact O-N 3.5Å
167	I	89.2	Confident	88.9	Confident	70 Å²	70	55.1 Å²	55.1	36%	0.359	30%	0.295	S	S	.	.	H	α-helix	trans	-66.4	-42.9	176.4	-57.8	175.8	0	0	0	110	A157 A164 A165 Y169 I170 F171	A157-I167 HydrophobicContact CB-CD1 4.47Å; A164-I167 WeakPolarHBondContact O-CB 3.25Å; A164-I167 PolarHBondContact O-N 3.33Å; A164-I167 VanDerWaalsContact O-N 3.12Å; A165-I167 VanDerWaalsContact C-N 3.34Å; A165-I167 PolarHBondContact O-N 2.99Å; I167-Y169 PolarHBondContact O-N 3.44Å; I167-I170 PolarHBondContact O-N 3.43Å; I167-F171 PolarHBondContact O-N 2.81Å
168	I	91.5	Very high	89.3	Confident	89 Å²	89	57 Å²	57	46%	0.456	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-45	176.6	-64.9	168.4	0	0	0	111.2	A164 A165 I170 F171 F172	A164-I168 PolarHBondContact O-N 2.94Å; A164-I168 VanDerWaalsContact O-N 3.16Å; A165-I168 PolarHBondContact O-N 3.49Å; I168-I170 VanDerWaalsContact C-N 3.34Å; I168-I170 PolarHBondContact O-N 2.88Å; I168-F171 PolarHBondContact O-N 3.38Å; I168-F172 HydrophobicContact CG2-CD2 3.78Å; I168-F172 HydrophobicContact CG2-CE2 3.7Å; I168-F172 VanDerWaalsContact O-CD2 3.32Å; I168-F172 WeakPolarHBondContact O-CD2 3.3Å; I168-F172 PolarHBondContact O-N 3.28Å
169	Y	93.1	Very high	89.8	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-45	174.8	154.7	-102.4	0	0	0	112.3	E73 F78 Y82 F86 A165 S166 I167 F172 K173	E73-Y169 HydrophobicContact CG-CD1 4.5Å; E73-Y169 HydrophobicContact CG-CE1 3.95Å; F78-Y169 HydrophobicContact CE1-CE1 4.24Å; F78-Y169 HydrophobicContact CE1-CE2 4.14Å; F78-Y169 AromaticContact CE1-CZ 3.75Å; Y82-Y169 VanDerWaalsContact CB-CE2 3.5Å; Y82-Y169 HydrophobicContact CG-CE2 4.19Å; F86-Y169 HydrophobicContact CD2-CD2 4.4Å; F86-Y169 HydrophobicContact CD2-CE2 4.44Å; F86-Y169 AromaticContact CE2-CD2 3.84Å; F86-Y169 HydrophobicContact CE2-CD2 3.84Å; F86-Y169 AromaticContact CE2-CE2 3.48Å; F86-Y169 HydrophobicContact CE2-CE2 3.48Å; F86-Y169 VanDerWaalsContact CE2-CE2 3.48Å; F86-Y169 HydrophobicContact CZ-CE2 4.1Å; A165-Y169 PolarHBondContact O-N 3.35Å; S166-Y169 PolarHBondContact O-N 3.39Å; I167-Y169 PolarHBondContact O-N 3.44Å; Y169-F172 PolarHBondContact O-N 2.71Å; Y169-K173 HydrophobicContact CE1-CD 4.44Å; Y169-K173 WeakPolarHBondContact O-CB 3.3Å; Y169-K173 PolarHBondContact O-N 3.43Å; Y169-K173 PolarHBondContact OH-NZ 2.82Å
170	I	92.8	Very high	90.4	Very high	4 Å²	4	50 Å²	50	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-71.7	-36.4	-178.7	-60.3	163.8	0	0	0	111.4	S149 C153 I156 S166 I167 I168 K173 I174	S149-I170 WeakPolarHBondContact O-CG2 3.48Å; C153-I170 HydrophobicContact CB-CD1 4.13Å; C153-I170 HydrophobicContact CB-CG2 3.84Å; I156-I170 HydrophobicContact CD1-CD1 3.56Å; S166-I170 WeakPolarHBondContact O-CD1 3.42Å; S166-I170 VanDerWaalsContact O-CG1 3.3Å; S166-I170 WeakPolarHBondContact O-CG1 3.24Å; S166-I170 PolarHBondContact O-N 3.5Å; I167-I170 PolarHBondContact O-N 3.43Å; I168-I170 VanDerWaalsContact C-N 3.34Å; I168-I170 PolarHBondContact O-N 2.88Å; I170-K173 WeakPolarHBondContact O-CB 3.41Å; I170-K173 PolarHBondContact O-N 3.08Å; I170-I174 HydrophobicContact CG2-CD1 4.05Å; I170-I174 HydrophobicContact CG2-CG1 4.46Å; I170-I174 WeakPolarHBondContact O-CG1 3.47Å; I170-I174 PolarHBondContact O-N 2.84Å
171	F	94	Very high	90.9	Very high	125 Å²	125	47.9 Å²	47.9	55%	0.548	26%	0.262	S	S	.	.	H	α-helix	trans	-57	-50.1	171.9	174.1	-95.7	0	0	0	111.2	I167 I168 K173 I174 L175	I167-F171 PolarHBondContact O-N 2.81Å; I168-F171 PolarHBondContact O-N 3.38Å; F171-K173 VanDerWaalsContact C-N 3.32Å; F171-K173 PolarHBondContact O-N 3.23Å; F171-I174 PolarHBondContact O-N 3.09Å; F171-L175 HydrophobicContact CE1-CD2 4.3Å; F171-L175 WeakPolarHBondContact O-CB 3.48Å; F171-L175 PolarHBondContact O-N 2.76Å
172	F	95.9	Very high	91.7	Very high	52 Å²	52	46.2 Å²	46.2	23%	0.228	25%	0.25	C	C	.	.	H	α-helix	trans	-67.1	-30.4	176.1	-76.3	-64.3	0	0	0	113.2	T83 F86 V87 I90 I168 Y169 L175 F176	T83-F172 HydrophobicContact CG2-CD2 3.74Å; T83-F172 HydrophobicContact CG2-CE2 4.27Å; T83-F172 HydrophobicContact CG2-CG 4.45Å; F86-F172 HydrophobicContact CB-CB 4.06Å; F86-F172 HydrophobicContact CD2-CB 4.29Å; V87-F172 HydrophobicContact CG2-CD1 3.64Å; V87-F172 HydrophobicContact CG2-CD2 3.98Å; V87-F172 HydrophobicContact CG2-CE1 3.65Å; V87-F172 HydrophobicContact CG2-CE2 3.97Å; V87-F172 HydrophobicContact CG2-CG 3.82Å; V87-F172 HydrophobicContact CG2-CZ 3.81Å; I90-F172 HydrophobicContact CD1-CD1 4.05Å; I168-F172 HydrophobicContact CG2-CD2 3.78Å; I168-F172 HydrophobicContact CG2-CE2 3.7Å; I168-F172 VanDerWaalsContact O-CD2 3.32Å; I168-F172 WeakPolarHBondContact O-CD2 3.3Å; I168-F172 PolarHBondContact O-N 3.28Å; Y169-F172 PolarHBondContact O-N 2.71Å; F172-L175 HydrophobicContact CD1-CD2 4.29Å; F172-L175 HydrophobicContact CE1-CD2 4.44Å; F172-L175 PolarHBondContact O-N 2.73Å; F172-F176 VanDerWaalsContact O-CB 3.23Å; F172-F176 WeakPolarHBondContact O-CB 3.29Å; F172-F176 PolarHBondContact O-N 2.74Å
173	K	95.5	Very high	92.5	Very high	11 Å²	11	38.4 Å²	38.4	5%	0.048	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-44.5	172.3	-165.9	169.3	-170.6	165.6	0	111.9	F86 Y169 I170 F171 F176 F177 D216	F86-K173 HydrophobicContact CD2-CB 4.01Å; F86-K173 HydrophobicContact CE2-CB 3.52Å; F86-K173 HydrophobicContact CE2-CD 4.16Å; F86-K173 HydrophobicContact CE2-CG 3.73Å; F86-K173 HydrophobicContact CZ-CB 4.17Å; F86-K173 HydrophobicContact CZ-CD 4.21Å; F86-K173 HydrophobicContact CZ-CG 3.86Å; Y169-K173 HydrophobicContact CE1-CD 4.44Å; Y169-K173 WeakPolarHBondContact O-CB 3.3Å; Y169-K173 PolarHBondContact O-N 3.43Å; Y169-K173 PolarHBondContact OH-NZ 2.82Å; I170-K173 WeakPolarHBondContact O-CB 3.41Å; I170-K173 PolarHBondContact O-N 3.08Å; F171-K173 VanDerWaalsContact C-N 3.32Å; F171-K173 PolarHBondContact O-N 3.23Å; K173-F176 PolarHBondContact O-N 3.28Å; K173-F177 HydrophobicContact CG-CD2 4.36Å; K173-F177 HydrophobicContact CG-CE2 3.82Å; K173-F177 WeakPolarHBondContact O-CD2 3.19Å; K173-F177 PolarHBondContact O-N 2.9Å; K173-F177 VanDerWaalsContact O-N 3.14Å; K173-D216 IonicContact NZ-OD2 3.92Å; K173-D216 PolarHBondContact NZ-OD2 3.01Å
174	I	96.2	Very high	93	Very high	40 Å²	40	34.9 Å²	34.9	21%	0.205	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-47	175.8	-69.8	167.9	0	0	0	110.4	I146 A150 I170 F171 F176 F177 I178	I146-I174 HydrophobicContact CG2-CG2 4.09Å; A150-I174 HydrophobicContact CB-CD1 4.45Å; I170-I174 HydrophobicContact CG2-CD1 4.05Å; I170-I174 HydrophobicContact CG2-CG1 4.46Å; I170-I174 WeakPolarHBondContact O-CG1 3.47Å; I170-I174 PolarHBondContact O-N 2.84Å; F171-I174 PolarHBondContact O-N 3.09Å; I174-F176 VanDerWaalsContact C-N 3.29Å; I174-F176 PolarHBondContact O-N 2.95Å; I174-F177 PolarHBondContact O-N 3Å; I174-I178 HydrophobicContact CG2-CD1 3.92Å; I174-I178 WeakPolarHBondContact O-CG1 3.25Å; I174-I178 PolarHBondContact O-N 3.45Å; I174-I178 VanDerWaalsContact O-N 3.09Å
175	L	96.3	Very high	93.3	Very high	54 Å²	54	34.8 Å²	34.8	28%	0.283	18%	0.183	S	C	.	.	H	α-helix	trans	-60.7	-39.3	177.8	-174.6	58.2	0	0	0	111.7	I90 F171 F172 I178 T179	I90-L175 HydrophobicContact CD1-CB 4.05Å; I90-L175 HydrophobicContact CD1-CD2 4.08Å; I90-L175 HydrophobicContact CD1-CG 3.9Å; I90-L175 HydrophobicContact CG2-CD2 4.33Å; I90-L175 HydrophobicContact CG2-CG 4.43Å; F171-L175 HydrophobicContact CE1-CD2 4.3Å; F171-L175 WeakPolarHBondContact O-CB 3.48Å; F171-L175 PolarHBondContact O-N 2.76Å; F172-L175 HydrophobicContact CD1-CD2 4.29Å; F172-L175 HydrophobicContact CE1-CD2 4.44Å; F172-L175 PolarHBondContact O-N 2.73Å; L175-I178 PolarHBondContact O-N 3.01Å; L175-T179 WeakPolarHBondContact O-CB 3.32Å; L175-T179 PolarHBondContact O-N 3.27Å; L175-T179 PolarHBondContact O-OG1 3.3Å
176	F	97.4	Very high	93.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-48.8	173.5	172	-91.4	0	0	0	112.1	F86 I90 M93 F172 K173 I174 I178 T179 Q180 V209 I213	F86-F176 HydrophobicContact CB-CB 4.23Å; F86-F176 HydrophobicContact CD1-CB 4.2Å; F86-F176 HydrophobicContact CD1-CD1 4.38Å; F86-F176 HydrophobicContact CD1-CD2 4.1Å; F86-F176 AromaticContact CD1-CG 3.97Å; F86-F176 HydrophobicContact CD1-CG 3.97Å; F86-F176 HydrophobicContact CG-CB 4.25Å; F86-F176 HydrophobicContact CG-CG 4.49Å; I90-F176 HydrophobicContact CD1-CB 4.13Å; I90-F176 HydrophobicContact CG1-CB 4.24Å; M93-F176 HydrophobicContact CE-CD2 4.02Å; M93-F176 HydrophobicContact CE-CE2 4.2Å; F172-F176 VanDerWaalsContact O-CB 3.23Å; F172-F176 WeakPolarHBondContact O-CB 3.29Å; F172-F176 PolarHBondContact O-N 2.74Å; K173-F176 PolarHBondContact O-N 3.28Å; I174-F176 VanDerWaalsContact C-N 3.29Å; I174-F176 PolarHBondContact O-N 2.95Å; F176-I178 VanDerWaalsContact C-N 3.3Å; F176-I178 PolarHBondContact O-N 3.09Å; F176-T179 PolarHBondContact O-N 2.85Å; F176-Q180 WeakPolarHBondContact O-CB 3.35Å; F176-Q180 PolarHBondContact O-N 3.06Å; F176-V209 HydrophobicContact CE2-CG1 3.73Å; F176-V209 HydrophobicContact CZ-CG1 3.75Å; F176-I213 HydrophobicContact CD1-CD1 3.94Å; F176-I213 HydrophobicContact CE1-CD1 3.31Å; F176-I213 HydrophobicContact CZ-CD1 3.87Å
177	F	96.5	Very high	92.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-39.2	177.4	-73.6	-56.1	0	0	0	112.5	I146 K173 I174 T181 I213 V253 Y256	I146-F177 HydrophobicContact CD1-CB 4.24Å; I146-F177 HydrophobicContact CG1-CB 3.84Å; K173-F177 HydrophobicContact CG-CD2 4.36Å; K173-F177 HydrophobicContact CG-CE2 3.82Å; K173-F177 WeakPolarHBondContact O-CD2 3.19Å; K173-F177 PolarHBondContact O-N 2.9Å; K173-F177 VanDerWaalsContact O-N 3.14Å; I174-F177 PolarHBondContact O-N 3Å; F177-T181 VanDerWaalsContact O-CB 3.22Å; F177-T181 WeakPolarHBondContact O-CB 3.24Å; F177-T181 PolarHBondContact O-N 3.4Å; F177-T181 VanDerWaalsContact O-N 3.13Å; F177-T181 PolarHBondContact O-OG1 3.21Å; F177-I213 HydrophobicContact CZ-CG2 4.43Å; F177-V253 HydrophobicContact CZ-CG1 4.27Å; F177-Y256 AromaticContact CD1-CD1 3.69Å; F177-Y256 HydrophobicContact CD1-CD1 3.69Å; F177-Y256 AromaticContact CD1-CE1 3.46Å; F177-Y256 HydrophobicContact CD1-CE1 3.46Å; F177-Y256 VanDerWaalsContact CD1-CE1 3.46Å; F177-Y256 HydrophobicContact CD1-CG 4.44Å; F177-Y256 AromaticContact CE1-CD1 3.56Å; F177-Y256 HydrophobicContact CE1-CD1 3.56Å; F177-Y256 AromaticContact CE1-CE1 3.76Å; F177-Y256 HydrophobicContact CE1-CE1 3.76Å; F177-Y256 HydrophobicContact CE1-CG 4.39Å
178	I	96.3	Very high	92.1	Very high	79 Å²	79	35 Å²	35	41%	0.405	18%	0.178	S	C	.	.	H	α-helix	trans	-66.8	-56.2	176.6	-63.8	167.1	0	0	0	110.2	I146 I174 L175 F176 Q180 T181 V182	I146-I178 HydrophobicContact CD1-CD1 4.48Å; I146-I178 HydrophobicContact CD1-CG1 3.67Å; I174-I178 HydrophobicContact CG2-CD1 3.92Å; I174-I178 WeakPolarHBondContact O-CG1 3.25Å; I174-I178 PolarHBondContact O-N 3.45Å; I174-I178 VanDerWaalsContact O-N 3.09Å; L175-I178 PolarHBondContact O-N 3.01Å; F176-I178 VanDerWaalsContact C-N 3.3Å; F176-I178 PolarHBondContact O-N 3.09Å; I178-Q180 PolarHBondContact O-N 3.48Å; I178-T181 PolarHBondContact O-N 3.37Å; I178-V182 WeakPolarHBondContact O-CG2 3.27Å; I178-V182 PolarHBondContact O-N 3.42Å
179	T	95.6	Very high	90.9	Very high	15 Å²	15	35.6 Å²	35.6	9%	0.092	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-42.5	-177.1	-55.7	0	0	0	0	111.7	M93 I94 L175 F176 V182 F183	M93-T179 HydrophobicContact CB-CG2 3.85Å; M93-T179 HydrophobicContact CE-CG2 3.89Å; M93-T179 HydrophobicContact SD-CG2 4.46Å; I94-T179 HydrophobicContact CG1-CG2 3.95Å; L175-T179 WeakPolarHBondContact O-CB 3.32Å; L175-T179 PolarHBondContact O-N 3.27Å; L175-T179 PolarHBondContact O-OG1 3.3Å; F176-T179 PolarHBondContact O-N 2.85Å; T179-V182 PolarHBondContact O-N 3.24Å; T179-F183 VanDerWaalsContact O-CB 3.25Å; T179-F183 WeakPolarHBondContact O-CB 3.45Å; T179-F183 PolarHBondContact O-N 2.93Å
180	Q	95.8	Very high	89.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-39.9	177.9	-176.1	173.9	-80.3	0	0	112.2	M93 F176 I178 V182 F183 L184 N210 Y256 A260	M93-Q180 HydrophobicContact CE-CB 4.03Å; M93-Q180 VanDerWaalsContact SD-CA 3.55Å; M93-Q180 HydrophobicContact SD-CB 3.79Å; M93-Q180 HydrophobicContact SD-CG 4.13Å; F176-Q180 WeakPolarHBondContact O-CB 3.35Å; F176-Q180 PolarHBondContact O-N 3.06Å; I178-Q180 PolarHBondContact O-N 3.48Å; Q180-V182 PolarHBondContact O-N 3.2Å; Q180-F183 WeakPolarHBondContact O-CB 3.43Å; Q180-F183 PolarHBondContact O-N 2.97Å; Q180-L184 HydrophobicContact CG-CD1 3.94Å; Q180-L184 HydrophobicContact CG-CG 4.12Å; Q180-L184 WeakPolarHBondContact O-CB 3.48Å; Q180-L184 VanDerWaalsContact O-CG 3.31Å; Q180-L184 WeakPolarHBondContact O-CG 3.3Å; Q180-L184 PolarHBondContact O-N 3.41Å; Q180-N210 PolarHBondContact NE2-ND2 2.9Å; Q180-N210 PolarHBondContact NE2-OD1 3.4Å; Q180-N210 PolarHBondContact OE1-ND2 2.76Å; Q180-Y256 WeakPolarHBondContact CG-OH 3.4Å; Q180-Y256 PolarHBondContact NE2-OH 3.04Å; Q180-Y256 VanDerWaalsContact NE2-OH 3.13Å; Q180-A260 VanDerWaalsContact NE2-CB 3.33Å
181	T	94.4	Very high	88.4	Confident	16 Å²	16	35.9 Å²	35.9	10%	0.098	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-44.6	177.5	-62.4	0	0	0	0	111	I138 A142 F177 I178 L185 Y256	I138-T181 HydrophobicContact CG2-CG2 4.05Å; A142-T181 HydrophobicContact CB-CG2 4.13Å; A142-T181 WeakPolarHBondContact CB-OG1 3.36Å; F177-T181 VanDerWaalsContact O-CB 3.22Å; F177-T181 WeakPolarHBondContact O-CB 3.24Å; F177-T181 PolarHBondContact O-N 3.4Å; F177-T181 VanDerWaalsContact O-N 3.13Å; F177-T181 PolarHBondContact O-OG1 3.21Å; I178-T181 PolarHBondContact O-N 3.37Å; T181-L185 HydrophobicContact CG2-CD1 3.81Å; T181-L185 HydrophobicContact CG2-CG 4.42Å; T181-L185 VanDerWaalsContact O-CB 3.28Å; T181-L185 WeakPolarHBondContact O-CB 3.27Å; T181-L185 WeakPolarHBondContact O-CG 3.45Å; T181-L185 PolarHBondContact O-N 2.96Å; T181-Y256 PolarHBondContact N-OH 2.84Å; T181-Y256 PolarHBondContact OG1-OH 2.77Å
182	V	92.7	Very high	87.1	Confident	68 Å²	68	30.1 Å²	30.1	41%	0.412	15%	0.151	S	C	.	.	H	α-helix	trans	-61.9	-44.8	172.9	173.7	0	0	0	0	111.4	L97 I178 T179 Q180 L185 L186	L97-V182 HydrophobicContact CD1-CG1 4.49Å; I178-V182 WeakPolarHBondContact O-CG2 3.27Å; I178-V182 PolarHBondContact O-N 3.42Å; T179-V182 PolarHBondContact O-N 3.24Å; Q180-V182 PolarHBondContact O-N 3.2Å; V182-L185 PolarHBondContact O-N 3.5Å; V182-L186 HydrophobicContact CG1-CD1 3.63Å; V182-L186 HydrophobicContact CG1-CG 4.28Å; V182-L186 WeakPolarHBondContact O-CB 3.37Å; V182-L186 VanDerWaalsContact O-CG 3.3Å; V182-L186 WeakPolarHBondContact O-CG 3.3Å; V182-L186 PolarHBondContact O-N 3.27Å
183	F	92.4	Very high	85.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-51	177.4	177.8	-90.7	0	0	0	112	M93 T96 L97 T179 Q180 L186 L187 F199 L203 I206	M93-F183 HydrophobicContact CB-CB 4.42Å; M93-F183 HydrophobicContact CB-CD2 3.77Å; M93-F183 HydrophobicContact CB-CE2 4.3Å; M93-F183 HydrophobicContact CB-CG 4.24Å; M93-F183 HydrophobicContact CG-CB 4.31Å; M93-F183 HydrophobicContact CG-CD1 4.36Å; M93-F183 HydrophobicContact CG-CD2 3.73Å; M93-F183 HydrophobicContact CG-CE2 4.06Å; M93-F183 HydrophobicContact CG-CG 3.9Å; M93-F183 HydrophobicContact CG-CZ 4.5Å; M93-F183 HydrophobicContact SD-CB 3.97Å; M93-F183 HydrophobicContact SD-CD1 4.27Å; M93-F183 HydrophobicContact SD-CD2 4.44Å; M93-F183 HydrophobicContact SD-CG 4Å; T96-F183 HydrophobicContact CG2-CE2 3.9Å; L97-F183 HydrophobicContact CD1-CB 4.25Å; L97-F183 HydrophobicContact CD1-CD2 4.32Å; L97-F183 HydrophobicContact CG-CD2 4.1Å; T179-F183 VanDerWaalsContact O-CB 3.25Å; T179-F183 WeakPolarHBondContact O-CB 3.45Å; T179-F183 PolarHBondContact O-N 2.93Å; Q180-F183 WeakPolarHBondContact O-CB 3.43Å; Q180-F183 PolarHBondContact O-N 2.97Å; F183-L186 PolarHBondContact O-N 2.8Å; F183-L187 HydrophobicContact CD2-CD1 3.76Å; F183-L187 HydrophobicContact CD2-CD2 4.32Å; F183-L187 HydrophobicContact CE1-CD2 4.31Å; F183-L187 HydrophobicContact CE2-CD1 3.96Å; F183-L187 HydrophobicContact CE2-CD2 3.66Å; F183-L187 HydrophobicContact CE2-CG 4.42Å; F183-L187 HydrophobicContact CG-CD1 4.17Å; F183-L187 HydrophobicContact CZ-CD2 3.67Å; F183-L187 WeakPolarHBondContact O-CB 3.46Å; F183-L187 VanDerWaalsContact O-CD1 3.27Å; F183-L187 WeakPolarHBondContact O-CD1 3.28Å; F183-L187 PolarHBondContact O-N 3.1Å; F183-F199 HydrophobicContact CZ-CE2 4.25Å; F183-L203 HydrophobicContact CE1-CD2 3.88Å; F183-L203 HydrophobicContact CZ-CD2 3.89Å; F183-I206 HydrophobicContact CE1-CD1 3.99Å; F183-I206 HydrophobicContact CZ-CD1 3.93Å
184	L	90.8	Very high	84	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-66.2	-41.8	179.2	-64.3	176.7	0	0	0	112	I138 Q180 L186 H188 A260 V263 V264 L267	I138-L184 HydrophobicContact CD1-CB 4.34Å; I138-L184 HydrophobicContact CD1-CD1 4.37Å; I138-L184 HydrophobicContact CG2-CD1 4.34Å; Q180-L184 HydrophobicContact CG-CD1 3.94Å; Q180-L184 HydrophobicContact CG-CG 4.12Å; Q180-L184 WeakPolarHBondContact O-CB 3.48Å; Q180-L184 VanDerWaalsContact O-CG 3.31Å; Q180-L184 WeakPolarHBondContact O-CG 3.3Å; Q180-L184 PolarHBondContact O-N 3.41Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 3.38Å; L184-H188 WeakPolarHBondContact O-CB 3.39Å; L184-H188 PolarHBondContact O-N 3.27Å; L184-A260 HydrophobicContact CD1-CB 4.01Å; L184-V263 HydrophobicContact CD2-CG1 4.11Å; L184-V264 HydrophobicContact CD2-CG2 3.64Å; L184-L267 HydrophobicContact CD2-CD1 4.08Å
185	L	87.8	Confident	83	Confident	60 Å²	60	34.1 Å²	34.1	31%	0.314	16%	0.164	S	C	.	.	H	α-helix	trans	-67.4	-28.4	178.3	-70.6	175.5	0	0	0	113.1	R135 T181 V182 H188	R135-L185 HydrophobicContact CB-CD2 3.57Å; R135-L185 HydrophobicContact CG-CD2 3.91Å; T181-L185 HydrophobicContact CG2-CD1 3.81Å; T181-L185 HydrophobicContact CG2-CG 4.42Å; T181-L185 VanDerWaalsContact O-CB 3.28Å; T181-L185 WeakPolarHBondContact O-CB 3.27Å; T181-L185 WeakPolarHBondContact O-CG 3.45Å; T181-L185 PolarHBondContact O-N 2.96Å; V182-L185 PolarHBondContact O-N 3.5Å; L185-H188 PolarHBondContact O-CE1 2.96Å; L185-H188 VanDerWaalsContact O-CE1 3.28Å; L185-H188 PolarHBondContact O-ND1 3.43Å
186	L	84.8	Confident	82.1	Confident	101 Å²	101	33.3 Å²	33.3	53%	0.529	16%	0.16	S	C	.	.	H	α-helix	trans	-88.5	-42.8	176.6	-67.9	176.6	0	0	0	113	L97 V182 F183 L184 H188	L97-L186 HydrophobicContact CD2-CB 4.06Å; L97-L186 HydrophobicContact CD2-CD1 3.69Å; V182-L186 HydrophobicContact CG1-CD1 3.63Å; V182-L186 HydrophobicContact CG1-CG 4.28Å; V182-L186 WeakPolarHBondContact O-CB 3.37Å; V182-L186 VanDerWaalsContact O-CG 3.3Å; V182-L186 WeakPolarHBondContact O-CG 3.3Å; V182-L186 PolarHBondContact O-N 3.27Å; F183-L186 PolarHBondContact O-N 2.8Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 3.38Å; L186-H188 PolarHBondContact O-N 3.41Å
187	L	81.2	Confident	81.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-81.3	-6.1	-175.4	-82	82.1	0	0	0	114.6	T96 L97 F183 R189 I190 I192 F199 L267	T96-L187 HydrophobicContact CG2-CD2 4.06Å; L97-L187 HydrophobicContact CD2-CD1 3.48Å; L97-L187 VanDerWaalsContact CD2-CD1 3.48Å; L97-L187 HydrophobicContact CG-CD1 4.17Å; F183-L187 HydrophobicContact CD2-CD1 3.76Å; F183-L187 HydrophobicContact CD2-CD2 4.32Å; F183-L187 HydrophobicContact CE1-CD2 4.31Å; F183-L187 HydrophobicContact CE2-CD1 3.96Å; F183-L187 HydrophobicContact CE2-CD2 3.66Å; F183-L187 HydrophobicContact CE2-CG 4.42Å; F183-L187 HydrophobicContact CG-CD1 4.17Å; F183-L187 HydrophobicContact CZ-CD2 3.67Å; F183-L187 WeakPolarHBondContact O-CB 3.46Å; F183-L187 VanDerWaalsContact O-CD1 3.27Å; F183-L187 WeakPolarHBondContact O-CD1 3.28Å; F183-L187 PolarHBondContact O-N 3.1Å; L187-R189 PolarHBondContact O-N 3.19Å; L187-I190 HydrophobicContact CG-CD1 4.27Å; L187-I190 WeakPolarHBondContact O-CB 3.18Å; L187-I190 PolarHBondContact O-N 3.01Å; L187-I192 HydrophobicContact CD2-CD1 4.34Å; L187-F199 HydrophobicContact CD2-CE2 3.98Å; L187-F199 HydrophobicContact CD2-CZ 3.9Å; L187-L267 WeakPolarHBondContact O-CD2 3.44Å
188	H	73.7	Confident	80.7	Confident	17 Å²	17	43.4 Å²	43.4	8%	0.079	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-28.8	-173.9	72.2	-81.2	0	0	0	116	D129 V130 R135 L184 L185 L186 R270	D129-H188 IonicContact OD1-CD2 3.97Å; D129-H188 IonicContact OD1-NE2 2.78Å; V130-H188 HydrophobicContact CB-CB 3.9Å; V130-H188 HydrophobicContact CG2-CB 3.79Å; R135-H188 PolarHBondContact NH1-CE1 2.71Å; R135-H188 PolarHBondContact NH1-NE2 3.41Å; R135-H188 PolarHBondContact NH2-CD2 3.25Å; R135-H188 VanDerWaalsContact NH2-CD2 3.28Å; R135-H188 PolarHBondContact NH2-NE2 3.1Å; L184-H188 WeakPolarHBondContact O-CB 3.39Å; L184-H188 PolarHBondContact O-N 3.27Å; L185-H188 PolarHBondContact O-CE1 2.96Å; L185-H188 VanDerWaalsContact O-CE1 3.28Å; L185-H188 PolarHBondContact O-ND1 3.43Å; L186-H188 PolarHBondContact O-N 3.41Å; H188-R270 PolarHBondContact O-NH1 3.33Å
189	R	66	Low	80.2	Confident	102 Å²	102	40.2 Å²	40.2	39%	0.385	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4	174.5	-49.4	-168	154.4	160.5	-10.4	114.3	F125 R126 G127 D129 L187 V191	F125-R189 CarbonylContact C-O 3.59Å; F125-R189 VanDerWaalsContact O-CB 3.28Å; F125-R189 WeakPolarHBondContact O-CB 3.5Å; R126-R189 PolarHBondContact N-O 3.06Å; G127-R189 WeakPolarHBondContact CA-O 3.45Å; G127-R189 PolarHBondContact N-O 2.54Å; D129-R189 IonicContact OD1-CZ 3.23Å; D129-R189 IonicContact OD1-NE 3.48Å; D129-R189 PolarHBondContact OD1-NE 3.09Å; D129-R189 IonicContact OD1-NH2 3.81Å; D129-R189 PolarHBondContact OD1-NH2 2.83Å; D129-R189 IonicContact OD2-CZ 2.71Å; D129-R189 IonicContact OD2-NE 2.96Å; D129-R189 IonicContact OD2-NH2 3.72Å; D129-R189 PolarHBondContact OD2-NH2 3.26Å; L187-R189 PolarHBondContact O-N 3.19Å; R189-V191 PolarHBondContact O-N 3.35Å
190	I	67.6	Low	79.7	Confident	10 Å²	10	39.6 Å²	39.6	5%	0.051	18%	0.183	C	C	.	.			trans	-92.2	110	-162.1	-55.4	-169.7	0	0	0	110.5	V100 F123 S124 F125 L187 I192	V100-I190 HydrophobicContact CG1-CD1 3.53Å; F123-I190 HydrophobicContact CB-CG2 3.97Å; F123-I190 HydrophobicContact CD1-CG2 3.62Å; F123-I190 HydrophobicContact CE1-CG2 4.45Å; F123-I190 HydrophobicContact CG-CG2 3.98Å; S124-I190 WeakPolarHBondContact O-CA 3.31Å; F125-I190 HydrophobicContact CD1-CD1 4.01Å; F125-I190 HydrophobicContact CD1-CG1 3.93Å; F125-I190 HydrophobicContact CE1-CD1 3.48Å; F125-I190 VanDerWaalsContact CE1-CD1 3.48Å; F125-I190 HydrophobicContact CE1-CG1 3.93Å; F125-I190 HydrophobicContact CZ-CD1 3.96Å; L187-I190 HydrophobicContact CG-CD1 4.27Å; L187-I190 WeakPolarHBondContact O-CB 3.18Å; L187-I190 PolarHBondContact O-N 3.01Å; I190-I192 HydrophobicContact CG2-CD1 4.39Å; I190-I192 HydrophobicContact CG2-CG1 4.06Å
191	V	64.9	Low	79.4	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	114	172.2	-176.4	0	0	0	0	108.6	F123 S124 R189 L193 Q273 Q276	F123-V191 WeakPolarHBondContact CA-O 3.46Å; S124-V191 PolarHBondContact N-O 2.98Å; S124-V191 VanDerWaalsContact N-O 3.1Å; S124-V191 PolarHBondContact O-N 3.13Å; R189-V191 PolarHBondContact O-N 3.35Å; V191-L193 HydrophobicContact CG1-CD2 4.11Å; V191-L193 HydrophobicContact CG1-CG 4.49Å; V191-Q273 WeakPolarHBondContact CG1-O 3.23Å; V191-Q276 HydrophobicContact CG2-CB 3.94Å
192	I	67.2	Low	79.2	Confident	4 Å²	4	43 Å²	43	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	112.5	-176	-54.6	-151.1	0	0	0	109.9	F123 L187 I190 V194 F199 V271 G272	F123-I192 HydrophobicContact CD1-CB 4.11Å; F123-I192 HydrophobicContact CD1-CD1 4.02Å; F123-I192 HydrophobicContact CD1-CG1 3.67Å; F123-I192 HydrophobicContact CD1-CG2 4.3Å; F123-I192 HydrophobicContact CE1-CB 3.83Å; F123-I192 HydrophobicContact CE1-CD1 3.42Å; F123-I192 VanDerWaalsContact CE1-CD1 3.42Å; F123-I192 HydrophobicContact CE1-CG1 3.47Å; F123-I192 VanDerWaalsContact CE1-CG1 3.47Å; F123-I192 HydrophobicContact CE1-CG2 3.61Å; F123-I192 HydrophobicContact CZ-CD1 4.32Å; L187-I192 HydrophobicContact CD2-CD1 4.34Å; I190-I192 HydrophobicContact CG2-CD1 4.39Å; I190-I192 HydrophobicContact CG2-CG1 4.06Å; I192-V194 WeakPolarHBondContact CG2-O 3.28Å; I192-F199 HydrophobicContact CB-CD1 3.56Å; I192-F199 HydrophobicContact CB-CE1 3.88Å; I192-F199 HydrophobicContact CB-CG 4.23Å; I192-F199 HydrophobicContact CD1-CD1 3.42Å; I192-F199 VanDerWaalsContact CD1-CD1 3.42Å; I192-F199 HydrophobicContact CD1-CD2 3.64Å; I192-F199 HydrophobicContact CD1-CE1 3.22Å; I192-F199 HydrophobicContact CD1-CE2 3.47Å; I192-F199 VanDerWaalsContact CD1-CE2 3.47Å; I192-F199 HydrophobicContact CD1-CG 3.62Å; I192-F199 HydrophobicContact CD1-CZ 3.26Å; I192-F199 HydrophobicContact CG1-CD1 3.64Å; I192-F199 HydrophobicContact CG1-CE1 3.47Å; I192-F199 VanDerWaalsContact CG1-CE1 3.47Å; I192-F199 HydrophobicContact CG1-CG 4.27Å; I192-F199 HydrophobicContact CG1-CZ 4Å; I192-F199 HydrophobicContact CG2-CB 3.96Å; I192-F199 HydrophobicContact CG2-CD1 3.75Å; I192-F199 HydrophobicContact CG2-CG 3.96Å; I192-V271 HydrophobicContact CB-CG1 4.39Å; I192-G272 PolarHBondContact O-N 2.78Å
193	L	62.4	Low	79.1	Confident	27 Å²	27	39.8 Å²	39.8	14%	0.141	18%	0.177	C	C	.	.			trans	-101.8	-21.7	-176.1	-58.9	164.7	0	0	0	111.5	I121 A122 V191 I196 L274 I277	I121-L193 HydrophobicContact CB-CD1 4.31Å; I121-L193 HydrophobicContact CG2-CD1 3.97Å; A122-L193 PolarHBondContact O-N 2.91Å; V191-L193 HydrophobicContact CG1-CD2 4.11Å; V191-L193 HydrophobicContact CG1-CG 4.49Å; L193-I196 WeakPolarHBondContact O-CD1 3.32Å; L193-L274 HydrophobicContact CD2-CD1 3.87Å; L193-L274 HydrophobicContact CD2-CG 4.11Å; L193-I277 HydrophobicContact CD1-CD1 3.42Å; L193-I277 VanDerWaalsContact CD1-CD1 3.42Å; L193-I277 HydrophobicContact CD1-CG1 4.24Å; L193-I277 HydrophobicContact CD2-CD1 4.08Å; L193-I277 HydrophobicContact CG-CD1 4.38Å
194	V	64.5	Low	79.1	Confident	8 Å²	8	40.4 Å²	40.4	5%	0.048	18%	0.181	C	C	.	.	S	Bend	trans	-106	145	-178.2	174	0	0	0	0	111.3	R120 A122 I192 I196	R120-V194 HydrophobicContact CB-CG2 3.21Å; R120-V194 HydrophobicContact CG-CG2 3.66Å; A122-V194 HydrophobicContact CB-CG2 4.29Å; I192-V194 WeakPolarHBondContact CG2-O 3.28Å; V194-I196 PolarHBondContact O-N 3.08Å
195	R	75.1	Confident	79.2	Confident	151 Å²	151	40.7 Å²	40.7	57%	0.57	18%	0.182	S	C	*	.	S	Bend	trans	50	32.7	-179	-66.5	173.9	-174.7	-128	3.5	113	R197 I198 F199	R195-R197 PolarHBondContact O-N 2.85Å; R195-I198 HydrophobicContact CB-CB 4.44Å; R195-I198 HydrophobicContact CB-CD1 4.36Å; R195-I198 HydrophobicContact CG-CD1 4.42Å; R195-I198 PolarHBondContact O-N 3.41Å; R195-F199 PolarHBondContact O-N 3.26Å
196	I	77.1	Confident	79.6	Confident	38 Å²	38	37.8 Å²	37.8	20%	0.195	17%	0.167	C	C	.	.	H	α-helix	trans	-36.7	-47.4	176.5	-69.2	161.1	0	0	0	112.1	L193 V194 I198 F199 S200 V271	L193-I196 WeakPolarHBondContact O-CD1 3.32Å; V194-I196 PolarHBondContact O-N 3.08Å; I196-I198 PolarHBondContact O-N 3.45Å; I196-F199 PolarHBondContact O-N 2.71Å; I196-S200 VanDerWaalsContact O-CB 3.29Å; I196-S200 WeakPolarHBondContact O-CB 3.11Å; I196-S200 PolarHBondContact O-N 2.88Å; I196-S200 PolarHBondContact O-OG 3.32Å; I196-S200 VanDerWaalsContact O-OG 3.13Å; I196-V271 HydrophobicContact CB-CG1 4.15Å; I196-V271 HydrophobicContact CG1-CG1 4.09Å; I196-V271 HydrophobicContact CG2-CG1 3.87Å
197	R	80.5	Confident	80	Confident	131 Å²	131	34 Å²	34	49%	0.494	15%	0.147	S	C	.	.	H	α-helix	trans	-54.1	-47.5	178.3	-70.9	-167.7	-51.8	119	-11.2	113.9	N41 Q44 R195 F201	N41-R197 WeakPolarHBondContact OD1-CD 3.49Å; N41-R197 WeakPolarHBondContact OD1-CG 3.31Å; Q44-R197 PolarHBondContact NE2-O 3.1Å; R195-R197 PolarHBondContact O-N 2.85Å; R197-F201 PolarHBondContact O-N 3.39Å
198	I	84.3	Confident	80.7	Confident	81 Å²	81	34.2 Å²	34.2	42%	0.415	15%	0.148	S	C	.	.	H	α-helix	trans	-74.1	-47.9	179.2	-62.1	171	0	0	0	109.6	R195 I196 S200 F201 I202	R195-I198 HydrophobicContact CB-CB 4.44Å; R195-I198 HydrophobicContact CB-CD1 4.36Å; R195-I198 HydrophobicContact CG-CD1 4.42Å; R195-I198 PolarHBondContact O-N 3.41Å; I196-I198 PolarHBondContact O-N 3.45Å; I198-S200 PolarHBondContact O-N 2.86Å; I198-F201 WeakPolarHBondContact O-CB 3.31Å; I198-F201 PolarHBondContact O-N 2.84Å; I198-I202 HydrophobicContact CG2-CD1 3.83Å; I198-I202 HydrophobicContact CG2-CG1 4.33Å; I198-I202 WeakPolarHBondContact O-CG1 3.26Å; I198-I202 PolarHBondContact O-N 2.84Å
199	F	85	Confident	81.8	Confident	12 Å²	12	33.5 Å²	33.5	5%	0.053	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-35.2	-176.9	-176.2	-114.1	0	0	0	113.3	T96 F183 L187 I192 R195 I196 F201 I202 L203 V271	T96-F199 HydrophobicContact CG2-CD2 4.03Å; T96-F199 HydrophobicContact CG2-CE2 3.81Å; F183-F199 HydrophobicContact CZ-CE2 4.25Å; L187-F199 HydrophobicContact CD2-CE2 3.98Å; L187-F199 HydrophobicContact CD2-CZ 3.9Å; I192-F199 HydrophobicContact CB-CD1 3.56Å; I192-F199 HydrophobicContact CB-CE1 3.88Å; I192-F199 HydrophobicContact CB-CG 4.23Å; I192-F199 HydrophobicContact CD1-CD1 3.42Å; I192-F199 VanDerWaalsContact CD1-CD1 3.42Å; I192-F199 HydrophobicContact CD1-CD2 3.64Å; I192-F199 HydrophobicContact CD1-CE1 3.22Å; I192-F199 HydrophobicContact CD1-CE2 3.47Å; I192-F199 VanDerWaalsContact CD1-CE2 3.47Å; I192-F199 HydrophobicContact CD1-CG 3.62Å; I192-F199 HydrophobicContact CD1-CZ 3.26Å; I192-F199 HydrophobicContact CG1-CD1 3.64Å; I192-F199 HydrophobicContact CG1-CE1 3.47Å; I192-F199 VanDerWaalsContact CG1-CE1 3.47Å; I192-F199 HydrophobicContact CG1-CG 4.27Å; I192-F199 HydrophobicContact CG1-CZ 4Å; I192-F199 HydrophobicContact CG2-CB 3.96Å; I192-F199 HydrophobicContact CG2-CD1 3.75Å; I192-F199 HydrophobicContact CG2-CG 3.96Å; R195-F199 PolarHBondContact O-N 3.26Å; I196-F199 PolarHBondContact O-N 2.71Å; F199-F201 VanDerWaalsContact C-N 3.34Å; F199-F201 PolarHBondContact O-N 3.24Å; F199-I202 HydrophobicContact CD2-CB 4.45Å; F199-I202 HydrophobicContact CD2-CG2 4.32Å; F199-I202 HydrophobicContact CE2-CG2 4.49Å; F199-I202 WeakPolarHBondContact O-CB 3.35Å; F199-I202 PolarHBondContact O-N 3.04Å; F199-L203 HydrophobicContact CD1-CD1 4.08Å; F199-L203 HydrophobicContact CD1-CG 4.35Å; F199-L203 HydrophobicContact CD2-CG 4.44Å; F199-L203 HydrophobicContact CE1-CD1 3.37Å; F199-L203 HydrophobicContact CE1-CD2 4.35Å; F199-L203 HydrophobicContact CE1-CG 3.81Å; F199-L203 HydrophobicContact CE2-CD1 4.34Å; F199-L203 HydrophobicContact CE2-CD2 3.91Å; F199-L203 HydrophobicContact CE2-CG 3.88Å; F199-L203 HydrophobicContact CZ-CD1 3.52Å; F199-L203 HydrophobicContact CZ-CD2 3.62Å; F199-L203 HydrophobicContact CZ-CG 3.54Å; F199-L203 PolarHBondContact O-N 2.89Å; F199-V271 HydrophobicContact CD1-CB 4.4Å; F199-V271 HydrophobicContact CD1-CG1 3.94Å; F199-V271 HydrophobicContact CD1-CG2 3.47Å; F199-V271 VanDerWaalsContact CD1-CG2 3.47Å; F199-V271 HydrophobicContact CE1-CG2 3.54Å
200	S	85.7	Confident	83.2	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-37.8	170.3	-69.7	0	0	0	0	112.4	I196 I198 L204	I196-S200 VanDerWaalsContact O-CB 3.29Å; I196-S200 WeakPolarHBondContact O-CB 3.11Å; I196-S200 PolarHBondContact O-N 2.88Å; I196-S200 PolarHBondContact O-OG 3.32Å; I196-S200 VanDerWaalsContact O-OG 3.13Å; I198-S200 PolarHBondContact O-N 2.86Å; S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.2Å; S200-L204 WeakPolarHBondContact O-CD1 3.42Å; S200-L204 VanDerWaalsContact O-CG 3.25Å; S200-L204 WeakPolarHBondContact O-CG 3.34Å; S200-L204 PolarHBondContact O-N 3.31Å
201	F	89.4	Confident	84.4	Confident	74 Å²	74	30.7 Å²	30.7	33%	0.325	14%	0.138	S	C	.	.	H	α-helix	trans	-65.5	-43.3	173.5	175.6	-91.4	0	0	0	111.5	Y51 R197 I198 F199 L204 H205	Y51-F201 AromaticContact CD1-CE2 3.55Å; Y51-F201 HydrophobicContact CD1-CE2 3.55Å; Y51-F201 AromaticContact CD1-CZ 3.9Å; Y51-F201 HydrophobicContact CD1-CZ 3.9Å; Y51-F201 AromaticContact CE1-CE2 3.87Å; Y51-F201 HydrophobicContact CE1-CE2 3.87Å; Y51-F201 AromaticContact CE1-CZ 3.7Å; Y51-F201 HydrophobicContact CE1-CZ 3.7Å; Y51-F201 AromaticContact CG-CE2 4Å; Y51-F201 HydrophobicContact CG-CE2 4Å; Y51-F201 HydrophobicContact CG-CZ 4.45Å; R197-F201 PolarHBondContact O-N 3.39Å; I198-F201 WeakPolarHBondContact O-CB 3.31Å; I198-F201 PolarHBondContact O-N 2.84Å; F199-F201 VanDerWaalsContact C-N 3.34Å; F199-F201 PolarHBondContact O-N 3.24Å; F201-L204 PolarHBondContact O-N 3.44Å; F201-H205 PolarHBondContact O-N 3.3Å
202	I	90.3	Very high	85.9	Confident	14 Å²	14	30.7 Å²	30.7	7%	0.072	14%	0.138	C	C	.	.	H	α-helix	trans	-56.8	-51.5	176.1	-71.5	175.2	0	0	0	111.7	V92 I198 F199 L204 H205 I206	V92-I202 HydrophobicContact CG1-CB 3.81Å; V92-I202 HydrophobicContact CG1-CD1 3.81Å; V92-I202 HydrophobicContact CG1-CG1 3.46Å; V92-I202 VanDerWaalsContact CG1-CG1 3.46Å; V92-I202 HydrophobicContact CG1-CG2 3.29Å; I198-I202 HydrophobicContact CG2-CD1 3.83Å; I198-I202 HydrophobicContact CG2-CG1 4.33Å; I198-I202 WeakPolarHBondContact O-CG1 3.26Å; I198-I202 PolarHBondContact O-N 2.84Å; F199-I202 HydrophobicContact CD2-CB 4.45Å; F199-I202 HydrophobicContact CD2-CG2 4.32Å; F199-I202 HydrophobicContact CE2-CG2 4.49Å; F199-I202 WeakPolarHBondContact O-CB 3.35Å; F199-I202 PolarHBondContact O-N 3.04Å; I202-L204 VanDerWaalsContact C-N 3.35Å; I202-L204 PolarHBondContact O-N 2.77Å; I202-H205 PolarHBondContact O-N 3.36Å; I202-I206 HydrophobicContact CG2-CD1 3.89Å; I202-I206 WeakPolarHBondContact O-CG1 3.36Å; I202-I206 PolarHBondContact O-N 3.35Å; I202-I206 VanDerWaalsContact O-N 3.07Å
203	L	91	Very high	87.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-38.4	178.6	-70.3	-175.1	0	0	0	112.2	F183 F199 I206 L207 V264 L267 L268 V271	F183-L203 HydrophobicContact CE1-CD2 3.88Å; F183-L203 HydrophobicContact CZ-CD2 3.89Å; F199-L203 HydrophobicContact CD1-CD1 4.08Å; F199-L203 HydrophobicContact CD1-CG 4.35Å; F199-L203 HydrophobicContact CD2-CG 4.44Å; F199-L203 HydrophobicContact CE1-CD1 3.37Å; F199-L203 HydrophobicContact CE1-CD2 4.35Å; F199-L203 HydrophobicContact CE1-CG 3.81Å; F199-L203 HydrophobicContact CE2-CD1 4.34Å; F199-L203 HydrophobicContact CE2-CD2 3.91Å; F199-L203 HydrophobicContact CE2-CG 3.88Å; F199-L203 HydrophobicContact CZ-CD1 3.52Å; F199-L203 HydrophobicContact CZ-CD2 3.62Å; F199-L203 HydrophobicContact CZ-CG 3.54Å; F199-L203 PolarHBondContact O-N 2.89Å; L203-I206 PolarHBondContact O-N 3.35Å; L203-L207 VanDerWaalsContact O-CB 3.31Å; L203-L207 WeakPolarHBondContact O-CB 3.47Å; L203-L207 PolarHBondContact O-N 3.06Å; L203-V264 HydrophobicContact CB-CG1 4Å; L203-V264 HydrophobicContact CD2-CG1 4.21Å; L203-V264 WeakPolarHBondContact O-CG1 3.33Å; L203-L267 HydrophobicContact CD1-CB 3.77Å; L203-L268 HydrophobicContact CB-CB 4.43Å; L203-L268 HydrophobicContact CB-CD1 4.3Å; L203-L268 HydrophobicContact CD1-CB 4.12Å; L203-V271 HydrophobicContact CD1-CG2 3.96Å
204	L	91.9	Very high	88.6	Confident	13 Å²	13	32 Å²	32	7%	0.068	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-41.5	175.5	-81.4	169.4	0	0	0	111.9	S48 M49 C52 S200 F201 I202 L207 T208 L268	S48-L204 VanDerWaalsContact CB-CD1 3.46Å; M49-L204 HydrophobicContact CG-CD1 4.32Å; M49-L204 HydrophobicContact CG-CD2 4.42Å; C52-L204 PolarHBondContact SG-O 2.97Å; S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.2Å; S200-L204 WeakPolarHBondContact O-CD1 3.42Å; S200-L204 VanDerWaalsContact O-CG 3.25Å; S200-L204 WeakPolarHBondContact O-CG 3.34Å; S200-L204 PolarHBondContact O-N 3.31Å; F201-L204 PolarHBondContact O-N 3.44Å; I202-L204 VanDerWaalsContact C-N 3.35Å; I202-L204 PolarHBondContact O-N 2.77Å; L204-L207 PolarHBondContact O-N 3.18Å; L204-T208 PolarHBondContact O-N 2.92Å; L204-T208 PolarHBondContact O-OG1 3.28Å; L204-L268 HydrophobicContact CD2-CD2 3.55Å; L204-L268 HydrophobicContact CG-CD1 4.18Å; L204-L268 HydrophobicContact CG-CD2 3.79Å
205	H	94	Very high	89.9	Confident	7 Å²	7	31.8 Å²	31.8	3%	0.032	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-50.6	174	-176.5	66.3	0	0	0	111.8	Y51 S88 S89 F201 I202 L207 T208 V209	Y51-H205 HydrophobicContact CE1-CB 4.49Å; Y51-H205 AromaticContact CE1-ND1 3.61Å; Y51-H205 AromaticContact CZ-ND1 3.83Å; Y51-H205 PolarHBondContact OH-CE1 3.48Å; Y51-H205 PolarHBondContact OH-ND1 3.23Å; Y51-H205 VanDerWaalsContact OH-ND1 3.16Å; S88-H205 PolarHBondContact OG-NE2 2.72Å; S89-H205 PolarHBondContact OG-NE2 3.05Å; F201-H205 PolarHBondContact O-N 3.3Å; I202-H205 PolarHBondContact O-N 3.36Å; H205-L207 VanDerWaalsContact C-N 3.3Å; H205-L207 PolarHBondContact O-N 3.09Å; H205-T208 PolarHBondContact O-N 2.96Å; H205-V209 WeakPolarHBondContact O-CG2 3.29Å; H205-V209 PolarHBondContact O-N 2.73Å
206	I	94.2	Very high	90.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.4	-42.1	178.2	-64.8	163.7	0	0	0	110.7	M93 F183 I202 L203 V209 N210 V264	M93-I206 HydrophobicContact CG-CD1 3.53Å; M93-I206 HydrophobicContact CG-CG1 4.23Å; M93-I206 HydrophobicContact SD-CD1 4.14Å; F183-I206 HydrophobicContact CE1-CD1 3.99Å; F183-I206 HydrophobicContact CZ-CD1 3.93Å; I202-I206 HydrophobicContact CG2-CD1 3.89Å; I202-I206 WeakPolarHBondContact O-CG1 3.36Å; I202-I206 PolarHBondContact O-N 3.35Å; I202-I206 VanDerWaalsContact O-N 3.07Å; L203-I206 PolarHBondContact O-N 3.35Å; I206-V209 PolarHBondContact O-N 3.28Å; I206-N210 PolarHBondContact O-N 2.86Å; I206-N210 VanDerWaalsContact O-N 3.11Å; I206-N210 PolarHBondContact O-ND2 2.86Å; I206-V264 HydrophobicContact CG2-CG2 4.15Å
207	L	94.7	Very high	91.1	Very high	22 Å²	22	23.5 Å²	23.5	12%	0.115	11%	0.107	C	C	.	.	H	α-helix	trans	-59.1	-48.4	175.8	-171.5	151	0	0	0	111.4	L203 L204 H205 V209 N210 L211 V261 V264	L203-L207 VanDerWaalsContact O-CB 3.31Å; L203-L207 WeakPolarHBondContact O-CB 3.47Å; L203-L207 PolarHBondContact O-N 3.06Å; L204-L207 PolarHBondContact O-N 3.18Å; H205-L207 VanDerWaalsContact C-N 3.3Å; H205-L207 PolarHBondContact O-N 3.09Å; L207-V209 PolarHBondContact O-N 2.78Å; L207-N210 PolarHBondContact O-N 3.42Å; L207-L211 HydrophobicContact CD2-CD1 3.68Å; L207-L211 HydrophobicContact CD2-CG 4.23Å; L207-L211 PolarHBondContact O-N 3.39Å; L207-L211 VanDerWaalsContact O-N 3.07Å; L207-V261 HydrophobicContact CD1-CG1 4.37Å; L207-V261 HydrophobicContact CD2-CG1 4.46Å; L207-V261 HydrophobicContact CG-CG1 4.15Å; L207-V261 HydrophobicContact CG-CG2 4.4Å; L207-V264 HydrophobicContact CB-CG1 3.79Å; L207-V264 HydrophobicContact CD1-CG1 4.27Å; L207-V264 HydrophobicContact CG-CG1 4.5Å
208	T	95	Very high	91.4	Very high	5 Å²	5	17.5 Å²	17.5	3%	0.031	9%	0.085	C	C	.	.	H	α-helix	trans	-59.9	-42.8	176.5	-73.6	0	0	0	0	112.4	C52 I55 F56 L204 H205 N210 L211 C212	C52-T208 WeakPolarHBondContact CA-OG1 3.47Å; C52-T208 WeakPolarHBondContact CB-OG1 3.23Å; C52-T208 WeakPolarHBondContact O-CG2 3.34Å; C52-T208 PolarHBondContact O-OG1 2.93Å; C52-T208 PolarHBondContact SG-OG1 2.82Å; I55-T208 HydrophobicContact CB-CG2 3.92Å; I55-T208 HydrophobicContact CG2-CG2 3.58Å; F56-T208 HydrophobicContact CB-CG2 4.15Å; L204-T208 PolarHBondContact O-N 2.92Å; L204-T208 PolarHBondContact O-OG1 3.28Å; H205-T208 PolarHBondContact O-N 2.96Å; T208-N210 VanDerWaalsContact C-N 3.32Å; T208-N210 PolarHBondContact O-N 3.08Å; T208-L211 WeakPolarHBondContact O-CB 3.31Å; T208-L211 PolarHBondContact O-N 3.36Å; T208-L211 VanDerWaalsContact O-N 3.13Å; T208-C212 PolarHBondContact O-N 3.19Å; T208-C212 PolarHBondContact O-SG 3.01Å; T208-C212 VanDerWaalsContact O-SG 3.36Å
209	V	96.3	Very high	91.4	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.006	7%	0.069	C	C	.	.	H	α-helix	trans	-62.7	-39.3	178.5	174	0	0	0	0	111.4	M85 F86 F176 H205 I206 L207 L211 C212 I213	M85-V209 HydrophobicContact CB-CG1 4.37Å; M85-V209 HydrophobicContact CB-CG2 3.94Å; M85-V209 HydrophobicContact CG-CG2 4.38Å; M85-V209 HydrophobicContact SD-CG2 3.98Å; F86-V209 HydrophobicContact CD1-CG1 4.09Å; F86-V209 HydrophobicContact CE1-CG1 4.2Å; F176-V209 HydrophobicContact CE2-CG1 3.73Å; F176-V209 HydrophobicContact CZ-CG1 3.75Å; H205-V209 WeakPolarHBondContact O-CG2 3.29Å; H205-V209 PolarHBondContact O-N 2.73Å; I206-V209 PolarHBondContact O-N 3.28Å; L207-V209 PolarHBondContact O-N 2.78Å; V209-L211 PolarHBondContact O-N 2.88Å; V209-C212 PolarHBondContact O-N 3.35Å; V209-I213 HydrophobicContact CG1-CD1 4.15Å; V209-I213 VanDerWaalsContact O-CG1 3.3Å; V209-I213 WeakPolarHBondContact O-CG1 3.32Å; V209-I213 PolarHBondContact O-N 3.05Å
210	N	95.7	Very high	91.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.8	-37.5	173.3	-74.5	-86.6	0	0	0	112.7	Q180 I206 L207 T208 I213 W214 C257 A260 V261	Q180-N210 PolarHBondContact NE2-ND2 2.9Å; Q180-N210 PolarHBondContact NE2-OD1 3.4Å; Q180-N210 PolarHBondContact OE1-ND2 2.76Å; I206-N210 PolarHBondContact O-N 2.86Å; I206-N210 VanDerWaalsContact O-N 3.11Å; I206-N210 PolarHBondContact O-ND2 2.86Å; L207-N210 PolarHBondContact O-N 3.42Å; T208-N210 VanDerWaalsContact C-N 3.32Å; T208-N210 PolarHBondContact O-N 3.08Å; N210-I213 PolarHBondContact O-N 3.48Å; N210-W214 WeakPolarHBondContact O-CB 3.35Å; N210-W214 PolarHBondContact O-N 2.67Å; N210-C257 HydrophobicContact CB-CB 4.36Å; N210-A260 WeakPolarHBondContact OD1-CB 3.29Å; N210-V261 HydrophobicContact CB-CG2 3.64Å
211	L	94.2	Very high	90.8	Very high	54 Å²	54	17.5 Å²	17.5	28%	0.283	8%	0.083	S	C	.	.	H	α-helix	trans	-63.4	-40.8	173.2	-68	175.4	0	0	0	111.9	F56 L207 T208 V209 W214 S215 V261	F56-L211 HydrophobicContact CD2-CB 3.73Å; F56-L211 HydrophobicContact CE2-CB 3.66Å; L207-L211 HydrophobicContact CD2-CD1 3.68Å; L207-L211 HydrophobicContact CD2-CG 4.23Å; L207-L211 PolarHBondContact O-N 3.39Å; L207-L211 VanDerWaalsContact O-N 3.07Å; T208-L211 WeakPolarHBondContact O-CB 3.31Å; T208-L211 PolarHBondContact O-N 3.36Å; T208-L211 VanDerWaalsContact O-N 3.13Å; V209-L211 PolarHBondContact O-N 2.88Å; L211-W214 PolarHBondContact O-N 2.87Å; L211-S215 PolarHBondContact O-N 3.37Å; L211-S215 PolarHBondContact O-OG 3.15Å; L211-V261 HydrophobicContact CD2-CG1 4.36Å; L211-V261 HydrophobicContact CD2-CG2 3.94Å; L211-V261 HydrophobicContact CG-CG2 4.06Å
212	C	95	Very high	90.1	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.007	7%	0.072	C	C	.	.	H	α-helix	trans	-65.2	-34.9	175.3	-66.1	0	0	0	0	113.1	Y82 T208 V209 S215 D216	Y82-C212 HydrophobicContact CE1-CB 3.93Å; Y82-C212 PolarHBondContact OH-O 2.87Å; T208-C212 PolarHBondContact O-N 3.19Å; T208-C212 PolarHBondContact O-SG 3.01Å; T208-C212 VanDerWaalsContact O-SG 3.36Å; V209-C212 PolarHBondContact O-N 3.35Å; C212-S215 WeakPolarHBondContact CA-OG 3.36Å; C212-S215 PolarHBondContact O-OG 2.95Å; C212-D216 PolarHBondContact O-N 3.37Å
213	I	94.3	Very high	89.2	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-72.1	-39.9	174.4	-60.5	161.3	0	0	0	110.4	F86 F176 F177 V209 N210 D216 A217 V253 C257	F86-I213 HydrophobicContact CE1-CD1 3.73Å; F86-I213 HydrophobicContact CE1-CG1 3.8Å; F86-I213 HydrophobicContact CZ-CD1 4.44Å; F86-I213 HydrophobicContact CZ-CG1 4.23Å; F176-I213 HydrophobicContact CD1-CD1 3.94Å; F176-I213 HydrophobicContact CE1-CD1 3.31Å; F176-I213 HydrophobicContact CZ-CD1 3.87Å; F177-I213 HydrophobicContact CZ-CG2 4.43Å; V209-I213 HydrophobicContact CG1-CD1 4.15Å; V209-I213 VanDerWaalsContact O-CG1 3.3Å; V209-I213 WeakPolarHBondContact O-CG1 3.32Å; V209-I213 PolarHBondContact O-N 3.05Å; N210-I213 PolarHBondContact O-N 3.48Å; I213-D216 PolarHBondContact O-N 3.27Å; I213-A217 PolarHBondContact O-N 3.27Å; I213-V253 HydrophobicContact CG2-CG1 3.7Å; I213-C257 VanDerWaalsContact CG2-SG 3.51Å
214	W	93.6	Very high	88	Confident	57 Å²	57	18.5 Å²	18.5	22%	0.216	9%	0.09	C	C	.	.	H	α-helix	trans	-60.5	-45.2	176	179.1	94.1	0	0	0	111.2	N210 L211 A217 V218 P254 C257 V497 M501	N210-W214 WeakPolarHBondContact O-CB 3.35Å; N210-W214 PolarHBondContact O-N 2.67Å; L211-W214 PolarHBondContact O-N 2.87Å; W214-A217 PolarHBondContact O-N 2.97Å; W214-V218 HydrophobicContact CD2-CG2 4.09Å; W214-V218 HydrophobicContact CE3-CG2 4.42Å; W214-V218 HydrophobicContact CH2-CG2 4.27Å; W214-V218 HydrophobicContact CZ2-CG2 3.93Å; W214-V218 WeakPolarHBondContact O-CB 3.42Å; W214-V218 VanDerWaalsContact O-CG2 3.3Å; W214-V218 WeakPolarHBondContact O-CG2 3.45Å; W214-V218 PolarHBondContact O-N 3.46Å; W214-P254 HydrophobicContact CG-CB 4.38Å; W214-C257 HydrophobicContact CB-CB 3.95Å; W214-V497 HydrophobicContact CH2-CG1 4.11Å; W214-M501 HydrophobicContact CZ2-CG 4.47Å
215	S	90.4	Very high	86.7	Confident	4 Å²	4	18.4 Å²	18.4	3%	0.028	9%	0.09	C	C	.	.	H	α-helix	trans	-64.5	-39.9	176.7	58.1	0	0	0	0	112.8	L211 C212 V218 I219	L211-S215 PolarHBondContact O-N 3.37Å; L211-S215 PolarHBondContact O-OG 3.15Å; C212-S215 WeakPolarHBondContact CA-OG 3.36Å; C212-S215 PolarHBondContact O-OG 2.95Å; S215-V218 PolarHBondContact O-N 3.43Å; S215-I219 WeakPolarHBondContact O-CB 3.19Å; S215-I219 VanDerWaalsContact O-CG1 3.31Å; S215-I219 WeakPolarHBondContact O-CG1 3.29Å; S215-I219 PolarHBondContact O-N 3.41Å
216	D	90.2	Very high	85.2	Confident	10 Å²	10	20.8 Å²	20.8	5%	0.053	10%	0.102	C	C	.	.	H	α-helix	trans	-56.9	-54.4	171.9	169.4	47.1	0	0	0	111.6	T63 K173 C212 I213 V218 I219 K220	T63-D216 HydrophobicContact CG2-CB 4.28Å; K173-D216 IonicContact NZ-OD2 3.92Å; K173-D216 PolarHBondContact NZ-OD2 3.01Å; C212-D216 PolarHBondContact O-N 3.37Å; I213-D216 PolarHBondContact O-N 3.27Å; D216-V218 VanDerWaalsContact C-N 3.3Å; D216-V218 PolarHBondContact O-N 3.16Å; D216-I219 PolarHBondContact O-N 2.9Å; D216-K220 WeakPolarHBondContact O-CB 3.43Å; D216-K220 PolarHBondContact O-N 3.24Å
217	A	88.7	Confident	83.4	Confident	5 Å²	5	23.1 Å²	23.1	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-37.3	-178.4	0	0	0	0	0	112.9	I213 W214 K221 V253 P254	I213-A217 PolarHBondContact O-N 3.27Å; W214-A217 PolarHBondContact O-N 2.97Å; A217-K221 WeakPolarHBondContact O-CB 3.36Å; A217-K221 PolarHBondContact O-N 3.38Å; A217-K221 VanDerWaalsContact O-N 3.11Å; A217-V253 HydrophobicContact CB-CB 4.2Å; A217-V253 HydrophobicContact CB-CG1 3.85Å; A217-P254 HydrophobicContact CB-CG 4.39Å
218	V	85.7	Confident	81.4	Confident	5 Å²	5	25.7 Å²	25.7	3%	0.03	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-48.6	175.1	165.7	0	0	0	0	111.5	W214 S215 D216 K221 I222 V497	W214-V218 HydrophobicContact CD2-CG2 4.09Å; W214-V218 HydrophobicContact CE3-CG2 4.42Å; W214-V218 HydrophobicContact CH2-CG2 4.27Å; W214-V218 HydrophobicContact CZ2-CG2 3.93Å; W214-V218 WeakPolarHBondContact O-CB 3.42Å; W214-V218 VanDerWaalsContact O-CG2 3.3Å; W214-V218 WeakPolarHBondContact O-CG2 3.45Å; W214-V218 PolarHBondContact O-N 3.46Å; S215-V218 PolarHBondContact O-N 3.43Å; D216-V218 VanDerWaalsContact C-N 3.3Å; D216-V218 PolarHBondContact O-N 3.16Å; V218-K221 WeakPolarHBondContact O-CB 3.29Å; V218-K221 PolarHBondContact O-N 3.48Å; V218-K221 VanDerWaalsContact O-N 3.16Å; V218-I222 HydrophobicContact CG1-CD1 4.03Å; V218-I222 WeakPolarHBondContact O-CG1 3.22Å; V218-I222 PolarHBondContact O-N 2.86Å; V218-V497 HydrophobicContact CG1-CB 4.07Å; V218-V497 HydrophobicContact CG1-CG1 4.1Å; V218-V497 HydrophobicContact CG1-CG2 3.65Å
219	I	84	Confident	79	Confident	16 Å²	16	28.2 Å²	28.2	8%	0.082	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-40.5	179.8	-71.6	164.4	0	0	0	111	L60 T63 L64 T67 S215 D216 K221 I222 S223	L60-I219 HydrophobicContact CD1-CD1 3.92Å; T63-I219 HydrophobicContact CG2-CB 3.76Å; T63-I219 HydrophobicContact CG2-CD1 3.47Å; T63-I219 VanDerWaalsContact CG2-CD1 3.47Å; T63-I219 HydrophobicContact CG2-CG1 4.18Å; T63-I219 HydrophobicContact CG2-CG2 3.93Å; L64-I219 HydrophobicContact CD2-CD1 3.61Å; L64-I219 HydrophobicContact CD2-CG1 4.26Å; L64-I219 HydrophobicContact CG-CD1 3.86Å; T67-I219 HydrophobicContact CG2-CG2 4.1Å; T67-I219 VanDerWaalsContact OG1-CG2 3.23Å; T67-I219 WeakPolarHBondContact OG1-CG2 3.43Å; S215-I219 WeakPolarHBondContact O-CB 3.19Å; S215-I219 VanDerWaalsContact O-CG1 3.31Å; S215-I219 WeakPolarHBondContact O-CG1 3.29Å; S215-I219 PolarHBondContact O-N 3.41Å; D216-I219 PolarHBondContact O-N 2.9Å; I219-K221 VanDerWaalsContact C-N 3.27Å; I219-K221 PolarHBondContact O-N 2.89Å; I219-I222 PolarHBondContact O-N 3.43Å; I219-I222 VanDerWaalsContact O-N 3.17Å; I219-S223 WeakPolarHBondContact O-CB 3.32Å; I219-S223 PolarHBondContact O-N 2.76Å
220	K	80.7	Confident	76.6	Confident	53 Å²	53	31.4 Å²	31.4	23%	0.23	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-37	172.8	-169.2	170	-176.2	177.5	0	112.1	E73 D216 K224	E73-K220 IonicContact OE1-NZ 3.96Å; E73-K220 PolarHBondContact OE1-NZ 3.28Å; E73-K220 IonicContact OE2-NZ 2.73Å; D216-K220 WeakPolarHBondContact O-CB 3.43Å; D216-K220 PolarHBondContact O-N 3.24Å; K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 3.32Å
221	K	77.5	Confident	74.2	Confident	26 Å²	26	34.4 Å²	34.4	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-45	173.8	-172.3	-178.2	-179.3	-176.3	0	112	A217 V218 I219 K224 S225 L250	A217-K221 WeakPolarHBondContact O-CB 3.36Å; A217-K221 PolarHBondContact O-N 3.38Å; A217-K221 VanDerWaalsContact O-N 3.11Å; V218-K221 WeakPolarHBondContact O-CB 3.29Å; V218-K221 PolarHBondContact O-N 3.48Å; V218-K221 VanDerWaalsContact O-N 3.16Å; I219-K221 VanDerWaalsContact C-N 3.27Å; I219-K221 PolarHBondContact O-N 2.89Å; K221-K224 PolarHBondContact O-N 3.41Å; K221-S225 PolarHBondContact O-N 3.29Å; K221-L250 HydrophobicContact CB-CD2 4.41Å
222	I	74.5	Confident	71.9	Confident	20 Å²	20	39.6 Å²	39.6	10%	0.103	23%	0.228	C	C	.	.	H	α-helix	trans	-60.7	-51.4	174.8	-61.9	160.2	0	0	0	110.5	V218 I219 K224 S225 I226 I493 N496 V497	V218-I222 HydrophobicContact CG1-CD1 4.03Å; V218-I222 WeakPolarHBondContact O-CG1 3.22Å; V218-I222 PolarHBondContact O-N 2.86Å; I219-I222 PolarHBondContact O-N 3.43Å; I219-I222 VanDerWaalsContact O-N 3.17Å; I222-K224 VanDerWaalsContact C-N 3.27Å; I222-K224 PolarHBondContact O-N 3.32Å; I222-S225 WeakPolarHBondContact O-CA 3.48Å; I222-S225 VanDerWaalsContact O-CB 3.3Å; I222-S225 WeakPolarHBondContact O-CB 3.25Å; I222-S225 PolarHBondContact O-N 2.94Å; I222-I226 HydrophobicContact CG2-CD1 3.64Å; I222-I226 HydrophobicContact CG2-CG1 4.29Å; I222-I226 PolarHBondContact O-N 3.02Å; I222-I493 HydrophobicContact CD1-CG2 4.1Å; I222-I493 HydrophobicContact CG2-CG1 4.33Å; I222-N496 HydrophobicContact CG1-CB 4.16Å; I222-V497 HydrophobicContact CD1-CG2 3.63Å; I222-V497 HydrophobicContact CG1-CG2 4.35Å
223	S	71	Confident	69.4	Low	21 Å²	21	46.6 Å²	46.6	15%	0.147	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-39.7	-179.2	-158.8	0	0	0	0	111.6	G68 I219 G227	G68-S223 PolarHBondContact N-OG 3.02Å; G68-S223 PolarHBondContact O-OG 3.17Å; I219-S223 WeakPolarHBondContact O-CB 3.32Å; I219-S223 PolarHBondContact O-N 2.76Å; S223-G227 WeakPolarHBondContact O-CA 3.31Å; S223-G227 PolarHBondContact O-N 2.71Å
224	K	67.1	Low	67.2	Low	69 Å²	69	50.2 Å²	50.2	30%	0.3	29%	0.287	S	S	.	.	H	α-helix	trans	-70.9	-32.1	173.5	-177.2	162.1	-173.6	173	0	113.2	K220 K221 I222 T228 E242 N247	K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 3.32Å; K221-K224 PolarHBondContact O-N 3.41Å; I222-K224 VanDerWaalsContact C-N 3.27Å; I222-K224 PolarHBondContact O-N 3.32Å; K224-T228 PolarHBondContact O-OG1 3.49Å; K224-T228 VanDerWaalsContact O-OG1 3.08Å; K224-E242 VanDerWaalsContact NZ-CD 3.25Å; K224-E242 IonicContact NZ-OE1 2.57Å; K224-E242 PolarHBondContact NZ-OE1 3.16Å; K224-E242 IonicContact NZ-OE2 3.16Å; K224-E242 PolarHBondContact NZ-OE2 3.28Å; K224-E242 VanDerWaalsContact NZ-OE2 3.16Å; K224-N247 PolarHBondContact NZ-ND2 2.66Å; K224-N247 PolarHBondContact NZ-OD1 2.72Å
225	S	63.5	Low	65	Low	10 Å²	10	50.2 Å²	50.2	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-48	176.4	-126.8	0	0	0	0	111.2	K221 I222 T228 F492 N496	K221-S225 PolarHBondContact O-N 3.29Å; I222-S225 WeakPolarHBondContact O-CA 3.48Å; I222-S225 VanDerWaalsContact O-CB 3.3Å; I222-S225 WeakPolarHBondContact O-CB 3.25Å; I222-S225 PolarHBondContact O-N 2.94Å; S225-T228 PolarHBondContact O-OG1 3.46Å; S225-T228 VanDerWaalsContact O-OG1 3.05Å; S225-F492 WeakPolarHBondContact OG-CZ 3.5Å; S225-N496 PolarHBondContact OG-OD1 3.41Å; S225-N496 VanDerWaalsContact OG-OD1 3.08Å
226	I	63.8	Low	63	Low	57 Å²	57	55.5 Å²	55.5	29%	0.292	33%	0.326	S	S	.	.	H	α-helix	trans	-74.1	-49.5	179.9	-60	174.8	0	0	0	111	I222 T228 L229	I222-I226 HydrophobicContact CG2-CD1 3.64Å; I222-I226 HydrophobicContact CG2-CG1 4.29Å; I222-I226 PolarHBondContact O-N 3.02Å; I226-T228 PolarHBondContact O-N 3.46Å; I226-L229 PolarHBondContact O-N 3.16Å
227	G	56	Low	61	Low	50 Å²	50	59.6 Å²	59.6	52%	0.515	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-11.7	-174.4	0	0	0	0	0	115.5	S223 L229	S223-G227 WeakPolarHBondContact O-CA 3.31Å; S223-G227 PolarHBondContact O-N 2.71Å; G227-L229 PolarHBondContact O-N 3.21Å
228	T	53.4	Low	59.2	Low	75 Å²	75	63.8 Å²	63.8	46%	0.46	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.5	169	17	0	0	0	0	114.5	K224 S225 I226 K480	K224-T228 PolarHBondContact O-OG1 3.49Å; K224-T228 VanDerWaalsContact O-OG1 3.08Å; S225-T228 PolarHBondContact O-OG1 3.46Å; S225-T228 VanDerWaalsContact O-OG1 3.05Å; I226-T228 PolarHBondContact O-N 3.46Å; T228-K480 PolarHBondContact OG1-NZ 3.27Å
229	L	44.5	Very low	58	Low	58 Å²	58	70.8 Å²	70.8	30%	0.304	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-17.4	-178.6	-116.2	74.9	0	0	0	115.7	I226 G227 K480 Q484	I226-L229 PolarHBondContact O-N 3.16Å; G227-L229 PolarHBondContact O-N 3.21Å; L229-K480 VanDerWaalsContact CD1-C 3.45Å; L229-K480 HydrophobicContact CD1-CB 3.71Å; L229-K480 WeakPolarHBondContact CD1-O 3.38Å; L229-K480 WeakPolarHBondContact CD2-O 3.44Å; L229-Q484 HydrophobicContact CD2-CB 3.92Å
230	A	45.8	Very low	56.9	Low	69 Å²	69	77.6 Å²	77.6	57%	0.57	43%	0.428	S	S	*	.	S	Bend	trans	-80.4	-39.7	-158.4	0	0	0	0	0	115.9
231	V	45.3	Very low	56.4	Low	62 Å²	62	78.6 Å²	78.6	38%	0.376	43%	0.431	S	S	.	.			trans	-147.9	110.7	-172.6	-167.2	0	0	0	0	113.2	N233 V234	V231-N233 HydrophobicContact CG1-CB 4.13Å; V231-N233 PolarHBondContact O-N 3.06Å; V231-V234 HydrophobicContact CB-CB 4.24Å; V231-V234 HydrophobicContact CB-CG2 4.03Å; V231-V234 HydrophobicContact CG1-CB 4.29Å; V231-V234 HydrophobicContact CG1-CG2 3.73Å; V231-V234 PolarHBondContact O-N 2.7Å
232	L	44.1	Very low	56.1	Low	164 Å²	164	80.9 Å²	80.9	86%	0.859	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.6	174.8	-113.8	105.1	0	0	0	113.3	T235	L232-T235 PolarHBondContact O-OG1 3.41Å
233	N	43.1	Very low	56.4	Low	148 Å²	148	83.8 Å²	83.8	79%	0.791	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-17	-175.4	-69.6	-11.1	0	0	0	115.7	V231	V231-N233 HydrophobicContact CG1-CB 4.13Å; V231-N233 PolarHBondContact O-N 3.06Å
234	V	48.2	Very low	56.7	Low	75 Å²	75	85.8 Å²	85.8	46%	0.455	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-20.3	-176.8	174.1	0	0	0	0	112.6	V231 V236 V237	V231-V234 HydrophobicContact CB-CB 4.24Å; V231-V234 HydrophobicContact CB-CG2 4.03Å; V231-V234 HydrophobicContact CG1-CB 4.29Å; V231-V234 HydrophobicContact CG1-CG2 3.73Å; V231-V234 PolarHBondContact O-N 2.7Å; V234-V236 VanDerWaalsContact C-N 3.27Å; V234-V236 PolarHBondContact O-N 3.05Å; V234-V236 VanDerWaalsContact O-N 3.17Å; V234-V237 PolarHBondContact O-N 3.07Å
235	T	48.1	Very low	57.4	Low	58 Å²	58	83.9 Å²	83.9	36%	0.356	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-24.2	-170.3	63.9	0	0	0	0	115	L232 K239	L232-T235 PolarHBondContact O-OG1 3.41Å; T235-K239 WeakPolarHBondContact O-CG 3.36Å; T235-K239 PolarHBondContact O-N 3.46Å
236	V	48.6	Very low	58.4	Low	114 Å²	114	83.8 Å²	83.8	69%	0.691	47%	0.472	S	S	*	.	H	α-helix	trans	-67	-40.3	-178.3	-177	0	0	0	0	111.6	V234	V234-V236 VanDerWaalsContact C-N 3.27Å; V234-V236 PolarHBondContact O-N 3.05Å; V234-V236 VanDerWaalsContact O-N 3.17Å
237	V	46.9	Very low	59.1	Low	97 Å²	97	82.3 Å²	82.3	59%	0.588	46%	0.464	S	S	*	.	H	α-helix	trans	-75.4	-40.2	179	-178.1	0	0	0	0	111	V234 K239 K240	V234-V237 PolarHBondContact O-N 3.07Å; V237-K239 PolarHBondContact O-N 3.31Å; V237-K240 PolarHBondContact O-N 3.46Å
238	H	52.3	Low	60.4	Low	93 Å²	93	83.2 Å²	83.2	43%	0.431	45%	0.453	S	S	.	.	H	α-helix	trans	-64.9	-37.1	-178.8	-95.6	-119.4	0	0	0	113.6	K159 K240	K159-H238 PolarHBondContact NZ-CE1 3.49Å; K159-H238 VanDerWaalsContact NZ-CE1 3.33Å; K159-H238 PolarHBondContact NZ-NE2 2.87Å; H238-K240 PolarHBondContact O-N 2.88Å
239	K	58.6	Low	62	Low	152 Å²	152	82.2 Å²	82.2	66%	0.661	44%	0.442	S	S	*	.	H	α-helix	trans	-72.2	-22.2	-178.7	-75.5	178.5	179.3	175	0	114.7	T235 V237 Y241	T235-K239 WeakPolarHBondContact O-CG 3.36Å; T235-K239 PolarHBondContact O-N 3.46Å; V237-K239 PolarHBondContact O-N 3.31Å; K239-Y241 VanDerWaalsContact C-N 3.26Å; K239-Y241 PolarHBondContact O-N 3.06Å
240	K	62.7	Low	63.8	Low	158 Å²	158	80.1 Å²	80.1	69%	0.687	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.8	-171.8	-171.2	173.3	-178.5	179.3	0	114.1	V237 H238	V237-K240 PolarHBondContact O-N 3.46Å; H238-K240 PolarHBondContact O-N 2.88Å
241	Y	68.6	Low	65.7	Low	74 Å²	74	77.9 Å²	77.9	29%	0.29	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-16.9	-176.9	-55.1	-51.9	0	0	0	114	E155 K158 K159 K239 L243	E155-Y241 WeakPolarHBondContact CG-O 3.41Å; K158-Y241 HydrophobicContact CD-CD1 3.56Å; K158-Y241 HydrophobicContact CD-CE1 4Å; K158-Y241 HydrophobicContact CD-CG 4.37Å; K158-Y241 HydrophobicContact CG-CD1 3.77Å; K158-Y241 HydrophobicContact CG-CE1 3.94Å; K158-Y241 HydrophobicContact CG-CG 4.34Å; K159-Y241 HydrophobicContact CB-CD2 4.33Å; K159-Y241 HydrophobicContact CG-CD2 4.45Å; K239-Y241 VanDerWaalsContact C-N 3.26Å; K239-Y241 PolarHBondContact O-N 3.06Å; Y241-L243 PolarHBondContact O-N 2.78Å
242	E	72.1	Confident	67.7	Low	74 Å²	74	75.2 Å²	75.2	35%	0.346	40%	0.395	S	S	.	.			trans	-70.3	120.7	-178.5	-170.1	177.6	-168.1	0	0	111.4	K224 N247	K224-E242 VanDerWaalsContact NZ-CD 3.25Å; K224-E242 IonicContact NZ-OE1 2.57Å; K224-E242 PolarHBondContact NZ-OE1 3.16Å; K224-E242 IonicContact NZ-OE2 3.16Å; K224-E242 PolarHBondContact NZ-OE2 3.28Å; K224-E242 VanDerWaalsContact NZ-OE2 3.16Å; E242-N247 PolarHBondContact OE1-ND2 3.16Å
243	L	80.9	Confident	70	Confident	81 Å²	81	67.5 Å²	67.5	42%	0.424	36%	0.355	S	S	.	.			trans	-85.6	131.7	179.5	-168.8	66.6	0	0	0	109.7	T151 E155 Y241 A245 T246	T151-L243 HydrophobicContact CG2-CD2 3.68Å; E155-L243 PolarHBondContact OE1-N 2.71Å; Y241-L243 PolarHBondContact O-N 2.78Å; L243-A245 HydrophobicContact CD2-CB 3.99Å; L243-A245 HydrophobicContact CG-CB 4.09Å; L243-A245 PolarHBondContact O-N 3.42Å; L243-A245 VanDerWaalsContact O-N 3.15Å; L243-T246 WeakPolarHBondContact O-CB 3.34Å; L243-T246 PolarHBondContact O-N 2.99Å; L243-T246 PolarHBondContact O-OG1 2.92Å
244	A	76.5	Confident	72.3	Confident	64 Å²	64	60.6 Å²	60.6	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-54.6	-38	179.3	0	0	0	0	0	112.4	T246 N247 Y248	A244-T246 VanDerWaalsContact C-N 3.29Å; A244-T246 PolarHBondContact O-N 2.81Å; A244-N247 WeakPolarHBondContact O-CB 3.43Å; A244-N247 PolarHBondContact O-N 2.87Å; A244-N247 VanDerWaalsContact O-N 3.08Å; A244-Y248 HydrophobicContact CB-CE2 4.46Å; A244-Y248 WeakPolarHBondContact O-CD2 3.18Å; A244-Y248 PolarHBondContact O-N 3.44Å
245	A	82	Confident	74.2	Confident	28 Å²	28	57.1 Å²	57.1	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-55.4	-37.6	176.5	0	0	0	0	0	113.7	T151 L243 N247 Y248 F249	T151-A245 HydrophobicContact CG2-CB 4.35Å; L243-A245 HydrophobicContact CD2-CB 3.99Å; L243-A245 HydrophobicContact CG-CB 4.09Å; L243-A245 PolarHBondContact O-N 3.42Å; L243-A245 VanDerWaalsContact O-N 3.15Å; A245-N247 PolarHBondContact O-N 3.49Å; A245-N247 VanDerWaalsContact O-N 3.14Å; A245-Y248 PolarHBondContact O-N 2.96Å; A245-Y248 VanDerWaalsContact O-N 3.12Å; A245-F249 HydrophobicContact CB-CD2 4.24Å; A245-F249 HydrophobicContact CB-CE2 4.2Å; A245-F249 VanDerWaalsContact O-CD2 3.25Å; A245-F249 WeakPolarHBondContact O-CD2 3.45Å; A245-F249 PolarHBondContact O-N 2.82Å
246	T	84.1	Confident	76.4	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.049	28%	0.28	C	S	.	.	H	α-helix	trans	-57.2	-32.8	178.5	-53.1	0	0	0	0	111.7	H148 T151 R152 E155 L243 A244 L250	H148-T246 PolarHBondContact CE1-O 3.09Å; H148-T246 PolarHBondContact ND1-O 3.37Å; T151-T246 VanDerWaalsContact CB-OG1 3.31Å; T151-T246 WeakPolarHBondContact CB-OG1 3.29Å; T151-T246 PolarHBondContact OG1-OG1 2.84Å; R152-T246 HydrophobicContact CB-CG2 4.41Å; E155-T246 WeakPolarHBondContact OE1-CB 3.28Å; E155-T246 PolarHBondContact OE1-OG1 3.27Å; L243-T246 WeakPolarHBondContact O-CB 3.34Å; L243-T246 PolarHBondContact O-N 2.99Å; L243-T246 PolarHBondContact O-OG1 2.92Å; A244-T246 VanDerWaalsContact C-N 3.29Å; A244-T246 PolarHBondContact O-N 2.81Å; T246-L250 PolarHBondContact O-N 3.25Å
247	N	79.9	Confident	78.6	Confident	26 Å²	26	49 Å²	49	14%	0.139	25%	0.248	C	C	.	.	H	α-helix	trans	-79.7	-35.5	178.7	-76.4	-84.4	0	0	0	113.6	K224 E242 A244 A245 K470	K224-N247 PolarHBondContact NZ-ND2 2.66Å; K224-N247 PolarHBondContact NZ-OD1 2.72Å; E242-N247 PolarHBondContact OE1-ND2 3.16Å; A244-N247 WeakPolarHBondContact O-CB 3.43Å; A244-N247 PolarHBondContact O-N 2.87Å; A244-N247 VanDerWaalsContact O-N 3.08Å; A245-N247 PolarHBondContact O-N 3.49Å; A245-N247 VanDerWaalsContact O-N 3.14Å; N247-K470 PolarHBondContact OD1-NZ 2.96Å; N247-K470 VanDerWaalsContact OD1-NZ 3.13Å
248	Y	81.6	Confident	80.7	Confident	69 Å²	69	45.1 Å²	45.1	27%	0.271	23%	0.225	S	C	.	.	H	α-helix	trans	-72.7	-33	177.7	-71.8	-67.5	0	0	0	112.7	A244 A245 P251 E317 F467	A244-Y248 HydrophobicContact CB-CE2 4.46Å; A244-Y248 WeakPolarHBondContact O-CD2 3.18Å; A244-Y248 PolarHBondContact O-N 3.44Å; A245-Y248 PolarHBondContact O-N 2.96Å; A245-Y248 VanDerWaalsContact O-N 3.12Å; Y248-P251 WeakPolarHBondContact O-CD 3.41Å; Y248-E317 PolarHBondContact OH-OE2 3.29Å; Y248-E317 VanDerWaalsContact OH-OE2 3.08Å; Y248-F467 HydrophobicContact CD1-CD1 4.04Å
249	F	87.2	Confident	82.5	Confident	55 Å²	55	40.7 Å²	40.7	24%	0.241	21%	0.205	C	C	.	.	S	Bend	trans	-89.7	-5	177.2	-64.2	-64.5	0	0	0	114.3	M144 V147 H148 A245 A252	M144-F249 HydrophobicContact CB-CD1 3.89Å; M144-F249 HydrophobicContact CB-CE1 4.47Å; M144-F249 HydrophobicContact CG-CD1 3.91Å; M144-F249 HydrophobicContact CG-CE1 4.05Å; M144-F249 HydrophobicContact SD-CD1 4.43Å; V147-F249 HydrophobicContact CB-CD2 4.38Å; V147-F249 HydrophobicContact CG1-CD2 3.58Å; V147-F249 HydrophobicContact CG1-CE2 3.55Å; V147-F249 HydrophobicContact CG1-CG 4.26Å; V147-F249 HydrophobicContact CG1-CZ 4.19Å; H148-F249 HydrophobicContact CB-CB 3.79Å; A245-F249 HydrophobicContact CB-CD2 4.24Å; A245-F249 HydrophobicContact CB-CE2 4.2Å; A245-F249 VanDerWaalsContact O-CD2 3.25Å; A245-F249 WeakPolarHBondContact O-CD2 3.45Å; A245-F249 PolarHBondContact O-N 2.82Å; F249-A252 WeakPolarHBondContact O-CB 3.48Å; F249-A252 PolarHBondContact O-N 2.99Å
250	L	83.6	Confident	84.1	Confident	14 Å²	14	33.5 Å²	33.5	7%	0.073	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-39.4	176.5	179.4	65.5	0	0	0	114	K221 T246 A252 V253 P254	K221-L250 HydrophobicContact CB-CD2 4.41Å; T246-L250 PolarHBondContact O-N 3.25Å; L250-A252 VanDerWaalsContact C-N 3.27Å; L250-A252 PolarHBondContact O-N 3.24Å; L250-V253 PolarHBondContact O-N 3.44Å; L250-P254 VanDerWaalsContact O-CD 3.26Å; L250-P254 WeakPolarHBondContact O-CD 3.38Å
251	P	84.9	Confident	85.5	Confident	22 Å²	22	27.4 Å²	27.4	14%	0.143	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.6	173.8	-28.7	38.6	0	0	0	115.2	Y248 V253 P254 E255 M503	Y248-P251 WeakPolarHBondContact O-CD 3.41Å; P251-V253 VanDerWaalsContact C-N 3.26Å; P251-V253 PolarHBondContact O-N 2.84Å; P251-P254 WeakPolarHBondContact O-CD 3.31Å; P251-P254 VanDerWaalsContact O-CG 3.27Å; P251-P254 WeakPolarHBondContact O-CG 3.09Å; P251-E255 PolarHBondContact O-N 3.5Å; P251-M503 HydrophobicContact CB-CE 3.77Å; P251-M503 HydrophobicContact CB-SD 4.3Å; P251-M503 HydrophobicContact CG-CE 4.41Å
252	A	88.5	Confident	86.5	Confident	5 Å²	5	24.5 Å²	24.5	4%	0.041	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-26.2	-175.7	0	0	0	0	0	113.7	F141 M144 S145 F249 L250 Y256	F141-A252 HydrophobicContact CD1-CB 4.11Å; M144-A252 HydrophobicContact CB-CB 3.33Å; M144-A252 HydrophobicContact CG-CB 4.26Å; M144-A252 HydrophobicContact SD-CB 3.93Å; S145-A252 PolarHBondContact OG-O 2.84Å; F249-A252 WeakPolarHBondContact O-CB 3.48Å; F249-A252 PolarHBondContact O-N 2.99Å; L250-A252 VanDerWaalsContact C-N 3.27Å; L250-A252 PolarHBondContact O-N 3.24Å; A252-Y256 VanDerWaalsContact O-CB 3.31Å; A252-Y256 WeakPolarHBondContact O-CB 3.45Å; A252-Y256 PolarHBondContact O-N 2.96Å
253	V	92.3	Very high	87.2	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-65.5	-56	179.4	178.6	0	0	0	0	112.2	S145 H148 F177 I213 A217 L250 P251 E255 Y256 C257	S145-V253 WeakPolarHBondContact OG-CA 3.45Å; H148-V253 HydrophobicContact CB-CG2 4.4Å; F177-V253 HydrophobicContact CZ-CG1 4.27Å; I213-V253 HydrophobicContact CG2-CG1 3.7Å; A217-V253 HydrophobicContact CB-CB 4.2Å; A217-V253 HydrophobicContact CB-CG1 3.85Å; L250-V253 PolarHBondContact O-N 3.44Å; P251-V253 VanDerWaalsContact C-N 3.26Å; P251-V253 PolarHBondContact O-N 2.84Å; V253-E255 VanDerWaalsContact C-N 3.31Å; V253-E255 PolarHBondContact O-N 3.25Å; V253-Y256 PolarHBondContact O-N 3.4Å; V253-C257 PolarHBondContact O-N 3.44Å; V253-C257 PolarHBondContact O-SG 3.41Å
254	P	90.7	Very high	87.7	Confident	4 Å²	4	17.2 Å²	17.2	3%	0.026	11%	0.105	C	C	.	.	H	α-helix	trans	-66.1	-30.8	176	25.1	-33.8	0	0	0	112.8	W214 A217 L250 P251 C257 A258 P500	W214-P254 HydrophobicContact CG-CB 4.38Å; A217-P254 HydrophobicContact CB-CG 4.39Å; L250-P254 VanDerWaalsContact O-CD 3.26Å; L250-P254 WeakPolarHBondContact O-CD 3.38Å; P251-P254 WeakPolarHBondContact O-CD 3.31Å; P251-P254 VanDerWaalsContact O-CG 3.27Å; P251-P254 WeakPolarHBondContact O-CG 3.09Å; P254-C257 PolarHBondContact O-N 3.15Å; P254-A258 VanDerWaalsContact O-CB 3.32Å; P254-A258 WeakPolarHBondContact O-CB 3.46Å; P254-A258 PolarHBondContact O-N 2.93Å; P254-P500 HydrophobicContact CB-CB 3.86Å; P254-P500 HydrophobicContact CB-CG 4.24Å; P254-P500 HydrophobicContact CG-CB 3.77Å; P254-P500 HydrophobicContact CG-CG 3.89Å
255	E	88.5	Confident	88.2	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-66	-45.4	174.6	-74.4	172.5	-121.6	0	0	111.9	F141 P251 V253 C257 A258 I259 W462 M503	F141-E255 HydrophobicContact CD1-CB 3.88Å; F141-E255 HydrophobicContact CE1-CB 3.74Å; F141-E255 HydrophobicContact CE1-CG 4.38Å; F141-E255 WeakPolarHBondContact CE1-OE2 3.11Å; F141-E255 HydrophobicContact CG-CB 4.36Å; F141-E255 HydrophobicContact CZ-CB 4.14Å; F141-E255 VanDerWaalsContact CZ-OE2 3.29Å; F141-E255 WeakPolarHBondContact CZ-OE2 3.49Å; P251-E255 PolarHBondContact O-N 3.5Å; V253-E255 VanDerWaalsContact C-N 3.31Å; V253-E255 PolarHBondContact O-N 3.25Å; E255-C257 PolarHBondContact O-N 3.02Å; E255-A258 PolarHBondContact O-N 2.69Å; E255-I259 WeakPolarHBondContact O-CG1 3.24Å; E255-I259 PolarHBondContact O-N 3.35Å; E255-I259 VanDerWaalsContact O-N 3.12Å; E255-W462 PolarHBondContact OE2-NE1 3.05Å; E255-M503 WeakPolarHBondContact OE1-CB 3.42Å; E255-M503 WeakPolarHBondContact OE1-CE 3.39Å
256	Y	93.9	Very high	88.2	Confident	1 Å²	1	19.2 Å²	19.2	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-56	-50.7	170.6	178.3	-97.4	0	0	0	111.7	I138 F141 A142 F177 Q180 T181 A252 V253 A258 I259 A260	I138-Y256 HydrophobicContact CG2-CE2 3.85Å; F141-Y256 HydrophobicContact CB-CD2 4.16Å; F141-Y256 HydrophobicContact CB-CG 4.5Å; A142-Y256 HydrophobicContact CB-CD2 3.99Å; A142-Y256 HydrophobicContact CB-CE2 3.65Å; F177-Y256 AromaticContact CD1-CD1 3.69Å; F177-Y256 HydrophobicContact CD1-CD1 3.69Å; F177-Y256 AromaticContact CD1-CE1 3.46Å; F177-Y256 HydrophobicContact CD1-CE1 3.46Å; F177-Y256 VanDerWaalsContact CD1-CE1 3.46Å; F177-Y256 HydrophobicContact CD1-CG 4.44Å; F177-Y256 AromaticContact CE1-CD1 3.56Å; F177-Y256 HydrophobicContact CE1-CD1 3.56Å; F177-Y256 AromaticContact CE1-CE1 3.76Å; F177-Y256 HydrophobicContact CE1-CE1 3.76Å; F177-Y256 HydrophobicContact CE1-CG 4.39Å; Q180-Y256 WeakPolarHBondContact CG-OH 3.4Å; Q180-Y256 PolarHBondContact NE2-OH 3.04Å; Q180-Y256 VanDerWaalsContact NE2-OH 3.13Å; T181-Y256 PolarHBondContact N-OH 2.84Å; T181-Y256 PolarHBondContact OG1-OH 2.77Å; A252-Y256 VanDerWaalsContact O-CB 3.31Å; A252-Y256 WeakPolarHBondContact O-CB 3.45Å; A252-Y256 PolarHBondContact O-N 2.96Å; V253-Y256 PolarHBondContact O-N 3.4Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; Y256-A258 PolarHBondContact O-N 3.06Å; Y256-I259 PolarHBondContact O-N 3.46Å; Y256-A260 HydrophobicContact CE1-CB 4.35Å; Y256-A260 VanDerWaalsContact O-CB 3.31Å; Y256-A260 WeakPolarHBondContact O-CB 3.4Å; Y256-A260 PolarHBondContact O-N 2.98Å
257	C	94.4	Very high	88.1	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-63.3	-39	-175.9	-65	0	0	0	0	111.8	N210 I213 W214 V253 P254 E255 A260 V261	N210-C257 HydrophobicContact CB-CB 4.36Å; I213-C257 VanDerWaalsContact CG2-SG 3.51Å; W214-C257 HydrophobicContact CB-CB 3.95Å; V253-C257 PolarHBondContact O-N 3.44Å; V253-C257 PolarHBondContact O-SG 3.41Å; P254-C257 PolarHBondContact O-N 3.15Å; E255-C257 PolarHBondContact O-N 3.02Å; C257-A260 PolarHBondContact O-N 3.13Å; C257-V261 WeakPolarHBondContact O-CB 3.18Å; C257-V261 VanDerWaalsContact O-CG2 3.26Å; C257-V261 WeakPolarHBondContact O-CG2 3.44Å; C257-V261 PolarHBondContact O-N 2.86Å
258	A	91.2	Very high	88.3	Confident	14 Å²	14	18.9 Å²	18.9	12%	0.116	9%	0.092	C	C	.	.	H	α-helix	trans	-67.4	-41.9	178	0	0	0	0	0	112.4	P254 E255 Y256 A262 M501 L504	P254-A258 VanDerWaalsContact O-CB 3.32Å; P254-A258 WeakPolarHBondContact O-CB 3.46Å; P254-A258 PolarHBondContact O-N 2.93Å; E255-A258 PolarHBondContact O-N 2.69Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; Y256-A258 PolarHBondContact O-N 3.06Å; A258-A262 WeakPolarHBondContact O-CB 3.47Å; A258-A262 PolarHBondContact O-N 3.2Å; A258-M501 HydrophobicContact CB-SD 4.14Å; A258-L504 HydrophobicContact CB-CD2 3.57Å
259	I	90	Very high	88.1	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-65	-42.8	173.7	-66	166.7	0	0	0	110.6	L134 I138 F141 E255 Y256 A262 V263 L504 Y507	L134-I259 HydrophobicContact CD1-CG2 3.8Å; L134-I259 HydrophobicContact CG-CG2 4.09Å; I138-I259 HydrophobicContact CD1-CG2 4.29Å; I138-I259 HydrophobicContact CG1-CG2 3.56Å; F141-I259 HydrophobicContact CD2-CD1 3.49Å; F141-I259 VanDerWaalsContact CD2-CD1 3.49Å; F141-I259 HydrophobicContact CE2-CD1 3.56Å; E255-I259 WeakPolarHBondContact O-CG1 3.24Å; E255-I259 PolarHBondContact O-N 3.35Å; E255-I259 VanDerWaalsContact O-N 3.12Å; Y256-I259 PolarHBondContact O-N 3.46Å; I259-A262 PolarHBondContact O-N 2.94Å; I259-V263 PolarHBondContact O-N 3.44Å; I259-L504 HydrophobicContact CD1-CD1 3.88Å; I259-L504 HydrophobicContact CG1-CD1 3.6Å; I259-Y507 HydrophobicContact CD1-CE1 4.28Å
260	A	93	Very high	87.2	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-61.4	-46.8	177.1	0	0	0	0	0	111.9	Q180 L184 N210 Y256 C257 A262 V263 V264	Q180-A260 VanDerWaalsContact NE2-CB 3.33Å; L184-A260 HydrophobicContact CD1-CB 4.01Å; N210-A260 WeakPolarHBondContact OD1-CB 3.29Å; Y256-A260 HydrophobicContact CE1-CB 4.35Å; Y256-A260 VanDerWaalsContact O-CB 3.31Å; Y256-A260 WeakPolarHBondContact O-CB 3.4Å; Y256-A260 PolarHBondContact O-N 2.98Å; C257-A260 PolarHBondContact O-N 3.13Å; A260-A262 VanDerWaalsContact C-N 3.31Å; A260-A262 PolarHBondContact O-N 3.22Å; A260-V263 PolarHBondContact O-N 3.39Å; A260-V264 WeakPolarHBondContact O-CB 3.39Å; A260-V264 WeakPolarHBondContact O-CG2 3.18Å; A260-V264 PolarHBondContact O-N 2.95Å
261	V	92.3	Very high	86.6	Confident	30 Å²	30	17.7 Å²	17.7	18%	0.182	9%	0.089	C	C	.	.	H	α-helix	trans	-57.2	-44.2	174.4	166.2	0	0	0	0	111	L207 N210 L211 C257 V264 Y265	L207-V261 HydrophobicContact CD1-CG1 4.37Å; L207-V261 HydrophobicContact CD2-CG1 4.46Å; L207-V261 HydrophobicContact CG-CG1 4.15Å; L207-V261 HydrophobicContact CG-CG2 4.4Å; N210-V261 HydrophobicContact CB-CG2 3.64Å; L211-V261 HydrophobicContact CD2-CG1 4.36Å; L211-V261 HydrophobicContact CD2-CG2 3.94Å; L211-V261 HydrophobicContact CG-CG2 4.06Å; C257-V261 WeakPolarHBondContact O-CB 3.18Å; C257-V261 VanDerWaalsContact O-CG2 3.26Å; C257-V261 WeakPolarHBondContact O-CG2 3.44Å; C257-V261 PolarHBondContact O-N 2.86Å; V261-V264 PolarHBondContact O-N 3.32Å; V261-Y265 WeakPolarHBondContact O-CB 2.94Å; V261-Y265 PolarHBondContact O-N 3.46Å
262	A	88.2	Confident	85.3	Confident	13 Å²	13	18 Å²	18	11%	0.107	10%	0.096	C	C	.	.	H	α-helix	trans	-62.3	-46.5	178.9	0	0	0	0	0	112.3	A258 I259 A260 Y265 E266 L367 L371	A258-A262 WeakPolarHBondContact O-CB 3.47Å; A258-A262 PolarHBondContact O-N 3.2Å; I259-A262 PolarHBondContact O-N 2.94Å; A260-A262 VanDerWaalsContact C-N 3.31Å; A260-A262 PolarHBondContact O-N 3.22Å; A262-Y265 PolarHBondContact O-N 3.36Å; A262-E266 PolarHBondContact O-N 2.97Å; A262-L367 HydrophobicContact CB-CD1 4.06Å; A262-L367 WeakPolarHBondContact O-CD1 3.5Å; A262-L371 HydrophobicContact CB-CD1 4.05Å; A262-L371 HydrophobicContact CB-CD2 4.13Å
263	V	88.2	Confident	83.8	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-69.9	-40.2	178.6	175.7	0	0	0	0	112	V130 L134 I138 L184 I259 A260 Y265 E266 L267 L367	V130-V263 HydrophobicContact CG1-CG2 4.45Å; V130-V263 HydrophobicContact CG2-CG1 4.39Å; L134-V263 HydrophobicContact CD2-CG2 3.53Å; L134-V263 HydrophobicContact CG-CG2 4.3Å; I138-V263 HydrophobicContact CD1-CG2 4.18Å; L184-V263 HydrophobicContact CD2-CG1 4.11Å; I259-V263 PolarHBondContact O-N 3.44Å; A260-V263 PolarHBondContact O-N 3.39Å; V263-Y265 VanDerWaalsContact C-N 3.33Å; V263-Y265 PolarHBondContact O-N 3.18Å; V263-E266 PolarHBondContact O-N 2.99Å; V263-L267 HydrophobicContact CG1-CD1 4.21Å; V263-L267 HydrophobicContact CG1-CG 4.44Å; V263-L267 WeakPolarHBondContact O-CB 3.25Å; V263-L267 VanDerWaalsContact O-CG 3.31Å; V263-L267 WeakPolarHBondContact O-CG 3.37Å; V263-L267 PolarHBondContact O-N 3.36Å; V263-L367 HydrophobicContact CG2-CD2 3.81Å
264	V	90.4	Very high	81.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.9	-38	175.7	174.5	0	0	0	0	111.4	L184 L203 I206 L207 A260 V261 L267 L268	L184-V264 HydrophobicContact CD2-CG2 3.64Å; L203-V264 HydrophobicContact CB-CG1 4Å; L203-V264 HydrophobicContact CD2-CG1 4.21Å; L203-V264 WeakPolarHBondContact O-CG1 3.33Å; I206-V264 HydrophobicContact CG2-CG2 4.15Å; L207-V264 HydrophobicContact CB-CG1 3.79Å; L207-V264 HydrophobicContact CD1-CG1 4.27Å; L207-V264 HydrophobicContact CG-CG1 4.5Å; A260-V264 WeakPolarHBondContact O-CB 3.39Å; A260-V264 WeakPolarHBondContact O-CG2 3.18Å; A260-V264 PolarHBondContact O-N 2.95Å; V261-V264 PolarHBondContact O-N 3.32Å; V264-L267 PolarHBondContact O-N 3.38Å; V264-L268 VanDerWaalsContact O-CB 3.28Å; V264-L268 WeakPolarHBondContact O-CB 3.47Å; V264-L268 PolarHBondContact O-N 3.07Å
265	Y	88.3	Confident	79.3	Confident	127 Å²	127	31.6 Å²	31.6	50%	0.498	16%	0.16	S	C	.	.	H	α-helix	trans	-63.4	-43.3	174	176.1	-96.6	0	0	0	112.1	V261 A262 V263 L268 H269	V261-Y265 WeakPolarHBondContact O-CB 2.94Å; V261-Y265 PolarHBondContact O-N 3.46Å; A262-Y265 PolarHBondContact O-N 3.36Å; V263-Y265 VanDerWaalsContact C-N 3.33Å; V263-Y265 PolarHBondContact O-N 3.18Å; Y265-L268 WeakPolarHBondContact O-CB 3.5Å; Y265-L268 PolarHBondContact O-N 3.26Å; Y265-H269 PolarHBondContact O-N 3.1Å
266	E	81.7	Confident	77.2	Confident	6 Å²	6	33.6 Å²	33.6	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-42.9	176.2	-174.1	57.9	-135	0	0	111.7	A262 V263 L268 H269 R270 L367 K370	A262-E266 PolarHBondContact O-N 2.97Å; V263-E266 PolarHBondContact O-N 2.99Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.27Å; E266-H269 PolarHBondContact O-N 3.29Å; E266-R270 WeakPolarHBondContact O-CD 3.25Å; E266-R270 VanDerWaalsContact O-CG 3.29Å; E266-R270 WeakPolarHBondContact O-CG 3.45Å; E266-R270 PolarHBondContact O-N 3.24Å; E266-R270 VanDerWaalsContact O-N 3.1Å; E266-R270 IonicContact OE1-CZ 3.22Å; E266-R270 IonicContact OE1-NE 3.24Å; E266-R270 PolarHBondContact OE1-NE 3.44Å; E266-R270 IonicContact OE1-NH2 3.18Å; E266-L367 HydrophobicContact CB-CB 4.46Å; E266-L367 HydrophobicContact CB-CD1 4.07Å; E266-L367 HydrophobicContact CB-CD2 4.03Å; E266-L367 HydrophobicContact CB-CG 4.42Å; E266-L367 HydrophobicContact CG-CB 4.12Å; E266-L367 HydrophobicContact CG-CD2 4.34Å; E266-K370 IonicContact OE2-NZ 2.72Å; E266-K370 PolarHBondContact OE2-NZ 3.35Å
267	L	82.2	Confident	74.8	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-56.2	-46.7	170.7	-73.4	172	0	0	0	111.2	L184 L187 L203 V263 V264 H269 R270 V271	L184-L267 HydrophobicContact CD2-CD1 4.08Å; L187-L267 WeakPolarHBondContact O-CD2 3.44Å; L203-L267 HydrophobicContact CD1-CB 3.77Å; V263-L267 HydrophobicContact CG1-CD1 4.21Å; V263-L267 HydrophobicContact CG1-CG 4.44Å; V263-L267 WeakPolarHBondContact O-CB 3.25Å; V263-L267 VanDerWaalsContact O-CG 3.31Å; V263-L267 WeakPolarHBondContact O-CG 3.37Å; V263-L267 PolarHBondContact O-N 3.36Å; V264-L267 PolarHBondContact O-N 3.38Å; L267-H269 VanDerWaalsContact C-N 3.33Å; L267-H269 PolarHBondContact O-N 2.84Å; L267-R270 PolarHBondContact O-N 3.06Å; L267-V271 VanDerWaalsContact O-CG2 3.24Å; L267-V271 WeakPolarHBondContact O-CG2 3.38Å; L267-V271 PolarHBondContact O-N 2.89Å
268	L	82.9	Confident	72.2	Confident	21 Å²	21	38.5 Å²	38.5	11%	0.11	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-40.4	179	178.1	66.1	0	0	0	112.2	L203 L204 V264 Y265 E266 V271	L203-L268 HydrophobicContact CB-CB 4.43Å; L203-L268 HydrophobicContact CB-CD1 4.3Å; L203-L268 HydrophobicContact CD1-CB 4.12Å; L204-L268 HydrophobicContact CD2-CD2 3.55Å; L204-L268 HydrophobicContact CG-CD1 4.18Å; L204-L268 HydrophobicContact CG-CD2 3.79Å; V264-L268 VanDerWaalsContact O-CB 3.28Å; V264-L268 WeakPolarHBondContact O-CB 3.47Å; V264-L268 PolarHBondContact O-N 3.07Å; Y265-L268 WeakPolarHBondContact O-CB 3.5Å; Y265-L268 PolarHBondContact O-N 3.26Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.27Å; L268-V271 PolarHBondContact O-N 3.3Å
269	H	76.9	Confident	69.6	Low	97 Å²	97	40.4 Å²	40.4	45%	0.449	21%	0.205	S	C	.	.	H	α-helix	trans	-66.4	-37.1	177.3	-174.9	-106.7	0	0	0	112.2	Y265 E266 L267 V271 Q273	Y265-H269 PolarHBondContact O-N 3.1Å; E266-H269 PolarHBondContact O-N 3.29Å; L267-H269 VanDerWaalsContact C-N 3.33Å; L267-H269 PolarHBondContact O-N 2.84Å; H269-V271 VanDerWaalsContact C-N 3.34Å; H269-V271 PolarHBondContact O-N 3.11Å; H269-Q273 PolarHBondContact CE1-NE2 2.83Å; H269-Q273 PolarHBondContact O-NE2 3.5Å
270	R	69.2	Low	67	Low	11 Å²	11	46.6 Å²	46.6	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-71.8	-22.5	178.1	-66.4	164.9	-178.8	-165	-3.4	113.5	E128 H188 E266 L267 G272 Q273	E128-R270 PolarHBondContact O-NH1 3.5Å; E128-R270 PolarHBondContact O-NH2 3.02Å; E128-R270 VanDerWaalsContact O-NH2 3.16Å; E128-R270 IonicContact OE2-CZ 3.57Å; E128-R270 IonicContact OE2-NH2 3.73Å; E128-R270 PolarHBondContact OE2-NH2 2.72Å; H188-R270 PolarHBondContact O-NH1 3.33Å; E266-R270 WeakPolarHBondContact O-CD 3.25Å; E266-R270 VanDerWaalsContact O-CG 3.29Å; E266-R270 WeakPolarHBondContact O-CG 3.45Å; E266-R270 PolarHBondContact O-N 3.24Å; E266-R270 VanDerWaalsContact O-N 3.1Å; E266-R270 IonicContact OE1-CZ 3.22Å; E266-R270 IonicContact OE1-NE 3.24Å; E266-R270 PolarHBondContact OE1-NE 3.44Å; E266-R270 IonicContact OE1-NH2 3.18Å; L267-R270 PolarHBondContact O-N 3.06Å; R270-G272 PolarHBondContact O-N 2.75Å; R270-Q273 PolarHBondContact O-N 3.41Å; R270-Q273 VanDerWaalsContact O-N 3.1Å
271	V	71.5	Confident	64.1	Low	4 Å²	4	54.1 Å²	54.1	2%	0.024	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	123.3	-179.5	-172.1	0	0	0	0	112.2	R45 I192 I196 F199 L203 L267 L268 H269 Q273	R45-V271 PolarHBondContact NH2-O 2.79Å; I192-V271 HydrophobicContact CB-CG1 4.39Å; I196-V271 HydrophobicContact CB-CG1 4.15Å; I196-V271 HydrophobicContact CG1-CG1 4.09Å; I196-V271 HydrophobicContact CG2-CG1 3.87Å; F199-V271 HydrophobicContact CD1-CB 4.4Å; F199-V271 HydrophobicContact CD1-CG1 3.94Å; F199-V271 HydrophobicContact CD1-CG2 3.47Å; F199-V271 VanDerWaalsContact CD1-CG2 3.47Å; F199-V271 HydrophobicContact CE1-CG2 3.54Å; L203-V271 HydrophobicContact CD1-CG2 3.96Å; L267-V271 VanDerWaalsContact O-CG2 3.24Å; L267-V271 WeakPolarHBondContact O-CG2 3.38Å; L267-V271 PolarHBondContact O-N 2.89Å; L268-V271 PolarHBondContact O-N 3.3Å; H269-V271 VanDerWaalsContact C-N 3.34Å; H269-V271 PolarHBondContact O-N 3.11Å; V271-Q273 VanDerWaalsContact C-N 3.33Å
272	G	57.8	Low	61.3	Low	28 Å²	28	58.8 Å²	58.8	29%	0.289	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	5.8	179	0	0	0	0	0	115.2	I192 R270 L274	I192-G272 PolarHBondContact O-N 2.78Å; R270-G272 PolarHBondContact O-N 2.75Å; G272-L274 PolarHBondContact O-N 3.31Å
273	Q	55.9	Low	58.5	Low	64 Å²	64	67.2 Å²	67.2	30%	0.299	32%	0.323	S	S	.	.			trans	-86	105.5	171.7	-57.4	-162.7	19.1	0	0	110.3	V191 H269 R270 V271 K275	V191-Q273 WeakPolarHBondContact CG1-O 3.23Å; H269-Q273 PolarHBondContact CE1-NE2 2.83Å; H269-Q273 PolarHBondContact O-NE2 3.5Å; R270-Q273 PolarHBondContact O-N 3.41Å; R270-Q273 VanDerWaalsContact O-N 3.1Å; V271-Q273 VanDerWaalsContact C-N 3.33Å; Q273-K275 PolarHBondContact O-N 3.06Å
274	L	46.2	Very low	55.9	Low	130 Å²	130	76.4 Å²	76.4	68%	0.681	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-61.8	-10.8	170.6	-97.6	85.1	0	0	0	113.5	L193 G272 Q276 I277	L193-L274 HydrophobicContact CD2-CD1 3.87Å; L193-L274 HydrophobicContact CD2-CG 4.11Å; G272-L274 PolarHBondContact O-N 3.31Å; L274-Q276 PolarHBondContact O-N 2.98Å; L274-I277 HydrophobicContact CB-CD1 4.28Å; L274-I277 HydrophobicContact CD2-CD1 4.47Å; L274-I277 HydrophobicContact CG-CD1 3.89Å; L274-I277 WeakPolarHBondContact O-CG1 3.35Å; L274-I277 PolarHBondContact O-N 3.39Å
275	K	42.1	Very low	53	Low	104 Å²	104	84.3 Å²	84.3	45%	0.452	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-70.8	7.7	-170.6	-155.4	-173.2	165.9	-167	0	115.1	Q273 G534	Q273-K275 PolarHBondContact O-N 3.06Å; K275-G534 WeakPolarHBondContact CE-O 3.39Å; K275-G534 WeakPolarHBondContact CG-O 3.19Å
276	Q	45.1	Very low	50.3	Low	44 Å²	44	86 Å²	86	21%	0.206	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-132	29.1	-177.8	-76.7	-176.1	-28.6	0	0	112.1	S124 V191 L274	S124-Q276 PolarHBondContact OG-O 3.27Å; V191-Q276 HydrophobicContact CG2-CB 3.94Å; L274-Q276 PolarHBondContact O-N 2.98Å
277	I	42.5	Very low	47.9	Very low	55 Å²	55	93.5 Å²	93.5	28%	0.282	45%	0.447	S	S	.	.			trans	-111.6	64.4	177.7	-42.4	168.2	0	0	0	109	L193 L274	L193-I277 HydrophobicContact CD1-CD1 3.42Å; L193-I277 VanDerWaalsContact CD1-CD1 3.42Å; L193-I277 HydrophobicContact CD1-CG1 4.24Å; L193-I277 HydrophobicContact CD2-CD1 4.08Å; L193-I277 HydrophobicContact CG-CD1 4.38Å; L274-I277 HydrophobicContact CB-CD1 4.28Å; L274-I277 HydrophobicContact CD2-CD1 4.47Å; L274-I277 HydrophobicContact CG-CD1 3.89Å; L274-I277 WeakPolarHBondContact O-CG1 3.35Å; L274-I277 PolarHBondContact O-N 3.39Å
278	E	41.3	Very low	45.4	Very low	49 Å²	49	100.2 Å²	100.2	23%	0.229	48%	0.478	C	S	.	.			trans	-122.7	139.5	174	-101.7	-170.2	-136	0	0	112.7	R126 Q280 R533 H537	R126-E278 WeakPolarHBondContact CD-O 3.44Å; E278-Q280 PolarHBondContact O-N 2.87Å; E278-R533 WeakPolarHBondContact OE2-CA 3.31Å; E278-R533 WeakPolarHBondContact OE2-CB 3.49Å; E278-R533 WeakPolarHBondContact OE2-CG 3.41Å; E278-H537 IonicContact OE1-CE1 3.04Å; E278-H537 PolarHBondContact OE1-CE1 3.05Å; E278-H537 IonicContact OE1-ND1 3.91Å; E278-H537 IonicContact OE1-NE2 3.28Å
279	C	35.2	Very low	43.2	Very low	55 Å²	55	104 Å²	104	37%	0.372	50%	0.502	S	S	.	.			trans	-93.4	93.6	-164.5	-70.7	0	0	0	0	112.4	R126 H281	R126-C279 PolarHBondContact NH1-SG 3.32Å; C279-H281 PolarHBondContact O-N 2.93Å
280	Q	35.1	Very low	41	Very low	130 Å²	130	108.4 Å²	108.4	61%	0.607	52%	0.519	S	S	*	.			trans	-68.9	105.1	153.9	-92.3	-159.4	-31.4	0	0	109.4	R126 E278	R126-Q280 PolarHBondContact NH2-O 3.48Å; E278-Q280 PolarHBondContact O-N 2.87Å
281	H	33	Very low	39.5	Very low	159 Å²	159	111.9 Å²	111.9	74%	0.736	54%	0.544	S	S	*	.			trans	-124.7	56.7	162.7	-163.7	-57.7	0	0	0	109.5	C279	C279-H281 PolarHBondContact O-N 2.93Å
282	E	34.3	Very low	38.1	Very low	128 Å²	128	117.2 Å²	117.2	60%	0.598	58%	0.576	S	S	*	*			trans	-112.5	128.3	155.7	-73.3	-171	129.7	0	0	107.8	K284	E282-K284 PolarHBondContact O-N 3.39Å
283	K	29.5	Very low	37.9	Very low	190 Å²	190	122.2 Å²	122.2	83%	0.826	60%	0.597	S	S	*	*			trans	-56.1	134.1	158	-71.4	175.3	177	175.5	0	105.7	E285	K283-E285 VanDerWaalsContact C-N 3.3Å; K283-E285 PolarHBondContact O-N 3.49Å
284	K	32.4	Very low	37.7	Very low	196 Å²	196	129 Å²	129	85%	0.852	62%	0.62	S	S	*	*			trans	-57.7	104.9	157.5	-80.4	-178.2	175.1	178.5	0	106.2	E282 E286	E282-K284 PolarHBondContact O-N 3.39Å; K284-E286 VanDerWaalsContact C-N 3.35Å; K284-E286 PolarHBondContact O-N 2.86Å; K284-E286 VanDerWaalsContact O-N 3.09Å
285	E	29.5	Very low	38.3	Very low	166 Å²	166	124.2 Å²	124.2	78%	0.776	60%	0.601	S	S	*	*			trans	-57.3	114	145.8	-73.4	-160.4	153.2	0	0	105.1	K283 H287	K283-E285 VanDerWaalsContact C-N 3.3Å; K283-E285 PolarHBondContact O-N 3.49Å; E285-H287 PolarHBondContact O-N 2.93Å
286	E	30.7	Very low	39.8	Very low	162 Å²	162	120.8 Å²	120.8	76%	0.757	59%	0.59	S	S	*	*			trans	-66.4	86.2	168.9	-68.9	-170.1	148.8	0	0	107.2	K284 H288	K284-E286 VanDerWaalsContact C-N 3.35Å; K284-E286 PolarHBondContact O-N 2.86Å; K284-E286 VanDerWaalsContact O-N 3.09Å; E286-H288 PolarHBondContact O-N 3.4Å
287	H	32.4	Very low	41.4	Very low	164 Å²	164	123.2 Å²	123.2	76%	0.759	60%	0.604	S	S	*	*			trans	-65.6	82.2	155.6	-111	24.4	0	0	0	106.9	E285 V289	E285-H287 PolarHBondContact O-N 2.93Å; H287-V289 PolarHBondContact O-N 3.48Å
288	H	29	Very low	43.2	Very low	148 Å²	148	120.7 Å²	120.7	69%	0.685	59%	0.591	S	S	*	*			trans	-71.6	60.6	178.9	-162	-62.3	0	0	0	108.5	E286 K290	E286-H288 PolarHBondContact O-N 3.4Å; H288-K290 PolarHBondContact O-N 2.79Å
289	V	37.8	Very low	45.2	Very low	101 Å²	101	122.2 Å²	122.2	61%	0.612	60%	0.6	S	S	*	*			trans	-56.4	105.3	172	177.3	0	0	0	0	105.9	H287 C291	H287-V289 PolarHBondContact O-N 3.48Å; V289-C291 PolarHBondContact O-N 3.18Å
290	K	30.1	Very low	47.7	Very low	188 Å²	188	124 Å²	124	82%	0.817	61%	0.605	S	S	*	*			trans	-59.6	84	174.7	-75	-178.1	175.8	177.8	0	108.7	H288 V292	H288-K290 PolarHBondContact O-N 2.79Å; K290-V292 PolarHBondContact O-N 3.13Å
291	C	38.3	Very low	50.2	Low	84 Å²	84	121.4 Å²	121.4	57%	0.568	60%	0.595	S	S	*	*			trans	-64.2	109.6	170.8	-81.5	0	0	0	0	107.3	V289 N293	V289-C291 PolarHBondContact O-N 3.18Å; C291-N293 PolarHBondContact O-N 3.1Å
292	V	41.5	Very low	52.6	Low	116 Å²	116	114 Å²	114	70%	0.703	56%	0.561	S	S	*	*			trans	-52	132.4	170.7	177	0	0	0	0	108.5	K290 R294	K290-V292 PolarHBondContact O-N 3.13Å; V292-R294 HydrophobicContact CG1-CG 4.41Å; V292-R294 PolarHBondContact O-N 2.93Å
293	N	53	Low	55.1	Low	134 Å²	134	111.3 Å²	111.3	72%	0.717	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-70.3	22.4	-157.5	-148.7	1.1	0	0	0	115.8	C291 G295 S296	C291-N293 PolarHBondContact O-N 3.1Å; N293-G295 VanDerWaalsContact C-N 3.32Å; N293-G295 PolarHBondContact O-N 3.45Å; N293-S296 PolarHBondContact O-OG 2.84Å
294	R	53.4	Low	58	Low	207 Å²	207	106.5 Å²	106.5	78%	0.781	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-75.8	-16.9	-179	-68	-179.3	-178.6	166.9	1.2	113.8	V292 S296	V292-R294 HydrophobicContact CG1-CG 4.41Å; V292-R294 PolarHBondContact O-N 2.93Å; R294-S296 VanDerWaalsContact C-N 3.32Å; R294-S296 PolarHBondContact O-N 2.87Å
295	G	58.8	Low	60.6	Low	28 Å²	28	99 Å²	99	29%	0.289	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-73.6	-18.1	-177.4	0	0	0	0	0	115	N293 Y517	N293-G295 VanDerWaalsContact C-N 3.32Å; N293-G295 PolarHBondContact O-N 3.45Å; G295-Y517 PolarHBondContact O-OH 3.13Å
296	S	71.8	Confident	63.4	Low	32 Å²	32	92.9 Å²	92.9	22%	0.224	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-80.2	-20.3	-174.6	52.9	0	0	0	0	114.1	N293 R294 G298 I299 I300	N293-S296 PolarHBondContact O-OG 2.84Å; R294-S296 VanDerWaalsContact C-N 3.32Å; R294-S296 PolarHBondContact O-N 2.87Å; S296-G298 VanDerWaalsContact C-N 3.29Å; S296-G298 PolarHBondContact O-N 3.18Å; S296-I299 WeakPolarHBondContact O-CA 3.1Å; S296-I299 WeakPolarHBondContact O-CB 3.21Å; S296-I299 PolarHBondContact O-N 3.27Å; S296-I300 WeakPolarHBondContact O-CG1 3.19Å; S296-I300 PolarHBondContact O-N 3.46Å
297	I	80.4	Confident	66.2	Low	96 Å²	96	89.5 Å²	89.5	49%	0.492	47%	0.47	S	S	.	.	H	α-helix	trans	-53.2	-44.8	-174.6	-61.1	172.4	0	0	0	111.9	I299 I300 I301	I297-I299 VanDerWaalsContact C-N 3.31Å; I297-I299 PolarHBondContact O-N 3.04Å; I297-I300 PolarHBondContact O-N 3.38Å; I297-I301 HydrophobicContact CG2-CD1 3.68Å; I297-I301 HydrophobicContact CG2-CG1 4.36Å; I297-I301 WeakPolarHBondContact O-CG1 3.32Å; I297-I301 PolarHBondContact O-N 3.13Å
298	G	78.9	Confident	68.9	Low	1 Å²	1	86.7 Å²	86.7	1%	0.01	46%	0.46	C	S	.	.	H	α-helix	trans	-66.7	-29.7	178.2	0	0	0	0	0	114	S296 G302	S296-G298 VanDerWaalsContact C-N 3.29Å; S296-G298 PolarHBondContact O-N 3.18Å; G298-G302 PolarHBondContact O-N 3.19Å
299	I	83.6	Confident	71.5	Confident	82 Å²	82	80.2 Å²	80.2	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-73	-47	173.5	-62	176.2	0	0	0	109.6	S296 I297 I301 G302 T303 A452 Y517	S296-I299 WeakPolarHBondContact O-CA 3.1Å; S296-I299 WeakPolarHBondContact O-CB 3.21Å; S296-I299 PolarHBondContact O-N 3.27Å; I297-I299 VanDerWaalsContact C-N 3.31Å; I297-I299 PolarHBondContact O-N 3.04Å; I299-I301 PolarHBondContact O-N 3.11Å; I299-G302 CarbonylContact O-C 3.49Å; I299-G302 WeakPolarHBondContact O-CA 3.22Å; I299-G302 PolarHBondContact O-N 3.1Å; I299-G302 VanDerWaalsContact O-N 3.13Å; I299-T303 HydrophobicContact CG2-CG2 4.38Å; I299-T303 PolarHBondContact O-N 2.85Å; I299-T303 PolarHBondContact O-OG1 2.83Å; I299-A452 HydrophobicContact CG1-CB 4.46Å; I299-Y517 HydrophobicContact CD1-CE1 3.92Å; I299-Y517 VanDerWaalsContact CD1-OH 3.25Å; I299-Y517 WeakPolarHBondContact CD1-OH 3.39Å; I299-Y517 HydrophobicContact CG1-CE1 4.49Å; I299-Y517 HydrophobicContact CG1-CE2 4.48Å
300	I	87	Confident	73.7	Confident	91 Å²	91	78.3 Å²	78.3	47%	0.467	42%	0.416	S	S	.	.	H	α-helix	trans	-62.2	-45.4	-178.7	-63.6	164.7	0	0	0	111	S296 I297 G302 T303 I304	S296-I300 WeakPolarHBondContact O-CG1 3.19Å; S296-I300 PolarHBondContact O-N 3.46Å; I297-I300 PolarHBondContact O-N 3.38Å; I300-G302 VanDerWaalsContact C-N 3.33Å; I300-T303 PolarHBondContact O-OG1 3.42Å; I300-I304 HydrophobicContact CG2-CD1 4.11Å; I300-I304 WeakPolarHBondContact O-CD1 3.28Å; I300-I304 VanDerWaalsContact O-CG1 3.25Å; I300-I304 WeakPolarHBondContact O-CG1 3.39Å; I300-I304 PolarHBondContact O-N 2.85Å; I300-I304 VanDerWaalsContact O-N 3.12Å
301	I	87.7	Confident	76.3	Confident	77 Å²	77	70.9 Å²	70.9	40%	0.395	39%	0.392	S	S	.	.	H	α-helix	trans	-67.7	-37.6	175.2	-60.6	170.5	0	0	0	110.1	I297 I299 I304 I305 L453	I297-I301 HydrophobicContact CG2-CD1 3.68Å; I297-I301 HydrophobicContact CG2-CG1 4.36Å; I297-I301 WeakPolarHBondContact O-CG1 3.32Å; I297-I301 PolarHBondContact O-N 3.13Å; I299-I301 PolarHBondContact O-N 3.11Å; I301-I304 PolarHBondContact O-N 3.24Å; I301-I305 HydrophobicContact CG2-CD1 3.99Å; I301-I305 HydrophobicContact CG2-CG1 4.45Å; I301-I305 WeakPolarHBondContact O-CG1 3.32Å; I301-I305 PolarHBondContact O-N 3.49Å; I301-L453 HydrophobicContact CB-CD2 3.83Å; I301-L453 HydrophobicContact CG2-CD2 3.53Å
302	G	85.3	Confident	78.5	Confident	3 Å²	3	69.5 Å²	69.5	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-60.7	-44.9	175.5	0	0	0	0	0	113.6	G298 I299 I300 I305 I306 A456	G298-G302 PolarHBondContact O-N 3.19Å; I299-G302 CarbonylContact O-C 3.49Å; I299-G302 WeakPolarHBondContact O-CA 3.22Å; I299-G302 PolarHBondContact O-N 3.1Å; I299-G302 VanDerWaalsContact O-N 3.13Å; I300-G302 VanDerWaalsContact C-N 3.33Å; G302-I305 PolarHBondContact O-N 2.93Å; G302-I306 WeakPolarHBondContact O-CG1 3.47Å; G302-I306 PolarHBondContact O-N 3.37Å; G302-A456 WeakPolarHBondContact O-CB 3.38Å
303	T	86.1	Confident	80.4	Confident	72 Å²	72	64.2 Å²	64.2	44%	0.442	35%	0.349	S	S	.	.	H	α-helix	trans	-66.8	-38.2	176.4	53.7	0	0	0	0	111.6	I299 I300 I306 C307	I299-T303 HydrophobicContact CG2-CG2 4.38Å; I299-T303 PolarHBondContact O-N 2.85Å; I299-T303 PolarHBondContact O-OG1 2.83Å; I300-T303 PolarHBondContact O-OG1 3.42Å; T303-I306 PolarHBondContact O-N 3.32Å; T303-C307 PolarHBondContact O-N 3.13Å; T303-C307 PolarHBondContact O-SG 3.41Å
304	I	90.6	Very high	81.7	Confident	89 Å²	89	63.9 Å²	63.9	46%	0.456	35%	0.345	S	S	.	.	H	α-helix	trans	-60.4	-44.9	172.2	-68.3	165.1	0	0	0	111	I300 I301 I306 C307 I308	I300-I304 HydrophobicContact CG2-CD1 4.11Å; I300-I304 WeakPolarHBondContact O-CD1 3.28Å; I300-I304 VanDerWaalsContact O-CG1 3.25Å; I300-I304 WeakPolarHBondContact O-CG1 3.39Å; I300-I304 PolarHBondContact O-N 2.85Å; I300-I304 VanDerWaalsContact O-N 3.12Å; I301-I304 PolarHBondContact O-N 3.24Å; I304-I306 PolarHBondContact O-N 3.09Å; I304-C307 PolarHBondContact O-N 3.2Å; I304-I308 HydrophobicContact CG2-CD1 3.66Å; I304-I308 HydrophobicContact CG2-CG1 4.33Å; I304-I308 VanDerWaalsContact O-CG1 3.3Å; I304-I308 WeakPolarHBondContact O-CG1 3.48Å; I304-I308 PolarHBondContact O-N 3.14Å
305	I	87.7	Confident	83.2	Confident	37 Å²	37	58.7 Å²	58.7	19%	0.19	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-43.7	176.1	-71.7	166.6	0	0	0	111.3	I301 G302 I308 V309 L453 I457	I301-I305 HydrophobicContact CG2-CD1 3.99Å; I301-I305 HydrophobicContact CG2-CG1 4.45Å; I301-I305 WeakPolarHBondContact O-CG1 3.32Å; I301-I305 PolarHBondContact O-N 3.49Å; G302-I305 PolarHBondContact O-N 2.93Å; I305-I308 PolarHBondContact O-N 2.98Å; I305-V309 HydrophobicContact CG2-CG2 4.42Å; I305-V309 WeakPolarHBondContact O-CG2 3.22Å; I305-V309 PolarHBondContact O-N 3.47Å; I305-L453 HydrophobicContact CD1-CD2 3.75Å; I305-I457 HydrophobicContact CG2-CG1 4.21Å
306	I	87.5	Confident	84.2	Confident	39 Å²	39	58.8 Å²	58.8	20%	0.2	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-48.6	176.2	-66.9	164.2	0	0	0	110.2	G302 T303 I304 I308 V309 M310 A456 F459	G302-I306 WeakPolarHBondContact O-CG1 3.47Å; G302-I306 PolarHBondContact O-N 3.37Å; T303-I306 PolarHBondContact O-N 3.32Å; I304-I306 PolarHBondContact O-N 3.09Å; I306-I308 PolarHBondContact O-N 2.68Å; I306-V309 PolarHBondContact O-N 3.09Å; I306-M310 HydrophobicContact CG2-CG 4.26Å; I306-M310 VanDerWaalsContact O-CB 3.3Å; I306-M310 WeakPolarHBondContact O-CB 3.41Å; I306-M310 VanDerWaalsContact O-CG 3.23Å; I306-M310 WeakPolarHBondContact O-CG 3.34Å; I306-M310 PolarHBondContact O-N 3.1Å; I306-A456 HydrophobicContact CD1-CB 3.95Å; I306-A456 HydrophobicContact CG1-CB 4.05Å; I306-F459 HydrophobicContact CD1-CD1 3.92Å; I306-F459 HydrophobicContact CG1-CD1 4.12Å; I306-F459 HydrophobicContact CG2-CD1 4.03Å; I306-F459 HydrophobicContact CG2-CE1 4.1Å
307	C	88.8	Confident	84.5	Confident	91 Å²	91	58.4 Å²	58.4	62%	0.615	32%	0.32	S	S	*	.	H	α-helix	trans	-60.7	-41.2	178.3	-68.8	0	0	0	0	112.9	T303 I304 G311	T303-C307 PolarHBondContact O-N 3.13Å; T303-C307 PolarHBondContact O-SG 3.41Å; I304-C307 PolarHBondContact O-N 3.2Å; C307-G311 PolarHBondContact O-N 3.45Å
308	I	89.6	Confident	84.4	Confident	105 Å²	105	58.6 Å²	58.6	54%	0.538	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-51.5	177.5	-69.6	168.4	0	0	0	110.5	I304 I305 I306 M310 G311 V312	I304-I308 HydrophobicContact CG2-CD1 3.66Å; I304-I308 HydrophobicContact CG2-CG1 4.33Å; I304-I308 VanDerWaalsContact O-CG1 3.3Å; I304-I308 WeakPolarHBondContact O-CG1 3.48Å; I304-I308 PolarHBondContact O-N 3.14Å; I305-I308 PolarHBondContact O-N 2.98Å; I306-I308 PolarHBondContact O-N 2.68Å; I308-M310 VanDerWaalsContact C-N 3.3Å; I308-M310 PolarHBondContact O-N 3.3Å; I308-G311 WeakPolarHBondContact O-CA 3.47Å; I308-G311 PolarHBondContact O-N 3.01Å; I308-V312 WeakPolarHBondContact O-CG2 3.45Å; I308-V312 PolarHBondContact O-N 3.25Å
309	V	84.6	Confident	84.4	Confident	11 Å²	11	65.7 Å²	65.7	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-63.6	-37.6	179.8	177.3	0	0	0	0	111	I305 I306 G311 V312 V313 L338 I464	I305-V309 HydrophobicContact CG2-CG2 4.42Å; I305-V309 WeakPolarHBondContact O-CG2 3.22Å; I305-V309 PolarHBondContact O-N 3.47Å; I306-V309 PolarHBondContact O-N 3.09Å; V309-G311 VanDerWaalsContact C-N 3.31Å; V309-G311 PolarHBondContact O-N 3.35Å; V309-V312 PolarHBondContact O-N 3.28Å; V309-V313 HydrophobicContact CG1-CG2 4.08Å; V309-V313 WeakPolarHBondContact O-CB 3.4Å; V309-V313 WeakPolarHBondContact O-CG2 3.35Å; V309-V313 PolarHBondContact O-N 3.13Å; V309-L338 HydrophobicContact CG1-CD1 4.39Å; V309-L338 HydrophobicContact CG2-CD1 4.33Å; V309-L338 HydrophobicContact CG2-CD2 4.13Å; V309-I464 HydrophobicContact CG1-CD1 3.72Å; V309-I464 HydrophobicContact CG1-CG1 4.02Å
310	M	82.2	Confident	83.9	Confident	62 Å²	62	62.2 Å²	62.2	31%	0.305	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-38.6	172.6	-76.3	-53.7	-55.2	0	0	113	I306 I308 M314 M463	I306-M310 HydrophobicContact CG2-CG 4.26Å; I306-M310 VanDerWaalsContact O-CB 3.3Å; I306-M310 WeakPolarHBondContact O-CB 3.41Å; I306-M310 VanDerWaalsContact O-CG 3.23Å; I306-M310 WeakPolarHBondContact O-CG 3.34Å; I306-M310 PolarHBondContact O-N 3.1Å; I308-M310 VanDerWaalsContact C-N 3.3Å; I308-M310 PolarHBondContact O-N 3.3Å; M310-M314 WeakPolarHBondContact O-CB 3.17Å; M310-M314 PolarHBondContact O-N 2.95Å; M310-M463 HydrophobicContact CE-CE 3.44Å; M310-M463 VanDerWaalsContact CE-CE 3.44Å; M310-M463 HydrophobicContact SD-CB 3.78Å; M310-M463 HydrophobicContact SD-CE 3.26Å; M310-M463 WeakPolarHBondContact SD-CE 3.41Å; M310-M463 HydrophobicContact SD-CG 3.7Å; M310-M463 HydrophobicContact SD-SD 4.31Å
311	G	85.5	Confident	83	Confident	32 Å²	32	65.1 Å²	65.1	33%	0.33	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-46.1	171.6	0	0	0	0	0	112.4	C307 I308 V309 M314 L315	C307-G311 PolarHBondContact O-N 3.45Å; I308-G311 WeakPolarHBondContact O-CA 3.47Å; I308-G311 PolarHBondContact O-N 3.01Å; V309-G311 VanDerWaalsContact C-N 3.31Å; V309-G311 PolarHBondContact O-N 3.35Å; G311-M314 PolarHBondContact O-N 3.08Å; G311-L315 WeakPolarHBondContact O-CB 3.28Å; G311-L315 VanDerWaalsContact O-CG 3.25Å; G311-L315 WeakPolarHBondContact O-CG 3.23Å; G311-L315 PolarHBondContact O-N 3.46Å
312	V	84.9	Confident	82.3	Confident	54 Å²	54	70.1 Å²	70.1	33%	0.327	36%	0.36	S	S	.	.	H	α-helix	trans	-63.8	-46.1	177.7	178.4	0	0	0	0	111.4	I308 V309 M314 L315 L316 E334	I308-V312 WeakPolarHBondContact O-CG2 3.45Å; I308-V312 PolarHBondContact O-N 3.25Å; V309-V312 PolarHBondContact O-N 3.28Å; V312-M314 VanDerWaalsContact C-N 3.33Å; V312-M314 PolarHBondContact O-N 3.33Å; V312-L315 PolarHBondContact O-N 3.43Å; V312-L316 HydrophobicContact CG1-CD1 3.84Å; V312-L316 HydrophobicContact CG1-CG 4.19Å; V312-L316 WeakPolarHBondContact O-CB 3.27Å; V312-L316 WeakPolarHBondContact O-CG 3.25Å; V312-L316 PolarHBondContact O-N 3.41Å; V312-E334 HydrophobicContact CG1-CG 4.47Å; V312-E334 VanDerWaalsContact CG1-OE1 3.23Å; V312-E334 WeakPolarHBondContact CG1-OE1 3.45Å
313	V	81.5	Confident	81.7	Confident	5 Å²	5	73.3 Å²	73.3	3%	0.03	38%	0.376	C	S	.	.	H	α-helix	trans	-53.3	-49.7	173.3	167.8	0	0	0	0	111	V309 L315 L316 E317 I464 F467 Q468	V309-V313 HydrophobicContact CG1-CG2 4.08Å; V309-V313 WeakPolarHBondContact O-CB 3.4Å; V309-V313 WeakPolarHBondContact O-CG2 3.35Å; V309-V313 PolarHBondContact O-N 3.13Å; V313-L315 PolarHBondContact O-N 3.1Å; V313-L316 PolarHBondContact O-N 3.13Å; V313-E317 WeakPolarHBondContact O-CG 3.47Å; V313-E317 PolarHBondContact O-N 3.31Å; V313-I464 HydrophobicContact CG2-CG1 3.64Å; V313-F467 HydrophobicContact CG1-CB 4.03Å; V313-Q468 HydrophobicContact CG1-CG 4.11Å; V313-Q468 HydrophobicContact CG2-CG 4.48Å
314	M	79.9	Confident	81	Confident	127 Å²	127	75.5 Å²	75.5	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-65.1	-39.8	179.7	-174.5	175.5	179.6	0	0	112.1	M310 G311 V312 I318	M310-M314 WeakPolarHBondContact O-CB 3.17Å; M310-M314 PolarHBondContact O-N 2.95Å; G311-M314 PolarHBondContact O-N 3.08Å; V312-M314 VanDerWaalsContact C-N 3.33Å; V312-M314 PolarHBondContact O-N 3.33Å; M314-I318 HydrophobicContact CE-CD1 4.07Å; M314-I318 HydrophobicContact CG-CD1 3.9Å; M314-I318 WeakPolarHBondContact O-CB 2.82Å; M314-I318 WeakPolarHBondContact O-CD1 3.35Å; M314-I318 WeakPolarHBondContact O-CG1 3.08Å; M314-I318 PolarHBondContact O-N 2.84Å; M314-I318 VanDerWaalsContact O-N 3.12Å
315	L	83.8	Confident	80	Confident	98 Å²	98	76.8 Å²	76.8	51%	0.513	39%	0.388	S	S	.	.	H	α-helix	trans	-65.7	-46.9	176.7	-73.4	168.7	0	0	0	111.7	G311 V312 V313 E317 I318 W319	G311-L315 WeakPolarHBondContact O-CB 3.28Å; G311-L315 VanDerWaalsContact O-CG 3.25Å; G311-L315 WeakPolarHBondContact O-CG 3.23Å; G311-L315 PolarHBondContact O-N 3.46Å; V312-L315 PolarHBondContact O-N 3.43Å; V313-L315 PolarHBondContact O-N 3.1Å; L315-E317 PolarHBondContact O-N 3.48Å; L315-I318 PolarHBondContact O-N 2.96Å; L315-W319 WeakPolarHBondContact O-CB 3.31Å; L315-W319 PolarHBondContact O-N 3.46Å
316	L	80.9	Confident	79.7	Confident	30 Å²	30	82.7 Å²	82.7	16%	0.157	41%	0.41	C	S	.	.	H	α-helix	trans	-62.2	-40.9	178.5	-71.2	175.8	0	0	0	111.9	V312 V313 I318 G320 A330 E334	V312-L316 HydrophobicContact CG1-CD1 3.84Å; V312-L316 HydrophobicContact CG1-CG 4.19Å; V312-L316 WeakPolarHBondContact O-CB 3.27Å; V312-L316 WeakPolarHBondContact O-CG 3.25Å; V312-L316 PolarHBondContact O-N 3.41Å; V313-L316 PolarHBondContact O-N 3.13Å; L316-I318 PolarHBondContact O-N 3.29Å; L316-G320 WeakPolarHBondContact O-CA 3.3Å; L316-G320 PolarHBondContact O-N 3.2Å; L316-A330 HydrophobicContact CD2-CB 3.9Å; L316-E334 WeakPolarHBondContact CD1-OE2 3.38Å
317	E	77.4	Confident	79.5	Confident	25 Å²	25	81.4 Å²	81.4	12%	0.117	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-36.3	175.4	-75.1	-62	120.2	0	0	113.4	Y248 V313 L315 Q468 N472	Y248-E317 PolarHBondContact OH-OE2 3.29Å; Y248-E317 VanDerWaalsContact OH-OE2 3.08Å; V313-E317 WeakPolarHBondContact O-CG 3.47Å; V313-E317 PolarHBondContact O-N 3.31Å; L315-E317 PolarHBondContact O-N 3.48Å; E317-Q468 HydrophobicContact CG-CG 4.47Å; E317-N472 PolarHBondContact OE1-ND2 2.79Å
318	I	79.3	Confident	79.2	Confident	100 Å²	100	79.6 Å²	79.6	51%	0.513	38%	0.384	S	S	.	.	H	α-helix	trans	-72.8	-47	177.3	-70.3	166.6	0	0	0	110.9	M314 L315 L316	M314-I318 HydrophobicContact CE-CD1 4.07Å; M314-I318 HydrophobicContact CG-CD1 3.9Å; M314-I318 WeakPolarHBondContact O-CB 2.82Å; M314-I318 WeakPolarHBondContact O-CD1 3.35Å; M314-I318 WeakPolarHBondContact O-CG1 3.08Å; M314-I318 PolarHBondContact O-N 2.84Å; M314-I318 VanDerWaalsContact O-N 3.12Å; L315-I318 PolarHBondContact O-N 2.96Å; L316-I318 PolarHBondContact O-N 3.29Å
319	W	79.2	Confident	79.1	Confident	150 Å²	150	77.6 Å²	77.6	57%	0.568	37%	0.374	S	S	*	.	H	α-helix	trans	-79.5	-25.1	-174.6	-73.4	58.8	0	0	0	112.4	L315 K321 K322 I323	L315-W319 WeakPolarHBondContact O-CB 3.31Å; L315-W319 PolarHBondContact O-N 3.46Å; W319-K321 PolarHBondContact O-N 2.94Å; W319-K321 VanDerWaalsContact O-N 3.14Å; W319-K322 WeakPolarHBondContact O-CB 3.47Å; W319-K322 PolarHBondContact O-N 3.45Å; W319-I323 HydrophobicContact CE3-CD1 4Å; W319-I323 PolarHBondContact O-N 2.74Å
320	G	71.6	Confident	79.2	Confident	8 Å²	8	78.7 Å²	78.7	8%	0.082	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.7	-171.5	0	0	0	0	0	115.5	L316 K322 H324	L316-G320 WeakPolarHBondContact O-CA 3.3Å; L316-G320 PolarHBondContact O-N 3.2Å; G320-K322 VanDerWaalsContact C-N 3.3Å; G320-H324 PolarHBondContact O-ND1 3.3Å
321	K	68.3	Low	79.4	Confident	153 Å²	153	76.2 Å²	76.2	67%	0.665	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.3	169.4	-63.1	177.3	-175	170.4	0	113.8	W319	W319-K321 PolarHBondContact O-N 2.94Å; W319-K321 VanDerWaalsContact O-N 3.14Å
322	K	73.5	Confident	79.5	Confident	182 Å²	182	75 Å²	75	79%	0.791	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-26.8	178.1	-67.9	-173.3	176.4	-176.2	0	112.8	W319 G320	W319-K322 WeakPolarHBondContact O-CB 3.47Å; W319-K322 PolarHBondContact O-N 3.45Å; G320-K322 VanDerWaalsContact C-N 3.3Å
323	I	73.5	Confident	79.7	Confident	70 Å²	70	75.3 Å²	75.3	36%	0.359	36%	0.36	S	S	.	.			trans	-130	59.6	-167.8	-44	-177.9	0	0	0	110.1	W319 D325 Y326 V327	W319-I323 HydrophobicContact CE3-CD1 4Å; W319-I323 PolarHBondContact O-N 2.74Å; I323-D325 VanDerWaalsContact C-N 3.28Å; I323-D325 PolarHBondContact O-N 3.32Å; I323-D325 VanDerWaalsContact O-N 3.15Å; I323-Y326 HydrophobicContact CG2-CD2 3.56Å; I323-Y326 HydrophobicContact CG2-CG 4.1Å; I323-Y326 PolarHBondContact O-N 2.91Å; I323-V327 WeakPolarHBondContact O-CG2 3.43Å; I323-V327 PolarHBondContact O-N 3.32Å
324	H	70.7	Confident	80	Confident	118 Å²	118	76.1 Å²	76.1	55%	0.546	36%	0.364	S	S	.	.	H	α-helix	trans	-54.2	-37.8	-170.5	-83.1	-59.6	0	0	0	114.6	G320 Y328	G320-H324 PolarHBondContact O-ND1 3.3Å; H324-Y328 WeakPolarHBondContact O-CD2 3.35Å; H324-Y328 VanDerWaalsContact O-CE2 3.29Å; H324-Y328 WeakPolarHBondContact O-CE2 3.31Å
325	D	70.1	Confident	80.5	Confident	115 Å²	115	70.4 Å²	70.4	62%	0.615	34%	0.336	S	S	*	.	H	α-helix	trans	-73.3	-38	-174	-58.7	-21.3	0	0	0	113.5	I323	I323-D325 VanDerWaalsContact C-N 3.28Å; I323-D325 PolarHBondContact O-N 3.32Å; I323-D325 VanDerWaalsContact O-N 3.15Å
326	Y	81.8	Confident	81	Confident	162 Å²	162	66.1 Å²	66.1	64%	0.635	31%	0.314	S	S	*	.	H	α-helix	trans	-87.4	-15.4	-173.9	-64.7	-90.7	0	0	0	113.5	I323 Y328 I329 A330	I323-Y326 HydrophobicContact CG2-CD2 3.56Å; I323-Y326 HydrophobicContact CG2-CG 4.1Å; I323-Y326 PolarHBondContact O-N 2.91Å; Y326-Y328 PolarHBondContact O-N 3.48Å; Y326-I329 PolarHBondContact O-N 3.47Å; Y326-A330 PolarHBondContact O-N 2.95Å
327	V	83	Confident	81.5	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-42.1	-179.3	167.8	0	0	0	0	112.3	I323 I329 A330 H331 N472	I323-V327 WeakPolarHBondContact O-CG2 3.43Å; I323-V327 PolarHBondContact O-N 3.32Å; V327-I329 VanDerWaalsContact C-N 3.28Å; V327-I329 PolarHBondContact O-N 2.87Å; V327-A330 PolarHBondContact O-N 2.84Å; V327-H331 VanDerWaalsContact O-CB 3.28Å; V327-H331 WeakPolarHBondContact O-CB 3.25Å; V327-H331 PolarHBondContact O-N 3.26Å; V327-N472 HydrophobicContact CG1-CB 3.7Å; V327-N472 WeakPolarHBondContact CG1-OD1 3.34Å
328	Y	83	Confident	82.3	Confident	52 Å²	52	68.8 Å²	68.8	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-39.5	178.1	-55.6	-62.9	0	0	0	111.7	H324 Y326 S332 N472 I474 S477	H324-Y328 WeakPolarHBondContact O-CD2 3.35Å; H324-Y328 VanDerWaalsContact O-CE2 3.29Å; H324-Y328 WeakPolarHBondContact O-CE2 3.31Å; Y326-Y328 PolarHBondContact O-N 3.48Å; Y328-S332 VanDerWaalsContact O-CB 3.25Å; Y328-S332 WeakPolarHBondContact O-CB 3.2Å; Y328-S332 PolarHBondContact O-N 3.4Å; Y328-N472 WeakPolarHBondContact CD1-O 3.44Å; Y328-I474 HydrophobicContact CD1-CB 4.08Å; Y328-I474 HydrophobicContact CD1-CD1 3.88Å; Y328-I474 HydrophobicContact CD2-CD1 3.69Å; Y328-I474 HydrophobicContact CE1-CD1 4.2Å; Y328-I474 HydrophobicContact CE2-CD1 4Å; Y328-I474 HydrophobicContact CG-CB 4.3Å; Y328-I474 HydrophobicContact CG-CD1 3.61Å; Y328-S477 WeakPolarHBondContact CE1-OG 3.26Å; Y328-S477 PolarHBondContact OH-OG 3.03Å
329	I	86.5	Confident	83.1	Confident	64 Å²	64	64 Å²	64	33%	0.328	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-49.2	176.6	-56.8	176.8	0	0	0	109.9	Y326 V327 H331 S332 T333 L409	Y326-I329 PolarHBondContact O-N 3.47Å; V327-I329 VanDerWaalsContact C-N 3.28Å; V327-I329 PolarHBondContact O-N 2.87Å; I329-H331 PolarHBondContact O-N 3.41Å; I329-S332 PolarHBondContact O-N 3.07Å; I329-T333 HydrophobicContact CG2-CG2 4.46Å; I329-T333 WeakPolarHBondContact O-CG2 3.34Å; I329-T333 PolarHBondContact O-N 3.18Å; I329-T333 PolarHBondContact O-OG1 3.4Å; I329-T333 VanDerWaalsContact O-OG1 3.13Å; I329-L409 HydrophobicContact CG2-CD2 4.06Å
330	A	86.3	Confident	83.9	Confident	34 Å²	34	60.6 Å²	60.6	28%	0.281	30%	0.296	S	S	.	.	H	α-helix	trans	-62.2	-42.7	-179.4	0	0	0	0	0	113	L316 Y326 V327 T333 E334	L316-A330 HydrophobicContact CD2-CB 3.9Å; Y326-A330 PolarHBondContact O-N 2.95Å; V327-A330 PolarHBondContact O-N 2.84Å; A330-T333 PolarHBondContact O-N 3.35Å; A330-T333 PolarHBondContact O-OG1 3.36Å; A330-E334 WeakPolarHBondContact O-CB 3.26Å; A330-E334 PolarHBondContact O-N 2.94Å
331	H	86.3	Confident	85	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-44.6	175.3	177.7	70.6	0	0	0	111.6	V327 I329 T333 E334 T335 Q468 N472	V327-H331 VanDerWaalsContact O-CB 3.28Å; V327-H331 WeakPolarHBondContact O-CB 3.25Å; V327-H331 PolarHBondContact O-N 3.26Å; I329-H331 PolarHBondContact O-N 3.41Å; H331-T333 VanDerWaalsContact C-N 3.34Å; H331-T333 PolarHBondContact O-N 3.46Å; H331-E334 PolarHBondContact O-N 3.13Å; H331-T335 WeakPolarHBondContact O-CG2 3.32Å; H331-T335 PolarHBondContact O-N 2.86Å; H331-T335 VanDerWaalsContact O-N 3.09Å; H331-T335 PolarHBondContact O-OG1 3.05Å; H331-T335 VanDerWaalsContact O-OG1 3.11Å; H331-Q468 PolarHBondContact ND1-OE1 2.98Å; H331-N472 HydrophobicContact CB-CB 3.77Å; H331-N472 PolarHBondContact CD2-O 3.07Å
332	S	87.7	Confident	86.3	Confident	7 Å²	7	55.8 Å²	55.8	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-72.2	-24.3	-179.7	-163.2	0	0	0	0	113.4	Y328 I329 T335 S336	Y328-S332 VanDerWaalsContact O-CB 3.25Å; Y328-S332 WeakPolarHBondContact O-CB 3.2Å; Y328-S332 PolarHBondContact O-N 3.4Å; I329-S332 PolarHBondContact O-N 3.07Å; S332-T335 PolarHBondContact O-OG1 3.07Å; S332-S336 VanDerWaalsContact O-CB 3.3Å; S332-S336 WeakPolarHBondContact O-CB 3.32Å; S332-S336 PolarHBondContact O-N 2.65Å; S332-S336 PolarHBondContact O-OG 3.49Å
333	T	88.9	Confident	87.4	Confident	59 Å²	59	49 Å²	49	36%	0.362	25%	0.247	S	C	.	.	H	α-helix	trans	-79.3	-41.4	170.9	54.9	0	0	0	0	111.9	I329 A330 H331 T335 S336 I337 L409	I329-T333 HydrophobicContact CG2-CG2 4.46Å; I329-T333 WeakPolarHBondContact O-CG2 3.34Å; I329-T333 PolarHBondContact O-N 3.18Å; I329-T333 PolarHBondContact O-OG1 3.4Å; I329-T333 VanDerWaalsContact O-OG1 3.13Å; A330-T333 PolarHBondContact O-N 3.35Å; A330-T333 PolarHBondContact O-OG1 3.36Å; H331-T333 VanDerWaalsContact C-N 3.34Å; H331-T333 PolarHBondContact O-N 3.46Å; T333-T335 PolarHBondContact O-N 3.45Å; T333-S336 PolarHBondContact O-N 3.01Å; T333-I337 WeakPolarHBondContact O-CB 3.43Å; T333-I337 WeakPolarHBondContact O-CD1 3.46Å; T333-I337 VanDerWaalsContact O-CG1 3.25Å; T333-I337 WeakPolarHBondContact O-CG1 3.3Å; T333-I337 PolarHBondContact O-N 3.42Å; T333-L409 HydrophobicContact CG2-CD2 4.2Å
334	E	88.7	Confident	88.4	Confident	22 Å²	22	49.7 Å²	49.7	10%	0.103	25%	0.251	C	S	.	.	H	α-helix	trans	-53.7	-54.2	173.7	-179.6	-174.8	-155.4	0	0	111.3	V312 L316 A330 H331 S336 I337 L338 I464 Q468	V312-E334 HydrophobicContact CG1-CG 4.47Å; V312-E334 VanDerWaalsContact CG1-OE1 3.23Å; V312-E334 WeakPolarHBondContact CG1-OE1 3.45Å; L316-E334 WeakPolarHBondContact CD1-OE2 3.38Å; A330-E334 WeakPolarHBondContact O-CB 3.26Å; A330-E334 PolarHBondContact O-N 2.94Å; H331-E334 PolarHBondContact O-N 3.13Å; E334-S336 PolarHBondContact O-N 3.35Å; E334-I337 PolarHBondContact O-N 3.05Å; E334-L338 HydrophobicContact CG-CD1 4.37Å; E334-L338 WeakPolarHBondContact O-CG 3.46Å; E334-L338 PolarHBondContact O-N 2.92Å; E334-L338 VanDerWaalsContact O-N 3.08Å; E334-I464 HydrophobicContact CG-CD1 4.26Å; E334-Q468 PolarHBondContact OE2-NE2 3.44Å
335	T	90.9	Very high	89.6	Confident	7 Å²	7	46 Å²	46	4%	0.043	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-43.6	-179.9	53.5	0	0	0	0	111.9	H331 S332 T333 I337 L338 F339 S413 I464	H331-T335 WeakPolarHBondContact O-CG2 3.32Å; H331-T335 PolarHBondContact O-N 2.86Å; H331-T335 VanDerWaalsContact O-N 3.09Å; H331-T335 PolarHBondContact O-OG1 3.05Å; H331-T335 VanDerWaalsContact O-OG1 3.11Å; S332-T335 PolarHBondContact O-OG1 3.07Å; T333-T335 PolarHBondContact O-N 3.45Å; T335-I337 PolarHBondContact O-N 3.47Å; T335-L338 PolarHBondContact O-N 3.38Å; T335-F339 WeakPolarHBondContact O-CD2 3.45Å; T335-F339 VanDerWaalsContact O-CG 3.23Å; T335-F339 WeakPolarHBondContact O-CG 3.38Å; T335-F339 PolarHBondContact O-N 2.94Å; T335-S413 PolarHBondContact OG1-OG 3.41Å; T335-I464 HydrophobicContact CG2-CG2 3.93Å
336	S	93	Very high	90.8	Very high	8 Å²	8	40.5 Å²	40.5	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-40.7	178.4	-59.6	0	0	0	0	112.6	S332 T333 E334 F339 I340 S413 L416	S332-S336 VanDerWaalsContact O-CB 3.3Å; S332-S336 WeakPolarHBondContact O-CB 3.32Å; S332-S336 PolarHBondContact O-N 2.65Å; S332-S336 PolarHBondContact O-OG 3.49Å; T333-S336 PolarHBondContact O-N 3.01Å; E334-S336 PolarHBondContact O-N 3.35Å; S336-F339 PolarHBondContact O-N 3.4Å; S336-I340 WeakPolarHBondContact O-CG1 3.31Å; S336-I340 PolarHBondContact O-N 3.03Å; S336-S413 WeakPolarHBondContact OG-CB 3.37Å; S336-S413 PolarHBondContact OG-OG 3.2Å; S336-S413 VanDerWaalsContact OG-OG 3.06Å; S336-L416 WeakPolarHBondContact O-CD2 3.46Å
337	I	92.9	Very high	91.5	Very high	97 Å²	97	36.7 Å²	36.7	50%	0.497	20%	0.197	S	C	.	.	H	α-helix	trans	-62.2	-46.4	175.3	-70.6	164	0	0	0	110.2	T333 E334 T335 F339 I340 I341	T333-I337 WeakPolarHBondContact O-CB 3.43Å; T333-I337 WeakPolarHBondContact O-CD1 3.46Å; T333-I337 VanDerWaalsContact O-CG1 3.25Å; T333-I337 WeakPolarHBondContact O-CG1 3.3Å; T333-I337 PolarHBondContact O-N 3.42Å; E334-I337 PolarHBondContact O-N 3.05Å; T335-I337 PolarHBondContact O-N 3.47Å; I337-F339 VanDerWaalsContact C-N 3.34Å; I337-F339 PolarHBondContact O-N 2.84Å; I337-I340 PolarHBondContact O-N 2.76Å; I337-I341 HydrophobicContact CG2-CD1 3.76Å; I337-I341 WeakPolarHBondContact O-CG1 3.41Å; I337-I341 PolarHBondContact O-N 3.29Å
338	L	93.5	Very high	92	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.073	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-38.4	177.3	-69.9	173.8	0	0	0	112.4	V309 E334 T335 I341 A342 I457 L461 I464	V309-L338 HydrophobicContact CG1-CD1 4.39Å; V309-L338 HydrophobicContact CG2-CD1 4.33Å; V309-L338 HydrophobicContact CG2-CD2 4.13Å; E334-L338 HydrophobicContact CG-CD1 4.37Å; E334-L338 WeakPolarHBondContact O-CG 3.46Å; E334-L338 PolarHBondContact O-N 2.92Å; E334-L338 VanDerWaalsContact O-N 3.08Å; T335-L338 PolarHBondContact O-N 3.38Å; L338-I341 PolarHBondContact O-N 3.43Å; L338-A342 VanDerWaalsContact O-CB 3.22Å; L338-A342 WeakPolarHBondContact O-CB 3.49Å; L338-A342 PolarHBondContact O-N 3.36Å; L338-I457 HydrophobicContact CB-CG2 4.43Å; L338-I457 HydrophobicContact CD2-CG2 4.39Å; L338-L461 HydrophobicContact CB-CD2 3.98Å; L338-L461 HydrophobicContact CD1-CD2 4.03Å; L338-I464 HydrophobicContact CD1-CD1 3.34Å
339	F	95.4	Very high	92.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-40	175.6	-61.2	-37.3	0	0	0	112.8	T335 S336 I337 A342 L343 L416 E417 Q420 L461	T335-F339 WeakPolarHBondContact O-CD2 3.45Å; T335-F339 VanDerWaalsContact O-CG 3.23Å; T335-F339 WeakPolarHBondContact O-CG 3.38Å; T335-F339 PolarHBondContact O-N 2.94Å; S336-F339 PolarHBondContact O-N 3.4Å; I337-F339 VanDerWaalsContact C-N 3.34Å; I337-F339 PolarHBondContact O-N 2.84Å; F339-A342 PolarHBondContact O-N 3.39Å; F339-L343 VanDerWaalsContact O-CB 3.28Å; F339-L343 WeakPolarHBondContact O-CB 3.47Å; F339-L343 PolarHBondContact O-N 3.38Å; F339-L416 HydrophobicContact CB-CD2 3.86Å; F339-L416 HydrophobicContact CB-CG 3.77Å; F339-L416 HydrophobicContact CD2-CD2 4.37Å; F339-L416 HydrophobicContact CD2-CG 4.41Å; F339-E417 HydrophobicContact CD1-CG 4.43Å; F339-E417 HydrophobicContact CD2-CB 4.06Å; F339-E417 HydrophobicContact CE1-CB 4.36Å; F339-E417 HydrophobicContact CE1-CG 3.83Å; F339-E417 HydrophobicContact CE2-CB 3.67Å; F339-E417 HydrophobicContact CE2-CG 3.97Å; F339-E417 HydrophobicContact CZ-CB 3.85Å; F339-E417 HydrophobicContact CZ-CG 3.58Å; F339-Q420 HydrophobicContact CB-CB 4.36Å; F339-Q420 HydrophobicContact CB-CG 4.22Å; F339-Q420 HydrophobicContact CD1-CG 4.38Å; F339-Q420 WeakPolarHBondContact O-CG 3.42Å; F339-L461 HydrophobicContact CD1-CD1 4.02Å; F339-L461 HydrophobicContact CD1-CD2 4.11Å; F339-L461 HydrophobicContact CE1-CD1 3.88Å; F339-L461 HydrophobicContact CE1-CD2 3.61Å; F339-L461 HydrophobicContact CE1-CG 4.39Å; F339-L461 HydrophobicContact CZ-CD2 4.29Å
340	I	96	Very high	92.8	Very high	78 Å²	78	35.6 Å²	35.6	40%	0.4	19%	0.194	S	C	.	.	H	α-helix	trans	-61.5	-49.1	174.5	-69.2	164.6	0	0	0	110.3	S336 I337 A342 L343 I344 L416	S336-I340 WeakPolarHBondContact O-CG1 3.31Å; S336-I340 PolarHBondContact O-N 3.03Å; I337-I340 PolarHBondContact O-N 2.76Å; I340-A342 PolarHBondContact O-N 3.25Å; I340-L343 PolarHBondContact O-N 3.01Å; I340-I344 HydrophobicContact CG2-CD1 3.83Å; I340-I344 VanDerWaalsContact O-CG1 3.32Å; I340-I344 WeakPolarHBondContact O-CG1 3.45Å; I340-I344 PolarHBondContact O-N 3.25Å; I340-L416 HydrophobicContact CD1-CD2 4.38Å; I340-L416 HydrophobicContact CG1-CD1 4.17Å; I340-L416 HydrophobicContact CG1-CD2 3.87Å
341	I	94.5	Very high	93.1	Very high	61 Å²	61	42.2 Å²	42.2	31%	0.313	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-44	179.7	-63.4	167.7	0	0	0	110.6	I337 L338 L343 I344 F345 I457	I337-I341 HydrophobicContact CG2-CD1 3.76Å; I337-I341 WeakPolarHBondContact O-CG1 3.41Å; I337-I341 PolarHBondContact O-N 3.29Å; L338-I341 PolarHBondContact O-N 3.43Å; I341-L343 PolarHBondContact O-N 3.47Å; I341-I344 PolarHBondContact O-N 3.49Å; I341-F345 HydrophobicContact CG2-CD2 4.02Å; I341-F345 HydrophobicContact CG2-CE1 4.42Å; I341-F345 HydrophobicContact CG2-CE2 3.59Å; I341-F345 HydrophobicContact CG2-CZ 3.82Å; I341-F345 WeakPolarHBondContact O-CG 3.13Å; I341-F345 PolarHBondContact O-N 2.92Å; I341-I457 HydrophobicContact CB-CD1 4.43Å; I341-I457 HydrophobicContact CG2-CD1 3.66Å
342	A	95.6	Very high	93.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-42.8	176.3	0	0	0	0	0	112	L338 F339 I340 F345 C346 Q420 L454 I457	L338-A342 VanDerWaalsContact O-CB 3.22Å; L338-A342 WeakPolarHBondContact O-CB 3.49Å; L338-A342 PolarHBondContact O-N 3.36Å; F339-A342 PolarHBondContact O-N 3.39Å; I340-A342 PolarHBondContact O-N 3.25Å; A342-F345 PolarHBondContact O-N 3.48Å; A342-C346 PolarHBondContact O-N 3.25Å; A342-C346 PolarHBondContact O-SG 3.41Å; A342-Q420 HydrophobicContact CB-CG 3.93Å; A342-L454 HydrophobicContact CB-CD1 3.91Å; A342-I457 HydrophobicContact CB-CG2 4.02Å
343	L	96.6	Very high	93.4	Very high	40 Å²	40	42.1 Å²	42.1	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-43.2	177.3	-178.5	61.9	0	0	0	111.7	F339 I340 I341 C346 V347 I419 Q420 V423	F339-L343 VanDerWaalsContact O-CB 3.28Å; F339-L343 WeakPolarHBondContact O-CB 3.47Å; F339-L343 PolarHBondContact O-N 3.38Å; I340-L343 PolarHBondContact O-N 3.01Å; I341-L343 PolarHBondContact O-N 3.47Å; L343-C346 WeakPolarHBondContact O-CB 3.43Å; L343-C346 PolarHBondContact O-N 2.9Å; L343-V347 WeakPolarHBondContact O-CG2 3.43Å; L343-V347 PolarHBondContact O-N 3.48Å; L343-I419 HydrophobicContact CD1-CG2 4.24Å; L343-I419 HydrophobicContact CD2-CG2 4.13Å; L343-Q420 HydrophobicContact CB-CG 4.41Å; L343-V423 HydrophobicContact CD1-CB 3.93Å; L343-V423 HydrophobicContact CD1-CG1 4.02Å; L343-V423 HydrophobicContact CD1-CG2 3.99Å
344	I	95.8	Very high	93.3	Very high	84 Å²	84	47.8 Å²	47.8	43%	0.431	23%	0.227	S	C	.	.	H	α-helix	trans	-59.5	-47.5	174.3	-68.4	165.3	0	0	0	110.5	I340 I341 C346 V347 I348	I340-I344 HydrophobicContact CG2-CD1 3.83Å; I340-I344 VanDerWaalsContact O-CG1 3.32Å; I340-I344 WeakPolarHBondContact O-CG1 3.45Å; I340-I344 PolarHBondContact O-N 3.25Å; I341-I344 PolarHBondContact O-N 3.49Å; I344-C346 VanDerWaalsContact C-N 3.35Å; I344-C346 PolarHBondContact O-N 2.8Å; I344-V347 PolarHBondContact O-N 2.72Å; I344-I348 HydrophobicContact CG2-CD1 3.68Å; I344-I348 HydrophobicContact CG2-CG1 4.41Å; I344-I348 WeakPolarHBondContact O-CG1 3.49Å; I344-I348 PolarHBondContact O-N 3.11Å
345	F	94.9	Very high	93.1	Very high	39 Å²	39	52.2 Å²	52.2	17%	0.171	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-31.5	177.5	-68.4	-13.9	0	0	0	113.2	I341 A342 G349 M450 L453 I457	I341-F345 HydrophobicContact CG2-CD2 4.02Å; I341-F345 HydrophobicContact CG2-CE1 4.42Å; I341-F345 HydrophobicContact CG2-CE2 3.59Å; I341-F345 HydrophobicContact CG2-CZ 3.82Å; I341-F345 WeakPolarHBondContact O-CG 3.13Å; I341-F345 PolarHBondContact O-N 2.92Å; A342-F345 PolarHBondContact O-N 3.48Å; F345-G349 WeakPolarHBondContact O-CA 3.11Å; F345-G349 PolarHBondContact O-N 2.77Å; F345-M450 HydrophobicContact CD1-SD 3.85Å; F345-M450 HydrophobicContact CE1-SD 4.41Å; F345-M450 HydrophobicContact CG-SD 4.34Å; F345-L453 HydrophobicContact CD2-CB 3.76Å; F345-L453 HydrophobicContact CD2-CD1 4.48Å; F345-L453 HydrophobicContact CE2-CB 3.68Å; F345-L453 HydrophobicContact CE2-CD1 3.92Å; F345-L453 HydrophobicContact CE2-CG 4.28Å; F345-L453 HydrophobicContact CZ-CD1 3.95Å; F345-I457 HydrophobicContact CD2-CD1 3.66Å; F345-I457 HydrophobicContact CE2-CD1 3.7Å
346	C	95.9	Very high	92.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-48.1	169.5	-70.3	0	0	0	0	111.3	A342 L343 I344 G349 I350 V423 L454	A342-C346 PolarHBondContact O-N 3.25Å; A342-C346 PolarHBondContact O-SG 3.41Å; L343-C346 WeakPolarHBondContact O-CB 3.43Å; L343-C346 PolarHBondContact O-N 2.9Å; I344-C346 VanDerWaalsContact C-N 3.35Å; I344-C346 PolarHBondContact O-N 2.8Å; C346-G349 WeakPolarHBondContact O-CA 3.13Å; C346-G349 PolarHBondContact O-N 3.09Å; C346-I350 VanDerWaalsContact O-CG1 3.27Å; C346-I350 WeakPolarHBondContact O-CG1 3.21Å; C346-I350 PolarHBondContact O-N 3.32Å; C346-V423 HydrophobicContact CB-CG1 3.91Å; C346-L454 VanDerWaalsContact SG-CD2 3.52Å
347	V	95.2	Very high	92.3	Very high	83 Å²	83	52.6 Å²	52.6	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-65.1	-45.6	-178.7	173.9	0	0	0	0	111.6	L343 I344 G349 I350 W351	L343-V347 WeakPolarHBondContact O-CG2 3.43Å; L343-V347 PolarHBondContact O-N 3.48Å; I344-V347 PolarHBondContact O-N 2.72Å; V347-G349 VanDerWaalsContact C-N 3.31Å; V347-G349 PolarHBondContact O-N 3.48Å; V347-I350 PolarHBondContact O-N 3.12Å; V347-W351 WeakPolarHBondContact O-CB 3.29Å; V347-W351 PolarHBondContact O-N 3.1Å
348	I	94.5	Very high	91.8	Very high	73 Å²	73	53.9 Å²	53.9	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-37	175	-60.4	170.4	0	0	0	110.6	I344 W351 S352 M450	I344-I348 HydrophobicContact CG2-CD1 3.68Å; I344-I348 HydrophobicContact CG2-CG1 4.41Å; I344-I348 WeakPolarHBondContact O-CG1 3.49Å; I344-I348 PolarHBondContact O-N 3.11Å; I348-W351 PolarHBondContact O-N 3.29Å; I348-S352 VanDerWaalsContact O-CB 3.25Å; I348-S352 WeakPolarHBondContact O-CB 3.14Å; I348-S352 PolarHBondContact O-N 3.37Å; I348-S352 PolarHBondContact O-OG 3.02Å; I348-M450 HydrophobicContact CB-CG 4.38Å; I348-M450 HydrophobicContact CB-SD 4.03Å; I348-M450 HydrophobicContact CG2-CG 3.88Å; I348-M450 HydrophobicContact CG2-SD 3.67Å
349	G	93	Very high	91	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.8	-60.7	172.3	0	0	0	0	0	111.4	F345 C346 V347 W351 S352 T353 F427	F345-G349 WeakPolarHBondContact O-CA 3.11Å; F345-G349 PolarHBondContact O-N 2.77Å; C346-G349 WeakPolarHBondContact O-CA 3.13Å; C346-G349 PolarHBondContact O-N 3.09Å; V347-G349 VanDerWaalsContact C-N 3.31Å; V347-G349 PolarHBondContact O-N 3.48Å; G349-W351 VanDerWaalsContact C-N 3.34Å; G349-W351 PolarHBondContact O-N 3.43Å; G349-S352 PolarHBondContact O-N 3.34Å; G349-S352 PolarHBondContact O-OG 2.86Å; G349-T353 WeakPolarHBondContact O-CB 3.39Å; G349-T353 WeakPolarHBondContact O-CG2 3.5Å; G349-T353 PolarHBondContact O-N 3.03Å; G349-T353 PolarHBondContact O-OG1 3.16Å; G349-F427 VanDerWaalsContact C-CE2 3.45Å
350	I	93.9	Very high	89.7	Confident	32 Å²	32	57.1 Å²	57.1	16%	0.164	27%	0.269	C	S	.	.	H	α-helix	trans	-52.7	-50.1	176.2	-65.8	162	0	0	0	110.7	C346 V347 S352 T353 R354 V423 F426 F427	C346-I350 VanDerWaalsContact O-CG1 3.27Å; C346-I350 WeakPolarHBondContact O-CG1 3.21Å; C346-I350 PolarHBondContact O-N 3.32Å; V347-I350 PolarHBondContact O-N 3.12Å; I350-S352 VanDerWaalsContact C-N 3.35Å; I350-S352 PolarHBondContact O-N 3.23Å; I350-T353 PolarHBondContact O-OG1 3.2Å; I350-R354 HydrophobicContact CG2-CG 4.45Å; I350-R354 WeakPolarHBondContact O-CB 3.32Å; I350-R354 WeakPolarHBondContact O-CG 3.26Å; I350-R354 PolarHBondContact O-N 2.86Å; I350-V423 HydrophobicContact CD1-CG1 4.13Å; I350-F426 HydrophobicContact CD1-CD1 4.16Å; I350-F426 HydrophobicContact CD1-CE1 4.46Å; I350-F427 HydrophobicContact CB-CD2 4.38Å; I350-F427 HydrophobicContact CD1-CB 4.12Å; I350-F427 HydrophobicContact CG1-CB 3.85Å; I350-F427 HydrophobicContact CG1-CD2 3.48Å; I350-F427 VanDerWaalsContact CG1-CD2 3.48Å; I350-F427 HydrophobicContact CG1-CE2 4.27Å; I350-F427 HydrophobicContact CG1-CG 3.85Å
351	W	92.6	Very high	88.3	Confident	173 Å²	173	53.8 Å²	53.8	66%	0.655	25%	0.252	S	S	*	.	H	α-helix	trans	-63.7	-38.2	-177.7	-176.5	75.7	0	0	0	113.2	V347 I348 G349	V347-W351 WeakPolarHBondContact O-CB 3.29Å; V347-W351 PolarHBondContact O-N 3.1Å; I348-W351 PolarHBondContact O-N 3.29Å; G349-W351 VanDerWaalsContact C-N 3.34Å; G349-W351 PolarHBondContact O-N 3.43Å
352	S	90.3	Very high	86.6	Confident	15 Å²	15	53.2 Å²	53.2	11%	0.105	25%	0.248	C	C	.	.	H	α-helix	trans	-77.5	-37.1	-179.5	61.4	0	0	0	0	113.2	I348 G349 I350 G447	I348-S352 VanDerWaalsContact O-CB 3.25Å; I348-S352 WeakPolarHBondContact O-CB 3.14Å; I348-S352 PolarHBondContact O-N 3.37Å; I348-S352 PolarHBondContact O-OG 3.02Å; G349-S352 PolarHBondContact O-N 3.34Å; G349-S352 PolarHBondContact O-OG 2.86Å; I350-S352 VanDerWaalsContact C-N 3.35Å; I350-S352 PolarHBondContact O-N 3.23Å; S352-G447 WeakPolarHBondContact OG-CA 3.42Å
353	T	88.9	Confident	84.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-79.9	-18.9	178.8	63.2	0	0	0	0	113.1	G349 I350 K355 L356 F427 L431 R434 I451	G349-T353 WeakPolarHBondContact O-CB 3.39Å; G349-T353 WeakPolarHBondContact O-CG2 3.5Å; G349-T353 PolarHBondContact O-N 3.03Å; G349-T353 PolarHBondContact O-OG1 3.16Å; I350-T353 PolarHBondContact O-OG1 3.2Å; T353-K355 PolarHBondContact O-N 2.88Å; T353-L356 HydrophobicContact CG2-CD1 4.38Å; T353-L356 VanDerWaalsContact O-CB 3.28Å; T353-L356 WeakPolarHBondContact O-CB 3.33Å; T353-L356 PolarHBondContact O-N 2.94Å; T353-F427 HydrophobicContact CG2-CE2 4.08Å; T353-F427 HydrophobicContact CG2-CZ 4.26Å; T353-L431 HydrophobicContact CG2-CD2 3.9Å; T353-R434 WeakPolarHBondContact O-CD 3.26Å; T353-R434 PolarHBondContact O-NE 2.94Å; T353-R434 PolarHBondContact O-NH1 3.45Å; T353-R434 VanDerWaalsContact O-NH1 3.09Å; T353-R434 PolarHBondContact OG1-NE 3.44Å; T353-I451 HydrophobicContact CG2-CD1 4.38Å
354	R	87.5	Confident	82.4	Confident	177 Å²	177	55.8 Å²	55.8	67%	0.668	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-16.3	170.5	-89.1	178.4	76.6	171	6.7	115.1	I350	I350-R354 HydrophobicContact CG2-CG 4.45Å; I350-R354 WeakPolarHBondContact O-CB 3.32Å; I350-R354 WeakPolarHBondContact O-CG 3.26Å; I350-R354 PolarHBondContact O-N 2.86Å
355	K	83.4	Confident	80.4	Confident	115 Å²	115	58.2 Å²	58.2	50%	0.5	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.8	174.7	-60.9	178.3	-176.6	177.8	0	113.6	T353 Y441	T353-K355 PolarHBondContact O-N 2.88Å; K355-Y441 HydrophobicContact CB-CE1 4.4Å
356	L	84.9	Confident	79.2	Confident	11 Å²	11	57 Å²	57	6%	0.058	27%	0.266	C	S	.	.	S	Bend	trans	-80.5	154.6	178	-62.7	162.9	0	0	0	111.1	T353 R434 P446 V520 Y521	T353-L356 HydrophobicContact CG2-CD1 4.38Å; T353-L356 VanDerWaalsContact O-CB 3.28Å; T353-L356 WeakPolarHBondContact O-CB 3.33Å; T353-L356 PolarHBondContact O-N 2.94Å; L356-R434 HydrophobicContact CB-CB 4.28Å; L356-R434 HydrophobicContact CB-CG 4.48Å; L356-R434 HydrophobicContact CD1-CB 4.44Å; L356-R434 PolarHBondContact O-NH1 3.41Å; L356-P446 HydrophobicContact CD2-CG 4.26Å; L356-P446 HydrophobicContact CG-CG 4.44Å; L356-V520 HydrophobicContact CD1-CG1 3.38Å; L356-Y521 HydrophobicContact CD1-CE1 4.37Å; L356-Y521 HydrophobicContact CD2-CE1 4.46Å
357	K	82.1	Confident	78.4	Confident	13 Å²	13	57.6 Å²	57.6	6%	0.057	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.6	-178.8	-177.6	175.3	176	-176.3	0	109.4	R434 C435 H437 E524 R638	K357-R434 WeakPolarHBondContact O-CA 3.15Å; K357-C435 PolarHBondContact N-O 3.04Å; K357-C435 VanDerWaalsContact N-O 3.1Å; K357-C435 PolarHBondContact O-N 3.33Å; K357-H437 HydrophobicContact CB-CB 4.3Å; K357-H437 HydrophobicContact CD-CB 4.49Å; K357-E524 VanDerWaalsContact CE-OE1 3.32Å; K357-E524 WeakPolarHBondContact CE-OE1 3.2Å; K357-E524 WeakPolarHBondContact CE-OE2 3.47Å; K357-E524 IonicContact NZ-OE1 2.72Å; K357-E524 PolarHBondContact NZ-OE1 2.92Å; K357-E524 IonicContact NZ-OE2 2.8Å; K357-E524 PolarHBondContact NZ-OE2 3.02Å; K357-R638 PolarHBondContact NZ-O 3.29Å
358	F	83	Confident	77.8	Confident	124 Å²	124	54.2 Å²	54.2	54%	0.544	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	129.2	166.8	-165.3	-87.4	0	0	0	108.6	Y433	F358-Y433 CarbonylContact C-O 3.35Å; F358-Y433 WeakPolarHBondContact CA-O 3.3Å; F358-Y433 AromaticContact CE1-CD1 3.68Å; F358-Y433 HydrophobicContact CE1-CD1 3.68Å; F358-Y433 HydrophobicContact CE1-CG 4.21Å; F358-Y433 AromaticContact CE2-CD1 3.99Å; F358-Y433 HydrophobicContact CE2-CD1 3.99Å; F358-Y433 HydrophobicContact CE2-CD2 4.49Å; F358-Y433 AromaticContact CE2-CG 3.7Å; F358-Y433 HydrophobicContact CE2-CG 3.7Å; F358-Y433 AromaticContact CZ-CD1 3.28Å; F358-Y433 HydrophobicContact CZ-CD1 3.28Å; F358-Y433 HydrophobicContact CZ-CD2 4.42Å; F358-Y433 HydrophobicContact CZ-CE1 4.13Å; F358-Y433 AromaticContact CZ-CG 3.49Å; F358-Y433 HydrophobicContact CZ-CG 3.49Å; F358-Y433 VanDerWaalsContact CZ-CG 3.49Å
359	S	75.9	Confident	77.3	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.042	23%	0.232	C	C	.	.			trans	-136.2	178.4	-179.4	-161.7	0	0	0	0	109.7	N361 Y433 E524	S359-N361 PolarHBondContact O-N 2.92Å; S359-Y433 PolarHBondContact N-O 2.8Å; S359-E524 WeakPolarHBondContact CB-OE1 3.23Å; S359-E524 WeakPolarHBondContact OG-CG 3.47Å; S359-E524 PolarHBondContact OG-OE1 3.04Å
360	V	69	Low	77	Confident	76 Å²	76	54 Å²	54	46%	0.461	25%	0.245	S	C	.	.			trans	-66.6	134.7	-178.8	-179.1	0	0	0	0	110	F362 R527 Y528	V360-F362 HydrophobicContact CB-CE1 3.95Å; V360-F362 HydrophobicContact CB-CE2 4.13Å; V360-F362 HydrophobicContact CB-CZ 3.65Å; V360-F362 HydrophobicContact CG1-CD1 4.22Å; V360-F362 HydrophobicContact CG1-CE1 3.71Å; V360-F362 HydrophobicContact CG1-CZ 3.98Å; V360-F362 VanDerWaalsContact O-CD2 3.29Å; V360-F362 WeakPolarHBondContact O-CD2 3.25Å; V360-F362 VanDerWaalsContact O-CE2 3.31Å; V360-F362 WeakPolarHBondContact O-CE2 3.23Å; V360-F362 PolarHBondContact O-N 3.41Å; V360-R527 PolarHBondContact O-NH1 2.86Å; V360-Y528 HydrophobicContact CG2-CE1 4.32Å
361	N	66.6	Low	76.7	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.043	24%	0.241	C	C	.	.			trans	-82.8	99.1	174.2	-177.4	19.3	0	0	0	111.5	S359 S363 N364 F432 Y433	S359-N361 PolarHBondContact O-N 2.92Å; N361-S363 VanDerWaalsContact C-N 3.26Å; N361-S363 VanDerWaalsContact OD1-CA 3.25Å; N361-S363 WeakPolarHBondContact OD1-CA 3.31Å; N361-S363 WeakPolarHBondContact OD1-CB 3.34Å; N361-S363 PolarHBondContact OD1-N 3.25Å; N361-N364 PolarHBondContact ND2-OD1 2.91Å; N361-F432 WeakPolarHBondContact OD1-CB 3.43Å; N361-F432 PolarHBondContact OD1-O 2.94Å; N361-Y433 HydrophobicContact CB-CD1 3.41Å; N361-Y433 VanDerWaalsContact CB-CD1 3.41Å; N361-Y433 HydrophobicContact CB-CD2 3.84Å; N361-Y433 HydrophobicContact CB-CE1 3.19Å; N361-Y433 HydrophobicContact CB-CE2 3.64Å; N361-Y433 HydrophobicContact CB-CG 3.71Å; N361-Y433 WeakPolarHBondContact ND2-CE2 3.38Å
362	F	58.1	Low	76.6	Confident	49 Å²	49	45 Å²	45	22%	0.215	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-72.6	-21	171.4	-53.1	-68	0	0	0	112.4	V360 N364 Q365 N366 R527 Y528 M531	V360-F362 HydrophobicContact CB-CE1 3.95Å; V360-F362 HydrophobicContact CB-CE2 4.13Å; V360-F362 HydrophobicContact CB-CZ 3.65Å; V360-F362 HydrophobicContact CG1-CD1 4.22Å; V360-F362 HydrophobicContact CG1-CE1 3.71Å; V360-F362 HydrophobicContact CG1-CZ 3.98Å; V360-F362 VanDerWaalsContact O-CD2 3.29Å; V360-F362 WeakPolarHBondContact O-CD2 3.25Å; V360-F362 VanDerWaalsContact O-CE2 3.31Å; V360-F362 WeakPolarHBondContact O-CE2 3.23Å; V360-F362 PolarHBondContact O-N 3.41Å; F362-N364 PolarHBondContact O-N 3.17Å; F362-N364 VanDerWaalsContact O-N 3.1Å; F362-Q365 PolarHBondContact O-N 3.5Å; F362-N366 PolarHBondContact O-OD1 2.95Å; F362-R527 HydrophobicContact CD2-CB 4.16Å; F362-R527 HydrophobicContact CD2-CG 3.56Å; F362-R527 HydrophobicContact CE2-CB 3.85Å; F362-R527 HydrophobicContact CE2-CG 3.76Å; F362-Y528 AromaticContact CZ-CD1 3.71Å; F362-Y528 HydrophobicContact CZ-CD1 3.71Å; F362-Y528 AromaticContact CZ-CE1 3.78Å; F362-Y528 HydrophobicContact CZ-CE1 3.78Å; F362-M531 HydrophobicContact CD1-CB 4.07Å; F362-M531 HydrophobicContact CD1-CG 4.07Å; F362-M531 HydrophobicContact CD1-SD 4.32Å; F362-M531 HydrophobicContact CE1-CB 3.8Å; F362-M531 HydrophobicContact CE1-CG 3.74Å; F362-M531 HydrophobicContact CE1-SD 3.48Å; F362-M531 WeakPolarHBondContact CE1-SD 3.32Å; F362-M531 HydrophobicContact CZ-CB 4.35Å; F362-M531 HydrophobicContact CZ-SD 4.22Å
363	S	54.5	Low	76.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.007	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-63.6	-12.1	175.4	-151.2	0	0	0	0	114	N361 Q365 N366 S369	N361-S363 VanDerWaalsContact C-N 3.26Å; N361-S363 VanDerWaalsContact OD1-CA 3.25Å; N361-S363 WeakPolarHBondContact OD1-CA 3.31Å; N361-S363 WeakPolarHBondContact OD1-CB 3.34Å; N361-S363 PolarHBondContact OD1-N 3.25Å; S363-Q365 PolarHBondContact O-N 3.47Å; S363-Q365 VanDerWaalsContact O-N 3.17Å; S363-N366 WeakPolarHBondContact CA-OD1 3.42Å; S363-N366 WeakPolarHBondContact O-CB 3.36Å; S363-N366 PolarHBondContact O-N 3.29Å; S363-S369 WeakPolarHBondContact O-CB 3.49Å
364	N	50	Low	76.9	Confident	92 Å²	92	52.2 Å²	52.2	49%	0.492	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-62	-19.6	174.5	-81.4	-12	0	0	0	113.4	N361 F362 Y433	N361-N364 PolarHBondContact ND2-OD1 2.91Å; F362-N364 PolarHBondContact O-N 3.17Å; F362-N364 VanDerWaalsContact O-N 3.1Å; N364-Y433 PolarHBondContact ND2-OH 3.41Å
365	Q	55	Low	77.2	Confident	136 Å²	136	43.8 Å²	43.8	64%	0.636	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-95.7	-14.1	171.4	-64	-167.7	1.4	0	0	113.3	F362 S363 K370	F362-Q365 PolarHBondContact O-N 3.5Å; S363-Q365 PolarHBondContact O-N 3.47Å; S363-Q365 VanDerWaalsContact O-N 3.17Å; Q365-K370 WeakPolarHBondContact O-CE 3.48Å; Q365-K370 PolarHBondContact O-NZ 3.02Å
366	N	68.5	Low	77.7	Confident	13 Å²	13	40.2 Å²	40.2	7%	0.07	20%	0.202	C	C	.	.	S	Bend	trans	-73.3	146.4	-175.8	-68.1	54.2	0	0	0	112	E128 F362 S363 D368 S369 R519	E128-N366 PolarHBondContact OE1-ND2 3.43Å; E128-N366 PolarHBondContact OE1-OD1 3.48Å; F362-N366 PolarHBondContact O-OD1 2.95Å; S363-N366 WeakPolarHBondContact CA-OD1 3.42Å; S363-N366 WeakPolarHBondContact O-CB 3.36Å; S363-N366 PolarHBondContact O-N 3.29Å; N366-D368 PolarHBondContact O-N 3.28Å; N366-S369 PolarHBondContact O-N 2.91Å; N366-R519 PolarHBondContact ND2-NH2 3.2Å
367	L	78.8	Confident	78.2	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.063	23%	0.229	C	C	.	.	H	α-helix	trans	-54.6	-40.3	172.8	-179.6	54	0	0	0	112.5	L134 A262 V263 E266 S369 K370 L371	L134-L367 HydrophobicContact CD2-CD2 3.74Å; A262-L367 HydrophobicContact CB-CD1 4.06Å; A262-L367 WeakPolarHBondContact O-CD1 3.5Å; V263-L367 HydrophobicContact CG2-CD2 3.81Å; E266-L367 HydrophobicContact CB-CB 4.46Å; E266-L367 HydrophobicContact CB-CD1 4.07Å; E266-L367 HydrophobicContact CB-CD2 4.03Å; E266-L367 HydrophobicContact CB-CG 4.42Å; E266-L367 HydrophobicContact CG-CB 4.12Å; E266-L367 HydrophobicContact CG-CD2 4.34Å; L367-S369 PolarHBondContact O-N 2.91Å; L367-K370 PolarHBondContact O-N 3.37Å; L367-L371 WeakPolarHBondContact O-CB 3.16Å; L367-L371 PolarHBondContact O-N 3.33Å
368	D	82.4	Confident	78.8	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-42.4	-173.6	-58.3	-40	0	0	0	112.5	N366 L372 H508	N366-D368 PolarHBondContact O-N 3.28Å; D368-L372 VanDerWaalsContact O-CB 3.32Å; D368-L372 WeakPolarHBondContact O-CB 3.31Å; D368-L372 PolarHBondContact O-N 3.16Å; D368-H508 PolarHBondContact O-NE2 3.02Å; D368-H508 IonicContact OD1-CE1 3.26Å
369	S	85.5	Confident	79.4	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	21%	0.21	C	C	.	.	H	α-helix	trans	-66.4	-45.9	177.5	-177.4	0	0	0	0	111.8	S363 N366 L367 L371 L372 I373	S363-S369 WeakPolarHBondContact O-CB 3.49Å; N366-S369 PolarHBondContact O-N 2.91Å; L367-S369 PolarHBondContact O-N 2.91Å; S369-L371 PolarHBondContact O-N 3.23Å; S369-L372 PolarHBondContact O-N 3.45Å; S369-I373 WeakPolarHBondContact O-CG1 3.41Å; S369-I373 PolarHBondContact O-N 2.93Å; S369-I373 VanDerWaalsContact O-N 3.07Å
370	K	86	Confident	80.4	Confident	65 Å²	65	43.2 Å²	43.2	28%	0.283	22%	0.218	S	C	.	.	H	α-helix	trans	-60	-47.5	178.4	-58.3	168.3	-156.8	161.7	0	111.2	E266 Q365 L367 I373 V374	E266-K370 IonicContact OE2-NZ 2.72Å; E266-K370 PolarHBondContact OE2-NZ 3.35Å; Q365-K370 WeakPolarHBondContact O-CE 3.48Å; Q365-K370 PolarHBondContact O-NZ 3.02Å; L367-K370 PolarHBondContact O-N 3.37Å; K370-I373 PolarHBondContact O-N 3.46Å; K370-V374 WeakPolarHBondContact O-CG2 3.23Å; K370-V374 PolarHBondContact O-N 2.91Å
371	L	87.6	Confident	81.6	Confident	15 Å²	15	41.5 Å²	41.5	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-37.7	-178.8	-176.6	58.3	0	0	0	111.9	A262 L367 S369 T375 L504	A262-L371 HydrophobicContact CB-CD1 4.05Å; A262-L371 HydrophobicContact CB-CD2 4.13Å; L367-L371 WeakPolarHBondContact O-CB 3.16Å; L367-L371 PolarHBondContact O-N 3.33Å; S369-L371 PolarHBondContact O-N 3.23Å; L371-T375 HydrophobicContact CD1-CG2 4.05Å; L371-T375 WeakPolarHBondContact O-CB 3.41Å; L371-T375 VanDerWaalsContact O-CG2 3.32Å; L371-T375 WeakPolarHBondContact O-CG2 3.32Å; L371-T375 PolarHBondContact O-N 3.28Å; L371-T375 PolarHBondContact O-OG1 3.44Å; L371-L504 HydrophobicContact CD1-CD2 4.32Å
372	L	91.5	Very high	82.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-44.8	175.3	-174.3	68.6	0	0	0	111.9	D368 S369 T375 F376 I428 F432 Y505	D368-L372 VanDerWaalsContact O-CB 3.32Å; D368-L372 WeakPolarHBondContact O-CB 3.31Å; D368-L372 PolarHBondContact O-N 3.16Å; S369-L372 PolarHBondContact O-N 3.45Å; L372-T375 PolarHBondContact O-N 3.03Å; L372-T375 PolarHBondContact O-OG1 2.96Å; L372-F376 WeakPolarHBondContact O-CB 3.4Å; L372-F376 PolarHBondContact O-N 2.85Å; L372-I428 HydrophobicContact CD2-CB 4.15Å; L372-I428 HydrophobicContact CD2-CG2 3.49Å; L372-I428 VanDerWaalsContact CD2-CG2 3.49Å; L372-F432 HydrophobicContact CD2-CE2 4.18Å; L372-F432 HydrophobicContact CD2-CZ 4.24Å; L372-Y505 HydrophobicContact CD1-CD2 4.1Å; L372-Y505 HydrophobicContact CD1-CE2 3.75Å
373	I	92.2	Very high	84.6	Confident	88 Å²	88	39.6 Å²	39.6	45%	0.451	20%	0.2	S	C	.	.	H	α-helix	trans	-63.7	-44.8	-180	-67.6	164.8	0	0	0	111.4	S369 K370 F376 F377	S369-I373 WeakPolarHBondContact O-CG1 3.41Å; S369-I373 PolarHBondContact O-N 2.93Å; S369-I373 VanDerWaalsContact O-N 3.07Å; K370-I373 PolarHBondContact O-N 3.46Å; I373-F376 PolarHBondContact O-N 2.87Å; I373-F377 PolarHBondContact O-N 3.08Å
374	V	92.1	Very high	86.5	Confident	80 Å²	80	42.6 Å²	42.6	49%	0.485	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-47.5	178.8	171.9	0	0	0	0	111.3	K370 F377 I378	K370-V374 WeakPolarHBondContact O-CG2 3.23Å; K370-V374 PolarHBondContact O-N 2.91Å; V374-F377 PolarHBondContact O-N 2.68Å; V374-I378 HydrophobicContact CG1-CD1 4.13Å; V374-I378 WeakPolarHBondContact O-CG1 3.49Å; V374-I378 PolarHBondContact O-N 3.35Å
375	T	93.2	Very high	88.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.5	-33.2	-178.9	54.8	0	0	0	0	112.4	L371 L372 T379 M501 L504	L371-T375 HydrophobicContact CD1-CG2 4.05Å; L371-T375 WeakPolarHBondContact O-CB 3.41Å; L371-T375 VanDerWaalsContact O-CG2 3.32Å; L371-T375 WeakPolarHBondContact O-CG2 3.32Å; L371-T375 PolarHBondContact O-N 3.28Å; L371-T375 PolarHBondContact O-OG1 3.44Å; L372-T375 PolarHBondContact O-N 3.03Å; L372-T375 PolarHBondContact O-OG1 2.96Å; T375-T379 WeakPolarHBondContact O-CB 3.45Å; T375-T379 PolarHBondContact O-N 2.97Å; T375-T379 PolarHBondContact O-OG1 3.43Å; T375-M501 HydrophobicContact CG2-CE 4.24Å; T375-L504 HydrophobicContact CG2-CB 4.41Å; T375-L504 HydrophobicContact CG2-CD2 3.82Å; T375-L504 HydrophobicContact CG2-CG 3.97Å
376	F	95.3	Very high	90.3	Very high	40 Å²	40	32.3 Å²	32.3	18%	0.175	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-48.4	171	171.2	-101.7	0	0	0	112.1	L372 I373 I378 T379 V380 V421 N425 Y505	L372-F376 WeakPolarHBondContact O-CB 3.4Å; L372-F376 PolarHBondContact O-N 2.85Å; I373-F376 PolarHBondContact O-N 2.87Å; F376-I378 PolarHBondContact O-N 3.46Å; F376-T379 WeakPolarHBondContact O-CB 3.3Å; F376-T379 PolarHBondContact O-N 3.2Å; F376-T379 VanDerWaalsContact O-N 3.09Å; F376-V380 HydrophobicContact CD1-CG2 4.42Å; F376-V380 HydrophobicContact CD2-CG2 4.2Å; F376-V380 HydrophobicContact CE1-CG2 3.97Å; F376-V380 HydrophobicContact CE2-CG2 3.73Å; F376-V380 HydrophobicContact CZ-CG2 3.6Å; F376-V380 PolarHBondContact O-N 2.88Å; F376-V421 HydrophobicContact CD2-CG1 3.78Å; F376-V421 HydrophobicContact CE2-CG1 3.75Å; F376-N425 VanDerWaalsContact CD1-ND2 3.32Å; F376-N425 WeakPolarHBondContact CD1-ND2 3.27Å; F376-N425 HydrophobicContact CD2-CB 3.43Å; F376-N425 VanDerWaalsContact CD2-CB 3.43Å; F376-N425 VanDerWaalsContact CD2-CG 3.43Å; F376-N425 WeakPolarHBondContact CD2-ND2 3.45Å; F376-N425 WeakPolarHBondContact CE1-ND2 3.39Å; F376-N425 HydrophobicContact CE2-CB 3.41Å; F376-N425 VanDerWaalsContact CE2-CB 3.41Å; F376-N425 WeakPolarHBondContact CE2-ND2 3.22Å; F376-N425 HydrophobicContact CG-CB 4.16Å; F376-N425 VanDerWaalsContact CG-ND2 3.31Å; F376-N425 WeakPolarHBondContact CG-ND2 3.33Å; F376-N425 HydrophobicContact CZ-CB 4.15Å; F376-N425 WeakPolarHBondContact CZ-ND2 3.41Å; F376-Y505 HydrophobicContact CB-CD2 4.12Å; F376-Y505 HydrophobicContact CB-CE2 3.86Å; F376-Y505 HydrophobicContact CD2-CE2 4.15Å
377	F	95.5	Very high	91.4	Very high	142 Å²	142	32.6 Å²	32.6	62%	0.623	17%	0.17	S	C	*	.	H	α-helix	trans	-60.1	-46.1	-179.5	-177.1	-95.8	0	0	0	111.7	I373 V374 T379 V380 T381	I373-F377 PolarHBondContact O-N 3.08Å; V374-F377 PolarHBondContact O-N 2.68Å; F377-T379 VanDerWaalsContact C-N 3.26Å; F377-T379 PolarHBondContact O-N 3.48Å; F377-V380 PolarHBondContact O-N 3.47Å; F377-T381 HydrophobicContact CD1-CG2 4.45Å; F377-T381 HydrophobicContact CE1-CG2 4.01Å; F377-T381 HydrophobicContact CZ-CG2 4.06Å; F377-T381 PolarHBondContact O-N 3.02Å; F377-T381 PolarHBondContact O-OG1 3.46Å
378	I	94.4	Very high	92.1	Very high	38 Å²	38	36.8 Å²	36.8	20%	0.195	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-34.3	176.4	-60.3	166.1	0	0	0	111.3	V374 F376 T381 F382 A498 M501	V374-I378 HydrophobicContact CG1-CD1 4.13Å; V374-I378 WeakPolarHBondContact O-CG1 3.49Å; V374-I378 PolarHBondContact O-N 3.35Å; F376-I378 PolarHBondContact O-N 3.46Å; I378-T381 WeakPolarHBondContact CA-OG1 3.29Å; I378-T381 PolarHBondContact O-OG1 3.19Å; I378-T381 VanDerWaalsContact O-OG1 3.05Å; I378-F382 VanDerWaalsContact O-CB 3.27Å; I378-F382 WeakPolarHBondContact O-CB 3.38Å; I378-F382 PolarHBondContact O-N 3.48Å; I378-A498 HydrophobicContact CG2-CB 3.9Å; I378-M501 HydrophobicContact CB-CB 4.23Å; I378-M501 HydrophobicContact CD1-CB 4.11Å; I378-M501 HydrophobicContact CD1-CE 3.81Å; I378-M501 HydrophobicContact CD1-CG 4.09Å; I378-M501 HydrophobicContact CG2-CB 3.63Å; I378-M501 HydrophobicContact CG2-CG 4.25Å
379	T	95	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-46	176.2	-58.8	0	0	0	0	111.8	T375 F376 F377 T381 F382 L383 V421 V502 Y505	T375-T379 WeakPolarHBondContact O-CB 3.45Å; T375-T379 PolarHBondContact O-N 2.97Å; T375-T379 PolarHBondContact O-OG1 3.43Å; F376-T379 WeakPolarHBondContact O-CB 3.3Å; F376-T379 PolarHBondContact O-N 3.2Å; F376-T379 VanDerWaalsContact O-N 3.09Å; F377-T379 VanDerWaalsContact C-N 3.26Å; F377-T379 PolarHBondContact O-N 3.48Å; T379-T381 VanDerWaalsContact C-N 3.35Å; T379-T381 PolarHBondContact O-N 3.25Å; T379-F382 WeakPolarHBondContact O-CB 3.43Å; T379-F382 PolarHBondContact O-N 2.99Å; T379-L383 HydrophobicContact CG2-CD1 4.11Å; T379-L383 HydrophobicContact CG2-CG 4.43Å; T379-L383 VanDerWaalsContact O-CG 3.29Å; T379-L383 WeakPolarHBondContact O-CG 3.37Å; T379-L383 PolarHBondContact O-N 2.92Å; T379-V421 HydrophobicContact CG2-CG1 4.14Å; T379-V421 HydrophobicContact CG2-CG2 4.44Å; T379-V502 HydrophobicContact CG2-CG1 4.12Å; T379-V502 HydrophobicContact CG2-CG2 4.43Å; T379-Y505 HydrophobicContact CG2-CD1 4.05Å; T379-Y505 VanDerWaalsContact OG1-CB 3.26Å; T379-Y505 WeakPolarHBondContact OG1-CB 3.38Å
380	V	96.4	Very high	92.5	Very high	36 Å²	36	36 Å²	36	22%	0.218	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-45	176.8	171.1	0	0	0	0	111	F376 F377 L383 V384 L418	F376-V380 HydrophobicContact CD1-CG2 4.42Å; F376-V380 HydrophobicContact CD2-CG2 4.2Å; F376-V380 HydrophobicContact CE1-CG2 3.97Å; F376-V380 HydrophobicContact CE2-CG2 3.73Å; F376-V380 HydrophobicContact CZ-CG2 3.6Å; F376-V380 PolarHBondContact O-N 2.88Å; F377-V380 PolarHBondContact O-N 3.47Å; V380-L383 PolarHBondContact O-N 3.3Å; V380-V384 WeakPolarHBondContact O-CG2 3.38Å; V380-V384 PolarHBondContact O-N 2.75Å; V380-L418 HydrophobicContact CG1-CD1 4.1Å; V380-L418 HydrophobicContact CG2-CD1 4.42Å
381	T	94.6	Very high	92.7	Very high	41 Å²	41	36.4 Å²	36.4	25%	0.252	19%	0.192	S	C	.	.	H	α-helix	trans	-68.1	-34.4	178	51.1	0	0	0	0	112.8	F377 I378 T379 A385 Y494	F377-T381 HydrophobicContact CD1-CG2 4.45Å; F377-T381 HydrophobicContact CE1-CG2 4.01Å; F377-T381 HydrophobicContact CZ-CG2 4.06Å; F377-T381 PolarHBondContact O-N 3.02Å; F377-T381 PolarHBondContact O-OG1 3.46Å; I378-T381 WeakPolarHBondContact CA-OG1 3.29Å; I378-T381 PolarHBondContact O-OG1 3.19Å; I378-T381 VanDerWaalsContact O-OG1 3.05Å; T379-T381 VanDerWaalsContact C-N 3.35Å; T379-T381 PolarHBondContact O-N 3.25Å; T381-A385 WeakPolarHBondContact O-CB 3.32Å; T381-A385 PolarHBondContact O-N 2.92Å; T381-Y494 WeakPolarHBondContact CB-OH 3.22Å; T381-Y494 PolarHBondContact OG1-OH 2.7Å
382	F	93.8	Very high	92.7	Very high	14 Å²	14	37.3 Å²	37.3	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-45.8	169.2	168.8	-89.1	0	0	0	112	I378 T379 A385 C386 I495 A498 L499 V502	I378-F382 VanDerWaalsContact O-CB 3.27Å; I378-F382 WeakPolarHBondContact O-CB 3.38Å; I378-F382 PolarHBondContact O-N 3.48Å; T379-F382 WeakPolarHBondContact O-CB 3.43Å; T379-F382 PolarHBondContact O-N 2.99Å; F382-A385 WeakPolarHBondContact O-CB 3.38Å; F382-A385 PolarHBondContact O-N 3.41Å; F382-C386 WeakPolarHBondContact O-CB 3.45Å; F382-C386 PolarHBondContact O-N 3.48Å; F382-C386 PolarHBondContact O-SG 3.07Å; F382-C386 VanDerWaalsContact O-SG 3.33Å; F382-I495 HydrophobicContact CD2-CG2 4.38Å; F382-I495 HydrophobicContact CE2-CB 4.31Å; F382-I495 HydrophobicContact CE2-CG2 3.7Å; F382-I495 WeakPolarHBondContact CE2-O 3.34Å; F382-I495 HydrophobicContact CZ-CG2 4.39Å; F382-A498 HydrophobicContact CB-CB 4.14Å; F382-A498 HydrophobicContact CD2-CB 3.99Å; F382-L499 HydrophobicContact CE2-CB 4.12Å; F382-L499 HydrophobicContact CE2-CD1 4.47Å; F382-L499 HydrophobicContact CZ-CD1 4.26Å; F382-V502 HydrophobicContact CB-CG2 3.79Å; F382-V502 HydrophobicContact CD1-CG1 4.49Å; F382-V502 HydrophobicContact CD1-CG2 3.63Å; F382-V502 HydrophobicContact CD2-CG2 3.98Å; F382-V502 HydrophobicContact CE1-CG1 4.49Å; F382-V502 HydrophobicContact CE1-CG2 4.16Å; F382-V502 HydrophobicContact CE2-CG2 4.44Å; F382-V502 HydrophobicContact CG-CG2 3.54Å
383	L	94.7	Very high	92.4	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-40.9	-179.9	-66	173.8	0	0	0	111.9	T379 V380 C386 I387 E417 L418 V421	T379-L383 HydrophobicContact CG2-CD1 4.11Å; T379-L383 HydrophobicContact CG2-CG 4.43Å; T379-L383 VanDerWaalsContact O-CG 3.29Å; T379-L383 WeakPolarHBondContact O-CG 3.37Å; T379-L383 PolarHBondContact O-N 2.92Å; V380-L383 PolarHBondContact O-N 3.3Å; L383-C386 PolarHBondContact O-N 3.06Å; L383-I387 WeakPolarHBondContact O-CB 3.48Å; L383-I387 WeakPolarHBondContact O-CD1 3.48Å; L383-I387 VanDerWaalsContact O-CG1 3.26Å; L383-I387 WeakPolarHBondContact O-CG1 3.23Å; L383-I387 PolarHBondContact O-N 2.98Å; L383-E417 HydrophobicContact CD1-CB 4.35Å; L383-E417 HydrophobicContact CD1-CG 3.9Å; L383-E417 HydrophobicContact CD2-CB 4.24Å; L383-E417 VanDerWaalsContact CD2-CD 3.44Å; L383-E417 HydrophobicContact CD2-CG 4Å; L383-E417 WeakPolarHBondContact CD2-OE2 3.45Å; L383-L418 HydrophobicContact CB-CD1 4.33Å; L383-L418 HydrophobicContact CD1-CB 4.24Å; L383-L418 HydrophobicContact CD1-CD1 4.3Å; L383-V421 HydrophobicContact CD1-CG2 4.27Å
384	V	95	Very high	92.1	Very high	65 Å²	65	35.5 Å²	35.5	39%	0.394	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-44.5	172.3	172.3	0	0	0	0	111.1	V380 C386 I387 L388	V380-V384 WeakPolarHBondContact O-CG2 3.38Å; V380-V384 PolarHBondContact O-N 2.75Å; V384-C386 PolarHBondContact O-N 2.94Å; V384-I387 PolarHBondContact O-N 3.32Å; V384-L388 HydrophobicContact CG1-CD1 4.03Å; V384-L388 HydrophobicContact CG1-CG 4.42Å; V384-L388 WeakPolarHBondContact O-CG 3.19Å; V384-L388 PolarHBondContact O-N 3.26Å
385	A	92.2	Very high	91.9	Very high	5 Å²	5	38.2 Å²	38.2	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-43.9	175.6	0	0	0	0	0	112.3	T381 F382 L388 L389 L491 Y494 I495	T381-A385 WeakPolarHBondContact O-CB 3.32Å; T381-A385 PolarHBondContact O-N 2.92Å; F382-A385 WeakPolarHBondContact O-CB 3.38Å; F382-A385 PolarHBondContact O-N 3.41Å; A385-L388 PolarHBondContact O-N 3.5Å; A385-L389 WeakPolarHBondContact O-CB 3.18Å; A385-L389 PolarHBondContact O-N 2.86Å; A385-L491 HydrophobicContact CB-CD1 3.55Å; A385-L491 HydrophobicContact CB-CG 4.33Å; A385-Y494 HydrophobicContact CB-CD1 3.77Å; A385-Y494 HydrophobicContact CB-CE1 4.02Å; A385-I495 HydrophobicContact CB-CD1 4.37Å; A385-I495 HydrophobicContact CB-CG1 4.05Å
386	C	90.8	Very high	91.3	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-46.2	174.3	-72.9	0	0	0	0	111.7	F382 L383 V384 L389 N390 L475	F382-C386 WeakPolarHBondContact O-CB 3.45Å; F382-C386 PolarHBondContact O-N 3.48Å; F382-C386 PolarHBondContact O-SG 3.07Å; F382-C386 VanDerWaalsContact O-SG 3.33Å; L383-C386 PolarHBondContact O-N 3.06Å; V384-C386 PolarHBondContact O-N 2.94Å; C386-L389 PolarHBondContact O-N 3.43Å; C386-N390 PolarHBondContact O-N 3.07Å; C386-N390 PolarHBondContact O-ND2 3Å; C386-L475 HydrophobicContact CB-CD2 3.8Å
387	I	93.4	Very high	90.1	Very high	20 Å²	20	45 Å²	45	10%	0.103	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-47.8	178.5	-71.6	160.6	0	0	0	111.1	L383 V384 L389 N390 I391 L411 A414 L415 L418	L383-I387 WeakPolarHBondContact O-CB 3.48Å; L383-I387 WeakPolarHBondContact O-CD1 3.48Å; L383-I387 VanDerWaalsContact O-CG1 3.26Å; L383-I387 WeakPolarHBondContact O-CG1 3.23Å; L383-I387 PolarHBondContact O-N 2.98Å; V384-I387 PolarHBondContact O-N 3.32Å; I387-L389 VanDerWaalsContact C-N 3.34Å; I387-L389 PolarHBondContact O-N 3.38Å; I387-N390 PolarHBondContact O-N 3.18Å; I387-I391 HydrophobicContact CG2-CD1 3.78Å; I387-I391 WeakPolarHBondContact O-CG1 3.16Å; I387-I391 PolarHBondContact O-N 3.06Å; I387-L411 HydrophobicContact CB-CD1 4.45Å; I387-L411 HydrophobicContact CG1-CD1 4.36Å; I387-L411 HydrophobicContact CG2-CD1 4Å; I387-A414 HydrophobicContact CG1-CB 3.94Å; I387-L415 HydrophobicContact CD1-CD2 3.87Å; I387-L415 HydrophobicContact CD1-CG 4.39Å; I387-L415 HydrophobicContact CG1-CD2 4.43Å; I387-L418 HydrophobicContact CD1-CD2 4.01Å
388	L	92	Very high	89.1	Confident	99 Å²	99	40.6 Å²	40.6	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-43.8	178.2	-70.4	172.1	0	0	0	111.9	V384 A385 I391 A392 L491	V384-L388 HydrophobicContact CG1-CD1 4.03Å; V384-L388 HydrophobicContact CG1-CG 4.42Å; V384-L388 WeakPolarHBondContact O-CG 3.19Å; V384-L388 PolarHBondContact O-N 3.26Å; A385-L388 PolarHBondContact O-N 3.5Å; L388-I391 PolarHBondContact O-N 2.81Å; L388-A392 WeakPolarHBondContact O-CB 3.33Å; L388-A392 PolarHBondContact O-N 3.06Å; L388-L491 HydrophobicContact CB-CD2 4.26Å
389	L	87.6	Confident	88.3	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-40.5	176.9	-175.1	63.6	0	0	0	112.3	A385 C386 I387 A392 F393 L475 N479 L488 L491 I495	A385-L389 WeakPolarHBondContact O-CB 3.18Å; A385-L389 PolarHBondContact O-N 2.86Å; C386-L389 PolarHBondContact O-N 3.43Å; I387-L389 VanDerWaalsContact C-N 3.34Å; I387-L389 PolarHBondContact O-N 3.38Å; L389-A392 PolarHBondContact O-N 2.98Å; L389-F393 HydrophobicContact CD1-CD1 4.33Å; L389-F393 HydrophobicContact CD1-CE1 3.65Å; L389-F393 HydrophobicContact CD1-CE2 4.15Å; L389-F393 HydrophobicContact CD1-CZ 3.53Å; L389-F393 HydrophobicContact CD2-CE2 4.49Å; L389-F393 HydrophobicContact CD2-CZ 4.45Å; L389-F393 HydrophobicContact CG-CE1 4.38Å; L389-F393 HydrophobicContact CG-CE2 4.03Å; L389-F393 HydrophobicContact CG-CZ 3.94Å; L389-F393 WeakPolarHBondContact O-CG 3.5Å; L389-F393 PolarHBondContact O-N 3.38Å; L389-L475 HydrophobicContact CB-CD1 4.38Å; L389-L475 HydrophobicContact CD2-CD1 3.76Å; L389-L475 HydrophobicContact CD2-CD2 4.05Å; L389-L475 HydrophobicContact CD2-CG 3.89Å; L389-L475 HydrophobicContact CG-CD1 3.86Å; L389-N479 VanDerWaalsContact CD2-OD1 3.25Å; L389-N479 WeakPolarHBondContact CD2-OD1 3.47Å; L389-L488 HydrophobicContact CD1-CB 4.27Å; L389-L488 HydrophobicContact CD1-CD1 4.12Å; L389-L491 HydrophobicContact CB-CD2 3.86Å; L389-L491 HydrophobicContact CD1-CD2 4.37Å; L389-I495 HydrophobicContact CB-CD1 4.4Å; L389-I495 HydrophobicContact CD2-CD1 3.48Å; L389-I495 VanDerWaalsContact CD2-CD1 3.48Å
390	N	88.3	Confident	87.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-44.8	174.7	-85	-107.6	0	0	0	111.5	C386 I387 F393 L394 L407 H410 L411 L475	C386-N390 PolarHBondContact O-N 3.07Å; C386-N390 PolarHBondContact O-ND2 3Å; I387-N390 PolarHBondContact O-N 3.18Å; N390-F393 PolarHBondContact O-N 3.18Å; N390-L394 WeakPolarHBondContact O-CB 3.5Å; N390-L394 WeakPolarHBondContact O-CG 3.34Å; N390-L394 PolarHBondContact O-N 3.38Å; N390-L407 HydrophobicContact CB-CD1 4.38Å; N390-L407 VanDerWaalsContact OD1-CD1 3.28Å; N390-L407 WeakPolarHBondContact OD1-CD1 3.46Å; N390-L407 PolarHBondContact OD1-O 2.74Å; N390-H410 PolarHBondContact ND2-CE1 3.26Å; N390-H410 PolarHBondContact ND2-ND1 3.15Å; N390-H410 VanDerWaalsContact ND2-ND1 3.15Å; N390-H410 PolarHBondContact OD1-ND1 3.35Å; N390-L411 HydrophobicContact CB-CB 4.23Å; N390-L411 HydrophobicContact CB-CD1 4.12Å; N390-L475 WeakPolarHBondContact ND2-CD1 3.28Å; N390-L475 VanDerWaalsContact ND2-CD2 3.3Å; N390-L475 WeakPolarHBondContact ND2-CD2 3.33Å
391	I	90.5	Very high	87.2	Confident	73 Å²	73	49.3 Å²	49.3	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-45.9	178.7	-67.6	165.4	0	0	0	110.4	I387 L388 F393 L394 L395 L411	I387-I391 HydrophobicContact CG2-CD1 3.78Å; I387-I391 WeakPolarHBondContact O-CG1 3.16Å; I387-I391 PolarHBondContact O-N 3.06Å; L388-I391 PolarHBondContact O-N 2.81Å; I391-F393 VanDerWaalsContact C-N 3.3Å; I391-F393 PolarHBondContact O-N 3.46Å; I391-L394 PolarHBondContact O-N 3.19Å; I391-L395 HydrophobicContact CG2-CD1 4.04Å; I391-L395 WeakPolarHBondContact O-CG 3.41Å; I391-L395 PolarHBondContact O-N 2.96Å; I391-L411 HydrophobicContact CG1-CD1 4.32Å; I391-L411 HydrophobicContact CG1-CD2 4.36Å
392	A	87.3	Confident	86.7	Confident	34 Å²	34	52.5 Å²	52.5	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-40	177.9	0	0	0	0	0	112.4	L388 L389 L395 G396 L488	L388-A392 WeakPolarHBondContact O-CB 3.33Å; L388-A392 PolarHBondContact O-N 3.06Å; L389-A392 PolarHBondContact O-N 2.98Å; A392-L395 PolarHBondContact O-N 3.39Å; A392-G396 PolarHBondContact O-N 2.91Å; A392-L488 HydrophobicContact CB-CD1 3.66Å
393	F	85.3	Confident	86.1	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-70.2	-37.3	174.5	-72.7	-4.7	0	0	0	113.4	L389 N390 I391 L395 G396 F399 L407 L475 N479 Y482 V483 L488	L389-F393 HydrophobicContact CD1-CD1 4.33Å; L389-F393 HydrophobicContact CD1-CE1 3.65Å; L389-F393 HydrophobicContact CD1-CE2 4.15Å; L389-F393 HydrophobicContact CD1-CZ 3.53Å; L389-F393 HydrophobicContact CD2-CE2 4.49Å; L389-F393 HydrophobicContact CD2-CZ 4.45Å; L389-F393 HydrophobicContact CG-CE1 4.38Å; L389-F393 HydrophobicContact CG-CE2 4.03Å; L389-F393 HydrophobicContact CG-CZ 3.94Å; L389-F393 WeakPolarHBondContact O-CG 3.5Å; L389-F393 PolarHBondContact O-N 3.38Å; N390-F393 PolarHBondContact O-N 3.18Å; I391-F393 VanDerWaalsContact C-N 3.3Å; I391-F393 PolarHBondContact O-N 3.46Å; F393-L395 PolarHBondContact O-N 2.87Å; F393-G396 PolarHBondContact O-N 3.5Å; F393-F399 HydrophobicContact CB-CD2 4.46Å; F393-F399 HydrophobicContact CB-CE2 3.66Å; F393-F399 HydrophobicContact CB-CZ 4.21Å; F393-F399 HydrophobicContact CD1-CE2 4.36Å; F393-F399 HydrophobicContact CD1-CZ 4.33Å; F393-F399 HydrophobicContact CD2-CZ 4.33Å; F393-F399 AromaticContact CG-CE2 3.98Å; F393-F399 HydrophobicContact CG-CE2 3.98Å; F393-F399 HydrophobicContact CG-CZ 4.04Å; F393-F399 WeakPolarHBondContact O-CD2 3.3Å; F393-F399 WeakPolarHBondContact O-CE2 3.33Å; F393-L407 HydrophobicContact CB-CD1 4.47Å; F393-L407 HydrophobicContact CB-CD2 3.45Å; F393-L407 VanDerWaalsContact CB-CD2 3.45Å; F393-L407 HydrophobicContact CD2-CD1 4.3Å; F393-L475 HydrophobicContact CD2-CD1 4.08Å; F393-L475 HydrophobicContact CE2-CD1 3.96Å; F393-N479 HydrophobicContact CE2-CB 3.97Å; F393-N479 HydrophobicContact CZ-CB 4.03Å; F393-N479 WeakPolarHBondContact CZ-OD1 3.29Å; F393-Y482 AromaticContact CD1-CD1 3.99Å; F393-Y482 HydrophobicContact CD1-CD1 3.99Å; F393-Y482 HydrophobicContact CD1-CE1 4.27Å; F393-Y482 AromaticContact CE1-CD1 3.78Å; F393-Y482 HydrophobicContact CE1-CD1 3.78Å; F393-Y482 HydrophobicContact CE1-CE1 4.42Å; F393-V483 HydrophobicContact CE1-CG2 3.74Å; F393-V483 HydrophobicContact CZ-CG2 3.47Å; F393-V483 VanDerWaalsContact CZ-CG2 3.47Å; F393-L488 HydrophobicContact CE1-CD1 4.33Å
394	L	87.8	Confident	85.7	Confident	48 Å²	48	57 Å²	57	25%	0.251	32%	0.321	S	S	.	.	H	α-helix	trans	-66.9	-25.1	176.3	-75.6	169.8	0	0	0	113.2	N390 I391 L407 K408 L411	N390-L394 WeakPolarHBondContact O-CB 3.5Å; N390-L394 WeakPolarHBondContact O-CG 3.34Å; N390-L394 PolarHBondContact O-N 3.38Å; I391-L394 PolarHBondContact O-N 3.19Å; L394-L407 HydrophobicContact CB-CD2 4.45Å; L394-L407 HydrophobicContact CD2-CB 4.06Å; L394-L407 HydrophobicContact CD2-CD2 3.67Å; L394-L407 HydrophobicContact CD2-CG 3.93Å; L394-L407 HydrophobicContact CG-CD2 3.6Å; L394-L407 HydrophobicContact CG-CG 3.89Å; L394-K408 HydrophobicContact CD1-CG 4.31Å; L394-K408 HydrophobicContact CD2-CD 4.5Å; L394-K408 HydrophobicContact CD2-CG 3.69Å; L394-L411 HydrophobicContact CD1-CD2 3.68Å
395	L	87.1	Confident	85.3	Confident	136 Å²	136	59.7 Å²	59.7	71%	0.712	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.9	172.5	-65.9	171.1	0	0	0	112.8	I391 A392 F393	I391-L395 HydrophobicContact CG2-CD1 4.04Å; I391-L395 WeakPolarHBondContact O-CG 3.41Å; I391-L395 PolarHBondContact O-N 2.96Å; A392-L395 PolarHBondContact O-N 3.39Å; F393-L395 PolarHBondContact O-N 2.87Å
396	G	80.5	Confident	85.1	Confident	14 Å²	14	60 Å²	60	14%	0.144	33%	0.33	C	S	.	.	S	Bend	trans	-84.1	121.9	177.7	0	0	0	0	0	112.1	A392 F393 G398	A392-G396 PolarHBondContact O-N 2.91Å; F393-G396 PolarHBondContact O-N 3.5Å; G396-G398 PolarHBondContact O-N 3.09Å
397	N	69.4	Low	85	Confident	170 Å²	170	60 Å²	60	91%	0.909	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	28	179.4	-69.3	-16.3	0	0	0	114.4
398	G	74.6	Confident	84.9	Confident	49 Å²	49	64.7 Å²	64.7	51%	0.505	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-4.7	-172.3	0	0	0	0	0	116.3	G396	G396-G398 PolarHBondContact O-N 3.09Å
399	F	79	Confident	84.9	Confident	21 Å²	21	62.3 Å²	62.3	9%	0.092	34%	0.337	C	S	.	.	S	Bend	trans	-111.3	141.8	-170.6	-61.2	-67.3	0	0	0	113.2	F393 E403 Q404 V478 Y482	F393-F399 HydrophobicContact CB-CD2 4.46Å; F393-F399 HydrophobicContact CB-CE2 3.66Å; F393-F399 HydrophobicContact CB-CZ 4.21Å; F393-F399 HydrophobicContact CD1-CE2 4.36Å; F393-F399 HydrophobicContact CD1-CZ 4.33Å; F393-F399 HydrophobicContact CD2-CZ 4.33Å; F393-F399 AromaticContact CG-CE2 3.98Å; F393-F399 HydrophobicContact CG-CE2 3.98Å; F393-F399 HydrophobicContact CG-CZ 4.04Å; F393-F399 WeakPolarHBondContact O-CD2 3.3Å; F393-F399 WeakPolarHBondContact O-CE2 3.33Å; F399-E403 HydrophobicContact CB-CB 4.14Å; F399-Q404 HydrophobicContact CB-CG 3.94Å; F399-Q404 PolarHBondContact O-NE2 2.99Å; F399-V478 HydrophobicContact CD1-CG1 3.86Å; F399-V478 HydrophobicContact CE1-CG1 3.3Å; F399-V478 HydrophobicContact CZ-CG1 4.17Å; F399-Y482 HydrophobicContact CE1-CD2 4.11Å; F399-Y482 HydrophobicContact CE1-CG 4.22Å; F399-Y482 HydrophobicContact CE2-CD2 4.45Å; F399-Y482 HydrophobicContact CE2-CE1 4.47Å; F399-Y482 HydrophobicContact CE2-CE2 4.42Å; F399-Y482 HydrophobicContact CE2-CG 4.5Å; F399-Y482 AromaticContact CZ-CD1 3.94Å; F399-Y482 HydrophobicContact CZ-CD1 3.94Å; F399-Y482 AromaticContact CZ-CD2 3.74Å; F399-Y482 HydrophobicContact CZ-CD2 3.74Å; F399-Y482 HydrophobicContact CZ-CE1 4.32Å; F399-Y482 HydrophobicContact CZ-CE2 4.15Å; F399-Y482 AromaticContact CZ-CG 3.63Å; F399-Y482 HydrophobicContact CZ-CG 3.63Å
400	N	82.4	Confident	85.1	Confident	115 Å²	115	63.2 Å²	63.2	62%	0.615	34%	0.341	S	S	*	.			trans	-65.9	157.8	176.1	-64.4	-64.4	0	0	0	111.7	N402 E403 Q404	N400-N402 PolarHBondContact O-N 3Å; N400-N402 VanDerWaalsContact O-N 3.13Å; N400-E403 HydrophobicContact CB-CG 4.32Å; N400-E403 VanDerWaalsContact CB-OE2 3.3Å; N400-E403 WeakPolarHBondContact CB-OE2 3.25Å; N400-E403 PolarHBondContact N-OE2 3.49Å; N400-E403 PolarHBondContact ND2-OE2 3.34Å; N400-E403 WeakPolarHBondContact O-CB 3.45Å; N400-E403 PolarHBondContact O-N 3.01Å; N400-Q404 WeakPolarHBondContact O-CG 3.42Å; N400-Q404 PolarHBondContact O-N 3.02Å
401	N	84.5	Confident	85.3	Confident	120 Å²	120	64.7 Å²	64.7	64%	0.642	35%	0.349	S	S	*	.	H	α-helix	trans	-51.4	-41	-179.9	-70	-21.6	0	0	0	113.4	Q405	N401-Q405 WeakPolarHBondContact O-CG 3.36Å; N401-Q405 PolarHBondContact O-N 3.42Å
402	N	83.7	Confident	85.5	Confident	108 Å²	108	66.7 Å²	66.7	58%	0.578	36%	0.355	S	S	*	.	H	α-helix	trans	-68.2	-40.1	178.8	-62.5	-1.3	0	0	0	112.1	N400 Q405 C406	N400-N402 PolarHBondContact O-N 3Å; N400-N402 VanDerWaalsContact O-N 3.13Å; N402-Q405 PolarHBondContact O-N 3.44Å; N402-C406 PolarHBondContact O-N 3.38Å; N402-C406 PolarHBondContact O-SG 3.26Å
403	E	82.1	Confident	85.8	Confident	57 Å²	57	65.4 Å²	65.4	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-67.5	-42.4	177.3	-64.1	173.7	120.7	0	0	110.7	F399 N400 Q405 C406 L407	F399-E403 HydrophobicContact CB-CB 4.14Å; N400-E403 HydrophobicContact CB-CG 4.32Å; N400-E403 VanDerWaalsContact CB-OE2 3.3Å; N400-E403 WeakPolarHBondContact CB-OE2 3.25Å; N400-E403 PolarHBondContact N-OE2 3.49Å; N400-E403 PolarHBondContact ND2-OE2 3.34Å; N400-E403 WeakPolarHBondContact O-CB 3.45Å; N400-E403 PolarHBondContact O-N 3.01Å; E403-Q405 VanDerWaalsContact C-N 3.31Å; E403-Q405 PolarHBondContact O-N 3.39Å; E403-C406 PolarHBondContact O-N 2.6Å; E403-L407 VanDerWaalsContact O-CB 3.29Å; E403-L407 WeakPolarHBondContact O-CB 3.36Å; E403-L407 PolarHBondContact O-N 3.46Å
404	Q	85.3	Confident	86.1	Confident	54 Å²	54	65.5 Å²	65.5	25%	0.252	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-38.2	173.6	-67	-174.4	21.9	0	0	112.2	F399 N400 K408	F399-Q404 HydrophobicContact CB-CG 3.94Å; F399-Q404 PolarHBondContact O-NE2 2.99Å; N400-Q404 WeakPolarHBondContact O-CG 3.42Å; N400-Q404 PolarHBondContact O-N 3.02Å; Q404-K408 WeakPolarHBondContact O-CB 3.37Å; Q404-K408 WeakPolarHBondContact O-CD 3.21Å; Q404-K408 VanDerWaalsContact O-CG 3.23Å; Q404-K408 WeakPolarHBondContact O-CG 3.39Å; Q404-K408 PolarHBondContact O-N 3.34Å
405	Q	87.9	Confident	86.5	Confident	122 Å²	122	67.1 Å²	67.1	57%	0.57	35%	0.354	S	S	*	.	H	α-helix	trans	-65.6	-45.7	174.1	-74.6	178.1	9.7	0	0	111.7	N401 N402 E403 L407 K408 L409	N401-Q405 WeakPolarHBondContact O-CG 3.36Å; N401-Q405 PolarHBondContact O-N 3.42Å; N402-Q405 PolarHBondContact O-N 3.44Å; E403-Q405 VanDerWaalsContact C-N 3.31Å; E403-Q405 PolarHBondContact O-N 3.39Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 2.87Å; Q405-K408 PolarHBondContact O-N 2.8Å; Q405-L409 PolarHBondContact O-N 3.49Å
406	C	87.8	Confident	87	Confident	10 Å²	10	61.5 Å²	61.5	7%	0.068	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-40.2	175.7	-65.9	0	0	0	0	111.9	N402 E403 L409 H410 I474	N402-C406 PolarHBondContact O-N 3.38Å; N402-C406 PolarHBondContact O-SG 3.26Å; E403-C406 PolarHBondContact O-N 2.6Å; C406-L409 PolarHBondContact O-N 2.87Å; C406-H410 WeakPolarHBondContact O-CB 3.39Å; C406-H410 PolarHBondContact O-N 3.43Å; C406-I474 HydrophobicContact CB-CB 4.44Å; C406-I474 HydrophobicContact CB-CD1 3.99Å; C406-I474 HydrophobicContact CB-CG1 3.91Å
407	L	88.7	Confident	87.7	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-70.1	-38.3	179.2	-169.4	68.4	0	0	0	112.3	N390 F393 L394 E403 Q405 H410 L411 L475	N390-L407 HydrophobicContact CB-CD1 4.38Å; N390-L407 VanDerWaalsContact OD1-CD1 3.28Å; N390-L407 WeakPolarHBondContact OD1-CD1 3.46Å; N390-L407 PolarHBondContact OD1-O 2.74Å; F393-L407 HydrophobicContact CB-CD1 4.47Å; F393-L407 HydrophobicContact CB-CD2 3.45Å; F393-L407 VanDerWaalsContact CB-CD2 3.45Å; F393-L407 HydrophobicContact CD2-CD1 4.3Å; L394-L407 HydrophobicContact CB-CD2 4.45Å; L394-L407 HydrophobicContact CD2-CB 4.06Å; L394-L407 HydrophobicContact CD2-CD2 3.67Å; L394-L407 HydrophobicContact CD2-CG 3.93Å; L394-L407 HydrophobicContact CG-CD2 3.6Å; L394-L407 HydrophobicContact CG-CG 3.89Å; E403-L407 VanDerWaalsContact O-CB 3.29Å; E403-L407 WeakPolarHBondContact O-CB 3.36Å; E403-L407 PolarHBondContact O-N 3.46Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 2.87Å; L407-H410 PolarHBondContact O-N 3.48Å; L407-L411 WeakPolarHBondContact O-CB 3.3Å; L407-L411 PolarHBondContact O-N 3.14Å; L407-L475 HydrophobicContact CD1-CD1 4.32Å
408	K	91.1	Very high	89	Confident	117 Å²	117	55 Å²	55	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-42.3	170.5	-74.3	165.6	-173.3	170	0	111.6	L394 Q404 Q405 L411 F412	L394-K408 HydrophobicContact CD1-CG 4.31Å; L394-K408 HydrophobicContact CD2-CD 4.5Å; L394-K408 HydrophobicContact CD2-CG 3.69Å; Q404-K408 WeakPolarHBondContact O-CB 3.37Å; Q404-K408 WeakPolarHBondContact O-CD 3.21Å; Q404-K408 VanDerWaalsContact O-CG 3.23Å; Q404-K408 WeakPolarHBondContact O-CG 3.39Å; Q404-K408 PolarHBondContact O-N 3.34Å; Q405-K408 PolarHBondContact O-N 2.8Å; K408-L411 PolarHBondContact O-N 3.37Å; K408-F412 PolarHBondContact O-N 3.17Å; K408-F412 VanDerWaalsContact O-N 3.09Å
409	L	91.6	Very high	90.1	Very high	49 Å²	49	57.2 Å²	57.2	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-67.4	-40.4	177.3	-175.2	63.7	0	0	0	112	I329 T333 Q405 C406 F412 S413	I329-L409 HydrophobicContact CG2-CD2 4.06Å; T333-L409 HydrophobicContact CG2-CD2 4.2Å; Q405-L409 PolarHBondContact O-N 3.49Å; C406-L409 PolarHBondContact O-N 2.87Å; L409-F412 WeakPolarHBondContact O-CB 3.49Å; L409-F412 PolarHBondContact O-N 2.98Å; L409-S413 PolarHBondContact O-N 2.9Å
410	H	91.2	Very high	91	Very high	20 Å²	20	56.2 Å²	56.2	9%	0.093	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-40.9	174.5	179.9	-82.5	0	0	0	112	N390 C406 L407 F412 S413 A414 N473 I474	N390-H410 PolarHBondContact ND2-CE1 3.26Å; N390-H410 PolarHBondContact ND2-ND1 3.15Å; N390-H410 VanDerWaalsContact ND2-ND1 3.15Å; N390-H410 PolarHBondContact OD1-ND1 3.35Å; C406-H410 WeakPolarHBondContact O-CB 3.39Å; C406-H410 PolarHBondContact O-N 3.43Å; L407-H410 PolarHBondContact O-N 3.48Å; H410-F412 VanDerWaalsContact C-N 3.33Å; H410-F412 PolarHBondContact O-N 2.97Å; H410-S413 WeakPolarHBondContact O-CB 3.13Å; H410-S413 PolarHBondContact O-N 2.73Å; H410-A414 WeakPolarHBondContact O-CB 3.47Å; H410-A414 PolarHBondContact O-N 2.89Å; H410-N473 PolarHBondContact CD2-OD1 3.2Å; H410-N473 PolarHBondContact NE2-ND2 3.31Å; H410-N473 PolarHBondContact NE2-OD1 3.07Å; H410-I474 HydrophobicContact CB-CG2 3.65Å
411	L	93.3	Very high	91.7	Very high	31 Å²	31	50.8 Å²	50.8	16%	0.162	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-43.7	173.2	176.1	61.5	0	0	0	111.8	I387 N390 I391 L394 L407 K408 A414 L415	I387-L411 HydrophobicContact CB-CD1 4.45Å; I387-L411 HydrophobicContact CG1-CD1 4.36Å; I387-L411 HydrophobicContact CG2-CD1 4Å; N390-L411 HydrophobicContact CB-CB 4.23Å; N390-L411 HydrophobicContact CB-CD1 4.12Å; I391-L411 HydrophobicContact CG1-CD1 4.32Å; I391-L411 HydrophobicContact CG1-CD2 4.36Å; L394-L411 HydrophobicContact CD1-CD2 3.68Å; L407-L411 WeakPolarHBondContact O-CB 3.3Å; L407-L411 PolarHBondContact O-N 3.14Å; K408-L411 PolarHBondContact O-N 3.37Å; L411-A414 PolarHBondContact O-N 3.49Å; L411-L415 HydrophobicContact CD1-CD1 4.26Å; L411-L415 HydrophobicContact CD1-CG 4.39Å; L411-L415 HydrophobicContact CG-CD1 4.25Å; L411-L415 WeakPolarHBondContact O-CG 3.19Å; L411-L415 PolarHBondContact O-N 3.35Å
412	F	94.5	Very high	92.2	Very high	115 Å²	115	48.2 Å²	48.2	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-46.1	173.3	173.8	-97.3	0	0	0	111.7	K408 L409 H410 A414 L415 L416	K408-F412 PolarHBondContact O-N 3.17Å; K408-F412 VanDerWaalsContact O-N 3.09Å; L409-F412 WeakPolarHBondContact O-CB 3.49Å; L409-F412 PolarHBondContact O-N 2.98Å; H410-F412 VanDerWaalsContact C-N 3.33Å; H410-F412 PolarHBondContact O-N 2.97Å; F412-A414 PolarHBondContact O-N 2.84Å; F412-L415 PolarHBondContact O-N 2.99Å; F412-L416 HydrophobicContact CE1-CD2 4.14Å; F412-L416 VanDerWaalsContact O-CB 3.3Å; F412-L416 WeakPolarHBondContact O-CB 3.4Å; F412-L416 PolarHBondContact O-N 3.15Å
413	S	93.2	Very high	92.9	Very high	7 Å²	7	45 Å²	45	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-42.5	177.6	-160.2	0	0	0	0	112.3	T335 S336 L409 H410 L416 E417	T335-S413 PolarHBondContact OG1-OG 3.41Å; S336-S413 WeakPolarHBondContact OG-CB 3.37Å; S336-S413 PolarHBondContact OG-OG 3.2Å; S336-S413 VanDerWaalsContact OG-OG 3.06Å; L409-S413 PolarHBondContact O-N 2.9Å; H410-S413 WeakPolarHBondContact O-CB 3.13Å; H410-S413 PolarHBondContact O-N 2.73Å; S413-L416 PolarHBondContact O-N 3.12Å; S413-E417 WeakPolarHBondContact O-CB 3.42Å; S413-E417 PolarHBondContact O-N 3.31Å
414	A	93.4	Very high	93.6	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-67.8	-37.4	178.9	0	0	0	0	0	113.3	I387 H410 L411 F412 E417 L418	I387-A414 HydrophobicContact CG1-CB 3.94Å; H410-A414 WeakPolarHBondContact O-CB 3.47Å; H410-A414 PolarHBondContact O-N 2.89Å; L411-A414 PolarHBondContact O-N 3.49Å; F412-A414 PolarHBondContact O-N 2.84Å; A414-E417 PolarHBondContact O-N 3.1Å; A414-L418 WeakPolarHBondContact O-CB 3.33Å; A414-L418 PolarHBondContact O-N 3.33Å
415	L	96.1	Very high	94	Very high	82 Å²	82	40.5 Å²	40.5	43%	0.429	20%	0.204	S	C	.	.	H	α-helix	trans	-66.7	-44.4	173.6	-73.9	167.8	0	0	0	111.5	I387 L411 F412 E417 L418 I419	I387-L415 HydrophobicContact CD1-CD2 3.87Å; I387-L415 HydrophobicContact CD1-CG 4.39Å; I387-L415 HydrophobicContact CG1-CD2 4.43Å; L411-L415 HydrophobicContact CD1-CD1 4.26Å; L411-L415 HydrophobicContact CD1-CG 4.39Å; L411-L415 HydrophobicContact CG-CD1 4.25Å; L411-L415 WeakPolarHBondContact O-CG 3.19Å; L411-L415 PolarHBondContact O-N 3.35Å; F412-L415 PolarHBondContact O-N 2.99Å; L415-E417 VanDerWaalsContact C-N 3.33Å; L415-L418 PolarHBondContact O-N 3.2Å; L415-I419 WeakPolarHBondContact O-CG1 3.38Å; L415-I419 PolarHBondContact O-N 2.73Å; L415-I419 VanDerWaalsContact O-N 3.15Å
416	L	96.3	Very high	94.4	Very high	18 Å²	18	40.9 Å²	40.9	9%	0.094	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-40.6	175	175.5	64.7	0	0	0	111.4	S336 F339 I340 F412 S413 I419 Q420	S336-L416 WeakPolarHBondContact O-CD2 3.46Å; F339-L416 HydrophobicContact CB-CD2 3.86Å; F339-L416 HydrophobicContact CB-CG 3.77Å; F339-L416 HydrophobicContact CD2-CD2 4.37Å; F339-L416 HydrophobicContact CD2-CG 4.41Å; I340-L416 HydrophobicContact CD1-CD2 4.38Å; I340-L416 HydrophobicContact CG1-CD1 4.17Å; I340-L416 HydrophobicContact CG1-CD2 3.87Å; F412-L416 HydrophobicContact CE1-CD2 4.14Å; F412-L416 VanDerWaalsContact O-CB 3.3Å; F412-L416 WeakPolarHBondContact O-CB 3.4Å; F412-L416 PolarHBondContact O-N 3.15Å; S413-L416 PolarHBondContact O-N 3.12Å; L416-I419 PolarHBondContact O-N 2.92Å; L416-Q420 VanDerWaalsContact O-CB 3.29Å; L416-Q420 WeakPolarHBondContact O-CB 3.31Å; L416-Q420 PolarHBondContact O-N 3.15Å
417	E	95.8	Very high	94.7	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-46.9	174.4	-169.3	177.5	179.8	0	0	111.4	F339 L383 S413 A414 L415 I419 Q420 V421 Y465 R506	F339-E417 HydrophobicContact CD1-CG 4.43Å; F339-E417 HydrophobicContact CD2-CB 4.06Å; F339-E417 HydrophobicContact CE1-CB 4.36Å; F339-E417 HydrophobicContact CE1-CG 3.83Å; F339-E417 HydrophobicContact CE2-CB 3.67Å; F339-E417 HydrophobicContact CE2-CG 3.97Å; F339-E417 HydrophobicContact CZ-CB 3.85Å; F339-E417 HydrophobicContact CZ-CG 3.58Å; L383-E417 HydrophobicContact CD1-CB 4.35Å; L383-E417 HydrophobicContact CD1-CG 3.9Å; L383-E417 HydrophobicContact CD2-CB 4.24Å; L383-E417 VanDerWaalsContact CD2-CD 3.44Å; L383-E417 HydrophobicContact CD2-CG 4Å; L383-E417 WeakPolarHBondContact CD2-OE2 3.45Å; S413-E417 WeakPolarHBondContact O-CB 3.42Å; S413-E417 PolarHBondContact O-N 3.31Å; A414-E417 PolarHBondContact O-N 3.1Å; L415-E417 VanDerWaalsContact C-N 3.33Å; E417-I419 VanDerWaalsContact C-N 3.31Å; E417-I419 PolarHBondContact O-N 3.47Å; E417-Q420 PolarHBondContact O-N 2.75Å; E417-Q420 VanDerWaalsContact O-N 3.13Å; E417-V421 HydrophobicContact CG-CG2 3.98Å; E417-V421 WeakPolarHBondContact O-CB 3.4Å; E417-V421 VanDerWaalsContact O-CG2 3.3Å; E417-V421 WeakPolarHBondContact O-CG2 3.35Å; E417-V421 PolarHBondContact O-N 3.1Å; E417-Y465 PolarHBondContact OE1-OH 2.98Å; E417-Y465 PolarHBondContact OE2-OH 3.2Å; E417-R506 IonicContact OE1-CZ 3.68Å; E417-R506 IonicContact OE1-NE 2.72Å; E417-R506 IonicContact OE1-NH2 3.68Å; E417-R506 PolarHBondContact OE1-NH2 3.34Å
418	L	97.2	Very high	94.9	Very high	41 Å²	41	40 Å²	40	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-42.1	179.4	179.7	61.9	0	0	0	112	V380 L383 I387 A414 L415 T422	V380-L418 HydrophobicContact CG1-CD1 4.1Å; V380-L418 HydrophobicContact CG2-CD1 4.42Å; L383-L418 HydrophobicContact CB-CD1 4.33Å; L383-L418 HydrophobicContact CD1-CB 4.24Å; L383-L418 HydrophobicContact CD1-CD1 4.3Å; I387-L418 HydrophobicContact CD1-CD2 4.01Å; A414-L418 WeakPolarHBondContact O-CB 3.33Å; A414-L418 PolarHBondContact O-N 3.33Å; L415-L418 PolarHBondContact O-N 3.2Å; L418-T422 WeakPolarHBondContact O-CB 3.48Å; L418-T422 PolarHBondContact O-N 3.37Å; L418-T422 VanDerWaalsContact O-N 3.13Å; L418-T422 PolarHBondContact O-OG1 3.36Å
419	I	97.1	Very high	94.9	Very high	95 Å²	95	36.3 Å²	36.3	49%	0.487	19%	0.185	S	C	.	.	H	α-helix	trans	-64.2	-49.3	173.9	-64.8	166	0	0	0	110.2	L343 L415 L416 E417 V421 T422 V423	L343-I419 HydrophobicContact CD1-CG2 4.24Å; L343-I419 HydrophobicContact CD2-CG2 4.13Å; L415-I419 WeakPolarHBondContact O-CG1 3.38Å; L415-I419 PolarHBondContact O-N 2.73Å; L415-I419 VanDerWaalsContact O-N 3.15Å; L416-I419 PolarHBondContact O-N 2.92Å; E417-I419 VanDerWaalsContact C-N 3.31Å; E417-I419 PolarHBondContact O-N 3.47Å; I419-V421 PolarHBondContact O-N 2.64Å; I419-T422 PolarHBondContact O-N 3.07Å; I419-V423 HydrophobicContact CG2-CG2 4.43Å; I419-V423 WeakPolarHBondContact O-CG2 3.36Å; I419-V423 PolarHBondContact O-N 3.4Å
420	Q	97.1	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-48.4	-178.3	-169.9	-73.8	-46.9	0	0	111.9	F339 A342 L343 L416 E417 V423 Q424	F339-Q420 HydrophobicContact CB-CB 4.36Å; F339-Q420 HydrophobicContact CB-CG 4.22Å; F339-Q420 HydrophobicContact CD1-CG 4.38Å; F339-Q420 WeakPolarHBondContact O-CG 3.42Å; A342-Q420 HydrophobicContact CB-CG 3.93Å; L343-Q420 HydrophobicContact CB-CG 4.41Å; L416-Q420 VanDerWaalsContact O-CB 3.29Å; L416-Q420 WeakPolarHBondContact O-CB 3.31Å; L416-Q420 PolarHBondContact O-N 3.15Å; E417-Q420 PolarHBondContact O-N 2.75Å; E417-Q420 VanDerWaalsContact O-N 3.13Å; Q420-V423 PolarHBondContact O-N 3.16Å; Q420-Q424 WeakPolarHBondContact O-CB 3.23Å; Q420-Q424 PolarHBondContact O-N 3.14Å
421	V	96.9	Very high	94.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-42.4	179.1	167.7	0	0	0	0	111.2	F376 T379 L383 E417 I419 N425 Y505	F376-V421 HydrophobicContact CD2-CG1 3.78Å; F376-V421 HydrophobicContact CE2-CG1 3.75Å; T379-V421 HydrophobicContact CG2-CG1 4.14Å; T379-V421 HydrophobicContact CG2-CG2 4.44Å; L383-V421 HydrophobicContact CD1-CG2 4.27Å; E417-V421 HydrophobicContact CG-CG2 3.98Å; E417-V421 WeakPolarHBondContact O-CB 3.4Å; E417-V421 VanDerWaalsContact O-CG2 3.3Å; E417-V421 WeakPolarHBondContact O-CG2 3.35Å; E417-V421 PolarHBondContact O-N 3.1Å; I419-V421 PolarHBondContact O-N 2.64Å; V421-N425 VanDerWaalsContact O-CB 3.29Å; V421-N425 WeakPolarHBondContact O-CB 3.32Å; V421-N425 PolarHBondContact O-N 3Å; V421-Y505 HydrophobicContact CB-CE1 4.46Å; V421-Y505 HydrophobicContact CG1-CE1 3.78Å; V421-Y505 HydrophobicContact CG2-CE1 4.07Å
422	T	96.6	Very high	94.6	Very high	67 Å²	67	32.7 Å²	32.7	41%	0.411	17%	0.167	S	C	.	.	H	α-helix	trans	-65.1	-49.4	178.7	-57.8	0	0	0	0	111.8	L418 I419 N425 F426	L418-T422 WeakPolarHBondContact O-CB 3.48Å; L418-T422 PolarHBondContact O-N 3.37Å; L418-T422 VanDerWaalsContact O-N 3.13Å; L418-T422 PolarHBondContact O-OG1 3.36Å; I419-T422 PolarHBondContact O-N 3.07Å; T422-N425 PolarHBondContact O-N 2.94Å; T422-F426 PolarHBondContact O-N 2.89Å
423	V	96.9	Very high	94.1	Very high	40 Å²	40	30.3 Å²	30.3	24%	0.242	16%	0.155	C	C	.	.	H	α-helix	trans	-67	-38.3	179.9	176.9	0	0	0	0	111.3	L343 C346 I350 I419 Q420 F427	L343-V423 HydrophobicContact CD1-CB 3.93Å; L343-V423 HydrophobicContact CD1-CG1 4.02Å; L343-V423 HydrophobicContact CD1-CG2 3.99Å; C346-V423 HydrophobicContact CB-CG1 3.91Å; I350-V423 HydrophobicContact CD1-CG1 4.13Å; I419-V423 HydrophobicContact CG2-CG2 4.43Å; I419-V423 WeakPolarHBondContact O-CG2 3.36Å; I419-V423 PolarHBondContact O-N 3.4Å; Q420-V423 PolarHBondContact O-N 3.16Å; V423-F427 PolarHBondContact O-N 2.91Å
424	Q	97	Very high	93.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-46.7	174.7	177.6	175.4	-62.5	0	0	112.4	Q420 F426 F427 I428 L454 N458 S509	Q420-Q424 WeakPolarHBondContact O-CB 3.23Å; Q420-Q424 PolarHBondContact O-N 3.14Å; Q424-F426 VanDerWaalsContact C-N 3.29Å; Q424-F426 PolarHBondContact O-N 3.45Å; Q424-F427 WeakPolarHBondContact O-CB 3.47Å; Q424-F427 PolarHBondContact O-N 3.26Å; Q424-F427 VanDerWaalsContact O-N 3.09Å; Q424-I428 HydrophobicContact CG-CD1 3.82Å; Q424-I428 HydrophobicContact CG-CG1 4.31Å; Q424-I428 WeakPolarHBondContact O-CG1 3.31Å; Q424-I428 PolarHBondContact O-N 3.47Å; Q424-L454 HydrophobicContact CG-CD2 4.35Å; Q424-N458 VanDerWaalsContact CD-ND2 3.31Å; Q424-N458 VanDerWaalsContact NE2-CG 3.32Å; Q424-N458 PolarHBondContact NE2-ND2 2.98Å; Q424-N458 PolarHBondContact NE2-OD1 2.91Å; Q424-N458 PolarHBondContact OE1-ND2 3.21Å; Q424-N458 PolarHBondContact OE1-OD1 2.9Å; Q424-S509 PolarHBondContact NE2-OG 2.91Å
425	N	95.5	Very high	93	Very high	17 Å²	17	30.8 Å²	30.8	9%	0.091	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-39.5	-180	-176	49.7	0	0	0	110.9	F376 V421 T422 F427 I428 N429	F376-N425 VanDerWaalsContact CD1-ND2 3.32Å; F376-N425 WeakPolarHBondContact CD1-ND2 3.27Å; F376-N425 HydrophobicContact CD2-CB 3.43Å; F376-N425 VanDerWaalsContact CD2-CB 3.43Å; F376-N425 VanDerWaalsContact CD2-CG 3.43Å; F376-N425 WeakPolarHBondContact CD2-ND2 3.45Å; F376-N425 WeakPolarHBondContact CE1-ND2 3.39Å; F376-N425 HydrophobicContact CE2-CB 3.41Å; F376-N425 VanDerWaalsContact CE2-CB 3.41Å; F376-N425 WeakPolarHBondContact CE2-ND2 3.22Å; F376-N425 HydrophobicContact CG-CB 4.16Å; F376-N425 VanDerWaalsContact CG-ND2 3.31Å; F376-N425 WeakPolarHBondContact CG-ND2 3.33Å; F376-N425 HydrophobicContact CZ-CB 4.15Å; F376-N425 WeakPolarHBondContact CZ-ND2 3.41Å; V421-N425 VanDerWaalsContact O-CB 3.29Å; V421-N425 WeakPolarHBondContact O-CB 3.32Å; V421-N425 PolarHBondContact O-N 3Å; T422-N425 PolarHBondContact O-N 2.94Å; N425-F427 PolarHBondContact O-N 3.18Å; N425-I428 PolarHBondContact O-N 3.21Å; N425-N429 WeakPolarHBondContact O-CB 3.37Å; N425-N429 PolarHBondContact O-N 2.89Å; N425-N429 PolarHBondContact O-ND2 3.33Å; N425-N429 PolarHBondContact OD1-ND2 3.47Å
426	F	94.4	Very high	92.1	Very high	130 Å²	130	26.9 Å²	26.9	57%	0.57	13%	0.134	S	C	*	.	H	α-helix	trans	-57.6	-47	170	176	-94.4	0	0	0	111.9	I350 T422 Q424 N429 D430	I350-F426 HydrophobicContact CD1-CD1 4.16Å; I350-F426 HydrophobicContact CD1-CE1 4.46Å; T422-F426 PolarHBondContact O-N 2.89Å; Q424-F426 VanDerWaalsContact C-N 3.29Å; Q424-F426 PolarHBondContact O-N 3.45Å; F426-N429 PolarHBondContact O-N 2.89Å; F426-D430 WeakPolarHBondContact O-CB 3.42Å; F426-D430 PolarHBondContact O-N 3.06Å
427	F	95.1	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.3	-45.4	178.7	178.4	-135.5	0	0	0	112.9	G349 I350 T353 V423 Q424 N425 N429 D430 L431 I451 L454 L513	G349-F427 VanDerWaalsContact C-CE2 3.45Å; I350-F427 HydrophobicContact CB-CD2 4.38Å; I350-F427 HydrophobicContact CD1-CB 4.12Å; I350-F427 HydrophobicContact CG1-CB 3.85Å; I350-F427 HydrophobicContact CG1-CD2 3.48Å; I350-F427 VanDerWaalsContact CG1-CD2 3.48Å; I350-F427 HydrophobicContact CG1-CE2 4.27Å; I350-F427 HydrophobicContact CG1-CG 3.85Å; T353-F427 HydrophobicContact CG2-CE2 4.08Å; T353-F427 HydrophobicContact CG2-CZ 4.26Å; V423-F427 PolarHBondContact O-N 2.91Å; Q424-F427 WeakPolarHBondContact O-CB 3.47Å; Q424-F427 PolarHBondContact O-N 3.26Å; Q424-F427 VanDerWaalsContact O-N 3.09Å; N425-F427 PolarHBondContact O-N 3.18Å; F427-N429 VanDerWaalsContact C-N 3.34Å; F427-N429 PolarHBondContact O-N 3.32Å; F427-D430 PolarHBondContact O-N 2.94Å; F427-L431 HydrophobicContact CD2-CD2 4.4Å; F427-L431 HydrophobicContact CD2-CG 4.17Å; F427-L431 HydrophobicContact CE1-CD1 4.15Å; F427-L431 HydrophobicContact CE2-CD1 4.21Å; F427-L431 HydrophobicContact CE2-CD2 3.66Å; F427-L431 HydrophobicContact CE2-CG 3.86Å; F427-L431 HydrophobicContact CZ-CD1 3.96Å; F427-L431 HydrophobicContact CZ-CD2 3.94Å; F427-L431 HydrophobicContact CZ-CG 4.12Å; F427-L431 WeakPolarHBondContact O-CG 3.47Å; F427-L431 PolarHBondContact O-N 3.02Å; F427-I451 HydrophobicContact CE1-CG1 4.49Å; F427-I451 HydrophobicContact CZ-CG1 4.1Å; F427-L454 HydrophobicContact CD1-CD2 3.71Å; F427-L454 HydrophobicContact CE1-CD2 3.86Å; F427-L513 HydrophobicContact CE1-CD2 4.46Å
428	I	93.7	Very high	89.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.8	-42.7	177.8	-63.7	168.8	0	0	0	110.7	L372 Q424 N425 D430 L431 F432 C512 L513	L372-I428 HydrophobicContact CD2-CB 4.15Å; L372-I428 HydrophobicContact CD2-CG2 3.49Å; L372-I428 VanDerWaalsContact CD2-CG2 3.49Å; Q424-I428 HydrophobicContact CG-CD1 3.82Å; Q424-I428 HydrophobicContact CG-CG1 4.31Å; Q424-I428 WeakPolarHBondContact O-CG1 3.31Å; Q424-I428 PolarHBondContact O-N 3.47Å; N425-I428 PolarHBondContact O-N 3.21Å; I428-D430 PolarHBondContact O-N 2.84Å; I428-L431 WeakPolarHBondContact O-CB 3.45Å; I428-L431 PolarHBondContact O-N 3.45Å; I428-F432 HydrophobicContact CG2-CE1 4.25Å; I428-F432 HydrophobicContact CG2-CE2 4.06Å; I428-F432 HydrophobicContact CG2-CZ 3.74Å; I428-F432 PolarHBondContact O-N 2.99Å; I428-C512 HydrophobicContact CG2-CB 3.88Å; I428-L513 HydrophobicContact CD1-CD1 4.2Å; I428-L513 HydrophobicContact CD1-CD2 4.39Å; I428-L513 HydrophobicContact CD1-CG 4.02Å; I428-L513 HydrophobicContact CG1-CD1 4.47Å; I428-L513 HydrophobicContact CG1-CD2 3.79Å; I428-L513 HydrophobicContact CG1-CG 3.95Å
429	N	91.1	Very high	88.2	Confident	38 Å²	38	30.8 Å²	30.8	20%	0.203	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175.7	-80.8	-82.1	0	0	0	111.9	N425 F426 F427 L431 F432 Y433	N425-N429 WeakPolarHBondContact O-CB 3.37Å; N425-N429 PolarHBondContact O-N 2.89Å; N425-N429 PolarHBondContact O-ND2 3.33Å; N425-N429 PolarHBondContact OD1-ND2 3.47Å; F426-N429 PolarHBondContact O-N 2.89Å; F427-N429 VanDerWaalsContact C-N 3.34Å; F427-N429 PolarHBondContact O-N 3.32Å; N429-L431 PolarHBondContact O-N 2.97Å; N429-F432 WeakPolarHBondContact O-CB 3.18Å; N429-F432 PolarHBondContact O-N 3.29Å; N429-Y433 VanDerWaalsContact O-CD2 3.24Å; N429-Y433 WeakPolarHBondContact O-CD2 3.35Å
430	D	90.9	Very high	86.8	Confident	23 Å²	23	29.6 Å²	29.6	12%	0.123	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-39.1	174.1	176.4	63.8	0	0	0	112.4	F426 F427 I428 F432 Y433 R434	F426-D430 WeakPolarHBondContact O-CB 3.42Å; F426-D430 PolarHBondContact O-N 3.06Å; F427-D430 PolarHBondContact O-N 2.94Å; I428-D430 PolarHBondContact O-N 2.84Å; D430-F432 VanDerWaalsContact C-N 3.31Å; D430-F432 PolarHBondContact O-N 3.33Å; D430-Y433 PolarHBondContact O-N 3.13Å; D430-R434 WeakPolarHBondContact O-CG 3.26Å; D430-R434 PolarHBondContact O-N 2.91Å; D430-R434 IonicContact OD1-CZ 2.67Å; D430-R434 IonicContact OD1-NE 2.97Å; D430-R434 IonicContact OD1-NH2 3.24Å; D430-R434 PolarHBondContact OD1-NH2 2.98Å; D430-R434 IonicContact OD2-CZ 3.49Å; D430-R434 IonicContact OD2-NE 3.82Å; D430-R434 PolarHBondContact OD2-NE 2.92Å; D430-R434 IonicContact OD2-NH2 3.35Å; D430-R434 PolarHBondContact OD2-NH2 3.39Å
431	L	90.1	Very high	85.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-39.1	174.5	-69.5	177.6	0	0	0	112.5	T353 F427 I428 N429 Y433 R434 I451 L513 E516 V520	T353-L431 HydrophobicContact CG2-CD2 3.9Å; F427-L431 HydrophobicContact CD2-CD2 4.4Å; F427-L431 HydrophobicContact CD2-CG 4.17Å; F427-L431 HydrophobicContact CE1-CD1 4.15Å; F427-L431 HydrophobicContact CE2-CD1 4.21Å; F427-L431 HydrophobicContact CE2-CD2 3.66Å; F427-L431 HydrophobicContact CE2-CG 3.86Å; F427-L431 HydrophobicContact CZ-CD1 3.96Å; F427-L431 HydrophobicContact CZ-CD2 3.94Å; F427-L431 HydrophobicContact CZ-CG 4.12Å; F427-L431 WeakPolarHBondContact O-CG 3.47Å; F427-L431 PolarHBondContact O-N 3.02Å; I428-L431 WeakPolarHBondContact O-CB 3.45Å; I428-L431 PolarHBondContact O-N 3.45Å; N429-L431 PolarHBondContact O-N 2.97Å; L431-Y433 PolarHBondContact O-N 3.49Å; L431-Y433 VanDerWaalsContact O-N 3.13Å; L431-R434 PolarHBondContact O-N 3.21Å; L431-I451 HydrophobicContact CD1-CD1 4.15Å; L431-I451 HydrophobicContact CD1-CG1 4.22Å; L431-I451 HydrophobicContact CD1-CG2 4.49Å; L431-I451 HydrophobicContact CD2-CD1 3.91Å; L431-L513 HydrophobicContact CD1-CD2 3.92Å; L431-E516 HydrophobicContact CB-CB 4.25Å; L431-E516 HydrophobicContact CB-CG 4.35Å; L431-E516 HydrophobicContact CD1-CB 4.28Å; L431-V520 HydrophobicContact CB-CG2 4.16Å; L431-V520 HydrophobicContact CD2-CG2 4.19Å
432	F	87.1	Confident	84	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-27.9	178.8	-62.3	-39.4	0	0	0	113.4	N361 L372 I428 N429 D430 C512 E516 R527	N361-F432 WeakPolarHBondContact OD1-CB 3.43Å; N361-F432 PolarHBondContact OD1-O 2.94Å; L372-F432 HydrophobicContact CD2-CE2 4.18Å; L372-F432 HydrophobicContact CD2-CZ 4.24Å; I428-F432 HydrophobicContact CG2-CE1 4.25Å; I428-F432 HydrophobicContact CG2-CE2 4.06Å; I428-F432 HydrophobicContact CG2-CZ 3.74Å; I428-F432 PolarHBondContact O-N 2.99Å; N429-F432 WeakPolarHBondContact O-CB 3.18Å; N429-F432 PolarHBondContact O-N 3.29Å; D430-F432 VanDerWaalsContact C-N 3.31Å; D430-F432 PolarHBondContact O-N 3.33Å; F432-C512 HydrophobicContact CZ-CB 4.42Å; F432-E516 HydrophobicContact CD1-CG 3.76Å; F432-E516 WeakPolarHBondContact CD1-OE1 3.27Å; F432-E516 HydrophobicContact CE1-CG 3.81Å; F432-R527 PolarHBondContact O-NH1 3.28Å; F432-R527 PolarHBondContact O-NH2 3.01Å
433	Y	84.5	Confident	82.7	Confident	65 Å²	65	41 Å²	41	26%	0.255	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.9	176.1	-63.7	-102.3	0	0	0	113.6	F358 S359 N361 N364 N429 D430 L431	F358-Y433 CarbonylContact C-O 3.35Å; F358-Y433 WeakPolarHBondContact CA-O 3.3Å; F358-Y433 AromaticContact CE1-CD1 3.68Å; F358-Y433 HydrophobicContact CE1-CD1 3.68Å; F358-Y433 HydrophobicContact CE1-CG 4.21Å; F358-Y433 AromaticContact CE2-CD1 3.99Å; F358-Y433 HydrophobicContact CE2-CD1 3.99Å; F358-Y433 HydrophobicContact CE2-CD2 4.49Å; F358-Y433 AromaticContact CE2-CG 3.7Å; F358-Y433 HydrophobicContact CE2-CG 3.7Å; F358-Y433 AromaticContact CZ-CD1 3.28Å; F358-Y433 HydrophobicContact CZ-CD1 3.28Å; F358-Y433 HydrophobicContact CZ-CD2 4.42Å; F358-Y433 HydrophobicContact CZ-CE1 4.13Å; F358-Y433 AromaticContact CZ-CG 3.49Å; F358-Y433 HydrophobicContact CZ-CG 3.49Å; F358-Y433 VanDerWaalsContact CZ-CG 3.49Å; S359-Y433 PolarHBondContact N-O 2.8Å; N361-Y433 HydrophobicContact CB-CD1 3.41Å; N361-Y433 VanDerWaalsContact CB-CD1 3.41Å; N361-Y433 HydrophobicContact CB-CD2 3.84Å; N361-Y433 HydrophobicContact CB-CE1 3.19Å; N361-Y433 HydrophobicContact CB-CE2 3.64Å; N361-Y433 HydrophobicContact CB-CG 3.71Å; N361-Y433 WeakPolarHBondContact ND2-CE2 3.38Å; N364-Y433 PolarHBondContact ND2-OH 3.41Å; N429-Y433 VanDerWaalsContact O-CD2 3.24Å; N429-Y433 WeakPolarHBondContact O-CD2 3.35Å; D430-Y433 PolarHBondContact O-N 3.13Å; L431-Y433 PolarHBondContact O-N 3.49Å; L431-Y433 VanDerWaalsContact O-N 3.13Å
434	R	86.1	Confident	81.6	Confident	19 Å²	19	48.8 Å²	48.8	7%	0.072	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.4	-177.4	-72.2	-176.4	-175	-58.4	-15.8	112.7	T353 L356 K357 D430 L431 V520	T353-R434 WeakPolarHBondContact O-CD 3.26Å; T353-R434 PolarHBondContact O-NE 2.94Å; T353-R434 PolarHBondContact O-NH1 3.45Å; T353-R434 VanDerWaalsContact O-NH1 3.09Å; T353-R434 PolarHBondContact OG1-NE 3.44Å; L356-R434 HydrophobicContact CB-CB 4.28Å; L356-R434 HydrophobicContact CB-CG 4.48Å; L356-R434 HydrophobicContact CD1-CB 4.44Å; L356-R434 PolarHBondContact O-NH1 3.41Å; K357-R434 WeakPolarHBondContact O-CA 3.15Å; D430-R434 WeakPolarHBondContact O-CG 3.26Å; D430-R434 PolarHBondContact O-N 2.91Å; D430-R434 IonicContact OD1-CZ 2.67Å; D430-R434 IonicContact OD1-NE 2.97Å; D430-R434 IonicContact OD1-NH2 3.24Å; D430-R434 PolarHBondContact OD1-NH2 2.98Å; D430-R434 IonicContact OD2-CZ 3.49Å; D430-R434 IonicContact OD2-NE 3.82Å; D430-R434 PolarHBondContact OD2-NE 2.92Å; D430-R434 IonicContact OD2-NH2 3.35Å; D430-R434 PolarHBondContact OD2-NH2 3.39Å; L431-R434 PolarHBondContact O-N 3.21Å; R434-V520 HydrophobicContact CB-CG1 4.14Å
435	C	78.2	Confident	80.8	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.014	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	159.8	174.7	-55	0	0	0	0	111.7	K357 V520 R527	K357-C435 PolarHBondContact N-O 3.04Å; K357-C435 VanDerWaalsContact N-O 3.1Å; K357-C435 PolarHBondContact O-N 3.33Å; C435-V520 CarbonylContact C-O 3.58Å; C435-R527 WeakPolarHBondContact SG-CD 3.5Å; C435-R527 VanDerWaalsContact SG-CZ 3.52Å; C435-R527 PolarHBondContact SG-NE 3.38Å
436	C	76.5	Confident	80.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-75.6	152.3	171.1	-152.5	0	0	0	0	111	D438 Y441 Q442 V520 E522	C436-D438 PolarHBondContact SG-O 2.85Å; C436-D438 VanDerWaalsContact SG-O 3.41Å; C436-Y441 VanDerWaalsContact SG-C 3.54Å; C436-Y441 WeakPolarHBondContact SG-CB 3.27Å; C436-Q442 HydrophobicContact CB-CG 3.91Å; C436-Q442 WeakPolarHBondContact SG-CG 3.45Å; C436-Q442 PolarHBondContact SG-N 3.48Å; C436-V520 PolarHBondContact N-O 3.08Å; C436-E522 WeakPolarHBondContact CB-O 3.27Å; C436-E522 PolarHBondContact N-O 3.19Å
437	H	69.4	Low	79.8	Confident	20 Å²	20	45.7 Å²	45.7	9%	0.093	23%	0.226	C	C	.	.			trans	-115.2	-48.3	179.6	-167.5	53.7	0	0	0	113.1	K357 R637 R638	K357-H437 HydrophobicContact CB-CB 4.3Å; K357-H437 HydrophobicContact CD-CB 4.49Å; H437-R637 WeakPolarHBondContact NE2-CA 3.47Å; H437-R637 WeakPolarHBondContact NE2-CG 3.43Å; H437-R638 PolarHBondContact CE1-N 3.46Å; H437-R638 VanDerWaalsContact CE1-N 3.32Å; H437-R638 PolarHBondContact CE1-O 3.03Å; H437-R638 PolarHBondContact NE2-N 3.15Å
438	D	68.4	Low	79.4	Confident	68 Å²	68	47.7 Å²	47.7	36%	0.364	23%	0.233	S	C	.	.	S	Bend	trans	-117	151.2	-177.1	-51.5	-64.3	0	0	0	110.5	C436 S440 Y441 Q442	C436-D438 PolarHBondContact SG-O 2.85Å; C436-D438 VanDerWaalsContact SG-O 3.41Å; D438-S440 WeakPolarHBondContact CB-OG 3.44Å; D438-S440 PolarHBondContact O-N 3.29Å; D438-S440 VanDerWaalsContact O-N 3.13Å; D438-Y441 HydrophobicContact CB-CD2 4.13Å; D438-Y441 PolarHBondContact O-N 2.71Å; D438-Q442 PolarHBondContact O-N 3.05Å; D438-Q442 VanDerWaalsContact O-N 3.15Å
439	A	69.1	Low	79.2	Confident	60 Å²	60	49.6 Å²	49.6	50%	0.496	25%	0.249	S	C	.	.	H	α-helix	trans	-56	-28.4	172.6	0	0	0	0	0	112.8	Y441 Q442 Q443	A439-Y441 PolarHBondContact O-N 3.05Å; A439-Q442 WeakPolarHBondContact O-CB 3.45Å; A439-Q442 PolarHBondContact O-N 3.33Å; A439-Q443 WeakPolarHBondContact O-CG 3.47Å; A439-Q443 PolarHBondContact O-N 3.03Å
440	S	67.5	Low	79.2	Confident	70 Å²	70	49.5 Å²	49.5	49%	0.49	25%	0.247	S	C	.	.	H	α-helix	trans	-62.7	-39.4	175.1	61.6	0	0	0	0	112.7	D438 Q443 R444	D438-S440 WeakPolarHBondContact CB-OG 3.44Å; D438-S440 PolarHBondContact O-N 3.29Å; D438-S440 VanDerWaalsContact O-N 3.13Å; S440-Q443 PolarHBondContact O-N 3.22Å; S440-R444 WeakPolarHBondContact O-CB 3.29Å; S440-R444 PolarHBondContact O-N 3.16Å
441	Y	70.1	Confident	79.3	Confident	79 Å²	79	48.4 Å²	48.4	31%	0.31	24%	0.242	S	C	.	.	H	α-helix	trans	-74.8	-31.7	173.3	-73.1	-74	0	0	0	111.9	K355 C436 D438 A439 Q443 R444 K445 P446	K355-Y441 HydrophobicContact CB-CE1 4.4Å; C436-Y441 VanDerWaalsContact SG-C 3.54Å; C436-Y441 WeakPolarHBondContact SG-CB 3.27Å; D438-Y441 HydrophobicContact CB-CD2 4.13Å; D438-Y441 PolarHBondContact O-N 2.71Å; A439-Y441 PolarHBondContact O-N 3.05Å; Y441-Q443 VanDerWaalsContact C-N 3.27Å; Y441-Q443 PolarHBondContact O-N 3.3Å; Y441-R444 PolarHBondContact O-N 3.36Å; Y441-K445 WeakPolarHBondContact O-CA 3.15Å; Y441-K445 PolarHBondContact O-N 2.74Å; Y441-P446 HydrophobicContact CD1-CG 4.06Å
442	Q	66.8	Low	79.3	Confident	67 Å²	67	49 Å²	49	31%	0.313	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-31.3	171.8	-63	-175.3	-37.3	0	0	112	C436 D438 A439 K445 Y521	C436-Q442 HydrophobicContact CB-CG 3.91Å; C436-Q442 WeakPolarHBondContact SG-CG 3.45Å; C436-Q442 PolarHBondContact SG-N 3.48Å; D438-Q442 PolarHBondContact O-N 3.05Å; D438-Q442 VanDerWaalsContact O-N 3.15Å; A439-Q442 WeakPolarHBondContact O-CB 3.45Å; A439-Q442 PolarHBondContact O-N 3.33Å; Q442-K445 WeakPolarHBondContact O-CE 3.5Å; Q442-K445 WeakPolarHBondContact O-CG 3.25Å; Q442-Y521 PolarHBondContact NE2-O 3.45Å
443	Q	68.2	Low	79.6	Confident	160 Å²	160	49.4 Å²	49.4	75%	0.748	25%	0.249	S	C	*	.	H	α-helix	trans	-80	-45.2	173.5	-69.5	178.2	9.9	0	0	112.3	A439 S440 Y441	A439-Q443 WeakPolarHBondContact O-CG 3.47Å; A439-Q443 PolarHBondContact O-N 3.03Å; S440-Q443 PolarHBondContact O-N 3.22Å; Y441-Q443 VanDerWaalsContact C-N 3.27Å; Y441-Q443 PolarHBondContact O-N 3.3Å
444	R	73.7	Confident	80.1	Confident	204 Å²	204	46.3 Å²	46.3	77%	0.77	24%	0.236	S	C	*	.	H	α-helix	trans	-75.5	-26.8	-176	-170.6	173.4	-178.2	173.4	4.3	113.9	S440 Y441	S440-R444 WeakPolarHBondContact O-CB 3.29Å; S440-R444 PolarHBondContact O-N 3.16Å; Y441-R444 PolarHBondContact O-N 3.36Å
445	K	81.7	Confident	80.4	Confident	51 Å²	51	46.3 Å²	46.3	22%	0.222	24%	0.239	C	C	.	.			trans	39	63.5	-179.5	-53.9	-165.4	-178	-173.1	0	114.1	Y441 Q442 G447 R448 Y521	Y441-K445 WeakPolarHBondContact O-CA 3.15Å; Y441-K445 PolarHBondContact O-N 2.74Å; Q442-K445 WeakPolarHBondContact O-CE 3.5Å; Q442-K445 WeakPolarHBondContact O-CG 3.25Å; K445-G447 PolarHBondContact O-N 2.87Å; K445-R448 HydrophobicContact CB-CB 3.94Å; K445-R448 HydrophobicContact CB-CG 4.44Å; K445-R448 VanDerWaalsContact CD-CD 3.43Å; K445-R448 VanDerWaalsContact O-CB 3.23Å; K445-R448 WeakPolarHBondContact O-CB 3.19Å; K445-R448 PolarHBondContact O-N 2.94Å; K445-Y521 HydrophobicContact CB-CD1 3.97Å; K445-Y521 HydrophobicContact CB-CD2 4.46Å; K445-Y521 HydrophobicContact CB-CE1 3.77Å; K445-Y521 HydrophobicContact CB-CE2 4.26Å; K445-Y521 HydrophobicContact CB-CG 4.32Å; K445-Y521 HydrophobicContact CD-CD2 4.14Å; K445-Y521 HydrophobicContact CD-CG 4.09Å; K445-Y521 HydrophobicContact CG-CD1 4Å; K445-Y521 HydrophobicContact CG-CD2 4.44Å; K445-Y521 HydrophobicContact CG-CE1 4.33Å; K445-Y521 HydrophobicContact CG-CG 4.07Å
446	P	81.6	Confident	81.1	Confident	19 Å²	19	46.5 Å²	46.5	12%	0.123	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	136.9	-177.9	28	-36.6	0	0	0	111.5	L356 Y441 R448 Y521	L356-P446 HydrophobicContact CD2-CG 4.26Å; L356-P446 HydrophobicContact CG-CG 4.44Å; Y441-P446 HydrophobicContact CD1-CG 4.06Å; P446-R448 VanDerWaalsContact C-N 3.26Å; P446-R448 PolarHBondContact O-N 3.45Å; P446-Y521 PolarHBondContact O-OH 2.97Å
447	G	85.8	Confident	82	Confident	13 Å²	13	46.5 Å²	46.5	13%	0.134	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-9.4	-179.6	0	0	0	0	0	115.8	S352 K445 A449 M450 I451	S352-G447 WeakPolarHBondContact OG-CA 3.42Å; K445-G447 PolarHBondContact O-N 2.87Å; G447-A449 VanDerWaalsContact C-N 3.3Å; G447-A449 PolarHBondContact O-N 3.47Å; G447-M450 WeakPolarHBondContact O-CA 3.36Å; G447-M450 WeakPolarHBondContact O-CB 3.37Å; G447-M450 PolarHBondContact O-N 2.88Å; G447-I451 PolarHBondContact O-N 2.76Å; G447-I451 VanDerWaalsContact O-N 3.14Å
448	R	87.8	Confident	83.2	Confident	41 Å²	41	45.6 Å²	45.6	16%	0.155	24%	0.237	C	C	.	.	H	α-helix	trans	-56.7	-39.7	-172.1	-172.3	163.3	-164.6	-134.6	5.9	114.1	K445 P446 I451 A452 Y517 Y521	K445-R448 HydrophobicContact CB-CB 3.94Å; K445-R448 HydrophobicContact CB-CG 4.44Å; K445-R448 VanDerWaalsContact CD-CD 3.43Å; K445-R448 VanDerWaalsContact O-CB 3.23Å; K445-R448 WeakPolarHBondContact O-CB 3.19Å; K445-R448 PolarHBondContact O-N 2.94Å; P446-R448 VanDerWaalsContact C-N 3.26Å; P446-R448 PolarHBondContact O-N 3.45Å; R448-I451 PolarHBondContact O-N 3.13Å; R448-A452 PolarHBondContact O-N 3.32Å; R448-A452 VanDerWaalsContact O-N 3.16Å; R448-Y517 HydrophobicContact CG-CD2 3.59Å; R448-Y517 HydrophobicContact CG-CE2 3.2Å; R448-Y517 PolarHBondContact NE-O 3.47Å; R448-Y517 PolarHBondContact NE-OH 2.92Å; R448-Y517 PolarHBondContact NH1-OH 2.88Å; R448-Y517 PolarHBondContact NH2-OH 3.43Å; R448-Y521 VanDerWaalsContact CA-OH 3.29Å; R448-Y521 WeakPolarHBondContact CA-OH 3.35Å; R448-Y521 HydrophobicContact CB-CE2 3.89Å; R448-Y521 WeakPolarHBondContact CB-OH 3.3Å; R448-Y521 HydrophobicContact CG-CE2 3.87Å; R448-Y521 PolarHBondContact N-OH 3.46Å; R448-Y521 VanDerWaalsContact N-OH 3.08Å
449	A	88.8	Confident	84.3	Confident	40 Å²	40	45.2 Å²	45.2	33%	0.331	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-38.5	175.8	0	0	0	0	0	112.3	G447 A452 L453	G447-A449 VanDerWaalsContact C-N 3.3Å; G447-A449 PolarHBondContact O-N 3.47Å; A449-A452 PolarHBondContact O-N 3.42Å; A449-L453 WeakPolarHBondContact O-CB 3.25Å; A449-L453 WeakPolarHBondContact O-CG 3.33Å; A449-L453 PolarHBondContact O-N 3.23Å
450	M	91.3	Very high	85.4	Confident	36 Å²	36	42.4 Å²	42.4	18%	0.177	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-40.6	178.4	-56.8	-63.9	99.8	0	0	111.2	F345 I348 G447 L453 L454	F345-M450 HydrophobicContact CD1-SD 3.85Å; F345-M450 HydrophobicContact CE1-SD 4.41Å; F345-M450 HydrophobicContact CG-SD 4.34Å; I348-M450 HydrophobicContact CB-CG 4.38Å; I348-M450 HydrophobicContact CB-SD 4.03Å; I348-M450 HydrophobicContact CG2-CG 3.88Å; I348-M450 HydrophobicContact CG2-SD 3.67Å; G447-M450 WeakPolarHBondContact O-CA 3.36Å; G447-M450 WeakPolarHBondContact O-CB 3.37Å; G447-M450 PolarHBondContact O-N 2.88Å; M450-L453 HydrophobicContact CE-CD1 3.9Å; M450-L453 PolarHBondContact O-N 3.09Å; M450-L454 WeakPolarHBondContact O-CB 3.47Å; M450-L454 PolarHBondContact O-N 2.99Å
451	I	92.6	Very high	86.6	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-46.3	176.3	-59.3	172.4	0	0	0	110.5	T353 F427 L431 G447 R448 S455 L513	T353-I451 HydrophobicContact CG2-CD1 4.38Å; F427-I451 HydrophobicContact CE1-CG1 4.49Å; F427-I451 HydrophobicContact CZ-CG1 4.1Å; L431-I451 HydrophobicContact CD1-CD1 4.15Å; L431-I451 HydrophobicContact CD1-CG1 4.22Å; L431-I451 HydrophobicContact CD1-CG2 4.49Å; L431-I451 HydrophobicContact CD2-CD1 3.91Å; G447-I451 PolarHBondContact O-N 2.76Å; G447-I451 VanDerWaalsContact O-N 3.14Å; R448-I451 PolarHBondContact O-N 3.13Å; I451-S455 WeakPolarHBondContact O-CB 3.33Å; I451-S455 PolarHBondContact O-N 3.04Å; I451-L513 HydrophobicContact CG2-CB 4.25Å; I451-L513 HydrophobicContact CG2-CD2 4.08Å; I451-L513 WeakPolarHBondContact CG2-O 3.5Å
452	A	91.4	Very high	87.6	Confident	12 Å²	12	35.5 Å²	35.5	10%	0.099	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-44	177.6	0	0	0	0	0	113.1	I299 R448 A449 S455 A456 Y517	I299-A452 HydrophobicContact CG1-CB 4.46Å; R448-A452 PolarHBondContact O-N 3.32Å; R448-A452 VanDerWaalsContact O-N 3.16Å; A449-A452 PolarHBondContact O-N 3.42Å; A452-S455 WeakPolarHBondContact O-CB 3.46Å; A452-S455 PolarHBondContact O-N 2.83Å; A452-A456 PolarHBondContact O-N 3.2Å; A452-Y517 HydrophobicContact CB-CD2 3.9Å; A452-Y517 HydrophobicContact CB-CE2 3.75Å
453	L	92.2	Very high	88.6	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.058	16%	0.163	C	C	.	.	H	α-helix	trans	-65.9	-41.3	178.2	-70.6	169.5	0	0	0	112	I301 I305 F345 A449 M450 S455 A456 I457	I301-L453 HydrophobicContact CB-CD2 3.83Å; I301-L453 HydrophobicContact CG2-CD2 3.53Å; I305-L453 HydrophobicContact CD1-CD2 3.75Å; F345-L453 HydrophobicContact CD2-CB 3.76Å; F345-L453 HydrophobicContact CD2-CD1 4.48Å; F345-L453 HydrophobicContact CE2-CB 3.68Å; F345-L453 HydrophobicContact CE2-CD1 3.92Å; F345-L453 HydrophobicContact CE2-CG 4.28Å; F345-L453 HydrophobicContact CZ-CD1 3.95Å; A449-L453 WeakPolarHBondContact O-CB 3.25Å; A449-L453 WeakPolarHBondContact O-CG 3.33Å; A449-L453 PolarHBondContact O-N 3.23Å; M450-L453 HydrophobicContact CE-CD1 3.9Å; M450-L453 PolarHBondContact O-N 3.09Å; L453-S455 VanDerWaalsContact C-N 3.34Å; L453-A456 PolarHBondContact O-N 3.46Å; L453-I457 WeakPolarHBondContact O-CG1 3.44Å; L453-I457 PolarHBondContact O-N 3.11Å
454	L	94.6	Very high	89.6	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.3	-36.4	176.5	-171.6	65.7	0	0	0	111.6	A342 C346 Q424 F427 M450 I457 N458 L513	A342-L454 HydrophobicContact CB-CD1 3.91Å; C346-L454 VanDerWaalsContact SG-CD2 3.52Å; Q424-L454 HydrophobicContact CG-CD2 4.35Å; F427-L454 HydrophobicContact CD1-CD2 3.71Å; F427-L454 HydrophobicContact CE1-CD2 3.86Å; M450-L454 WeakPolarHBondContact O-CB 3.47Å; M450-L454 PolarHBondContact O-N 2.99Å; L454-I457 PolarHBondContact O-N 2.83Å; L454-N458 PolarHBondContact O-N 2.85Å; L454-N458 PolarHBondContact O-ND2 3.1Å; L454-L513 HydrophobicContact CB-CD1 4.1Å; L454-L513 HydrophobicContact CD2-CD1 3.87Å; L454-L513 HydrophobicContact CD2-CD2 4.07Å; L454-L513 HydrophobicContact CG-CD1 3.69Å
455	S	93.2	Very high	90.2	Very high	19 Å²	19	17.3 Å²	17.3	13%	0.133	10%	0.095	C	C	.	.	H	α-helix	trans	-58.8	-48.3	170.3	-173.8	0	0	0	0	110.9	I451 A452 L453 N458 F459 S510	I451-S455 WeakPolarHBondContact O-CB 3.33Å; I451-S455 PolarHBondContact O-N 3.04Å; A452-S455 WeakPolarHBondContact O-CB 3.46Å; A452-S455 PolarHBondContact O-N 2.83Å; L453-S455 VanDerWaalsContact C-N 3.34Å; S455-N458 PolarHBondContact O-N 2.88Å; S455-F459 PolarHBondContact O-N 3.27Å; S455-F459 VanDerWaalsContact O-N 3.07Å; S455-S510 WeakPolarHBondContact O-CB 3.46Å; S455-S510 PolarHBondContact OG-O 3.43Å
456	A	93	Very high	90.3	Very high	6 Å²	6	15.6 Å²	15.6	5%	0.05	9%	0.089	C	C	.	.	H	α-helix	trans	-62.3	-44.1	179.1	0	0	0	0	0	112.4	G302 I306 A452 L453 N458 F459 S460	G302-A456 WeakPolarHBondContact O-CB 3.38Å; I306-A456 HydrophobicContact CD1-CB 3.95Å; I306-A456 HydrophobicContact CG1-CB 4.05Å; A452-A456 PolarHBondContact O-N 3.2Å; L453-A456 PolarHBondContact O-N 3.46Å; A456-N458 PolarHBondContact O-N 2.96Å; A456-F459 PolarHBondContact O-N 2.98Å; A456-S460 PolarHBondContact O-N 2.67Å; A456-S460 PolarHBondContact O-OG 3.31Å
457	I	94.1	Very high	90.3	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-64.8	-39	177.9	-66.5	167.4	0	0	0	111.6	I305 L338 I341 A342 F345 L453 L454 F459 S460 L461	I305-I457 HydrophobicContact CG2-CG1 4.21Å; L338-I457 HydrophobicContact CB-CG2 4.43Å; L338-I457 HydrophobicContact CD2-CG2 4.39Å; I341-I457 HydrophobicContact CB-CD1 4.43Å; I341-I457 HydrophobicContact CG2-CD1 3.66Å; A342-I457 HydrophobicContact CB-CG2 4.02Å; F345-I457 HydrophobicContact CD2-CD1 3.66Å; F345-I457 HydrophobicContact CE2-CD1 3.7Å; L453-I457 WeakPolarHBondContact O-CG1 3.44Å; L453-I457 PolarHBondContact O-N 3.11Å; L454-I457 PolarHBondContact O-N 2.83Å; I457-F459 VanDerWaalsContact C-N 3.34Å; I457-F459 PolarHBondContact O-N 2.67Å; I457-S460 PolarHBondContact O-N 3.05Å; I457-L461 HydrophobicContact CG2-CD1 4.04Å; I457-L461 HydrophobicContact CG2-CG 4.31Å; I457-L461 WeakPolarHBondContact O-CB 3.47Å; I457-L461 WeakPolarHBondContact O-CG 3.5Å; I457-L461 PolarHBondContact O-N 3.37Å
458	N	94.6	Very high	90	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.3	-35.6	176.4	-81.2	-82.3	0	0	0	112.8	Q424 L454 S455 A456 L461 W462 R506	Q424-N458 VanDerWaalsContact CD-ND2 3.31Å; Q424-N458 VanDerWaalsContact NE2-CG 3.32Å; Q424-N458 PolarHBondContact NE2-ND2 2.98Å; Q424-N458 PolarHBondContact NE2-OD1 2.91Å; Q424-N458 PolarHBondContact OE1-ND2 3.21Å; Q424-N458 PolarHBondContact OE1-OD1 2.9Å; L454-N458 PolarHBondContact O-N 2.85Å; L454-N458 PolarHBondContact O-ND2 3.1Å; S455-N458 PolarHBondContact O-N 2.88Å; A456-N458 PolarHBondContact O-N 2.96Å; N458-L461 PolarHBondContact O-N 3.47Å; N458-W462 PolarHBondContact O-N 3.34Å; N458-R506 PolarHBondContact OD1-NH1 3.5Å
459	F	92.2	Very high	89.1	Confident	60 Å²	60	14.7 Å²	14.7	26%	0.263	8%	0.082	S	C	.	.	H	α-helix	trans	-64	-45.4	171.6	-172.7	-97.6	0	0	0	111.4	I306 S455 A456 I457 L461 W462 M463	I306-F459 HydrophobicContact CD1-CD1 3.92Å; I306-F459 HydrophobicContact CG1-CD1 4.12Å; I306-F459 HydrophobicContact CG2-CD1 4.03Å; I306-F459 HydrophobicContact CG2-CE1 4.1Å; S455-F459 PolarHBondContact O-N 3.27Å; S455-F459 VanDerWaalsContact O-N 3.07Å; A456-F459 PolarHBondContact O-N 2.98Å; I457-F459 VanDerWaalsContact C-N 3.34Å; I457-F459 PolarHBondContact O-N 2.67Å; F459-L461 PolarHBondContact O-N 2.97Å; F459-W462 AromaticContact CD2-CE3 3.87Å; F459-W462 HydrophobicContact CD2-CE3 3.87Å; F459-W462 HydrophobicContact CD2-CZ3 4.16Å; F459-W462 HydrophobicContact CE1-CZ3 4.5Å; F459-W462 AromaticContact CE2-CE3 3.64Å; F459-W462 HydrophobicContact CE2-CE3 3.64Å; F459-W462 AromaticContact CE2-CZ3 3.43Å; F459-W462 HydrophobicContact CE2-CZ3 3.43Å; F459-W462 VanDerWaalsContact CE2-CZ3 3.43Å; F459-W462 HydrophobicContact CZ-CE3 4.09Å; F459-W462 AromaticContact CZ-CZ3 3.64Å; F459-W462 HydrophobicContact CZ-CZ3 3.64Å; F459-W462 WeakPolarHBondContact O-CB 3.47Å; F459-W462 PolarHBondContact O-N 2.85Å; F459-M463 HydrophobicContact CD1-CG 4.49Å; F459-M463 HydrophobicContact CE1-CG 4.25Å; F459-M463 HydrophobicContact CZ-SD 4.49Å; F459-M463 WeakPolarHBondContact O-CG 3.32Å; F459-M463 PolarHBondContact O-N 3.06Å
460	S	92.2	Very high	88.2	Confident	1 Å²	1	15.9 Å²	15.9	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-59.8	-41.7	173.4	-65.4	0	0	0	0	113	A456 I457 M463 I464	A456-S460 PolarHBondContact O-N 2.67Å; A456-S460 PolarHBondContact O-OG 3.31Å; I457-S460 PolarHBondContact O-N 3.05Å; S460-M463 WeakPolarHBondContact O-CB 3.27Å; S460-M463 PolarHBondContact O-N 3.21Å; S460-I464 WeakPolarHBondContact O-CG1 3.37Å; S460-I464 PolarHBondContact O-N 3.3Å
461	L	92.7	Very high	87	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.3	-46	174.4	-74.6	169.1	0	0	0	111	L338 F339 I457 N458 F459 M463 I464 Y465	L338-L461 HydrophobicContact CB-CD2 3.98Å; L338-L461 HydrophobicContact CD1-CD2 4.03Å; F339-L461 HydrophobicContact CD1-CD1 4.02Å; F339-L461 HydrophobicContact CD1-CD2 4.11Å; F339-L461 HydrophobicContact CE1-CD1 3.88Å; F339-L461 HydrophobicContact CE1-CD2 3.61Å; F339-L461 HydrophobicContact CE1-CG 4.39Å; F339-L461 HydrophobicContact CZ-CD2 4.29Å; I457-L461 HydrophobicContact CG2-CD1 4.04Å; I457-L461 HydrophobicContact CG2-CG 4.31Å; I457-L461 WeakPolarHBondContact O-CB 3.47Å; I457-L461 WeakPolarHBondContact O-CG 3.5Å; I457-L461 PolarHBondContact O-N 3.37Å; N458-L461 PolarHBondContact O-N 3.47Å; F459-L461 PolarHBondContact O-N 2.97Å; L461-M463 VanDerWaalsContact C-N 3.28Å; L461-M463 PolarHBondContact O-N 2.83Å; L461-I464 WeakPolarHBondContact O-CB 3.25Å; L461-I464 PolarHBondContact O-N 2.76Å; L461-Y465 VanDerWaalsContact O-CD2 3.25Å; L461-Y465 WeakPolarHBondContact O-CD2 3.42Å; L461-Y465 PolarHBondContact O-N 3.2Å
462	W	91.7	Very high	85.8	Confident	5 Å²	5	18.7 Å²	18.7	2%	0.019	9%	0.093	C	C	.	.	H	α-helix	trans	-55.3	-41.8	174.2	167.1	67.8	0	0	0	112.3	L140 F141 E255 N458 F459 Y465 S466 R506 Y507	L140-W462 HydrophobicContact CD2-CH2 4.25Å; F141-W462 HydrophobicContact CE1-CH2 4.49Å; F141-W462 AromaticContact CE1-CZ2 3.58Å; F141-W462 HydrophobicContact CE1-CZ2 3.58Å; F141-W462 AromaticContact CZ-CE2 3.98Å; F141-W462 HydrophobicContact CZ-CH2 4.36Å; F141-W462 AromaticContact CZ-CZ2 3.53Å; F141-W462 HydrophobicContact CZ-CZ2 3.53Å; E255-W462 PolarHBondContact OE2-NE1 3.05Å; N458-W462 PolarHBondContact O-N 3.34Å; F459-W462 AromaticContact CD2-CE3 3.87Å; F459-W462 HydrophobicContact CD2-CE3 3.87Å; F459-W462 HydrophobicContact CD2-CZ3 4.16Å; F459-W462 HydrophobicContact CE1-CZ3 4.5Å; F459-W462 AromaticContact CE2-CE3 3.64Å; F459-W462 HydrophobicContact CE2-CE3 3.64Å; F459-W462 AromaticContact CE2-CZ3 3.43Å; F459-W462 HydrophobicContact CE2-CZ3 3.43Å; F459-W462 VanDerWaalsContact CE2-CZ3 3.43Å; F459-W462 HydrophobicContact CZ-CE3 4.09Å; F459-W462 AromaticContact CZ-CZ3 3.64Å; F459-W462 HydrophobicContact CZ-CZ3 3.64Å; F459-W462 WeakPolarHBondContact O-CB 3.47Å; F459-W462 PolarHBondContact O-N 2.85Å; W462-Y465 PolarHBondContact O-N 3.48Å; W462-S466 PolarHBondContact NE1-OG 3.27Å; W462-S466 WeakPolarHBondContact O-CB 3.42Å; W462-S466 PolarHBondContact O-N 3.17Å; W462-S466 PolarHBondContact O-OG 3.46Å; W462-R506 HydrophobicContact CB-CB 3.74Å; W462-Y507 HydrophobicContact CD2-CD2 4.12Å; W462-Y507 HydrophobicContact CE3-CD2 4.22Å; W462-Y507 HydrophobicContact CZ3-CD2 4.46Å
463	M	87.3	Confident	85	Confident	25 Å²	25	19.5 Å²	19.5	12%	0.123	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-44.3	173.5	-62.4	-63.9	-82.8	0	0	111.6	M310 F459 S460 L461 Y465 S466 F467	M310-M463 HydrophobicContact CE-CE 3.44Å; M310-M463 VanDerWaalsContact CE-CE 3.44Å; M310-M463 HydrophobicContact SD-CB 3.78Å; M310-M463 HydrophobicContact SD-CE 3.26Å; M310-M463 WeakPolarHBondContact SD-CE 3.41Å; M310-M463 HydrophobicContact SD-CG 3.7Å; M310-M463 HydrophobicContact SD-SD 4.31Å; F459-M463 HydrophobicContact CD1-CG 4.49Å; F459-M463 HydrophobicContact CE1-CG 4.25Å; F459-M463 HydrophobicContact CZ-SD 4.49Å; F459-M463 WeakPolarHBondContact O-CG 3.32Å; F459-M463 PolarHBondContact O-N 3.06Å; S460-M463 WeakPolarHBondContact O-CB 3.27Å; S460-M463 PolarHBondContact O-N 3.21Å; L461-M463 VanDerWaalsContact C-N 3.28Å; L461-M463 PolarHBondContact O-N 2.83Å; M463-Y465 PolarHBondContact O-N 3.23Å; M463-S466 PolarHBondContact O-N 3.01Å; M463-F467 HydrophobicContact CB-CD2 4.41Å; M463-F467 HydrophobicContact CE-CD2 4.21Å; M463-F467 HydrophobicContact CE-CE2 3.47Å; M463-F467 VanDerWaalsContact CE-CE2 3.47Å; M463-F467 HydrophobicContact CE-CZ 4.32Å; M463-F467 VanDerWaalsContact O-CD2 3.23Å; M463-F467 WeakPolarHBondContact O-CD2 3.31Å; M463-F467 PolarHBondContact O-N 2.84Å; M463-F467 HydrophobicContact SD-CE2 3.86Å
464	I	89	Confident	84.2	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-45.1	176.2	-67.2	165	0	0	0	111.5	V309 V313 E334 T335 L338 S460 L461 S466 Q468 A469	V309-I464 HydrophobicContact CG1-CD1 3.72Å; V309-I464 HydrophobicContact CG1-CG1 4.02Å; V313-I464 HydrophobicContact CG2-CG1 3.64Å; E334-I464 HydrophobicContact CG-CD1 4.26Å; T335-I464 HydrophobicContact CG2-CG2 3.93Å; L338-I464 HydrophobicContact CD1-CD1 3.34Å; S460-I464 WeakPolarHBondContact O-CG1 3.37Å; S460-I464 PolarHBondContact O-N 3.3Å; L461-I464 WeakPolarHBondContact O-CB 3.25Å; L461-I464 PolarHBondContact O-N 2.76Å; I464-S466 VanDerWaalsContact C-N 3.33Å; I464-S466 PolarHBondContact O-N 3.26Å; I464-Q468 HydrophobicContact CG2-CB 4.28Å; I464-Q468 WeakPolarHBondContact O-CA 3.26Å; I464-Q468 WeakPolarHBondContact O-CB 3.48Å; I464-Q468 PolarHBondContact O-N 3.34Å; I464-A469 PolarHBondContact O-N 2.83Å
465	Y	87.3	Confident	83.4	Confident	23 Å²	23	19.8 Å²	19.8	9%	0.09	10%	0.097	C	C	.	.	H	α-helix	trans	-64.7	-36.7	175.8	-77.5	-86.5	0	0	0	112.6	E417 L461 W462 M463 A469 L499 V502 M503 R506	E417-Y465 PolarHBondContact OE1-OH 2.98Å; E417-Y465 PolarHBondContact OE2-OH 3.2Å; L461-Y465 VanDerWaalsContact O-CD2 3.25Å; L461-Y465 WeakPolarHBondContact O-CD2 3.42Å; L461-Y465 PolarHBondContact O-N 3.2Å; W462-Y465 PolarHBondContact O-N 3.48Å; M463-Y465 PolarHBondContact O-N 3.23Å; Y465-A469 HydrophobicContact CD1-CB 4.15Å; Y465-A469 WeakPolarHBondContact O-CB 3.48Å; Y465-L499 HydrophobicContact CD1-CD1 3.97Å; Y465-V502 HydrophobicContact CE1-CG1 4.4Å; Y465-M503 HydrophobicContact CG-CG 4.49Å; Y465-R506 HydrophobicContact CD2-CG 4.26Å; Y465-R506 HydrophobicContact CE2-CG 4.47Å
466	S	83.7	Confident	82.5	Confident	15 Å²	15	19.6 Å²	19.6	11%	0.105	9%	0.094	C	C	.	.	H	α-helix	trans	-68.3	-44.3	-178.5	-60.1	0	0	0	0	112.9	W462 M463 I464	W462-S466 PolarHBondContact NE1-OG 3.27Å; W462-S466 WeakPolarHBondContact O-CB 3.42Å; W462-S466 PolarHBondContact O-N 3.17Å; W462-S466 PolarHBondContact O-OG 3.46Å; M463-S466 PolarHBondContact O-N 3.01Å; I464-S466 VanDerWaalsContact C-N 3.33Å; I464-S466 PolarHBondContact O-N 3.26Å
467	F	81.4	Confident	81.4	Confident	48 Å²	48	20.7 Å²	20.7	21%	0.211	10%	0.101	C	C	.	.	H	α-helix	trans	-99.4	-47.3	-173	-63.3	-72.1	0	0	0	113.4	Y248 V313 M463	Y248-F467 HydrophobicContact CD1-CD1 4.04Å; V313-F467 HydrophobicContact CG1-CB 4.03Å; M463-F467 HydrophobicContact CB-CD2 4.41Å; M463-F467 HydrophobicContact CE-CD2 4.21Å; M463-F467 HydrophobicContact CE-CE2 3.47Å; M463-F467 VanDerWaalsContact CE-CE2 3.47Å; M463-F467 HydrophobicContact CE-CZ 4.32Å; M463-F467 VanDerWaalsContact O-CD2 3.23Å; M463-F467 WeakPolarHBondContact O-CD2 3.31Å; M463-F467 PolarHBondContact O-N 2.84Å; M463-F467 HydrophobicContact SD-CE2 3.86Å
468	Q	78.3	Confident	80	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-37.9	-170.6	-64.1	-163.3	47.1	0	0	114.5	V313 E317 H331 E334 I464 K470 H471 N472	V313-Q468 HydrophobicContact CG1-CG 4.11Å; V313-Q468 HydrophobicContact CG2-CG 4.48Å; E317-Q468 HydrophobicContact CG-CG 4.47Å; H331-Q468 PolarHBondContact ND1-OE1 2.98Å; E334-Q468 PolarHBondContact OE2-NE2 3.44Å; I464-Q468 HydrophobicContact CG2-CB 4.28Å; I464-Q468 WeakPolarHBondContact O-CA 3.26Å; I464-Q468 WeakPolarHBondContact O-CB 3.48Å; I464-Q468 PolarHBondContact O-N 3.34Å; Q468-K470 PolarHBondContact O-N 2.79Å; Q468-H471 PolarHBondContact O-N 3.06Å; Q468-N472 HydrophobicContact CB-CB 4.41Å; Q468-N472 WeakPolarHBondContact CB-ND2 3.25Å; Q468-N472 PolarHBondContact O-N 2.79Å; Q468-N472 PolarHBondContact OE1-ND2 3.5Å; Q468-N472 VanDerWaalsContact OE1-ND2 3.11Å
469	A	70.7	Confident	78.4	Confident	6 Å²	6	21.8 Å²	21.8	5%	0.05	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.6	-164	0	0	0	0	0	115	I464 Y465 N473	I464-A469 PolarHBondContact O-N 2.83Å; Y465-A469 HydrophobicContact CD1-CB 4.15Å; Y465-A469 WeakPolarHBondContact O-CB 3.48Å; A469-N473 VanDerWaalsContact O-CB 3.27Å; A469-N473 WeakPolarHBondContact O-CB 3.35Å
470	K	68.1	Low	76.7	Confident	65 Å²	65	21.8 Å²	21.8	28%	0.283	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-28.6	174.2	-168.6	179.9	-179	-178.6	0	113.6	N247 Q468 L476	N247-K470 PolarHBondContact OD1-NZ 2.96Å; N247-K470 VanDerWaalsContact OD1-NZ 3.13Å; Q468-K470 PolarHBondContact O-N 2.79Å; K470-L476 HydrophobicContact CB-CD2 4.4Å; K470-L476 HydrophobicContact CG-CD2 4.15Å
471	H	66.9	Low	75.1	Confident	86 Å²	86	27.7 Å²	27.7	40%	0.398	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-38.2	-171.4	-67.7	-63.5	0	0	0	112.1	Q468	Q468-H471 PolarHBondContact O-N 3.06Å
472	N	67.1	Low	73.7	Confident	9 Å²	9	31.6 Å²	31.6	5%	0.048	16%	0.155	C	C	.	.	S	Bend	trans	-108.4	-2.3	-166.1	-49.7	-21.4	0	0	0	113	E317 V327 Y328 H331 Q468	E317-N472 PolarHBondContact OE1-ND2 2.79Å; V327-N472 HydrophobicContact CG1-CB 3.7Å; V327-N472 WeakPolarHBondContact CG1-OD1 3.34Å; Y328-N472 WeakPolarHBondContact CD1-O 3.44Å; H331-N472 HydrophobicContact CB-CB 3.77Å; H331-N472 PolarHBondContact CD2-O 3.07Å; Q468-N472 HydrophobicContact CB-CB 4.41Å; Q468-N472 WeakPolarHBondContact CB-ND2 3.25Å; Q468-N472 PolarHBondContact O-N 2.79Å; Q468-N472 PolarHBondContact OE1-ND2 3.5Å; Q468-N472 VanDerWaalsContact OE1-ND2 3.11Å
473	N	75.3	Confident	72.2	Confident	29 Å²	29	31.6 Å²	31.6	16%	0.155	16%	0.155	C	C	.	.			trans	-88.7	116.2	172.4	-171	-47.1	0	0	0	110.7	H410 A469 L475 L476 S477	H410-N473 PolarHBondContact CD2-OD1 3.2Å; H410-N473 PolarHBondContact NE2-ND2 3.31Å; H410-N473 PolarHBondContact NE2-OD1 3.07Å; A469-N473 VanDerWaalsContact O-CB 3.27Å; A469-N473 WeakPolarHBondContact O-CB 3.35Å; N473-L475 PolarHBondContact O-N 3.15Å; N473-L475 WeakPolarHBondContact OD1-CA 3.38Å; N473-L475 VanDerWaalsContact OD1-CB 3.23Å; N473-L475 WeakPolarHBondContact OD1-CB 3.27Å; N473-L475 PolarHBondContact OD1-N 3.34Å; N473-L476 PolarHBondContact O-N 2.91Å; N473-S477 PolarHBondContact O-N 3.35Å; N473-S477 PolarHBondContact O-OG 3.14Å
474	I	74.3	Confident	70.7	Confident	10 Å²	10	35.9 Å²	35.9	5%	0.051	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-36.8	179.8	-165.5	75.3	0	0	0	112.9	Y328 C406 H410 L476 S477 V478	Y328-I474 HydrophobicContact CD1-CB 4.08Å; Y328-I474 HydrophobicContact CD1-CD1 3.88Å; Y328-I474 HydrophobicContact CD2-CD1 3.69Å; Y328-I474 HydrophobicContact CE1-CD1 4.2Å; Y328-I474 HydrophobicContact CE2-CD1 4Å; Y328-I474 HydrophobicContact CG-CB 4.3Å; Y328-I474 HydrophobicContact CG-CD1 3.61Å; C406-I474 HydrophobicContact CB-CB 4.44Å; C406-I474 HydrophobicContact CB-CD1 3.99Å; C406-I474 HydrophobicContact CB-CG1 3.91Å; H410-I474 HydrophobicContact CB-CG2 3.65Å; I474-L476 VanDerWaalsContact C-N 3.28Å; I474-L476 PolarHBondContact O-N 3.2Å; I474-S477 WeakPolarHBondContact CA-OG 3.37Å; I474-S477 PolarHBondContact O-N 3.37Å; I474-S477 PolarHBondContact O-OG 3Å; I474-V478 HydrophobicContact CD1-CG2 3.42Å; I474-V478 VanDerWaalsContact CD1-CG2 3.42Å; I474-V478 HydrophobicContact CG1-CG2 3.7Å; I474-V478 WeakPolarHBondContact O-CB 3.23Å; I474-V478 PolarHBondContact O-N 3.36Å
475	L	78.4	Confident	69.1	Low	7 Å²	7	42.2 Å²	42.2	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-25.8	179.5	-165.9	69.6	0	0	0	112.2	C386 L389 N390 F393 L407 N473 N479 I495	C386-L475 HydrophobicContact CB-CD2 3.8Å; L389-L475 HydrophobicContact CB-CD1 4.38Å; L389-L475 HydrophobicContact CD2-CD1 3.76Å; L389-L475 HydrophobicContact CD2-CD2 4.05Å; L389-L475 HydrophobicContact CD2-CG 3.89Å; L389-L475 HydrophobicContact CG-CD1 3.86Å; N390-L475 WeakPolarHBondContact ND2-CD1 3.28Å; N390-L475 VanDerWaalsContact ND2-CD2 3.3Å; N390-L475 WeakPolarHBondContact ND2-CD2 3.33Å; F393-L475 HydrophobicContact CD2-CD1 4.08Å; F393-L475 HydrophobicContact CE2-CD1 3.96Å; L407-L475 HydrophobicContact CD1-CD1 4.32Å; N473-L475 PolarHBondContact O-N 3.15Å; N473-L475 WeakPolarHBondContact OD1-CA 3.38Å; N473-L475 VanDerWaalsContact OD1-CB 3.23Å; N473-L475 WeakPolarHBondContact OD1-CB 3.27Å; N473-L475 PolarHBondContact OD1-N 3.34Å; L475-N479 WeakPolarHBondContact O-CB 3.5Å; L475-I495 HydrophobicContact CD2-CD1 4.41Å
476	L	74.8	Confident	67.9	Low	15 Å²	15	42.5 Å²	42.5	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-92	-26.7	175.6	-154.8	80.5	0	0	0	112.6	K470 N473 I474 F492	K470-L476 HydrophobicContact CB-CD2 4.4Å; K470-L476 HydrophobicContact CG-CD2 4.15Å; N473-L476 PolarHBondContact O-N 2.91Å; I474-L476 VanDerWaalsContact C-N 3.28Å; I474-L476 PolarHBondContact O-N 3.2Å; L476-F492 HydrophobicContact CD1-CE2 3.91Å
477	S	69.7	Low	67.3	Low	28 Å²	28	51.3 Å²	51.3	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-81.1	-54.1	178.9	64.8	0	0	0	0	112.6	Y328 N473 I474 K480	Y328-S477 WeakPolarHBondContact CE1-OG 3.26Å; Y328-S477 PolarHBondContact OH-OG 3.03Å; N473-S477 PolarHBondContact O-N 3.35Å; N473-S477 PolarHBondContact O-OG 3.14Å; I474-S477 WeakPolarHBondContact CA-OG 3.37Å; I474-S477 PolarHBondContact O-N 3.37Å; I474-S477 PolarHBondContact O-OG 3Å; S477-K480 WeakPolarHBondContact O-CB 3.33Å
478	V	64.7	Low	67.1	Low	24 Å²	24	51.5 Å²	51.5	15%	0.145	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-39.5	-175	173.5	0	0	0	0	111.9	F399 I474 K480 N481	F399-V478 HydrophobicContact CD1-CG1 3.86Å; F399-V478 HydrophobicContact CE1-CG1 3.3Å; F399-V478 HydrophobicContact CZ-CG1 4.17Å; I474-V478 HydrophobicContact CD1-CG2 3.42Å; I474-V478 VanDerWaalsContact CD1-CG2 3.42Å; I474-V478 HydrophobicContact CG1-CG2 3.7Å; I474-V478 WeakPolarHBondContact O-CB 3.23Å; I474-V478 PolarHBondContact O-N 3.36Å; V478-K480 PolarHBondContact O-N 3.32Å; V478-N481 PolarHBondContact O-N 3.05Å; V478-N481 VanDerWaalsContact O-N 3.13Å
479	N	60.6	Low	66.9	Low	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-53.5	-30	-179.2	-178.1	119.9	0	0	0	113	L389 F393 L475 N481 Y482 V483 F492	L389-N479 VanDerWaalsContact CD2-OD1 3.25Å; L389-N479 WeakPolarHBondContact CD2-OD1 3.47Å; F393-N479 HydrophobicContact CE2-CB 3.97Å; F393-N479 HydrophobicContact CZ-CB 4.03Å; F393-N479 WeakPolarHBondContact CZ-OD1 3.29Å; L475-N479 WeakPolarHBondContact O-CB 3.5Å; N479-N481 VanDerWaalsContact C-N 3.31Å; N479-N481 PolarHBondContact O-N 2.76Å; N479-Y482 PolarHBondContact O-N 2.93Å; N479-V483 HydrophobicContact CB-CG2 4.39Å; N479-V483 VanDerWaalsContact ND2-CB 3.35Å; N479-V483 WeakPolarHBondContact ND2-CB 3.36Å; N479-V483 WeakPolarHBondContact ND2-CG2 3.38Å; N479-V483 WeakPolarHBondContact O-CB 3.44Å; N479-V483 PolarHBondContact O-N 3.36Å; N479-V483 VanDerWaalsContact OD1-CG2 3.25Å; N479-V483 WeakPolarHBondContact OD1-CG2 3.48Å; N479-F492 HydrophobicContact CB-CD2 4.28Å; N479-F492 HydrophobicContact CB-CE2 4.17Å; N479-F492 WeakPolarHBondContact ND2-CD2 3.38Å; N479-F492 WeakPolarHBondContact ND2-CE2 3.39Å; N479-F492 WeakPolarHBondContact ND2-CG 3.29Å; N479-F492 WeakPolarHBondContact OD1-CD2 3.43Å
480	K	57.5	Low	67.4	Low	59 Å²	59	60 Å²	60	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-51.4	-51.7	178	-69.9	-169.7	174.2	-162.2	0	111.5	T228 L229 S477 V478	T228-K480 PolarHBondContact OG1-NZ 3.27Å; L229-K480 VanDerWaalsContact CD1-C 3.45Å; L229-K480 HydrophobicContact CD1-CB 3.71Å; L229-K480 WeakPolarHBondContact CD1-O 3.38Å; L229-K480 WeakPolarHBondContact CD2-O 3.44Å; S477-K480 WeakPolarHBondContact O-CB 3.33Å; V478-K480 PolarHBondContact O-N 3.32Å
481	N	58.1	Low	68.1	Low	126 Å²	126	59 Å²	59	67%	0.674	31%	0.308	S	S	*	.	H	α-helix	trans	-76.4	-31.7	-173.5	-64.4	-10.2	0	0	0	112.8	V478 N479	V478-N481 PolarHBondContact O-N 3.05Å; V478-N481 VanDerWaalsContact O-N 3.13Å; N479-N481 VanDerWaalsContact C-N 3.31Å; N479-N481 PolarHBondContact O-N 2.76Å
482	Y	63	Low	68.7	Low	82 Å²	82	55.3 Å²	55.3	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-91.3	-36.5	-171.5	-161.8	-98.7	0	0	0	113.9	F393 F399 N479 Q484 T485	F393-Y482 AromaticContact CD1-CD1 3.99Å; F393-Y482 HydrophobicContact CD1-CD1 3.99Å; F393-Y482 HydrophobicContact CD1-CE1 4.27Å; F393-Y482 AromaticContact CE1-CD1 3.78Å; F393-Y482 HydrophobicContact CE1-CD1 3.78Å; F393-Y482 HydrophobicContact CE1-CE1 4.42Å; F399-Y482 HydrophobicContact CE1-CD2 4.11Å; F399-Y482 HydrophobicContact CE1-CG 4.22Å; F399-Y482 HydrophobicContact CE2-CD2 4.45Å; F399-Y482 HydrophobicContact CE2-CE1 4.47Å; F399-Y482 HydrophobicContact CE2-CE2 4.42Å; F399-Y482 HydrophobicContact CE2-CG 4.5Å; F399-Y482 AromaticContact CZ-CD1 3.94Å; F399-Y482 HydrophobicContact CZ-CD1 3.94Å; F399-Y482 AromaticContact CZ-CD2 3.74Å; F399-Y482 HydrophobicContact CZ-CD2 3.74Å; F399-Y482 HydrophobicContact CZ-CE1 4.32Å; F399-Y482 HydrophobicContact CZ-CE2 4.15Å; F399-Y482 AromaticContact CZ-CG 3.63Å; F399-Y482 HydrophobicContact CZ-CG 3.63Å; N479-Y482 PolarHBondContact O-N 2.93Å; Y482-Q484 PolarHBondContact O-N 3.24Å; Y482-T485 PolarHBondContact O-N 2.92Å
483	V	59.5	Low	69.3	Low	4 Å²	4	57.5 Å²	57.5	2%	0.024	30%	0.302	C	S	.	.	H	α-helix	trans	-75.4	-26	-166.5	165	0	0	0	0	114.5	F393 N479 T485 S486 Q489 F492	F393-V483 HydrophobicContact CE1-CG2 3.74Å; F393-V483 HydrophobicContact CZ-CG2 3.47Å; F393-V483 VanDerWaalsContact CZ-CG2 3.47Å; N479-V483 HydrophobicContact CB-CG2 4.39Å; N479-V483 VanDerWaalsContact ND2-CB 3.35Å; N479-V483 WeakPolarHBondContact ND2-CB 3.36Å; N479-V483 WeakPolarHBondContact ND2-CG2 3.38Å; N479-V483 WeakPolarHBondContact O-CB 3.44Å; N479-V483 PolarHBondContact O-N 3.36Å; N479-V483 VanDerWaalsContact OD1-CG2 3.25Å; N479-V483 WeakPolarHBondContact OD1-CG2 3.48Å; V483-T485 PolarHBondContact O-N 2.91Å; V483-T485 VanDerWaalsContact O-N 3.08Å; V483-S486 WeakPolarHBondContact CA-OG 3.3Å; V483-S486 PolarHBondContact O-N 3.3Å; V483-S486 VanDerWaalsContact O-O 3.06Å; V483-S486 PolarHBondContact O-OG 3.45Å; V483-Q489 VanDerWaalsContact CG1-CA 3.48Å; V483-Q489 HydrophobicContact CG1-CB 4.11Å; V483-F492 HydrophobicContact CG1-CB 4.1Å
484	Q	55.6	Low	69.9	Low	116 Å²	116	60 Å²	60	54%	0.542	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.5	177.8	-167	160.2	-11.3	0	0	113	L229 Y482	L229-Q484 HydrophobicContact CD2-CB 3.92Å; Y482-Q484 PolarHBondContact O-N 3.24Å
485	T	56.3	Low	70.5	Confident	133 Å²	133	59.9 Å²	59.9	82%	0.816	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-2.6	174.6	-39.3	0	0	0	0	112.7	Y482 V483	Y482-T485 PolarHBondContact O-N 2.92Å; V483-T485 PolarHBondContact O-N 2.91Å; V483-T485 VanDerWaalsContact O-N 3.08Å
486	S	62.1	Low	70.6	Confident	29 Å²	29	59.6 Å²	59.6	20%	0.203	31%	0.308	C	S	.	.	S	Bend	trans	-119.6	150.8	-172.3	77.9	0	0	0	0	112.7	V483 L488	V483-S486 WeakPolarHBondContact CA-OG 3.3Å; V483-S486 PolarHBondContact O-N 3.3Å; V483-S486 VanDerWaalsContact O-O 3.06Å; V483-S486 PolarHBondContact O-OG 3.45Å; S486-L488 PolarHBondContact O-N 3.5Å; S486-L488 PolarHBondContact OG-N 3.42Å
487	E	71	Confident	71.1	Confident	200 Å²	200	60.7 Å²	60.7	94%	0.935	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-2.6	173.9	-57.1	-177.4	158.2	0	0	113.9	Q489	E487-Q489 VanDerWaalsContact C-N 3.32Å; E487-Q489 PolarHBondContact O-N 3.29Å
488	L	76.6	Confident	72.1	Confident	53 Å²	53	59.5 Å²	59.5	28%	0.277	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	4	-176.4	-55.1	174	0	0	0	114.1	L389 A392 F393 S486 S490 L491 F492	L389-L488 HydrophobicContact CD1-CB 4.27Å; L389-L488 HydrophobicContact CD1-CD1 4.12Å; A392-L488 HydrophobicContact CB-CD1 3.66Å; F393-L488 HydrophobicContact CE1-CD1 4.33Å; S486-L488 PolarHBondContact O-N 3.5Å; S486-L488 PolarHBondContact OG-N 3.42Å; L488-S490 VanDerWaalsContact C-N 3.26Å; L488-S490 PolarHBondContact O-N 3.48Å; L488-L491 WeakPolarHBondContact O-CB 3.36Å; L488-L491 PolarHBondContact O-N 3.11Å; L488-F492 PolarHBondContact O-N 2.91Å
489	Q	75.6	Confident	73.1	Confident	90 Å²	90	58.9 Å²	58.9	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-52.7	-41.1	-177.9	-176.3	178.1	-20.3	0	0	113.3	V483 E487 L491 F492 I493	V483-Q489 VanDerWaalsContact CG1-CA 3.48Å; V483-Q489 HydrophobicContact CG1-CB 4.11Å; E487-Q489 VanDerWaalsContact C-N 3.32Å; E487-Q489 PolarHBondContact O-N 3.29Å; Q489-L491 VanDerWaalsContact C-N 3.29Å; Q489-L491 PolarHBondContact O-N 3.03Å; Q489-F492 PolarHBondContact O-N 3.47Å; Q489-I493 HydrophobicContact CG-CD1 4.01Å; Q489-I493 WeakPolarHBondContact O-CG1 3.49Å; Q489-I493 PolarHBondContact O-N 2.82Å
490	S	80.3	Confident	74.3	Confident	94 Å²	94	58.9 Å²	58.9	66%	0.657	30%	0.303	S	S	*	.	H	α-helix	trans	-60.3	-36.8	178.1	-57.2	0	0	0	0	112.9	L488 I493 Y494	L488-S490 VanDerWaalsContact C-N 3.26Å; L488-S490 PolarHBondContact O-N 3.48Å; S490-I493 PolarHBondContact O-N 2.92Å; S490-Y494 PolarHBondContact O-N 3.25Å
491	L	83	Confident	75.8	Confident	43 Å²	43	57.2 Å²	57.2	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-39.8	179.8	-167.2	62.5	0	0	0	111.2	A385 L388 L389 L488 Q489 Y494 I495	A385-L491 HydrophobicContact CB-CD1 3.55Å; A385-L491 HydrophobicContact CB-CG 4.33Å; L388-L491 HydrophobicContact CB-CD2 4.26Å; L389-L491 HydrophobicContact CB-CD2 3.86Å; L389-L491 HydrophobicContact CD1-CD2 4.37Å; L488-L491 WeakPolarHBondContact O-CB 3.36Å; L488-L491 PolarHBondContact O-N 3.11Å; Q489-L491 VanDerWaalsContact C-N 3.29Å; Q489-L491 PolarHBondContact O-N 3.03Å; L491-Y494 WeakPolarHBondContact O-CB 3.28Å; L491-Y494 PolarHBondContact O-N 3.25Å; L491-I495 WeakPolarHBondContact O-CG1 3.29Å; L491-I495 PolarHBondContact O-N 3.47Å
492	F	78.9	Confident	77.4	Confident	10 Å²	10	51.2 Å²	51.2	4%	0.044	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-41.5	173.2	175.6	-116.8	0	0	0	112.6	S225 L476 N479 V483 L488 Q489 Y494 I495 N496	S225-F492 WeakPolarHBondContact OG-CZ 3.5Å; L476-F492 HydrophobicContact CD1-CE2 3.91Å; N479-F492 HydrophobicContact CB-CD2 4.28Å; N479-F492 HydrophobicContact CB-CE2 4.17Å; N479-F492 WeakPolarHBondContact ND2-CD2 3.38Å; N479-F492 WeakPolarHBondContact ND2-CE2 3.39Å; N479-F492 WeakPolarHBondContact ND2-CG 3.29Å; N479-F492 WeakPolarHBondContact OD1-CD2 3.43Å; V483-F492 HydrophobicContact CG1-CB 4.1Å; L488-F492 PolarHBondContact O-N 2.91Å; Q489-F492 PolarHBondContact O-N 3.47Å; F492-Y494 VanDerWaalsContact C-N 3.31Å; F492-Y494 PolarHBondContact O-N 3.15Å; F492-I495 PolarHBondContact O-N 3.22Å; F492-N496 VanDerWaalsContact CD2-ND2 3.31Å; F492-N496 WeakPolarHBondContact CD2-ND2 3.25Å; F492-N496 WeakPolarHBondContact CE2-ND2 3.48Å; F492-N496 WeakPolarHBondContact CZ-ND2 3.34Å; F492-N496 PolarHBondContact O-N 3.46Å; F492-N496 PolarHBondContact O-ND2 3.44Å
493	I	81	Confident	78.7	Confident	54 Å²	54	47.4 Å²	47.4	28%	0.277	25%	0.249	S	C	.	.	H	α-helix	trans	-57.2	-48.5	173.9	-70.5	167.1	0	0	0	109.4	I222 Q489 S490 I495 N496 V497	I222-I493 HydrophobicContact CD1-CG2 4.1Å; I222-I493 HydrophobicContact CG2-CG1 4.33Å; Q489-I493 HydrophobicContact CG-CD1 4.01Å; Q489-I493 WeakPolarHBondContact O-CG1 3.49Å; Q489-I493 PolarHBondContact O-N 2.82Å; S490-I493 PolarHBondContact O-N 2.92Å; I493-I495 PolarHBondContact O-N 3.35Å; I493-N496 PolarHBondContact O-N 3.09Å; I493-N496 VanDerWaalsContact O-N 3.17Å; I493-V497 HydrophobicContact CG2-CG2 4.23Å; I493-V497 VanDerWaalsContact O-CG2 3.23Å; I493-V497 WeakPolarHBondContact O-CG2 3.49Å; I493-V497 PolarHBondContact O-N 2.77Å
494	Y	87.1	Confident	80.2	Confident	82 Å²	82	47.3 Å²	47.3	32%	0.322	25%	0.248	S	C	.	.	H	α-helix	trans	-56.5	-46.1	176.9	179.8	-100.8	0	0	0	113.1	T381 A385 S490 L491 F492 N496 V497 A498	T381-Y494 WeakPolarHBondContact CB-OH 3.22Å; T381-Y494 PolarHBondContact OG1-OH 2.7Å; A385-Y494 HydrophobicContact CB-CD1 3.77Å; A385-Y494 HydrophobicContact CB-CE1 4.02Å; S490-Y494 PolarHBondContact O-N 3.25Å; L491-Y494 WeakPolarHBondContact O-CB 3.28Å; L491-Y494 PolarHBondContact O-N 3.25Å; F492-Y494 VanDerWaalsContact C-N 3.31Å; F492-Y494 PolarHBondContact O-N 3.15Å; Y494-N496 VanDerWaalsContact C-N 3.33Å; Y494-N496 PolarHBondContact O-N 2.89Å; Y494-V497 WeakPolarHBondContact O-CB 3.22Å; Y494-V497 PolarHBondContact O-N 3.2Å; Y494-A498 HydrophobicContact CE1-CB 4.23Å; Y494-A498 HydrophobicContact CE2-CB 4.45Å; Y494-A498 WeakPolarHBondContact O-CB 3.23Å; Y494-A498 PolarHBondContact O-N 3.28Å
495	I	86.8	Confident	82	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.036	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-42.8	176.9	-72.4	167.1	0	0	0	111.4	F382 A385 L389 L475 L491 F492 I493 L499	F382-I495 HydrophobicContact CD2-CG2 4.38Å; F382-I495 HydrophobicContact CE2-CB 4.31Å; F382-I495 HydrophobicContact CE2-CG2 3.7Å; F382-I495 WeakPolarHBondContact CE2-O 3.34Å; F382-I495 HydrophobicContact CZ-CG2 4.39Å; A385-I495 HydrophobicContact CB-CD1 4.37Å; A385-I495 HydrophobicContact CB-CG1 4.05Å; L389-I495 HydrophobicContact CB-CD1 4.4Å; L389-I495 HydrophobicContact CD2-CD1 3.48Å; L389-I495 VanDerWaalsContact CD2-CD1 3.48Å; L475-I495 HydrophobicContact CD2-CD1 4.41Å; L491-I495 WeakPolarHBondContact O-CG1 3.29Å; L491-I495 PolarHBondContact O-N 3.47Å; F492-I495 PolarHBondContact O-N 3.22Å; I493-I495 PolarHBondContact O-N 3.35Å; I495-L499 WeakPolarHBondContact O-CB 3.49Å; I495-L499 PolarHBondContact O-N 3.3Å
496	N	81	Confident	83.8	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.011	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-37.9	177.2	-76.9	-94	0	0	0	112.7	I222 S225 F492 I493 Y494	I222-N496 HydrophobicContact CG1-CB 4.16Å; S225-N496 PolarHBondContact OG-OD1 3.41Å; S225-N496 VanDerWaalsContact OG-OD1 3.08Å; F492-N496 VanDerWaalsContact CD2-ND2 3.31Å; F492-N496 WeakPolarHBondContact CD2-ND2 3.25Å; F492-N496 WeakPolarHBondContact CE2-ND2 3.48Å; F492-N496 WeakPolarHBondContact CZ-ND2 3.34Å; F492-N496 PolarHBondContact O-N 3.46Å; F492-N496 PolarHBondContact O-ND2 3.44Å; I493-N496 PolarHBondContact O-N 3.09Å; I493-N496 VanDerWaalsContact O-N 3.17Å; Y494-N496 VanDerWaalsContact C-N 3.33Å; Y494-N496 PolarHBondContact O-N 2.89Å
497	V	85.2	Confident	85.2	Confident	38 Å²	38	34.4 Å²	34.4	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-68.1	-44.4	177.8	170.8	0	0	0	0	112.3	W214 V218 I222 I493 Y494 P500	W214-V497 HydrophobicContact CH2-CG1 4.11Å; V218-V497 HydrophobicContact CG1-CB 4.07Å; V218-V497 HydrophobicContact CG1-CG1 4.1Å; V218-V497 HydrophobicContact CG1-CG2 3.65Å; I222-V497 HydrophobicContact CD1-CG2 3.63Å; I222-V497 HydrophobicContact CG1-CG2 4.35Å; I493-V497 HydrophobicContact CG2-CG2 4.23Å; I493-V497 VanDerWaalsContact O-CG2 3.23Å; I493-V497 WeakPolarHBondContact O-CG2 3.49Å; I493-V497 PolarHBondContact O-N 2.77Å; Y494-V497 WeakPolarHBondContact O-CB 3.22Å; Y494-V497 PolarHBondContact O-N 3.2Å; V497-P500 WeakPolarHBondContact O-CD 3.37Å
498	A	89.5	Confident	86.1	Confident	3 Å²	3	25 Å²	25	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-79.9	-24.8	-174.2	0	0	0	0	0	113.1	I378 F382 Y494 M501 V502	I378-A498 HydrophobicContact CG2-CB 3.9Å; F382-A498 HydrophobicContact CB-CB 4.14Å; F382-A498 HydrophobicContact CD2-CB 3.99Å; Y494-A498 HydrophobicContact CE1-CB 4.23Å; Y494-A498 HydrophobicContact CE2-CB 4.45Å; Y494-A498 WeakPolarHBondContact O-CB 3.23Å; Y494-A498 PolarHBondContact O-N 3.28Å; A498-M501 WeakPolarHBondContact O-CA 3.47Å; A498-M501 WeakPolarHBondContact O-CB 3.48Å; A498-M501 PolarHBondContact O-N 3.3Å; A498-V502 PolarHBondContact O-N 2.93Å; A498-V502 VanDerWaalsContact O-N 3.1Å
499	L	87	Confident	87	Confident	10 Å²	10	22.4 Å²	22.4	5%	0.052	12%	0.118	C	C	.	.	H	α-helix	trans	-51.6	-41.8	-176.8	177.2	56.9	0	0	0	115	F382 Y465 I495 M501 V502 M503	F382-L499 HydrophobicContact CE2-CB 4.12Å; F382-L499 HydrophobicContact CE2-CD1 4.47Å; F382-L499 HydrophobicContact CZ-CD1 4.26Å; Y465-L499 HydrophobicContact CD1-CD1 3.97Å; I495-L499 WeakPolarHBondContact O-CB 3.49Å; I495-L499 PolarHBondContact O-N 3.3Å; L499-M501 VanDerWaalsContact C-N 3.29Å; L499-M501 PolarHBondContact O-N 3.28Å; L499-V502 WeakPolarHBondContact O-CB 3.48Å; L499-V502 PolarHBondContact O-N 2.98Å; L499-M503 HydrophobicContact CD1-CG 4.47Å; L499-M503 HydrophobicContact CG-CE 4.21Å; L499-M503 PolarHBondContact O-N 3.46Å
500	P	85.6	Confident	87.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-59.4	-33.8	171.1	-24.3	36.4	0	0	0	114.9	P254 V497 M503 L504	P254-P500 HydrophobicContact CB-CB 3.86Å; P254-P500 HydrophobicContact CB-CG 4.24Å; P254-P500 HydrophobicContact CG-CB 3.77Å; P254-P500 HydrophobicContact CG-CG 3.89Å; V497-P500 WeakPolarHBondContact O-CD 3.37Å; P500-M503 HydrophobicContact CB-CE 4.29Å; P500-M503 HydrophobicContact CG-CE 4.38Å; P500-M503 PolarHBondContact O-N 3.35Å; P500-L504 WeakPolarHBondContact O-CB 3.35Å; P500-L504 PolarHBondContact O-N 3.12Å
501	M	89.1	Confident	88.3	Confident	24 Å²	24	14.2 Å²	14.2	12%	0.118	7%	0.071	C	C	.	.	H	α-helix	trans	-75.8	-28.1	177.2	-57.7	-57.5	-67.7	0	0	111.9	W214 A258 T375 I378 A498 L499 L504 Y505	W214-M501 HydrophobicContact CZ2-CG 4.47Å; A258-M501 HydrophobicContact CB-SD 4.14Å; T375-M501 HydrophobicContact CG2-CE 4.24Å; I378-M501 HydrophobicContact CB-CB 4.23Å; I378-M501 HydrophobicContact CD1-CB 4.11Å; I378-M501 HydrophobicContact CD1-CE 3.81Å; I378-M501 HydrophobicContact CD1-CG 4.09Å; I378-M501 HydrophobicContact CG2-CB 3.63Å; I378-M501 HydrophobicContact CG2-CG 4.25Å; A498-M501 WeakPolarHBondContact O-CA 3.47Å; A498-M501 WeakPolarHBondContact O-CB 3.48Å; A498-M501 PolarHBondContact O-N 3.3Å; L499-M501 VanDerWaalsContact C-N 3.29Å; L499-M501 PolarHBondContact O-N 3.28Å; M501-L504 HydrophobicContact CE-CD2 4.23Å; M501-Y505 PolarHBondContact O-N 2.99Å
502	V	91.8	Very high	88.7	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-68.8	-43.4	170	-179.8	0	0	0	0	111	T379 F382 Y465 A498 L499 L504 Y505 R506	T379-V502 HydrophobicContact CG2-CG1 4.12Å; T379-V502 HydrophobicContact CG2-CG2 4.43Å; F382-V502 HydrophobicContact CB-CG2 3.79Å; F382-V502 HydrophobicContact CD1-CG1 4.49Å; F382-V502 HydrophobicContact CD1-CG2 3.63Å; F382-V502 HydrophobicContact CD2-CG2 3.98Å; F382-V502 HydrophobicContact CE1-CG1 4.49Å; F382-V502 HydrophobicContact CE1-CG2 4.16Å; F382-V502 HydrophobicContact CE2-CG2 4.44Å; F382-V502 HydrophobicContact CG-CG2 3.54Å; Y465-V502 HydrophobicContact CE1-CG1 4.4Å; A498-V502 PolarHBondContact O-N 2.93Å; A498-V502 VanDerWaalsContact O-N 3.1Å; L499-V502 WeakPolarHBondContact O-CB 3.48Å; L499-V502 PolarHBondContact O-N 2.98Å; V502-L504 VanDerWaalsContact C-N 3.32Å; V502-L504 PolarHBondContact O-N 3.44Å; V502-Y505 WeakPolarHBondContact O-CB 3.23Å; V502-Y505 PolarHBondContact O-N 2.76Å; V502-R506 PolarHBondContact O-N 2.91Å
503	M	90.3	Very high	89.3	Confident	3 Å²	3	11.8 Å²	11.8	2%	0.015	6%	0.058	C	C	.	.	H	α-helix	trans	-58.9	-46.5	172.8	-71.3	-178.5	-60.7	0	0	110.4	P251 E255 Y465 L499 P500 Y505 R506 Y507	P251-M503 HydrophobicContact CB-CE 3.77Å; P251-M503 HydrophobicContact CB-SD 4.3Å; P251-M503 HydrophobicContact CG-CE 4.41Å; E255-M503 WeakPolarHBondContact OE1-CB 3.42Å; E255-M503 WeakPolarHBondContact OE1-CE 3.39Å; Y465-M503 HydrophobicContact CG-CG 4.49Å; L499-M503 HydrophobicContact CD1-CG 4.47Å; L499-M503 HydrophobicContact CG-CE 4.21Å; L499-M503 PolarHBondContact O-N 3.46Å; P500-M503 HydrophobicContact CB-CE 4.29Å; P500-M503 HydrophobicContact CG-CE 4.38Å; P500-M503 PolarHBondContact O-N 3.35Å; M503-Y505 VanDerWaalsContact C-N 3.35Å; M503-Y505 PolarHBondContact O-N 2.99Å; M503-R506 PolarHBondContact O-N 2.96Å; M503-Y507 PolarHBondContact O-N 3.45Å
504	L	89.8	Confident	89.7	Confident	1 Å²	1	9.8 Å²	9.8	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-60.4	-38.3	174.1	-175.2	62.5	0	0	0	113.3	A258 I259 L371 T375 P500 M501 V502 Y507 H508	A258-L504 HydrophobicContact CB-CD2 3.57Å; I259-L504 HydrophobicContact CD1-CD1 3.88Å; I259-L504 HydrophobicContact CG1-CD1 3.6Å; L371-L504 HydrophobicContact CD1-CD2 4.32Å; T375-L504 HydrophobicContact CG2-CB 4.41Å; T375-L504 HydrophobicContact CG2-CD2 3.82Å; T375-L504 HydrophobicContact CG2-CG 3.97Å; P500-L504 WeakPolarHBondContact O-CB 3.35Å; P500-L504 PolarHBondContact O-N 3.12Å; M501-L504 HydrophobicContact CE-CD2 4.23Å; V502-L504 VanDerWaalsContact C-N 3.32Å; V502-L504 PolarHBondContact O-N 3.44Å; L504-Y507 HydrophobicContact CD1-CD1 4.43Å; L504-Y507 PolarHBondContact O-N 2.73Å; L504-H508 WeakPolarHBondContact O-CB 3.32Å; L504-H508 PolarHBondContact O-N 3.07Å
505	Y	93.8	Very high	89.7	Confident	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-60.1	-46.1	173.6	173.2	-103.3	0	0	0	111.9	L372 F376 T379 V421 M501 V502 M503 H508 S509	L372-Y505 HydrophobicContact CD1-CD2 4.1Å; L372-Y505 HydrophobicContact CD1-CE2 3.75Å; F376-Y505 HydrophobicContact CB-CD2 4.12Å; F376-Y505 HydrophobicContact CB-CE2 3.86Å; F376-Y505 HydrophobicContact CD2-CE2 4.15Å; T379-Y505 HydrophobicContact CG2-CD1 4.05Å; T379-Y505 VanDerWaalsContact OG1-CB 3.26Å; T379-Y505 WeakPolarHBondContact OG1-CB 3.38Å; V421-Y505 HydrophobicContact CB-CE1 4.46Å; V421-Y505 HydrophobicContact CG1-CE1 3.78Å; V421-Y505 HydrophobicContact CG2-CE1 4.07Å; M501-Y505 PolarHBondContact O-N 2.99Å; V502-Y505 WeakPolarHBondContact O-CB 3.23Å; V502-Y505 PolarHBondContact O-N 2.76Å; M503-Y505 VanDerWaalsContact C-N 3.35Å; M503-Y505 PolarHBondContact O-N 2.99Å; Y505-H508 PolarHBondContact O-N 3.4Å; Y505-S509 VanDerWaalsContact O-CB 3.23Å; Y505-S509 WeakPolarHBondContact O-CB 3.3Å; Y505-S509 PolarHBondContact O-N 3.27Å; Y505-S509 PolarHBondContact O-OG 3.19Å
506	R	94.5	Very high	89.7	Confident	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-64	-44.6	179	-66.4	-60.2	-174.5	178.1	0.9	111.8	E417 N458 W462 Y465 V502 M503 S509 S510	E417-R506 IonicContact OE1-CZ 3.68Å; E417-R506 IonicContact OE1-NE 2.72Å; E417-R506 IonicContact OE1-NH2 3.68Å; E417-R506 PolarHBondContact OE1-NH2 3.34Å; N458-R506 PolarHBondContact OD1-NH1 3.5Å; W462-R506 HydrophobicContact CB-CB 3.74Å; Y465-R506 HydrophobicContact CD2-CG 4.26Å; Y465-R506 HydrophobicContact CE2-CG 4.47Å; V502-R506 PolarHBondContact O-N 2.91Å; M503-R506 PolarHBondContact O-N 2.96Å; R506-S509 PolarHBondContact O-OG 2.97Å; R506-S510 PolarHBondContact O-N 2.72Å
507	Y	91.4	Very high	90	Very high	8 Å²	8	7.1 Å²	7.1	3%	0.031	4%	0.04	C	C	.	.	H	α-helix	trans	-60.9	-54.9	173.6	177.4	-100.4	0	0	0	111.7	Y133 G137 F141 I259 W462 M503 L504 S509 S510 V511	Y133-Y507 PolarHBondContact O-OH 3.35Å; G137-Y507 WeakPolarHBondContact CA-OH 3.3Å; G137-Y507 PolarHBondContact N-OH 3.17Å; F141-Y507 HydrophobicContact CE2-CD1 4.1Å; F141-Y507 HydrophobicContact CE2-CD2 4.38Å; F141-Y507 AromaticContact CE2-CE1 3.99Å; F141-Y507 HydrophobicContact CE2-CE1 3.99Å; F141-Y507 HydrophobicContact CE2-CE2 4.28Å; F141-Y507 HydrophobicContact CE2-CG 4.3Å; F141-Y507 HydrophobicContact CZ-CD2 4.32Å; F141-Y507 HydrophobicContact CZ-CG 4.3Å; I259-Y507 HydrophobicContact CD1-CE1 4.28Å; W462-Y507 HydrophobicContact CD2-CD2 4.12Å; W462-Y507 HydrophobicContact CE3-CD2 4.22Å; W462-Y507 HydrophobicContact CZ3-CD2 4.46Å; M503-Y507 PolarHBondContact O-N 3.45Å; L504-Y507 HydrophobicContact CD1-CD1 4.43Å; L504-Y507 PolarHBondContact O-N 2.73Å; Y507-S509 PolarHBondContact O-N 3.25Å; Y507-S510 WeakPolarHBondContact O-CB 3.34Å; Y507-S510 PolarHBondContact O-N 3.15Å; Y507-S510 VanDerWaalsContact O-N 3.14Å; Y507-S510 PolarHBondContact O-OG 3.36Å; Y507-V511 HydrophobicContact CD1-CG2 4.4Å; Y507-V511 HydrophobicContact CE1-CG2 3.89Å; Y507-V511 HydrophobicContact CE2-CG2 4.39Å; Y507-V511 PolarHBondContact O-N 3.44Å; Y507-V511 VanDerWaalsContact O-N 3.1Å
508	H	90.7	Very high	89.8	Confident	1 Å²	1	10 Å²	10	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-69.1	-33	-173.2	-171.3	61.6	0	0	0	113.4	D368 L504 Y505 S510 V511 C512	D368-H508 PolarHBondContact O-NE2 3.02Å; D368-H508 IonicContact OD1-CE1 3.26Å; L504-H508 WeakPolarHBondContact O-CB 3.32Å; L504-H508 PolarHBondContact O-N 3.07Å; Y505-H508 PolarHBondContact O-N 3.4Å; H508-S510 VanDerWaalsContact C-N 3.34Å; H508-V511 WeakPolarHBondContact O-CB 3.38Å; H508-V511 PolarHBondContact O-N 2.86Å; H508-C512 PolarHBondContact NE2-SG 3.28Å; H508-C512 VanDerWaalsContact NE2-SG 3.39Å; H508-C512 PolarHBondContact O-N 3.4Å; H508-C512 PolarHBondContact O-SG 3.05Å
509	S	94.1	Very high	89.3	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-66.8	-33.9	172.4	58.6	0	0	0	0	112.5	Q424 Y505 R506 Y507 L513	Q424-S509 PolarHBondContact NE2-OG 2.91Å; Y505-S509 VanDerWaalsContact O-CB 3.23Å; Y505-S509 WeakPolarHBondContact O-CB 3.3Å; Y505-S509 PolarHBondContact O-N 3.27Å; Y505-S509 PolarHBondContact O-OG 3.19Å; R506-S509 PolarHBondContact O-OG 2.97Å; Y507-S509 PolarHBondContact O-N 3.25Å; S509-L513 WeakPolarHBondContact O-CD1 3.37Å; S509-L513 WeakPolarHBondContact O-CG 3.39Å; S509-L513 PolarHBondContact O-N 2.98Å; S509-L513 VanDerWaalsContact O-N 3.1Å
510	S	93.3	Very high	89.2	Confident	7 Å²	7	12 Å²	12	5%	0.049	6%	0.059	C	C	.	.	H	α-helix	trans	-63.8	-43.2	169.5	82.1	0	0	0	0	111.6	S455 R506 Y507 H508 L513 A514	S455-S510 WeakPolarHBondContact O-CB 3.46Å; S455-S510 PolarHBondContact OG-O 3.43Å; R506-S510 PolarHBondContact O-N 2.72Å; Y507-S510 WeakPolarHBondContact O-CB 3.34Å; Y507-S510 PolarHBondContact O-N 3.15Å; Y507-S510 VanDerWaalsContact O-N 3.14Å; Y507-S510 PolarHBondContact O-OG 3.36Å; H508-S510 VanDerWaalsContact C-N 3.34Å; S510-L513 PolarHBondContact O-N 3.02Å; S510-A514 PolarHBondContact O-N 3.33Å
511	V	90.4	Very high	89.1	Confident	5 Å²	5	12.4 Å²	12.4	3%	0.03	6%	0.06	C	C	.	.	H	α-helix	trans	-61.2	-47.1	176	169.1	0	0	0	0	111.3	Y133 Y507 H508 L513 A514 I515	Y133-V511 VanDerWaalsContact CB-CG1 3.49Å; Y133-V511 HydrophobicContact CG-CG1 4.23Å; Y507-V511 HydrophobicContact CD1-CG2 4.4Å; Y507-V511 HydrophobicContact CE1-CG2 3.89Å; Y507-V511 HydrophobicContact CE2-CG2 4.39Å; Y507-V511 PolarHBondContact O-N 3.44Å; Y507-V511 VanDerWaalsContact O-N 3.1Å; H508-V511 WeakPolarHBondContact O-CB 3.38Å; H508-V511 PolarHBondContact O-N 2.86Å; V511-L513 VanDerWaalsContact C-N 3.32Å; V511-L513 PolarHBondContact O-N 3.46Å; V511-A514 PolarHBondContact O-N 3.16Å; V511-A514 VanDerWaalsContact O-N 3.16Å; V511-I515 HydrophobicContact CG1-CD1 3.68Å; V511-I515 HydrophobicContact CG1-CG1 4.43Å; V511-I515 WeakPolarHBondContact O-CD1 3.49Å; V511-I515 VanDerWaalsContact O-CG1 3.23Å; V511-I515 WeakPolarHBondContact O-CG1 3.26Å; V511-I515 PolarHBondContact O-N 3.06Å
512	C	91.2	Very high	88.5	Confident	1 Å²	1	15 Å²	15	1%	0.007	7%	0.072	C	C	.	.	H	α-helix	trans	-57.3	-43.9	176.6	-67.8	0	0	0	0	112	I428 F432 H508 I515 E516	I428-C512 HydrophobicContact CG2-CB 3.88Å; F432-C512 HydrophobicContact CZ-CB 4.42Å; H508-C512 PolarHBondContact NE2-SG 3.28Å; H508-C512 VanDerWaalsContact NE2-SG 3.39Å; H508-C512 PolarHBondContact O-N 3.4Å; H508-C512 PolarHBondContact O-SG 3.05Å; C512-I515 PolarHBondContact O-N 2.8Å; C512-E516 WeakPolarHBondContact O-CG 3.37Å; C512-E516 PolarHBondContact O-N 3.17Å
513	L	92.7	Very high	87.8	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.4	-40.2	176.5	-72.4	164	0	0	0	112.3	F427 I428 L431 I451 L454 S509 S510 V511 I515 E516 Y517	F427-L513 HydrophobicContact CE1-CD2 4.46Å; I428-L513 HydrophobicContact CD1-CD1 4.2Å; I428-L513 HydrophobicContact CD1-CD2 4.39Å; I428-L513 HydrophobicContact CD1-CG 4.02Å; I428-L513 HydrophobicContact CG1-CD1 4.47Å; I428-L513 HydrophobicContact CG1-CD2 3.79Å; I428-L513 HydrophobicContact CG1-CG 3.95Å; L431-L513 HydrophobicContact CD1-CD2 3.92Å; I451-L513 HydrophobicContact CG2-CB 4.25Å; I451-L513 HydrophobicContact CG2-CD2 4.08Å; I451-L513 WeakPolarHBondContact CG2-O 3.5Å; L454-L513 HydrophobicContact CB-CD1 4.1Å; L454-L513 HydrophobicContact CD2-CD1 3.87Å; L454-L513 HydrophobicContact CD2-CD2 4.07Å; L454-L513 HydrophobicContact CG-CD1 3.69Å; S509-L513 WeakPolarHBondContact O-CD1 3.37Å; S509-L513 WeakPolarHBondContact O-CG 3.39Å; S509-L513 PolarHBondContact O-N 2.98Å; S509-L513 VanDerWaalsContact O-N 3.1Å; S510-L513 PolarHBondContact O-N 3.02Å; V511-L513 VanDerWaalsContact C-N 3.32Å; V511-L513 PolarHBondContact O-N 3.46Å; L513-I515 VanDerWaalsContact C-N 3.31Å; L513-I515 PolarHBondContact O-N 3.18Å; L513-E516 PolarHBondContact O-N 2.72Å; L513-Y517 WeakPolarHBondContact O-CB 3.41Å; L513-Y517 PolarHBondContact O-N 2.8Å
514	A	89.3	Confident	87.2	Confident	13 Å²	13	16.2 Å²	16.2	11%	0.107	8%	0.079	C	C	.	.	H	α-helix	trans	-65.4	-32	176.8	0	0	0	0	0	113.2	Y133 S510 V511	Y133-A514 HydrophobicContact CE1-CB 3.99Å; Y133-A514 HydrophobicContact CE2-CB 4.05Å; S510-A514 PolarHBondContact O-N 3.33Å; V511-A514 PolarHBondContact O-N 3.16Å; V511-A514 VanDerWaalsContact O-N 3.16Å
515	I	85.8	Confident	86.6	Confident	13 Å²	13	16.5 Å²	16.5	7%	0.067	8%	0.08	C	C	.	.	H	α-helix	trans	-71.8	-51.4	174.9	-63.6	161.1	0	0	0	110.3	N131 Y133 V511 C512 L513 Y517 I518 R519	N131-I515 HydrophobicContact CB-CD1 4.1Å; N131-I515 WeakPolarHBondContact ND2-CD1 3.49Å; N131-I515 VanDerWaalsContact ND2-CG1 3.28Å; N131-I515 WeakPolarHBondContact ND2-CG1 3.44Å; Y133-I515 HydrophobicContact CD2-CG1 3.8Å; Y133-I515 HydrophobicContact CE2-CG1 4.2Å; V511-I515 HydrophobicContact CG1-CD1 3.68Å; V511-I515 HydrophobicContact CG1-CG1 4.43Å; V511-I515 WeakPolarHBondContact O-CD1 3.49Å; V511-I515 VanDerWaalsContact O-CG1 3.23Å; V511-I515 WeakPolarHBondContact O-CG1 3.26Å; V511-I515 PolarHBondContact O-N 3.06Å; C512-I515 PolarHBondContact O-N 2.8Å; L513-I515 VanDerWaalsContact C-N 3.31Å; L513-I515 PolarHBondContact O-N 3.18Å; I515-Y517 VanDerWaalsContact C-N 3.25Å; I515-Y517 PolarHBondContact O-N 2.94Å; I515-I518 PolarHBondContact O-N 3.47Å; I515-I518 VanDerWaalsContact O-N 3.13Å; I515-R519 PolarHBondContact O-N 3.32Å; I515-R519 VanDerWaalsContact O-N 3.13Å
516	E	86.8	Confident	85.5	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-69.2	-21.9	-178	-64.3	-51.5	142	0	0	112.9	L431 F432 C512 L513 I518 R519 V520	L431-E516 HydrophobicContact CB-CB 4.25Å; L431-E516 HydrophobicContact CB-CG 4.35Å; L431-E516 HydrophobicContact CD1-CB 4.28Å; F432-E516 HydrophobicContact CD1-CG 3.76Å; F432-E516 WeakPolarHBondContact CD1-OE1 3.27Å; F432-E516 HydrophobicContact CE1-CG 3.81Å; C512-E516 WeakPolarHBondContact O-CG 3.37Å; C512-E516 PolarHBondContact O-N 3.17Å; L513-E516 PolarHBondContact O-N 2.72Å; E516-I518 PolarHBondContact O-N 3.27Å; E516-I518 VanDerWaalsContact O-N 3.1Å; E516-R519 PolarHBondContact O-N 3.47Å; E516-R519 WeakPolarHBondContact OE1-CD 3.41Å; E516-R519 IonicContact OE1-NH1 3.05Å; E516-R519 PolarHBondContact OE1-NH1 3.33Å; E516-R519 VanDerWaalsContact OE2-CD 3.32Å; E516-R519 WeakPolarHBondContact OE2-CD 3.23Å; E516-V520 HydrophobicContact CB-CG2 3.81Å; E516-V520 WeakPolarHBondContact O-CB 3.11Å; E516-V520 WeakPolarHBondContact O-CG2 3.47Å; E516-V520 PolarHBondContact O-N 2.71Å
517	Y	87	Confident	84.4	Confident	21 Å²	21	20 Å²	20	8%	0.082	10%	0.1	C	C	.	.	H	α-helix	trans	-54.7	-24.1	168.8	170.8	-94.3	0	0	0	114.5	G295 I299 R448 A452 L513 I515 Y521	G295-Y517 PolarHBondContact O-OH 3.13Å; I299-Y517 HydrophobicContact CD1-CE1 3.92Å; I299-Y517 VanDerWaalsContact CD1-OH 3.25Å; I299-Y517 WeakPolarHBondContact CD1-OH 3.39Å; I299-Y517 HydrophobicContact CG1-CE1 4.49Å; I299-Y517 HydrophobicContact CG1-CE2 4.48Å; R448-Y517 HydrophobicContact CG-CD2 3.59Å; R448-Y517 HydrophobicContact CG-CE2 3.2Å; R448-Y517 PolarHBondContact NE-O 3.47Å; R448-Y517 PolarHBondContact NE-OH 2.92Å; R448-Y517 PolarHBondContact NH1-OH 2.88Å; R448-Y517 PolarHBondContact NH2-OH 3.43Å; A452-Y517 HydrophobicContact CB-CD2 3.9Å; A452-Y517 HydrophobicContact CB-CE2 3.75Å; L513-Y517 WeakPolarHBondContact O-CB 3.41Å; L513-Y517 PolarHBondContact O-N 2.8Å; I515-Y517 VanDerWaalsContact C-N 3.25Å; I515-Y517 PolarHBondContact O-N 2.94Å; Y517-Y521 WeakPolarHBondContact O-CD2 3.17Å
518	I	81.5	Confident	83.5	Confident	97 Å²	97	20.2 Å²	20.2	50%	0.497	10%	0.101	S	C	.	.	H	α-helix	trans	-100.4	-57	171.8	-54.7	-178.9	0	0	0	109.6	I515 E516 V520 Y521	I515-I518 PolarHBondContact O-N 3.47Å; I515-I518 VanDerWaalsContact O-N 3.13Å; E516-I518 PolarHBondContact O-N 3.27Å; E516-I518 VanDerWaalsContact O-N 3.1Å; I518-V520 VanDerWaalsContact C-N 3.34Å; I518-V520 PolarHBondContact O-N 3.14Å; I518-Y521 PolarHBondContact O-N 3.12Å; I518-Y521 VanDerWaalsContact O-N 3.08Å
519	R	79.5	Confident	82.4	Confident	56 Å²	56	21.2 Å²	21.2	21%	0.211	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-34.6	-167.9	-175.6	-175.2	-113.1	-179.7	-3.8	114.5	N366 I515 E516 Y521 E522	N366-R519 PolarHBondContact ND2-NH2 3.2Å; I515-R519 PolarHBondContact O-N 3.32Å; I515-R519 VanDerWaalsContact O-N 3.13Å; E516-R519 PolarHBondContact O-N 3.47Å; E516-R519 WeakPolarHBondContact OE1-CD 3.41Å; E516-R519 IonicContact OE1-NH1 3.05Å; E516-R519 PolarHBondContact OE1-NH1 3.33Å; E516-R519 VanDerWaalsContact OE2-CD 3.32Å; E516-R519 WeakPolarHBondContact OE2-CD 3.23Å; R519-Y521 PolarHBondContact O-N 2.96Å; R519-Y521 VanDerWaalsContact O-N 3.11Å; R519-E522 WeakPolarHBondContact O-CB 3.3Å; R519-E522 PolarHBondContact O-N 2.97Å; R519-E522 VanDerWaalsContact O-N 3.1Å
520	V	84.5	Confident	81.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.4	179	170.1	0	0	0	0	112.7	L356 L431 R434 C435 C436 E516 I518	L356-V520 HydrophobicContact CD1-CG1 3.38Å; L431-V520 HydrophobicContact CB-CG2 4.16Å; L431-V520 HydrophobicContact CD2-CG2 4.19Å; R434-V520 HydrophobicContact CB-CG1 4.14Å; C435-V520 CarbonylContact C-O 3.58Å; C436-V520 PolarHBondContact N-O 3.08Å; E516-V520 HydrophobicContact CB-CG2 3.81Å; E516-V520 WeakPolarHBondContact O-CB 3.11Å; E516-V520 WeakPolarHBondContact O-CG2 3.47Å; E516-V520 PolarHBondContact O-N 2.71Å; I518-V520 VanDerWaalsContact C-N 3.34Å; I518-V520 PolarHBondContact O-N 3.14Å
521	Y	83.5	Confident	79.8	Confident	10 Å²	10	27.4 Å²	27.4	4%	0.039	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	2.8	179.2	-55.3	-67.8	0	0	0	114.2	L356 Q442 K445 P446 R448 Y517 I518 R519	L356-Y521 HydrophobicContact CD1-CE1 4.37Å; L356-Y521 HydrophobicContact CD2-CE1 4.46Å; Q442-Y521 PolarHBondContact NE2-O 3.45Å; K445-Y521 HydrophobicContact CB-CD1 3.97Å; K445-Y521 HydrophobicContact CB-CD2 4.46Å; K445-Y521 HydrophobicContact CB-CE1 3.77Å; K445-Y521 HydrophobicContact CB-CE2 4.26Å; K445-Y521 HydrophobicContact CB-CG 4.32Å; K445-Y521 HydrophobicContact CD-CD2 4.14Å; K445-Y521 HydrophobicContact CD-CG 4.09Å; K445-Y521 HydrophobicContact CG-CD1 4Å; K445-Y521 HydrophobicContact CG-CD2 4.44Å; K445-Y521 HydrophobicContact CG-CE1 4.33Å; K445-Y521 HydrophobicContact CG-CG 4.07Å; P446-Y521 PolarHBondContact O-OH 2.97Å; R448-Y521 VanDerWaalsContact CA-OH 3.29Å; R448-Y521 WeakPolarHBondContact CA-OH 3.35Å; R448-Y521 HydrophobicContact CB-CE2 3.89Å; R448-Y521 WeakPolarHBondContact CB-OH 3.3Å; R448-Y521 HydrophobicContact CG-CE2 3.87Å; R448-Y521 PolarHBondContact N-OH 3.46Å; R448-Y521 VanDerWaalsContact N-OH 3.08Å; Y517-Y521 WeakPolarHBondContact O-CD2 3.17Å; I518-Y521 PolarHBondContact O-N 3.12Å; I518-Y521 VanDerWaalsContact O-N 3.08Å; R519-Y521 PolarHBondContact O-N 2.96Å; R519-Y521 VanDerWaalsContact O-N 3.11Å
522	E	76.8	Confident	78.7	Confident	77 Å²	77	27.7 Å²	27.7	36%	0.36	14%	0.144	S	C	.	.	S	Bend	trans	-67	154.6	171.3	-66.6	172.6	175.6	0	0	110.9	C436 R519	C436-E522 WeakPolarHBondContact CB-O 3.27Å; C436-E522 PolarHBondContact N-O 3.19Å; R519-E522 WeakPolarHBondContact O-CB 3.3Å; R519-E522 PolarHBondContact O-N 2.97Å; R519-E522 VanDerWaalsContact O-N 3.1Å
523	D	77.1	Confident	77.2	Confident	30 Å²	30	29.6 Å²	29.6	16%	0.16	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-75.7	142.3	173.1	-172.3	24.6	0	0	0	110.5	I525 T526 R527 R638	D523-I525 PolarHBondContact O-N 3.46Å; D523-T526 WeakPolarHBondContact O-CB 3.37Å; D523-T526 PolarHBondContact O-N 2.88Å; D523-T526 VanDerWaalsContact O-N 3.09Å; D523-R527 PolarHBondContact O-N 3.49Å; D523-R638 IonicContact OD1-CZ 3.41Å; D523-R638 IonicContact OD1-NH1 2.77Å; D523-R638 PolarHBondContact OD1-NH1 2.94Å; D523-R638 IonicContact OD1-NH2 3.34Å; D523-R638 PolarHBondContact OD1-NH2 3.01Å; D523-R638 IonicContact OD2-CZ 3.63Å; D523-R638 IonicContact OD2-NH1 3.18Å; D523-R638 PolarHBondContact OD2-NH1 3.23Å; D523-R638 IonicContact OD2-NH2 3Å; D523-R638 PolarHBondContact OD2-NH2 3.05Å
524	E	77.2	Confident	75.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-30.9	179.8	-166.8	-176.5	-145.2	0	0	112.7	K357 S359 R527 Y528 S643	K357-E524 VanDerWaalsContact CE-OE1 3.32Å; K357-E524 WeakPolarHBondContact CE-OE1 3.2Å; K357-E524 WeakPolarHBondContact CE-OE2 3.47Å; K357-E524 IonicContact NZ-OE1 2.72Å; K357-E524 PolarHBondContact NZ-OE1 2.92Å; K357-E524 IonicContact NZ-OE2 2.8Å; K357-E524 PolarHBondContact NZ-OE2 3.02Å; S359-E524 WeakPolarHBondContact CB-OE1 3.23Å; S359-E524 WeakPolarHBondContact OG-CG 3.47Å; S359-E524 PolarHBondContact OG-OE1 3.04Å; E524-R527 WeakPolarHBondContact O-CB 3.32Å; E524-R527 PolarHBondContact O-N 3.05Å; E524-Y528 HydrophobicContact CG-CD2 3.92Å; E524-Y528 HydrophobicContact CG-CE2 3.54Å; E524-Y528 VanDerWaalsContact O-CD2 3.27Å; E524-Y528 WeakPolarHBondContact O-CD2 3.47Å; E524-Y528 PolarHBondContact O-N 3.15Å; E524-S643 VanDerWaalsContact OE2-CB 3.24Å; E524-S643 WeakPolarHBondContact OE2-CB 3.48Å; E524-S643 PolarHBondContact OE2-OG 3.46Å
525	I	76.4	Confident	73.6	Confident	6 Å²	6	32 Å²	32	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-50.6	173.6	-64.5	169.9	0	0	0	110	D523 R527 Y528 E529 R638 L646 A647	D523-I525 PolarHBondContact O-N 3.46Å; I525-R527 PolarHBondContact O-N 3.37Å; I525-Y528 PolarHBondContact O-N 2.95Å; I525-Y528 VanDerWaalsContact O-N 3.1Å; I525-E529 VanDerWaalsContact O-CB 3.22Å; I525-E529 WeakPolarHBondContact O-CB 3.33Å; I525-E529 PolarHBondContact O-N 3.03Å; I525-R638 VanDerWaalsContact CD1-NH1 3.28Å; I525-L646 HydrophobicContact CD1-CB 3.76Å; I525-L646 HydrophobicContact CD1-CD1 3.72Å; I525-L646 HydrophobicContact CD1-CG 4.39Å; I525-L646 HydrophobicContact CG1-CB 4.07Å; I525-L646 HydrophobicContact CG2-CB 4.5Å; I525-A647 HydrophobicContact CG2-CB 4.01Å
526	T	72.3	Confident	71.7	Confident	57 Å²	57	34.3 Å²	34.3	35%	0.35	18%	0.184	S	C	.	.	H	α-helix	trans	-59	-32	-179.1	-54.8	0	0	0	0	112	D523 S530	D523-T526 WeakPolarHBondContact O-CB 3.37Å; D523-T526 PolarHBondContact O-N 2.88Å; D523-T526 VanDerWaalsContact O-N 3.09Å; T526-S530 WeakPolarHBondContact O-CB 3.4Å; T526-S530 PolarHBondContact O-N 3.07Å; T526-S530 VanDerWaalsContact O-N 3.08Å; T526-S530 PolarHBondContact O-OG 2.87Å
527	R	70.1	Confident	69.9	Low	16 Å²	16	38.7 Å²	38.7	6%	0.06	21%	0.205	C	C	.	.	H	α-helix	trans	-68	-49.7	173.7	-124.8	-176.6	-165.3	-147.5	13.1	112.4	V360 F362 F432 C435 D523 E524 I525 E529 S530 M531	V360-R527 PolarHBondContact O-NH1 2.86Å; F362-R527 HydrophobicContact CD2-CB 4.16Å; F362-R527 HydrophobicContact CD2-CG 3.56Å; F362-R527 HydrophobicContact CE2-CB 3.85Å; F362-R527 HydrophobicContact CE2-CG 3.76Å; F432-R527 PolarHBondContact O-NH1 3.28Å; F432-R527 PolarHBondContact O-NH2 3.01Å; C435-R527 WeakPolarHBondContact SG-CD 3.5Å; C435-R527 VanDerWaalsContact SG-CZ 3.52Å; C435-R527 PolarHBondContact SG-NE 3.38Å; D523-R527 PolarHBondContact O-N 3.49Å; E524-R527 WeakPolarHBondContact O-CB 3.32Å; E524-R527 PolarHBondContact O-N 3.05Å; I525-R527 PolarHBondContact O-N 3.37Å; R527-E529 VanDerWaalsContact C-N 3.33Å; R527-S530 PolarHBondContact O-N 2.61Å; R527-M531 PolarHBondContact O-N 3.39Å; R527-M531 VanDerWaalsContact O-N 3.09Å
528	Y	73.1	Confident	67.6	Low	13 Å²	13	44.1 Å²	44.1	5%	0.051	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-33.9	175.4	-74.2	-60.3	0	0	0	112.6	V360 F362 E524 I525 S530 M531 L532 M644 A647	V360-Y528 HydrophobicContact CG2-CE1 4.32Å; F362-Y528 AromaticContact CZ-CD1 3.71Å; F362-Y528 HydrophobicContact CZ-CD1 3.71Å; F362-Y528 AromaticContact CZ-CE1 3.78Å; F362-Y528 HydrophobicContact CZ-CE1 3.78Å; E524-Y528 HydrophobicContact CG-CD2 3.92Å; E524-Y528 HydrophobicContact CG-CE2 3.54Å; E524-Y528 VanDerWaalsContact O-CD2 3.27Å; E524-Y528 WeakPolarHBondContact O-CD2 3.47Å; E524-Y528 PolarHBondContact O-N 3.15Å; I525-Y528 PolarHBondContact O-N 2.95Å; I525-Y528 VanDerWaalsContact O-N 3.1Å; Y528-S530 VanDerWaalsContact C-N 3.34Å; Y528-M531 HydrophobicContact CD1-CE 4.11Å; Y528-M531 HydrophobicContact CD1-SD 4.47Å; Y528-M531 WeakPolarHBondContact O-CB 3.49Å; Y528-M531 PolarHBondContact O-N 3.41Å; Y528-M531 VanDerWaalsContact O-N 3.13Å; Y528-L532 WeakPolarHBondContact O-CB 3.23Å; Y528-L532 VanDerWaalsContact O-CG 3.32Å; Y528-L532 WeakPolarHBondContact O-CG 3.22Å; Y528-L532 PolarHBondContact O-N 3.42Å; Y528-M644 HydrophobicContact CD1-CB 4.3Å; Y528-M644 HydrophobicContact CD1-CG 4.37Å; Y528-M644 HydrophobicContact CD2-CB 4.16Å; Y528-M644 HydrophobicContact CE1-CB 4.41Å; Y528-M644 HydrophobicContact CE2-CB 4.25Å; Y528-M644 HydrophobicContact CG-CB 4.2Å; Y528-A647 VanDerWaalsContact CB-CB 3.41Å
529	E	68.5	Low	65.8	Low	22 Å²	22	47.1 Å²	47.1	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-63.5	-43	177.5	-166.9	-169.3	129.3	0	0	109.9	I525 R527 M531 L532 R533 A647 R650 V651	I525-E529 VanDerWaalsContact O-CB 3.22Å; I525-E529 WeakPolarHBondContact O-CB 3.33Å; I525-E529 PolarHBondContact O-N 3.03Å; R527-E529 VanDerWaalsContact C-N 3.33Å; E529-M531 VanDerWaalsContact C-N 3.34Å; E529-M531 PolarHBondContact O-N 2.95Å; E529-L532 PolarHBondContact O-N 3.39Å; E529-R533 WeakPolarHBondContact O-CG 3.4Å; E529-R533 PolarHBondContact O-N 3.45Å; E529-R533 IonicContact OE1-CZ 3.51Å; E529-R533 VanDerWaalsContact OE1-CZ 3.24Å; E529-R533 IonicContact OE1-NH1 2.66Å; E529-R533 PolarHBondContact OE1-NH1 3.03Å; E529-R533 IonicContact OE1-NH2 2.88Å; E529-R533 PolarHBondContact OE1-NH2 3.2Å; E529-A647 HydrophobicContact CB-CB 4.16Å; E529-R650 HydrophobicContact CG-CB 4.25Å; E529-R650 WeakPolarHBondContact OE2-CD 3.19Å; E529-R650 IonicContact OE2-NH1 3.44Å; E529-R650 PolarHBondContact OE2-NH1 2.98Å; E529-V651 HydrophobicContact CB-CG2 4.4Å; E529-V651 HydrophobicContact CG-CG2 3.74Å
530	S	65.2	Low	64.2	Low	77 Å²	77	45.9 Å²	45.9	54%	0.538	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-32.5	172.2	-55.2	0	0	0	0	113.1	T526 R527 Y528	T526-S530 WeakPolarHBondContact O-CB 3.4Å; T526-S530 PolarHBondContact O-N 3.07Å; T526-S530 VanDerWaalsContact O-N 3.08Å; T526-S530 PolarHBondContact O-OG 2.87Å; R527-S530 PolarHBondContact O-N 2.61Å; Y528-S530 VanDerWaalsContact C-N 3.34Å
531	M	67	Low	62.3	Low	60 Å²	60	48 Å²	48	30%	0.296	26%	0.258	S	S	.	.	H	α-helix	trans	-71.7	-45	174.2	-179.8	-155.8	66.6	0	0	112	F362 R527 Y528 E529 G534	F362-M531 HydrophobicContact CD1-CB 4.07Å; F362-M531 HydrophobicContact CD1-CG 4.07Å; F362-M531 HydrophobicContact CD1-SD 4.32Å; F362-M531 HydrophobicContact CE1-CB 3.8Å; F362-M531 HydrophobicContact CE1-CG 3.74Å; F362-M531 HydrophobicContact CE1-SD 3.48Å; F362-M531 WeakPolarHBondContact CE1-SD 3.32Å; F362-M531 HydrophobicContact CZ-CB 4.35Å; F362-M531 HydrophobicContact CZ-SD 4.22Å; R527-M531 PolarHBondContact O-N 3.39Å; R527-M531 VanDerWaalsContact O-N 3.09Å; Y528-M531 HydrophobicContact CD1-CE 4.11Å; Y528-M531 HydrophobicContact CD1-SD 4.47Å; Y528-M531 WeakPolarHBondContact O-CB 3.49Å; Y528-M531 PolarHBondContact O-N 3.41Å; Y528-M531 VanDerWaalsContact O-N 3.13Å; E529-M531 VanDerWaalsContact C-N 3.34Å; E529-M531 PolarHBondContact O-N 2.95Å; M531-G534 WeakPolarHBondContact O-CA 3.5Å; M531-G534 PolarHBondContact O-N 2.98Å
532	L	66.2	Low	60.3	Low	11 Å²	11	51 Å²	51	6%	0.058	28%	0.279	C	S	.	.	H	α-helix	trans	-68.4	-36.6	-173.8	-74.5	168.1	0	0	0	111.7	Y528 E529 G534 V535 A647 Q648 V651	Y528-L532 WeakPolarHBondContact O-CB 3.23Å; Y528-L532 VanDerWaalsContact O-CG 3.32Å; Y528-L532 WeakPolarHBondContact O-CG 3.22Å; Y528-L532 PolarHBondContact O-N 3.42Å; E529-L532 PolarHBondContact O-N 3.39Å; L532-G534 PolarHBondContact O-N 2.89Å; L532-V535 PolarHBondContact O-N 3.28Å; L532-A647 HydrophobicContact CD1-CB 3.9Å; L532-Q648 HydrophobicContact CD1-CB 3.83Å; L532-V651 HydrophobicContact CB-CG2 3.94Å
533	R	60.5	Low	58.4	Low	42 Å²	42	55.9 Å²	55.9	16%	0.158	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-4.6	165.2	-69.8	-177.2	179.4	126.8	4.8	115	E278 E529 V651 S654	E278-R533 WeakPolarHBondContact OE2-CA 3.31Å; E278-R533 WeakPolarHBondContact OE2-CB 3.49Å; E278-R533 WeakPolarHBondContact OE2-CG 3.41Å; E529-R533 WeakPolarHBondContact O-CG 3.4Å; E529-R533 PolarHBondContact O-N 3.45Å; E529-R533 IonicContact OE1-CZ 3.51Å; E529-R533 VanDerWaalsContact OE1-CZ 3.24Å; E529-R533 IonicContact OE1-NH1 2.66Å; E529-R533 PolarHBondContact OE1-NH1 3.03Å; E529-R533 IonicContact OE1-NH2 2.88Å; E529-R533 PolarHBondContact OE1-NH2 3.2Å; R533-V651 HydrophobicContact CG-CG1 4.07Å; R533-V651 HydrophobicContact CG-CG2 3.88Å; R533-S654 PolarHBondContact NH2-OG 2.97Å
534	G	51.3	Low	56.6	Low	22 Å²	22	57.2 Å²	57.2	23%	0.227	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	0.1	172.2	0	0	0	0	0	113.6	K275 M531 L532	K275-G534 WeakPolarHBondContact CE-O 3.39Å; K275-G534 WeakPolarHBondContact CG-O 3.19Å; M531-G534 WeakPolarHBondContact O-CA 3.5Å; M531-G534 PolarHBondContact O-N 2.98Å; L532-G534 PolarHBondContact O-N 2.89Å
535	V	54.8	Low	54.8	Low	40 Å²	40	59.1 Å²	59.1	24%	0.242	33%	0.334	C	S	.	.	S	Bend	trans	-97.8	124.9	179.7	-179.4	0	0	0	0	108.6	L532 H537 K539 L540	L532-V535 PolarHBondContact O-N 3.28Å; V535-H537 PolarHBondContact O-N 3.35Å; V535-K539 HydrophobicContact CG1-CB 3.97Å; V535-L540 HydrophobicContact CB-CD1 4.18Å; V535-L540 HydrophobicContact CG1-CD1 4.39Å; V535-L540 WeakPolarHBondContact O-CD1 3.25Å
536	P	46.5	Very low	52.8	Low	62 Å²	62	66.8 Å²	66.8	40%	0.403	37%	0.367	S	S	.	.			trans	-54.8	130.8	178.2	-24.2	33	0	0	0	111.1	T538 K539	P536-T538 PolarHBondContact O-N 3.25Å; P536-K539 PolarHBondContact O-N 2.95Å
537	H	48	Very low	51.2	Low	94 Å²	94	68.4 Å²	68.4	44%	0.435	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-52.7	-25.7	-174.1	-49.4	-70.1	0	0	0	114	E278 V535 K539 L540 E655	E278-H537 IonicContact OE1-CE1 3.04Å; E278-H537 PolarHBondContact OE1-CE1 3.05Å; E278-H537 IonicContact OE1-ND1 3.91Å; E278-H537 IonicContact OE1-NE2 3.28Å; V535-H537 PolarHBondContact O-N 3.35Å; H537-K539 PolarHBondContact O-N 3.26Å; H537-L540 PolarHBondContact O-N 3.29Å; H537-E655 IonicContact CE1-OE1 3.18Å; H537-E655 PolarHBondContact CE1-OE1 3.48Å; H537-E655 VanDerWaalsContact CE1-OE1 3.25Å; H537-E655 IonicContact CE1-OE2 3.71Å; H537-E655 IonicContact ND1-OE1 3.97Å; H537-E655 PolarHBondContact ND1-OE1 3Å; H537-E655 IonicContact ND1-OE2 3.25Å
538	T	39.5	Very low	49.1	Very low	135 Å²	135	73.7 Å²	73.7	83%	0.828	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-65.5	-1.9	172.5	54.8	0	0	0	0	114.9	P536	P536-T538 PolarHBondContact O-N 3.25Å
539	K	44.3	Very low	47.2	Very low	159 Å²	159	77.3 Å²	77.3	69%	0.691	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-125.4	-3.6	175	-66.3	-167.7	174.9	-166.5	0	114	V535 P536 H537 L541	V535-K539 HydrophobicContact CG1-CB 3.97Å; P536-K539 PolarHBondContact O-N 2.95Å; H537-K539 PolarHBondContact O-N 3.26Å; K539-L541 PolarHBondContact O-N 3.47Å
540	L	45	Very low	45.3	Very low	30 Å²	30	82.2 Å²	82.2	16%	0.157	44%	0.441	C	S	.	.	S	Bend	trans	-74.5	123.9	166.8	-90.8	118.6	0	0	0	108	V535 H537 Q648	V535-L540 HydrophobicContact CB-CD1 4.18Å; V535-L540 HydrophobicContact CG1-CD1 4.39Å; V535-L540 WeakPolarHBondContact O-CD1 3.25Å; H537-L540 PolarHBondContact O-N 3.29Å; L540-Q648 HydrophobicContact CD2-CG 4.37Å
541	L	44.1	Very low	43.6	Very low	45 Å²	45	85.6 Å²	85.6	24%	0.236	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-67.4	145.1	-176.4	-70.2	166.6	0	0	0	110.9	K539 S545 W547	K539-L541 PolarHBondContact O-N 3.47Å; L541-S545 WeakPolarHBondContact CB-OG 3.43Å; L541-S545 VanDerWaalsContact CD1-OG 3.28Å; L541-S545 WeakPolarHBondContact CD1-OG 3.46Å; L541-W547 HydrophobicContact CD1-CD2 4.29Å; L541-W547 HydrophobicContact CD1-CE3 4.46Å; L541-W547 HydrophobicContact CD1-CH2 3.6Å; L541-W547 HydrophobicContact CD1-CZ2 3.35Å; L541-W547 HydrophobicContact CD1-CZ3 4.15Å; L541-W547 HydrophobicContact CG-CZ2 4.36Å
542	P	41.5	Very low	41.7	Very low	74 Å²	74	87.1 Å²	87.1	48%	0.481	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-60.5	153.7	173.1	25.2	-32.3	0	0	0	111.4	G544 S545 F584	P542-G544 PolarHBondContact O-N 2.8Å; P542-S545 PolarHBondContact O-N 2.87Å; P542-F584 HydrophobicContact CG-CE2 3.67Å; P542-F584 HydrophobicContact CG-CZ 4.32Å
543	F	36.8	Very low	40	Very low	178 Å²	178	94.8 Å²	94.8	78%	0.781	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	122.3	-177.7	-164.7	-90.4	0	0	0	111.4	Y649	F543-Y649 HydrophobicContact CE2-CE1 4.24Å
544	G	41.4	Very low	38.5	Very low	58 Å²	58	101.6 Å²	101.6	60%	0.598	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.1	-8.1	178.7	0	0	0	0	0	116.3	P542 K546	P542-G544 PolarHBondContact O-N 2.8Å; G544-K546 PolarHBondContact O-N 3.33Å
545	S	39.2	Very low	37.6	Very low	41 Å²	41	104.9 Å²	104.9	29%	0.287	55%	0.553	S	S	.	*			trans	-61.4	111	-179.5	66.1	0	0	0	0	113.5	L541 P542 W547	L541-S545 WeakPolarHBondContact CB-OG 3.43Å; L541-S545 VanDerWaalsContact CD1-OG 3.28Å; L541-S545 WeakPolarHBondContact CD1-OG 3.46Å; P542-S545 PolarHBondContact O-N 2.87Å; S545-W547 PolarHBondContact O-N 3.32Å
546	K	33.3	Very low	36.4	Very low	166 Å²	166	110.4 Å²	110.4	72%	0.722	58%	0.581	S	S	*	*			trans	-76.2	118.1	176.4	-170.6	-170.3	-179.2	-159.2	0	110.9	G544 E548	G544-K546 PolarHBondContact O-N 3.33Å; K546-E548 HydrophobicContact CD-CG 4.27Å; K546-E548 WeakPolarHBondContact CE-OE1 3.45Å; K546-E548 HydrophobicContact CG-CG 4.44Å; K546-E548 IonicContact NZ-OE1 2.67Å; K546-E548 PolarHBondContact NZ-OE1 2.81Å; K546-E548 PolarHBondContact O-N 2.88Å
547	W	38	Very low	35.5	Very low	92 Å²	92	117.5 Å²	117.5	35%	0.348	60%	0.601	S	S	.	*			trans	-79.5	113.8	169.5	-63.7	100	0	0	0	109.9	L541 S545 V577 M644	L541-W547 HydrophobicContact CD1-CD2 4.29Å; L541-W547 HydrophobicContact CD1-CE3 4.46Å; L541-W547 HydrophobicContact CD1-CH2 3.6Å; L541-W547 HydrophobicContact CD1-CZ2 3.35Å; L541-W547 HydrophobicContact CD1-CZ3 4.15Å; L541-W547 HydrophobicContact CG-CZ2 4.36Å; S545-W547 PolarHBondContact O-N 3.32Å; W547-V577 HydrophobicContact CE3-CG1 3.93Å; W547-V577 HydrophobicContact CZ3-CG1 3.95Å; W547-M644 HydrophobicContact CZ2-CE 4.37Å
548	E	27.7	Very low	34.6	Very low	126 Å²	126	118.2 Å²	118.2	59%	0.589	61%	0.614	S	S	*	*			trans	-96.1	101	168.3	-70.3	-170.4	162.8	0	0	109.6	K546 I550	K546-E548 HydrophobicContact CD-CG 4.27Å; K546-E548 WeakPolarHBondContact CE-OE1 3.45Å; K546-E548 HydrophobicContact CG-CG 4.44Å; K546-E548 IonicContact NZ-OE1 2.67Å; K546-E548 PolarHBondContact NZ-OE1 2.81Å; K546-E548 PolarHBondContact O-N 2.88Å; E548-I550 PolarHBondContact O-N 3.32Å
549	V	32.6	Very low	34	Very low	89 Å²	89	117.1 Å²	117.1	54%	0.539	61%	0.612	S	S	.	*			trans	-72.5	110.6	166.5	178.9	0	0	0	0	107.4	E551	V549-E551 PolarHBondContact O-N 2.93Å
550	I	28.5	Very low	33.4	Very low	126 Å²	126	115.4 Å²	115.4	65%	0.646	62%	0.62	S	S	*	*			trans	-71.5	83.1	169.5	-54.4	176	0	0	0	107.5	E548 S552	E548-I550 PolarHBondContact O-N 3.32Å; I550-S552 PolarHBondContact O-N 3.29Å
551	E	29.8	Very low	32.6	Very low	148 Å²	148	117.9 Å²	117.9	69%	0.692	65%	0.645	S	S	*	*			trans	-62.5	125.3	161.8	-164.2	168.6	-140.4	0	0	106.8	V549 Q553	V549-E551 PolarHBondContact O-N 2.93Å; E551-Q553 VanDerWaalsContact C-N 3.27Å; E551-Q553 PolarHBondContact O-N 2.92Å
552	S	27.6	Very low	31.8	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	67%	0.672	S	S	*	*			trans	-68.9	84.6	-174	50.7	0	0	0	0	111.1	I550 H554	I550-S552 PolarHBondContact O-N 3.29Å; S552-H554 PolarHBondContact O-N 2.71Å
553	Q	28.9	Very low	31.2	Very low	171 Å²	171	127.6 Å²	127.6	80%	0.799	69%	0.692	S	S	*	*			trans	-66	102.2	169.1	-70.6	-169.1	-13.8	0	0	108.1	E551 S555	E551-Q553 VanDerWaalsContact C-N 3.27Å; E551-Q553 PolarHBondContact O-N 2.92Å; Q553-S555 PolarHBondContact O-N 3.08Å
554	H	30.1	Very low	30.7	Very low	186 Å²	186	126.4 Å²	126.4	86%	0.861	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56.2	132.8	157.8	-95.1	-20.2	0	0	0	108.3	S552	S552-H554 PolarHBondContact O-N 2.71Å
555	S	32	Very low	30.1	Very low	90 Å²	90	130.2 Å²	130.2	63%	0.629	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-47.9	135.6	-173.8	47.1	0	0	0	0	113.4	Q553 Y557	Q553-S555 PolarHBondContact O-N 3.08Å; S555-Y557 PolarHBondContact O-N 3Å
556	N	29.1	Very low	29.5	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-49.9	119.2	168.8	-69.3	-40.7	0	0	0	111.3
557	Y	28.7	Very low	29.3	Very low	211 Å²	211	130.8 Å²	130.8	83%	0.827	73%	0.732	S	S	*	*			trans	-121.9	133.1	153.1	-89	-84.3	0	0	0	108	S555	S555-Y557 PolarHBondContact O-N 3Å
558	P	27.9	Very low	28.8	Very low	110 Å²	110	138.4 Å²	138.4	71%	0.714	76%	0.761	S	S	*	*			trans	-80.9	147.7	-174.8	32.4	-34.7	0	0	0	112.5
559	S	26.8	Very low	28.8	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	77%	0.774	S	S	*	*			trans	47.3	106	152.2	62.2	0	0	0	0	119.9
560	S	31.4	Very low	28.7	Very low	124 Å²	124	144.6 Å²	144.6	87%	0.867	79%	0.785	S	S	*	*				-163.7	145.3	123.5	54.7	0	0	0	0	111.1
561	A	28.5	Very low	28.6	Very low	82 Å²	82	143.1 Å²	143.1	68%	0.678	79%	0.792	S	S	*	*			trans	-75.4	170.8	179.6	0	0	0	0	0	112.9
562	N	28.8	Very low	28.6	Very low	150 Å²	150	144.7 Å²	144.7	80%	0.802	80%	0.804	S	S	*	*			trans	72.7	100.2	168.3	-49.4	-27	0	0	0	116.8
563	L	28.2	Very low	28.8	Very low	173 Å²	173	145.4 Å²	145.4	91%	0.906	81%	0.809	S	S	*	*				-163.5	156	105.7	-126.3	76.1	0	0	0	112
564	L	26.6	Very low	28.8	Very low	152 Å²	152	145.9 Å²	145.9	80%	0.796	81%	0.811	S	S	*	*			trans	-82.6	172.5	179.2	-74.9	97.3	0	0	0	113.1
565	T	27.6	Very low	28.8	Very low	139 Å²	139	141.9 Å²	141.9	85%	0.853	80%	0.802	S	S	*	*			trans	66.3	92.4	154.7	47.5	0	0	0	0	119.4
566	A	27.6	Very low	28.7	Very low	92 Å²	92	143.1 Å²	143.1	76%	0.76	81%	0.805	S	S	*	*			trans	-153.9	132.1	145.9	0	0	0	0	0	111
567	P	28.2	Very low	28.8	Very low	126 Å²	126	139.4 Å²	139.4	82%	0.818	79%	0.788	S	S	*	*			trans	-79.9	137.4	179.7	31.5	-33.4	0	0	0	112.2	T569	P567-T569 PolarHBondContact O-N 3.48Å
568	R	28.4	Very low	28.9	Very low	253 Å²	253	134 Å²	134	96%	0.955	78%	0.777	S	S	*	*			trans	-70.7	107.9	179.9	-85.8	178.2	161.3	146.1	-6.2	112.8
569	T	27.9	Very low	29.1	Very low	140 Å²	140	135.2 Å²	135.2	86%	0.859	78%	0.777	S	S	*	*			trans	-103.9	119.7	152.7	42.6	0	0	0	0	109.1	P567	P567-T569 PolarHBondContact O-N 3.48Å
570	R	30.2	Very low	29.5	Very low	205 Å²	205	135.4 Å²	135.4	77%	0.774	77%	0.769	S	S	*	*			trans	-150.8	94.4	172.1	-152	-179.7	-163.4	-170.5	5.7	110.6
571	A	27.3	Very low	29.5	Very low	95 Å²	95	134.2 Å²	134.2	79%	0.785	76%	0.758	S	S	*	*			trans	-155.1	98	168.7	0	0	0	0	0	108.2
572	L	28.4	Very low	29.8	Very low	181 Å²	181	133.9 Å²	133.9	95%	0.948	75%	0.751	S	S	*	*			trans	160.3	87.1	160.6	-92.3	159.4	0	0	0	109.2
573	S	32	Very low	30.4	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	74%	0.739	S	S	*	*			trans	-168.6	119.6	159	50	0	0	0	0	108
574	E	30	Very low	30.6	Very low	180 Å²	180	127.2 Å²	127.2	84%	0.841	72%	0.72	S	S	*	*			trans	-69	139	171.5	-62.2	-179.9	138.8	0	0	110	V576	E574-V576 PolarHBondContact O-N 2.8Å
575	P	30	Very low	31	Very low	102 Å²	102	125.6 Å²	125.6	66%	0.662	71%	0.712	S	S	*	*			trans	-75.6	109.5	170.2	30	-31.1	0	0	0	109.7
576	V	29.4	Very low	31.7	Very low	116 Å²	116	126.9 Å²	126.9	70%	0.703	71%	0.705	S	S	*	*			trans	-72.5	129.3	167.5	178.6	0	0	0	0	108.5	E574 T578	E574-V576 PolarHBondContact O-N 2.8Å; V576-T578 HydrophobicContact CG1-CG2 4.43Å
577	V	31.7	Very low	32.1	Very low	78 Å²	78	127.8 Å²	127.8	47%	0.473	69%	0.694	S	S	.	*			trans	-115.4	121.5	178.8	-178.3	0	0	0	0	109.4	W547	W547-V577 HydrophobicContact CE3-CG1 3.93Å; W547-V577 HydrophobicContact CZ3-CG1 3.95Å
578	T	30	Very low	32.5	Very low	99 Å²	99	125.9 Å²	125.9	61%	0.607	68%	0.676	S	S	*	*			trans	-114.4	144.9	177.9	47.3	0	0	0	0	110.8	V576	V576-T578 HydrophobicContact CG1-CG2 4.43Å
579	L	31.4	Very low	33	Very low	134 Å²	134	118.4 Å²	118.4	70%	0.702	66%	0.655	S	S	*	*			trans	-94.3	141.1	-177.6	-145.1	88.7	0	0	0	110.7
580	N	35.2	Very low	33.8	Very low	115 Å²	115	115.6 Å²	115.6	62%	0.615	64%	0.638	S	S	*	*			trans	-106.8	107.4	170.4	-173.8	-13	0	0	0	110.4	S582	N580-S582 PolarHBondContact O-N 3.38Å; N580-S582 PolarHBondContact OD1-N 3.05Å; N580-S582 PolarHBondContact OD1-OG 3.39Å
581	P	32.7	Very low	34	Very low	99 Å²	99	110.9 Å²	110.9	64%	0.643	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-21	-174	-22.6	34	0	0	0	115.2	A583	P581-A583 PolarHBondContact O-N 2.98Å
582	S	34.9	Very low	34.3	Very low	75 Å²	75	112 Å²	112	52%	0.524	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-22.5	-166.3	62.2	0	0	0	0	115.3	N580	N580-S582 PolarHBondContact O-N 3.38Å; N580-S582 PolarHBondContact OD1-N 3.05Å; N580-S582 PolarHBondContact OD1-OG 3.39Å
583	A	40.2	Very low	35	Very low	66 Å²	66	110.8 Å²	110.8	55%	0.545	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-42.2	179.9	0	0	0	0	0	112.3	P581 L585 K586	P581-A583 PolarHBondContact O-N 2.98Å; A583-L585 VanDerWaalsContact C-N 3.31Å; A583-L585 PolarHBondContact O-N 2.95Å; A583-K586 PolarHBondContact O-N 3.33Å; A583-K586 VanDerWaalsContact O-N 3.16Å
584	F	33.2	Very low	35.3	Very low	118 Å²	118	111.2 Å²	111.2	52%	0.518	60%	0.601	S	S	.	*	H	α-helix	trans	-59.9	-38.3	-175.4	-172.9	-116	0	0	0	113	P542 K586 E587 I588	P542-F584 HydrophobicContact CG-CE2 3.67Å; P542-F584 HydrophobicContact CG-CZ 4.32Å; F584-K586 VanDerWaalsContact C-N 3.3Å; F584-K586 PolarHBondContact O-N 3.08Å; F584-E587 PolarHBondContact O-N 2.94Å; F584-I588 HydrophobicContact CD1-CD1 3.99Å; F584-I588 HydrophobicContact CD2-CD1 4.49Å; F584-I588 HydrophobicContact CE1-CD1 3.54Å; F584-I588 HydrophobicContact CE2-CD1 4.08Å; F584-I588 HydrophobicContact CG-CD1 4.45Å; F584-I588 HydrophobicContact CZ-CD1 3.6Å; F584-I588 PolarHBondContact O-N 3.3Å
585	L	34.5	Very low	35.6	Very low	118 Å²	118	107.7 Å²	107.7	62%	0.618	59%	0.588	S	S	*	*	H	α-helix	trans	-71.5	-20.2	-178.4	-122.7	158.9	0	0	0	113.4	A583 N589	A583-L585 VanDerWaalsContact C-N 3.31Å; A583-L585 PolarHBondContact O-N 2.95Å; L585-N589 PolarHBondContact O-ND2 3.35Å
586	K	41.6	Very low	36	Very low	165 Å²	165	106.1 Å²	106.1	72%	0.717	58%	0.584	S	S	*	*	H	α-helix	trans	-81.3	-39.1	173.9	-77.4	-174.9	174.1	-179.6	0	112.3	A583 F584 N589 T590	A583-K586 PolarHBondContact O-N 3.33Å; A583-K586 VanDerWaalsContact O-N 3.16Å; F584-K586 VanDerWaalsContact C-N 3.3Å; F584-K586 PolarHBondContact O-N 3.08Å; K586-N589 PolarHBondContact O-N 3.43Å; K586-T590 PolarHBondContact O-N 3.36Å; K586-T590 PolarHBondContact O-OG1 3.13Å
587	E	37.5	Very low	36.5	Very low	112 Å²	112	108.4 Å²	108.4	52%	0.523	59%	0.587	S	S	.	*	H	α-helix	trans	-73	-37.3	-172.5	-159.6	160.1	-151.3	0	0	112.4	F584 T590 L591	F584-E587 PolarHBondContact O-N 2.94Å; E587-T590 WeakPolarHBondContact CA-OG1 3.48Å; E587-T590 PolarHBondContact O-N 3.33Å; E587-T590 PolarHBondContact O-OG1 3.44Å; E587-L591 PolarHBondContact O-N 3.24Å
588	I	36.8	Very low	36.7	Very low	86 Å²	86	108.9 Å²	108.9	44%	0.441	59%	0.593	S	S	.	*	H	α-helix	trans	-61.8	-47.2	172.3	-67.6	174.4	0	0	0	111.2	F584 T590 L591 D592	F584-I588 HydrophobicContact CD1-CD1 3.99Å; F584-I588 HydrophobicContact CD2-CD1 4.49Å; F584-I588 HydrophobicContact CE1-CD1 3.54Å; F584-I588 HydrophobicContact CE2-CD1 4.08Å; F584-I588 HydrophobicContact CG-CD1 4.45Å; F584-I588 HydrophobicContact CZ-CD1 3.6Å; F584-I588 PolarHBondContact O-N 3.3Å; I588-T590 PolarHBondContact O-N 3.11Å; I588-L591 PolarHBondContact O-N 3.29Å; I588-L591 VanDerWaalsContact O-N 3.11Å; I588-D592 PolarHBondContact O-N 2.89Å; I588-D592 VanDerWaalsContact O-N 3.14Å
589	N	38	Very low	36.9	Very low	95 Å²	95	109.3 Å²	109.3	51%	0.508	60%	0.601	S	S	.	*	H	α-helix	trans	-64	-22.2	-179.9	-81.3	-46.1	0	0	0	113.7	L585 K586	L585-N589 PolarHBondContact O-ND2 3.35Å; K586-N589 PolarHBondContact O-N 3.43Å
590	T	44.9	Very low	37.1	Very low	81 Å²	81	113.3 Å²	113.3	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-84.9	-30.3	173.1	45.3	0	0	0	0	113.8	K586 E587 I588 N594	K586-T590 PolarHBondContact O-N 3.36Å; K586-T590 PolarHBondContact O-OG1 3.13Å; E587-T590 WeakPolarHBondContact CA-OG1 3.48Å; E587-T590 PolarHBondContact O-N 3.33Å; E587-T590 PolarHBondContact O-OG1 3.44Å; I588-T590 PolarHBondContact O-N 3.11Å; T590-N594 VanDerWaalsContact O-CG 3.31Å; T590-N594 PolarHBondContact O-ND2 3.46Å
591	L	33.6	Very low	37.1	Very low	107 Å²	107	114.8 Å²	114.8	56%	0.56	61%	0.614	S	S	*	*	H	α-helix	trans	-74.7	-36	178.3	-98.6	145.6	0	0	0	112.5	E587 I588 N595	E587-L591 PolarHBondContact O-N 3.24Å; I588-L591 PolarHBondContact O-N 3.29Å; I588-L591 VanDerWaalsContact O-N 3.11Å; L591-N595 PolarHBondContact O-N 3.01Å; L591-N595 PolarHBondContact O-ND2 3.3Å
592	D	35	Very low	37.2	Very low	119 Å²	119	118.7 Å²	118.7	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-71	-38.6	-178.7	-145.8	27.2	0	0	0	112.1	I588 N594 N595 A596	I588-D592 PolarHBondContact O-N 2.89Å; I588-D592 VanDerWaalsContact O-N 3.14Å; D592-N594 PolarHBondContact O-N 3.16Å; D592-N595 PolarHBondContact O-N 3.47Å; D592-A596 PolarHBondContact O-N 2.77Å
593	K	41.6	Very low	37	Very low	155 Å²	155	123.6 Å²	123.6	67%	0.674	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-42.6	174.9	-76.1	-171.4	173.7	-170.7	0	113.2	N595 A596	K593-N595 VanDerWaalsContact C-N 3.3Å; K593-N595 PolarHBondContact O-N 3.46Å; K593-A596 PolarHBondContact O-N 2.57Å
594	N	39.7	Very low	36.7	Very low	115 Å²	115	127.6 Å²	127.6	62%	0.615	65%	0.651	S	S	*	*	H	α-helix	trans	-71.4	-24.3	-176.7	-67.9	-8.6	0	0	0	113	T590 D592	T590-N594 VanDerWaalsContact O-CG 3.31Å; T590-N594 PolarHBondContact O-ND2 3.46Å; D592-N594 PolarHBondContact O-N 3.16Å
595	N	36.3	Very low	36.8	Very low	106 Å²	106	128.9 Å²	128.9	57%	0.567	66%	0.661	S	S	*	*	H	α-helix	trans	-83.4	-28.7	175.5	-73.2	-29.4	0	0	0	112.8	L591 D592 K593	L591-N595 PolarHBondContact O-N 3.01Å; L591-N595 PolarHBondContact O-ND2 3.3Å; D592-N595 PolarHBondContact O-N 3.47Å; K593-N595 VanDerWaalsContact C-N 3.3Å; K593-N595 PolarHBondContact O-N 3.46Å
596	A	37.6	Very low	36.6	Very low	69 Å²	69	129 Å²	129	57%	0.57	67%	0.672	S	S	*	*	H	α-helix	trans	-71.4	-27.7	179.4	0	0	0	0	0	114.1	D592 K593	D592-A596 PolarHBondContact O-N 2.77Å; K593-A596 PolarHBondContact O-N 2.57Å
597	E	39.4	Very low	36.3	Very low	164 Å²	164	126.1 Å²	126.1	77%	0.766	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-14.8	-178.5	-68.2	-175.9	163.8	0	0	113.9
598	S	36.6	Very low	36.4	Very low	88 Å²	88	127.2 Å²	127.2	62%	0.615	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-23.5	-177.8	-163.5	0	0	0	0	113.8	R600	S598-R600 VanDerWaalsContact C-N 3.33Å; S598-R600 PolarHBondContact O-N 2.8Å; S598-R600 VanDerWaalsContact O-N 3.17Å
599	S	34.9	Very low	36.6	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	30.4	-172.5	-63.4	0	0	0	0	115.9
600	R	34.7	Very low	36.8	Very low	218 Å²	218	130.4 Å²	130.4	82%	0.823	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-7.2	177.9	-69	-168.2	-168.9	173.4	6.8	117	S598	S598-R600 VanDerWaalsContact C-N 3.33Å; S598-R600 PolarHBondContact O-N 2.8Å; S598-R600 VanDerWaalsContact O-N 3.17Å
601	N	35.4	Very low	36.7	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	70%	0.704	S	S	*	*			trans	-123.1	39.6	-170.7	-71.7	-12.9	0	0	0	114.2
602	H	34.6	Very low	37.2	Very low	182 Å²	182	133.1 Å²	133.1	84%	0.843	70%	0.699	S	S	*	*			trans	-125.1	64.1	176.7	-98.2	-60.3	0	0	0	113.3
603	E	32	Very low	37.5	Very low	177 Å²	177	134.5 Å²	134.5	83%	0.827	70%	0.699	S	S	*	*			trans	-117.8	147.5	150.9	-72	-171.3	151.2	0	0	108.8
604	N	32.7	Very low	37.7	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	69%	0.693	S	S	*	*			trans	80.2	158.3	-174.2	-53.1	-56.7	0	0	0	117.6
605	I	35.3	Very low	38.1	Very low	144 Å²	144	133.4 Å²	133.4	74%	0.738	69%	0.691	S	S	*	*			trans	79.2	60.9	-177.3	-41.8	177.8	0	0	0	114.6	L608	I605-L608 HydrophobicContact CG2-CD1 3.97Å
606	S	31	Very low	38.5	Very low	121 Å²	121	135.1 Å²	135.1	85%	0.846	70%	0.695	S	S	*	*			trans	-95.9	70.2	159.8	58.1	0	0	0	0	111.7
607	S	34.4	Very low	38.7	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	69%	0.691	S	S	*	*			trans	176.9	95.1	161.5	54	0	0	0	0	111.5
608	L	39.3	Very low	39.1	Very low	135 Å²	135	133.3 Å²	133.3	71%	0.707	68%	0.68	S	S	*	*			trans	-155.3	153.9	160.2	-91.1	129.8	0	0	0	109.4	I605 E612	I605-L608 HydrophobicContact CG2-CD1 3.97Å; L608-E612 WeakPolarHBondContact CD2-OE2 2.97Å
609	N	42	Very low	39.4	Very low	107 Å²	107	138 Å²	138	57%	0.572	68%	0.684	S	S	*	*			trans	-88.4	152.2	-146.5	-152	-8.1	0	0	0	113.6	Q611 E612 K613	N609-Q611 PolarHBondContact O-N 3.26Å; N609-Q611 VanDerWaalsContact O-N 3.1Å; N609-E612 PolarHBondContact O-N 2.9Å; N609-K613 PolarHBondContact O-N 3.09Å
610	E	41.9	Very low	39.5	Very low	141 Å²	141	135.4 Å²	135.4	66%	0.659	67%	0.665	S	S	*	*	H	α-helix	trans	-58.6	-28.8	-175.9	-86	-151.6	138.9	0	0	114	K613 K614	E610-K613 PolarHBondContact O-N 3.49Å; E610-K614 PolarHBondContact O-N 3.08Å; E610-K614 VanDerWaalsContact O-N 3.13Å
611	Q	42.4	Very low	39.6	Very low	148 Å²	148	129.5 Å²	129.5	69%	0.692	65%	0.65	S	S	*	*	H	α-helix	trans	-65	-38.5	176.9	-84.4	173.8	-79.9	0	0	112.6	N609 K614 E615	N609-Q611 PolarHBondContact O-N 3.26Å; N609-Q611 VanDerWaalsContact O-N 3.1Å; Q611-K614 PolarHBondContact O-N 3.34Å; Q611-E615 PolarHBondContact O-N 2.9Å
612	E	43.8	Very low	39.6	Very low	98 Å²	98	129.9 Å²	129.9	46%	0.458	65%	0.645	S	S	.	*	H	α-helix	trans	-71.4	-32.6	177.8	-72.1	177.2	122.9	0	0	112	L608 N609 K614 E615 Q616	L608-E612 WeakPolarHBondContact CD2-OE2 2.97Å; N609-E612 PolarHBondContact O-N 2.9Å; E612-K614 VanDerWaalsContact C-N 3.33Å; E612-E615 PolarHBondContact O-N 3.11Å; E612-Q616 WeakPolarHBondContact O-CB 3.34Å; E612-Q616 PolarHBondContact O-N 2.83Å
613	K	41.6	Very low	39.5	Very low	147 Å²	147	126.4 Å²	126.4	64%	0.639	63%	0.632	S	S	*	*	H	α-helix	trans	-60.3	-43.1	168.3	-94.8	-179.2	176.1	173.3	0	111.5	N609 E610 Q616 I617	N609-K613 PolarHBondContact O-N 3.09Å; E610-K613 PolarHBondContact O-N 3.49Å; K613-Q616 PolarHBondContact O-N 3.08Å; K613-I617 WeakPolarHBondContact O-CB 3.21Å; K613-I617 WeakPolarHBondContact O-CD1 3.35Å; K613-I617 WeakPolarHBondContact O-CG1 3.25Å; K613-I617 PolarHBondContact O-N 3.05Å
614	K	45.3	Very low	39.7	Very low	126 Å²	126	125 Å²	125	55%	0.548	63%	0.625	S	S	.	*	H	α-helix	trans	-65.5	-41	175.9	-73.7	174.1	-179.2	164	0	111.7	E610 Q611 E612 I617 I618	E610-K614 PolarHBondContact O-N 3.08Å; E610-K614 VanDerWaalsContact O-N 3.13Å; Q611-K614 PolarHBondContact O-N 3.34Å; E612-K614 VanDerWaalsContact C-N 3.33Å; K614-I617 PolarHBondContact O-N 3.47Å; K614-I618 WeakPolarHBondContact O-CB 3.31Å; K614-I618 WeakPolarHBondContact O-CD1 3.12Å; K614-I618 VanDerWaalsContact O-CG1 3.23Å; K614-I618 WeakPolarHBondContact O-CG1 3.43Å; K614-I618 PolarHBondContact O-N 3.5Å
615	E	49.3	Very low	39.8	Very low	122 Å²	122	124.9 Å²	124.9	57%	0.57	62%	0.624	S	S	*	*	H	α-helix	trans	-69.2	-36.8	175.4	-71	-155.9	148.3	0	0	113.6	Q611 E612 I618 R619	Q611-E615 PolarHBondContact O-N 2.9Å; E612-E615 PolarHBondContact O-N 3.11Å; E615-I618 PolarHBondContact O-N 3.02Å; E615-R619 WeakPolarHBondContact O-CB 3.23Å; E615-R619 WeakPolarHBondContact O-CG 3.25Å; E615-R619 PolarHBondContact O-N 3.25Å
616	Q	43.6	Very low	39.6	Very low	141 Å²	141	121.3 Å²	121.3	66%	0.659	61%	0.612	S	S	*	*	H	α-helix	trans	-64.7	-41.3	171.9	-87	-172.1	-19.7	0	0	111.7	E612 K613 R619 S620	E612-Q616 WeakPolarHBondContact O-CB 3.34Å; E612-Q616 PolarHBondContact O-N 2.83Å; K613-Q616 PolarHBondContact O-N 3.08Å; Q616-R619 CarbonylContact O-C 3.55Å; Q616-R619 PolarHBondContact O-N 2.79Å; Q616-S620 WeakPolarHBondContact O-CB 3.41Å; Q616-S620 PolarHBondContact O-N 3.19Å; Q616-S620 PolarHBondContact O-OG 3.35Å
617	I	43.3	Very low	39.6	Very low	92 Å²	92	124 Å²	124	47%	0.472	61%	0.608	S	S	.	*	H	α-helix	trans	-65.5	-38.7	174.9	-68.9	163.7	0	0	0	111	K613 K614 S620 N621	K613-I617 WeakPolarHBondContact O-CB 3.21Å; K613-I617 WeakPolarHBondContact O-CD1 3.35Å; K613-I617 WeakPolarHBondContact O-CG1 3.25Å; K613-I617 PolarHBondContact O-N 3.05Å; K614-I617 PolarHBondContact O-N 3.47Å; I617-S620 WeakPolarHBondContact CA-OG 3.22Å; I617-S620 PolarHBondContact O-OG 2.83Å; I617-N621 VanDerWaalsContact O-CB 3.24Å; I617-N621 WeakPolarHBondContact O-CB 3.3Å; I617-N621 PolarHBondContact O-N 2.92Å; I617-N621 PolarHBondContact O-ND2 3.4Å; I617-N621 PolarHBondContact O-OD1 3.39Å
618	I	46.8	Very low	39.3	Very low	104 Å²	104	122.5 Å²	122.5	53%	0.533	60%	0.598	S	S	.	*	H	α-helix	trans	-67.1	-37.7	174.2	-69.6	164.2	0	0	0	110.9	K614 E615 K622	K614-I618 WeakPolarHBondContact O-CB 3.31Å; K614-I618 WeakPolarHBondContact O-CD1 3.12Å; K614-I618 VanDerWaalsContact O-CG1 3.23Å; K614-I618 WeakPolarHBondContact O-CG1 3.43Å; K614-I618 PolarHBondContact O-N 3.5Å; E615-I618 PolarHBondContact O-N 3.02Å; I618-K622 WeakPolarHBondContact O-CB 3.39Å; I618-K622 PolarHBondContact O-N 2.81Å
619	R	42.5	Very low	38.8	Very low	186 Å²	186	120.3 Å²	120.3	70%	0.702	59%	0.592	S	S	*	*	H	α-helix	trans	-70	-41.5	174.5	-79.5	-175.6	-179.8	176.5	4	112.5	E615 Q616 K622 L623	E615-R619 WeakPolarHBondContact O-CB 3.23Å; E615-R619 WeakPolarHBondContact O-CG 3.25Å; E615-R619 PolarHBondContact O-N 3.25Å; Q616-R619 CarbonylContact O-C 3.55Å; Q616-R619 PolarHBondContact O-N 2.79Å; R619-K622 PolarHBondContact O-N 3.2Å; R619-L623 VanDerWaalsContact O-CB 3.32Å; R619-L623 WeakPolarHBondContact O-CB 3.39Å; R619-L623 PolarHBondContact O-N 3.41Å
620	S	37	Very low	38.3	Very low	53 Å²	53	124.2 Å²	124.2	37%	0.371	60%	0.604	S	S	.	*	H	α-helix	trans	-64.8	-45	175.9	64	0	0	0	0	110.6	Q616 I617 K622 L623 E624	Q616-S620 WeakPolarHBondContact O-CB 3.41Å; Q616-S620 PolarHBondContact O-N 3.19Å; Q616-S620 PolarHBondContact O-OG 3.35Å; I617-S620 WeakPolarHBondContact CA-OG 3.22Å; I617-S620 PolarHBondContact O-OG 2.83Å; S620-K622 VanDerWaalsContact C-N 3.32Å; S620-K622 PolarHBondContact O-N 2.91Å; S620-L623 CarbonylContact O-C 3.59Å; S620-L623 PolarHBondContact O-N 3.12Å; S620-E624 PolarHBondContact O-N 3.39Å
621	N	36.2	Very low	38	Very low	94 Å²	94	126.3 Å²	126.3	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-64.3	-35.9	175.8	-66.7	-3	0	0	0	111.4	I617 L625	I617-N621 VanDerWaalsContact O-CB 3.24Å; I617-N621 WeakPolarHBondContact O-CB 3.3Å; I617-N621 PolarHBondContact O-N 2.92Å; I617-N621 PolarHBondContact O-ND2 3.4Å; I617-N621 PolarHBondContact O-OD1 3.39Å; N621-L625 VanDerWaalsContact O-CB 3.25Å; N621-L625 WeakPolarHBondContact O-CB 2.96Å; N621-L625 PolarHBondContact O-N 3.43Å
622	K	35.6	Very low	37.4	Very low	155 Å²	155	124.5 Å²	124.5	67%	0.674	61%	0.606	S	S	*	*	H	α-helix	trans	-67	-33.3	169.8	-100.6	-177.6	172.6	177.1	0	113.4	I618 R619 S620 S626	I618-K622 WeakPolarHBondContact O-CB 3.39Å; I618-K622 PolarHBondContact O-N 2.81Å; R619-K622 PolarHBondContact O-N 3.2Å; S620-K622 VanDerWaalsContact C-N 3.32Å; S620-K622 PolarHBondContact O-N 2.91Å; K622-S626 VanDerWaalsContact O-CB 3.29Å; K622-S626 WeakPolarHBondContact O-CB 3.47Å; K622-S626 PolarHBondContact O-N 2.97Å; K622-S626 PolarHBondContact O-OG 3.37Å
623	L	34.4	Very low	36.8	Very low	108 Å²	108	127.3 Å²	127.3	57%	0.565	62%	0.624	S	S	*	*	H	α-helix	trans	-80.2	-29.9	-178.1	-154.5	76.3	0	0	0	112.6	R619 S620 S626 K627	R619-L623 VanDerWaalsContact O-CB 3.32Å; R619-L623 WeakPolarHBondContact O-CB 3.39Å; R619-L623 PolarHBondContact O-N 3.41Å; S620-L623 CarbonylContact O-C 3.59Å; S620-L623 PolarHBondContact O-N 3.12Å; L623-S626 WeakPolarHBondContact CA-OG 3.23Å; L623-S626 PolarHBondContact O-OG 2.93Å; L623-K627 PolarHBondContact O-N 2.97Å
624	E	35.1	Very low	36.4	Very low	148 Å²	148	126.9 Å²	126.9	69%	0.692	62%	0.624	S	S	*	*	H	α-helix	trans	-73.5	-41.2	168.3	-68.6	-166.2	151.1	0	0	111	S620 S626 K627	S620-E624 PolarHBondContact O-N 3.39Å; E624-S626 VanDerWaalsContact C-N 3.26Å; E624-S626 PolarHBondContact O-N 3.35Å; E624-K627 PolarHBondContact O-N 3.24Å
625	L	34.4	Very low	35.9	Very low	148 Å²	148	129.7 Å²	129.7	78%	0.775	65%	0.646	S	S	*	*	H	α-helix	trans	-64.8	-29.5	172.4	-148.9	75	0	0	0	112.4	N621 K627	N621-L625 VanDerWaalsContact O-CB 3.25Å; N621-L625 WeakPolarHBondContact O-CB 2.96Å; N621-L625 PolarHBondContact O-N 3.43Å; L625-K627 VanDerWaalsContact C-N 3.34Å
626	S	30.7	Very low	35.8	Very low	70 Å²	70	131.4 Å²	131.4	49%	0.49	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-3.2	176.5	79.1	0	0	0	0	114.8	K622 L623 E624 P629	K622-S626 VanDerWaalsContact O-CB 3.29Å; K622-S626 WeakPolarHBondContact O-CB 3.47Å; K622-S626 PolarHBondContact O-N 2.97Å; K622-S626 PolarHBondContact O-OG 3.37Å; L623-S626 WeakPolarHBondContact CA-OG 3.23Å; L623-S626 PolarHBondContact O-OG 2.93Å; E624-S626 VanDerWaalsContact C-N 3.26Å; E624-S626 PolarHBondContact O-N 3.35Å; S626-P629 WeakPolarHBondContact O-CD 3.28Å
627	K	30.9	Very low	36.5	Very low	176 Å²	176	133 Å²	133	77%	0.765	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	2.7	173.2	-81.6	-179.9	178.6	176.6	0	114	L623 E624 L625 P629	L623-K627 PolarHBondContact O-N 2.97Å; E624-K627 PolarHBondContact O-N 3.24Å; L625-K627 VanDerWaalsContact C-N 3.34Å; K627-P629 WeakPolarHBondContact O-CD 3.47Å
628	S	29.2	Very low	37.7	Very low	73 Å²	73	131 Å²	131	51%	0.51	64%	0.638	S	S	.	*			trans	-110.7	44.7	173.1	-157.5	0	0	0	0	117.2
629	P	28.6	Very low	39.1	Very low	89 Å²	89	129.4 Å²	129.4	58%	0.578	63%	0.633	S	S	*	*			trans	-89.2	4.9	170.4	36.2	-34	0	0	0	113.8	S626 K627	S626-P629 WeakPolarHBondContact O-CD 3.28Å; K627-P629 WeakPolarHBondContact O-CD 3.47Å
630	K	31.7	Very low	40.7	Very low	190 Å²	190	123.7 Å²	123.7	83%	0.826	62%	0.619	S	S	*	*	S	Bend	trans	-85.9	-9.1	-177.7	-87.6	-172.5	175.3	179.4	0	115.7
631	Y	35.7	Very low	42.5	Very low	185 Å²	185	124.1 Å²	124.1	73%	0.725	62%	0.615	S	S	*	*	S	Bend	trans	-122.9	-2.2	-177.5	-69.7	-78.6	0	0	0	114.8
632	T	30.5	Very low	44.6	Very low	110 Å²	110	122 Å²	122	68%	0.675	60%	0.603	S	S	*	*	S	Bend	trans	-90.3	5.1	-173.1	41.5	0	0	0	0	114.9
633	N	30.6	Very low	46.7	Very low	157 Å²	157	114.7 Å²	114.7	84%	0.84	57%	0.571	S	S	*	*	S	Bend	trans	-139.7	33.4	-171.4	-134.5	-7.8	0	0	0	115.2
634	Q	32.6	Very low	48.8	Very low	137 Å²	137	112 Å²	112	64%	0.64	56%	0.556	S	S	*	*			trans	-133.9	111.4	169.9	-72.6	-169.4	2.9	0	0	112.5	K636	Q634-K636 HydrophobicContact CB-CB 4.18Å; Q634-K636 PolarHBondContact O-N 2.74Å
635	N	35.6	Very low	50.8	Low	186 Å²	186	108 Å²	108	100%	0.995	54%	0.537	S	S	*	.			trans	-69.2	37.2	159.9	-78.2	-29.8	0	0	0	112.1
636	K	46.8	Very low	53	Low	157 Å²	157	104.2 Å²	104.2	68%	0.683	52%	0.518	S	S	*	.	S	Bend	trans	-99.8	123.5	176.4	-81	-178.7	173.3	173	0	109.5	Q634 R638	Q634-K636 HydrophobicContact CB-CB 4.18Å; Q634-K636 PolarHBondContact O-N 2.74Å; K636-R638 PolarHBondContact O-N 2.91Å; K636-R638 VanDerWaalsContact O-N 3.08Å
637	R	58.7	Low	55.4	Low	175 Å²	175	100.9 Å²	100.9	66%	0.66	50%	0.495	S	S	*	.			trans	-33.1	108	169.9	-174.9	-173.9	-174.2	-166.5	1.1	112.5	H437 T639	H437-R637 WeakPolarHBondContact NE2-CA 3.47Å; H437-R637 WeakPolarHBondContact NE2-CG 3.43Å; R637-T639 PolarHBondContact O-N 3.38Å
638	R	68.7	Low	57.6	Low	51 Å²	51	93.7 Å²	93.7	19%	0.192	46%	0.464	C	S	.	.			trans	-55	124.6	175.3	170.7	-168.8	95.1	-152.9	-5.7	110.1	K357 H437 D523 I525 K636 I642 S643	K357-R638 PolarHBondContact NZ-O 3.29Å; H437-R638 PolarHBondContact CE1-N 3.46Å; H437-R638 VanDerWaalsContact CE1-N 3.32Å; H437-R638 PolarHBondContact CE1-O 3.03Å; H437-R638 PolarHBondContact NE2-N 3.15Å; D523-R638 IonicContact OD1-CZ 3.41Å; D523-R638 IonicContact OD1-NH1 2.77Å; D523-R638 PolarHBondContact OD1-NH1 2.94Å; D523-R638 IonicContact OD1-NH2 3.34Å; D523-R638 PolarHBondContact OD1-NH2 3.01Å; D523-R638 IonicContact OD2-CZ 3.63Å; D523-R638 IonicContact OD2-NH1 3.18Å; D523-R638 PolarHBondContact OD2-NH1 3.23Å; D523-R638 IonicContact OD2-NH2 3Å; D523-R638 PolarHBondContact OD2-NH2 3.05Å; I525-R638 VanDerWaalsContact CD1-NH1 3.28Å; K636-R638 PolarHBondContact O-N 2.91Å; K636-R638 VanDerWaalsContact O-N 3.08Å; R638-I642 HydrophobicContact CG-CB 3.82Å; R638-I642 HydrophobicContact CG-CG2 3.68Å; R638-S643 PolarHBondContact NE-OG 3.4Å; R638-S643 PolarHBondContact NH2-OG 2.9Å; R638-S643 VanDerWaalsContact NH2-OG 3.09Å
639	T	76.7	Confident	59.9	Low	70 Å²	70	96.5 Å²	96.5	43%	0.429	46%	0.464	S	S	.	.			trans	-67.9	162	-177.4	63.1	0	0	0	0	110.8	R637 H641 I642 S643	R637-T639 PolarHBondContact O-N 3.38Å; T639-H641 PolarHBondContact O-N 3.32Å; T639-I642 HydrophobicContact CG2-CD1 4.44Å; T639-I642 PolarHBondContact O-N 2.85Å; T639-I642 WeakPolarHBondContact OG1-CD1 3.25Å; T639-I642 VanDerWaalsContact OG1-CG1 3.3Å; T639-I642 WeakPolarHBondContact OG1-CG1 3.41Å; T639-I642 PolarHBondContact OG1-N 3.02Å; T639-S643 PolarHBondContact O-N 2.85Å; T639-S643 VanDerWaalsContact O-N 3.13Å; T639-S643 PolarHBondContact O-OG 3.45Å
640	T	75.9	Confident	62.3	Low	66 Å²	66	97.6 Å²	97.6	41%	0.405	46%	0.456	S	S	.	.	H	α-helix	trans	-56.3	-40.5	172	42.5	0	0	0	0	111.3	S643 M644	T640-S643 WeakPolarHBondContact O-CB 3.3Å; T640-S643 PolarHBondContact O-N 2.83Å; T640-M644 PolarHBondContact O-N 3.25Å
641	H	74.4	Confident	64.1	Low	61 Å²	61	88.6 Å²	88.6	28%	0.282	42%	0.417	S	S	.	.	H	α-helix	trans	-54.7	-54.2	174.3	-167.9	-84.6	0	0	0	112.3	T639 S643 M644 E645	T639-H641 PolarHBondContact O-N 3.32Å; H641-S643 VanDerWaalsContact C-N 3.29Å; H641-S643 PolarHBondContact O-N 3.45Å; H641-M644 WeakPolarHBondContact O-CA 3.44Å; H641-M644 WeakPolarHBondContact O-CB 3.48Å; H641-M644 PolarHBondContact O-N 3.06Å; H641-E645 IonicContact CE1-OE1 2.9Å; H641-E645 PolarHBondContact CE1-OE1 2.96Å; H641-E645 VanDerWaalsContact CE1-OE1 3.22Å; H641-E645 IonicContact CE1-OE2 3.75Å; H641-E645 PolarHBondContact CE1-OE2 3.35Å; H641-E645 IonicContact CG-OE2 2.66Å; H641-E645 IonicContact ND1-OE1 2.71Å; H641-E645 IonicContact ND1-OE2 2.78Å; H641-E645 PolarHBondContact ND1-OE2 3.09Å; H641-E645 PolarHBondContact O-N 3.4Å
642	I	80.6	Confident	65.9	Low	51 Å²	51	82 Å²	82	26%	0.262	40%	0.395	S	S	.	.	H	α-helix	trans	-63.9	-35.1	-179.3	-61.2	162.7	0	0	0	111.2	R638 T639 M644 L646	R638-I642 HydrophobicContact CG-CB 3.82Å; R638-I642 HydrophobicContact CG-CG2 3.68Å; T639-I642 HydrophobicContact CG2-CD1 4.44Å; T639-I642 PolarHBondContact O-N 2.85Å; T639-I642 WeakPolarHBondContact OG1-CD1 3.25Å; T639-I642 VanDerWaalsContact OG1-CG1 3.3Å; T639-I642 WeakPolarHBondContact OG1-CG1 3.41Å; T639-I642 PolarHBondContact OG1-N 3.02Å; I642-M644 VanDerWaalsContact C-N 3.33Å; I642-M644 PolarHBondContact O-N 3.17Å; I642-L646 HydrophobicContact CG2-CD1 3.87Å; I642-L646 HydrophobicContact CG2-CG 4.3Å; I642-L646 WeakPolarHBondContact O-CB 3.38Å; I642-L646 WeakPolarHBondContact O-CD1 3.41Å; I642-L646 VanDerWaalsContact O-CG 3.24Å; I642-L646 WeakPolarHBondContact O-CG 3.28Å; I642-L646 PolarHBondContact O-N 3Å
643	S	79.9	Confident	67.9	Low	0 Å²	0	79.1 Å²	79.1	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-39.6	172.2	-60.1	0	0	0	0	112.6	E524 R638 T639 T640 H641 A647	E524-S643 VanDerWaalsContact OE2-CB 3.24Å; E524-S643 WeakPolarHBondContact OE2-CB 3.48Å; E524-S643 PolarHBondContact OE2-OG 3.46Å; R638-S643 PolarHBondContact NE-OG 3.4Å; R638-S643 PolarHBondContact NH2-OG 2.9Å; R638-S643 VanDerWaalsContact NH2-OG 3.09Å; T639-S643 PolarHBondContact O-N 2.85Å; T639-S643 VanDerWaalsContact O-N 3.13Å; T639-S643 PolarHBondContact O-OG 3.45Å; T640-S643 WeakPolarHBondContact O-CB 3.3Å; T640-S643 PolarHBondContact O-N 2.83Å; H641-S643 VanDerWaalsContact C-N 3.29Å; H641-S643 PolarHBondContact O-N 3.45Å; S643-A647 WeakPolarHBondContact O-CB 3.25Å; S643-A647 PolarHBondContact O-N 3.06Å; S643-A647 VanDerWaalsContact O-N 3.1Å
644	M	77.4	Confident	69.6	Low	53 Å²	53	73.1 Å²	73.1	26%	0.261	35%	0.353	S	S	.	.	H	α-helix	trans	-72.9	-41.6	179.1	179.8	174.9	167.3	0	0	111.9	Y528 W547 T640 H641 I642 A647 Q648	Y528-M644 HydrophobicContact CD1-CB 4.3Å; Y528-M644 HydrophobicContact CD1-CG 4.37Å; Y528-M644 HydrophobicContact CD2-CB 4.16Å; Y528-M644 HydrophobicContact CE1-CB 4.41Å; Y528-M644 HydrophobicContact CE2-CB 4.25Å; Y528-M644 HydrophobicContact CG-CB 4.2Å; W547-M644 HydrophobicContact CZ2-CE 4.37Å; T640-M644 PolarHBondContact O-N 3.25Å; H641-M644 WeakPolarHBondContact O-CA 3.44Å; H641-M644 WeakPolarHBondContact O-CB 3.48Å; H641-M644 PolarHBondContact O-N 3.06Å; I642-M644 VanDerWaalsContact C-N 3.33Å; I642-M644 PolarHBondContact O-N 3.17Å; M644-A647 WeakPolarHBondContact O-CB 3.34Å; M644-A647 PolarHBondContact O-N 3.47Å; M644-Q648 PolarHBondContact O-N 3.18Å
645	E	77.9	Confident	71.1	Confident	62 Å²	62	68 Å²	68	29%	0.29	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-48.8	173.4	-70.6	174.5	119.9	0	0	111.1	H641 A647 Q648 Y649	H641-E645 IonicContact CE1-OE1 2.9Å; H641-E645 PolarHBondContact CE1-OE1 2.96Å; H641-E645 VanDerWaalsContact CE1-OE1 3.22Å; H641-E645 IonicContact CE1-OE2 3.75Å; H641-E645 PolarHBondContact CE1-OE2 3.35Å; H641-E645 IonicContact CG-OE2 2.66Å; H641-E645 IonicContact ND1-OE1 2.71Å; H641-E645 IonicContact ND1-OE2 2.78Å; H641-E645 PolarHBondContact ND1-OE2 3.09Å; H641-E645 PolarHBondContact O-N 3.4Å; E645-A647 VanDerWaalsContact C-N 3.27Å; E645-A647 PolarHBondContact O-N 3.44Å; E645-Q648 WeakPolarHBondContact O-CB 3.41Å; E645-Q648 PolarHBondContact O-N 3.47Å; E645-Y649 HydrophobicContact CB-CE2 4.25Å; E645-Y649 WeakPolarHBondContact O-CD2 3.48Å; E645-Y649 PolarHBondContact O-N 2.83Å
646	L	80.4	Confident	72.6	Confident	70 Å²	70	65.9 Å²	65.9	37%	0.366	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-34.9	177	-73	169.5	0	0	0	112.7	I525 I642 R650	I525-L646 HydrophobicContact CD1-CB 3.76Å; I525-L646 HydrophobicContact CD1-CD1 3.72Å; I525-L646 HydrophobicContact CD1-CG 4.39Å; I525-L646 HydrophobicContact CG1-CB 4.07Å; I525-L646 HydrophobicContact CG2-CB 4.5Å; I642-L646 HydrophobicContact CG2-CD1 3.87Å; I642-L646 HydrophobicContact CG2-CG 4.3Å; I642-L646 WeakPolarHBondContact O-CB 3.38Å; I642-L646 WeakPolarHBondContact O-CD1 3.41Å; I642-L646 VanDerWaalsContact O-CG 3.24Å; I642-L646 WeakPolarHBondContact O-CG 3.28Å; I642-L646 PolarHBondContact O-N 3Å; L646-R650 WeakPolarHBondContact O-CG 3.34Å; L646-R650 PolarHBondContact O-N 3.19Å; L646-R650 VanDerWaalsContact O-N 3.09Å
647	A	79.8	Confident	73.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-42.3	172.2	0	0	0	0	0	112	I525 Y528 E529 L532 S643 M644 E645 Y649 R650 V651	I525-A647 HydrophobicContact CG2-CB 4.01Å; Y528-A647 VanDerWaalsContact CB-CB 3.41Å; E529-A647 HydrophobicContact CB-CB 4.16Å; L532-A647 HydrophobicContact CD1-CB 3.9Å; S643-A647 WeakPolarHBondContact O-CB 3.25Å; S643-A647 PolarHBondContact O-N 3.06Å; S643-A647 VanDerWaalsContact O-N 3.1Å; M644-A647 WeakPolarHBondContact O-CB 3.34Å; M644-A647 PolarHBondContact O-N 3.47Å; E645-A647 VanDerWaalsContact C-N 3.27Å; E645-A647 PolarHBondContact O-N 3.44Å; A647-Y649 PolarHBondContact O-N 3.06Å; A647-R650 PolarHBondContact O-N 2.64Å; A647-V651 WeakPolarHBondContact O-CG2 3.39Å; A647-V651 PolarHBondContact O-N 3.45Å
648	Q	77.7	Confident	73	Confident	25 Å²	25	60 Å²	60	12%	0.117	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-40.7	175.9	-168.9	175.9	-8.1	0	0	111.7	L532 L540 M644 E645 R650 V651 N652	L532-Q648 HydrophobicContact CD1-CB 3.83Å; L540-Q648 HydrophobicContact CD2-CG 4.37Å; M644-Q648 PolarHBondContact O-N 3.18Å; E645-Q648 WeakPolarHBondContact O-CB 3.41Å; E645-Q648 PolarHBondContact O-N 3.47Å; Q648-R650 PolarHBondContact O-N 3.37Å; Q648-V651 PolarHBondContact O-N 3.17Å; Q648-N652 VanDerWaalsContact O-CB 3.28Å; Q648-N652 WeakPolarHBondContact O-CB 3.37Å; Q648-N652 PolarHBondContact O-N 3.47Å; Q648-N652 PolarHBondContact O-OD1 2.91Å
649	Y	77.6	Confident	72.7	Confident	132 Å²	132	64 Å²	64	52%	0.518	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-43.2	172.5	-72.5	-63.5	0	0	0	112.3	F543 E645 A647 A653	F543-Y649 HydrophobicContact CE2-CE1 4.24Å; E645-Y649 HydrophobicContact CB-CE2 4.25Å; E645-Y649 WeakPolarHBondContact O-CD2 3.48Å; E645-Y649 PolarHBondContact O-N 2.83Å; A647-Y649 PolarHBondContact O-N 3.06Å; Y649-A653 VanDerWaalsContact O-CB 3.3Å; Y649-A653 WeakPolarHBondContact O-CB 3.05Å; Y649-A653 PolarHBondContact O-N 3.31Å
650	R	78.2	Confident	72.2	Confident	111 Å²	111	64.8 Å²	64.8	42%	0.419	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-44.7	176.5	-74.3	-176.8	-175.6	179.1	1.8	113.2	E529 L646 A647 Q648 A653 S654	E529-R650 HydrophobicContact CG-CB 4.25Å; E529-R650 WeakPolarHBondContact OE2-CD 3.19Å; E529-R650 IonicContact OE2-NH1 3.44Å; E529-R650 PolarHBondContact OE2-NH1 2.98Å; L646-R650 WeakPolarHBondContact O-CG 3.34Å; L646-R650 PolarHBondContact O-N 3.19Å; L646-R650 VanDerWaalsContact O-N 3.09Å; A647-R650 PolarHBondContact O-N 2.64Å; Q648-R650 PolarHBondContact O-N 3.37Å; R650-A653 PolarHBondContact O-N 3.06Å; R650-S654 PolarHBondContact O-N 3.49Å; R650-S654 PolarHBondContact O-OG 2.92Å
651	V	70	Confident	71.4	Confident	1 Å²	1	64 Å²	64	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-50.8	177.4	173.8	0	0	0	0	110.1	E529 L532 R533 A647 Q648 A653 S654 E655	E529-V651 HydrophobicContact CB-CG2 4.4Å; E529-V651 HydrophobicContact CG-CG2 3.74Å; L532-V651 HydrophobicContact CB-CG2 3.94Å; R533-V651 HydrophobicContact CG-CG1 4.07Å; R533-V651 HydrophobicContact CG-CG2 3.88Å; A647-V651 WeakPolarHBondContact O-CG2 3.39Å; A647-V651 PolarHBondContact O-N 3.45Å; Q648-V651 PolarHBondContact O-N 3.17Å; V651-A653 VanDerWaalsContact C-N 3.31Å; V651-A653 PolarHBondContact O-N 3.43Å; V651-S654 PolarHBondContact O-N 2.85Å; V651-S654 VanDerWaalsContact O-N 3.16Å; V651-S654 PolarHBondContact O-OG 3.46Å; V651-E655 PolarHBondContact O-N 2.8Å
652	N	73.2	Confident	70.8	Confident	46 Å²	46	64.6 Å²	64.6	25%	0.246	32%	0.317	C	S	.	.	H	α-helix	trans	-59.4	-38.2	178.2	-71.1	-2.6	0	0	0	112.8	Q648 M656	Q648-N652 VanDerWaalsContact O-CB 3.28Å; Q648-N652 WeakPolarHBondContact O-CB 3.37Å; Q648-N652 PolarHBondContact O-N 3.47Å; Q648-N652 PolarHBondContact O-OD1 2.91Å; N652-M656 WeakPolarHBondContact O-CB 3.32Å; N652-M656 PolarHBondContact O-N 2.87Å
653	A	73.3	Confident	69.9	Low	51 Å²	51	67.2 Å²	67.2	42%	0.421	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-49.7	174.4	0	0	0	0	0	111.4	Y649 R650 V651 E655 M656 E657	Y649-A653 VanDerWaalsContact O-CB 3.3Å; Y649-A653 WeakPolarHBondContact O-CB 3.05Å; Y649-A653 PolarHBondContact O-N 3.31Å; R650-A653 PolarHBondContact O-N 3.06Å; V651-A653 VanDerWaalsContact C-N 3.31Å; V651-A653 PolarHBondContact O-N 3.43Å; A653-E655 VanDerWaalsContact C-N 3.32Å; A653-E655 PolarHBondContact O-N 3.49Å; A653-M656 PolarHBondContact O-N 3.25Å; A653-M656 VanDerWaalsContact O-N 3.1Å; A653-E657 PolarHBondContact O-N 3.33Å
654	S	66.1	Low	69.3	Low	31 Å²	31	73.7 Å²	73.7	22%	0.217	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-34.7	177.5	63.7	0	0	0	0	113.2	R533 R650 V651 H658	R533-S654 PolarHBondContact NH2-OG 2.97Å; R650-S654 PolarHBondContact O-N 3.49Å; R650-S654 PolarHBondContact O-OG 2.92Å; V651-S654 PolarHBondContact O-N 2.85Å; V651-S654 VanDerWaalsContact O-N 3.16Å; V651-S654 PolarHBondContact O-OG 3.46Å; S654-H658 PolarHBondContact O-N 3.04Å
655	E	64.3	Low	68.2	Low	30 Å²	30	76.9 Å²	76.9	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-65.8	-41.8	170.8	-82.7	-164	-143.7	0	0	112.1	H537 V651 A653 E657 H658 R659	H537-E655 IonicContact CE1-OE1 3.18Å; H537-E655 PolarHBondContact CE1-OE1 3.48Å; H537-E655 VanDerWaalsContact CE1-OE1 3.25Å; H537-E655 IonicContact CE1-OE2 3.71Å; H537-E655 IonicContact ND1-OE1 3.97Å; H537-E655 PolarHBondContact ND1-OE1 3Å; H537-E655 IonicContact ND1-OE2 3.25Å; V651-E655 PolarHBondContact O-N 2.8Å; A653-E655 VanDerWaalsContact C-N 3.32Å; A653-E655 PolarHBondContact O-N 3.49Å; E655-E657 VanDerWaalsContact C-N 3.34Å; E655-H658 WeakPolarHBondContact O-CB 3.4Å; E655-H658 PolarHBondContact O-N 3.46Å; E655-R659 WeakPolarHBondContact O-CG 3.44Å; E655-R659 PolarHBondContact O-N 3.36Å; E655-R659 IonicContact OE2-CZ 3.78Å; E655-R659 IonicContact OE2-NE 3.91Å; E655-R659 IonicContact OE2-NH2 2.88Å; E655-R659 PolarHBondContact OE2-NH2 3.3Å
656	M	65.9	Low	67.7	Low	141 Å²	141	78.7 Å²	78.7	70%	0.695	38%	0.381	S	S	*	.	H	α-helix	trans	-65.4	-39	179.2	-175.9	173.4	176.8	0	0	111.4	N652 A653 R659 L660	N652-M656 WeakPolarHBondContact O-CB 3.32Å; N652-M656 PolarHBondContact O-N 2.87Å; A653-M656 PolarHBondContact O-N 3.25Å; A653-M656 VanDerWaalsContact O-N 3.1Å; M656-R659 PolarHBondContact O-N 3.39Å; M656-L660 VanDerWaalsContact O-CB 3.29Å; M656-L660 WeakPolarHBondContact O-CB 3.49Å; M656-L660 PolarHBondContact O-N 3.5Å
657	E	61.8	Low	66.9	Low	127 Å²	127	83.2 Å²	83.2	59%	0.593	40%	0.398	S	S	*	.	H	α-helix	trans	-63	-42.8	172.1	-71	-176.3	163.3	0	0	111.9	A653 E655 L660 A661	A653-E657 PolarHBondContact O-N 3.33Å; E655-E657 VanDerWaalsContact C-N 3.34Å; E657-L660 PolarHBondContact O-N 3.43Å; E657-A661 WeakPolarHBondContact O-CB 3.18Å; E657-A661 PolarHBondContact O-N 3.06Å
658	H	53.3	Low	65.7	Low	81 Å²	81	91.9 Å²	91.9	38%	0.375	43%	0.432	S	S	.	.	H	α-helix	trans	-60.6	-46.9	174.2	-165.3	-79.9	0	0	0	111.9	S654 E655 L660 A661 E662	S654-H658 PolarHBondContact O-N 3.04Å; E655-H658 WeakPolarHBondContact O-CB 3.4Å; E655-H658 PolarHBondContact O-N 3.46Å; H658-L660 VanDerWaalsContact C-N 3.33Å; H658-L660 PolarHBondContact O-N 3.08Å; H658-A661 PolarHBondContact O-N 3.02Å; H658-E662 IonicContact CE1-OE1 2.88Å; H658-E662 PolarHBondContact CE1-OE1 3.42Å; H658-E662 VanDerWaalsContact CE1-OE1 3.28Å; H658-E662 IonicContact ND1-OE1 3.8Å; H658-E662 PolarHBondContact ND1-OE1 3.18Å; H658-E662 PolarHBondContact O-N 2.93Å
659	R	62.5	Low	64.6	Low	135 Å²	135	95.5 Å²	95.5	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-64.3	-36.3	176.9	-68.7	-179.7	-162.9	-163.1	9.9	112.1	E655 M656 M663	E655-R659 WeakPolarHBondContact O-CG 3.44Å; E655-R659 PolarHBondContact O-N 3.36Å; E655-R659 IonicContact OE2-CZ 3.78Å; E655-R659 IonicContact OE2-NE 3.91Å; E655-R659 IonicContact OE2-NH2 2.88Å; E655-R659 PolarHBondContact OE2-NH2 3.3Å; M656-R659 PolarHBondContact O-N 3.39Å; R659-M663 HydrophobicContact CB-CE 4.12Å; R659-M663 WeakPolarHBondContact O-CB 3.5Å; R659-M663 WeakPolarHBondContact O-CE 3.29Å; R659-M663 VanDerWaalsContact O-CG 3.32Å; R659-M663 WeakPolarHBondContact O-CG 3.32Å; R659-M663 PolarHBondContact O-N 3.03Å
660	L	66.1	Low	63.7	Low	86 Å²	86	97.8 Å²	97.8	45%	0.45	46%	0.455	S	S	.	.	H	α-helix	trans	-69.1	-39.3	175.1	-174.4	66.9	0	0	0	111.5	M656 E657 H658 M663 K664	M656-L660 VanDerWaalsContact O-CB 3.29Å; M656-L660 WeakPolarHBondContact O-CB 3.49Å; M656-L660 PolarHBondContact O-N 3.5Å; E657-L660 PolarHBondContact O-N 3.43Å; H658-L660 VanDerWaalsContact C-N 3.33Å; H658-L660 PolarHBondContact O-N 3.08Å; L660-M663 PolarHBondContact O-N 3.01Å; L660-K664 WeakPolarHBondContact O-CB 3.49Å; L660-K664 WeakPolarHBondContact O-CG 3.19Å; L660-K664 PolarHBondContact O-N 3.36Å
661	A	58.6	Low	62.5	Low	51 Å²	51	94.3 Å²	94.3	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-46.6	173.7	0	0	0	0	0	111.2	E657 H658 M663 K664 L665	E657-A661 WeakPolarHBondContact O-CB 3.18Å; E657-A661 PolarHBondContact O-N 3.06Å; H658-A661 PolarHBondContact O-N 3.02Å; A661-M663 PolarHBondContact O-N 3.39Å; A661-K664 PolarHBondContact O-N 2.93Å; A661-L665 PolarHBondContact O-N 3.13Å
662	E	61.9	Low	61.7	Low	73 Å²	73	101.3 Å²	101.3	34%	0.341	48%	0.484	S	S	.	.	H	α-helix	trans	-57.1	-44.8	171.4	-80.7	-174.8	-136.5	0	0	112.6	H658 K664 L665 K666	H658-E662 IonicContact CE1-OE1 2.88Å; H658-E662 PolarHBondContact CE1-OE1 3.42Å; H658-E662 VanDerWaalsContact CE1-OE1 3.28Å; H658-E662 IonicContact ND1-OE1 3.8Å; H658-E662 PolarHBondContact ND1-OE1 3.18Å; H658-E662 PolarHBondContact O-N 2.93Å; E662-K664 VanDerWaalsContact C-N 3.34Å; E662-L665 PolarHBondContact O-N 3.02Å; E662-K666 WeakPolarHBondContact O-CB 3.46Å; E662-K666 WeakPolarHBondContact O-CD 3.29Å; E662-K666 VanDerWaalsContact O-CG 3.27Å; E662-K666 WeakPolarHBondContact O-CG 3.41Å; E662-K666 PolarHBondContact O-N 3.38Å; E662-K666 IonicContact OE2-NZ 2.82Å; E662-K666 PolarHBondContact OE2-NZ 3.41Å
663	M	62.8	Low	60.7	Low	106 Å²	106	102.3 Å²	102.3	52%	0.522	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-37	178.4	-80.1	-174.3	-92.4	0	0	112.1	R659 L660 A661 K667	R659-M663 HydrophobicContact CB-CE 4.12Å; R659-M663 WeakPolarHBondContact O-CB 3.5Å; R659-M663 WeakPolarHBondContact O-CE 3.29Å; R659-M663 VanDerWaalsContact O-CG 3.32Å; R659-M663 WeakPolarHBondContact O-CG 3.32Å; R659-M663 PolarHBondContact O-N 3.03Å; L660-M663 PolarHBondContact O-N 3.01Å; A661-M663 PolarHBondContact O-N 3.39Å; M663-K667 WeakPolarHBondContact O-CG 3.47Å; M663-K667 PolarHBondContact O-N 2.87Å
664	K	66.7	Low	59.8	Low	136 Å²	136	104.3 Å²	104.3	59%	0.591	49%	0.493	S	S	*	.	H	α-helix	trans	-64.8	-45.7	172.7	-75	172.7	178.5	178.7	0	111.3	L660 A661 E662 K667 Y668	L660-K664 WeakPolarHBondContact O-CB 3.49Å; L660-K664 WeakPolarHBondContact O-CG 3.19Å; L660-K664 PolarHBondContact O-N 3.36Å; A661-K664 PolarHBondContact O-N 2.93Å; E662-K664 VanDerWaalsContact C-N 3.34Å; K664-K667 PolarHBondContact O-N 3.36Å; K664-Y668 PolarHBondContact O-N 3Å
665	L	55.2	Low	59.1	Low	119 Å²	119	109.7 Å²	109.7	62%	0.623	51%	0.514	S	S	*	.	H	α-helix	trans	-59.3	-46.1	174.2	-102.2	150.3	0	0	0	112.1	A661 E662 K667 Y668 K669	A661-L665 PolarHBondContact O-N 3.13Å; E662-L665 PolarHBondContact O-N 3.02Å; L665-K667 PolarHBondContact O-N 2.94Å; L665-Y668 PolarHBondContact O-N 3.29Å; L665-K669 PolarHBondContact O-N 3.33Å
666	K	66	Low	58.6	Low	100 Å²	100	110.9 Å²	110.9	44%	0.435	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-37.1	176.8	-74.7	162.7	178.7	160.9	0	112.4	E662 R670	E662-K666 WeakPolarHBondContact O-CB 3.46Å; E662-K666 WeakPolarHBondContact O-CD 3.29Å; E662-K666 VanDerWaalsContact O-CG 3.27Å; E662-K666 WeakPolarHBondContact O-CG 3.41Å; E662-K666 PolarHBondContact O-N 3.38Å; E662-K666 IonicContact OE2-NZ 2.82Å; E662-K666 PolarHBondContact OE2-NZ 3.41Å; K666-R670 WeakPolarHBondContact O-CG 3.4Å; K666-R670 PolarHBondContact O-N 3.45Å
667	K	63.5	Low	58	Low	166 Å²	166	108.4 Å²	108.4	72%	0.722	51%	0.514	S	S	*	.	H	α-helix	trans	-68.1	-41.5	172.6	-77.8	-173.3	177.3	-170.1	0	112.3	M663 K664 L665 R670 G671	M663-K667 WeakPolarHBondContact O-CG 3.47Å; M663-K667 PolarHBondContact O-N 2.87Å; K664-K667 PolarHBondContact O-N 3.36Å; L665-K667 PolarHBondContact O-N 2.94Å; K667-R670 PolarHBondContact O-N 3.21Å; K667-G671 PolarHBondContact O-N 3.44Å
668	Y	55.7	Low	57.3	Low	182 Å²	182	107.4 Å²	107.4	71%	0.714	51%	0.513	S	S	*	.	H	α-helix	trans	-65.3	-38.7	177.3	-166.4	-95.2	0	0	0	112	K664 L665 G671 K672	K664-Y668 PolarHBondContact O-N 3Å; L665-Y668 PolarHBondContact O-N 3.29Å; Y668-G671 PolarHBondContact O-N 3.46Å; Y668-K672 PolarHBondContact O-N 3.39Å; Y668-K672 VanDerWaalsContact O-N 3.1Å
669	K	54.8	Low	57.1	Low	100 Å²	100	110.1 Å²	110.1	44%	0.435	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-52.7	174.1	-163.8	175.3	-177.5	179.9	0	111.1	K113 L665 G671 K672 D673	K113-K669 PolarHBondContact O-NZ 2.85Å; L665-K669 PolarHBondContact O-N 3.33Å; K669-G671 PolarHBondContact O-N 3.29Å; K669-K672 PolarHBondContact O-N 2.96Å; K669-D673 PolarHBondContact O-N 3.4Å
670	R	57	Low	56.4	Low	181 Å²	181	111.2 Å²	111.2	68%	0.683	54%	0.535	S	S	*	.	H	α-helix	trans	-54.8	-48.2	175.3	-69.1	-175.9	-160.4	-163.1	2.4	112.7	K666 K667 K672 D673 D674	K666-R670 WeakPolarHBondContact O-CG 3.4Å; K666-R670 PolarHBondContact O-N 3.45Å; K667-R670 PolarHBondContact O-N 3.21Å; R670-K672 PolarHBondContact O-N 3.39Å; R670-D673 PolarHBondContact O-N 3.33Å; R670-D674 VanDerWaalsContact O-CB 3.3Å; R670-D674 WeakPolarHBondContact O-CB 3.13Å; R670-D674 PolarHBondContact O-N 3.14Å
671	G	53.4	Low	55.5	Low	37 Å²	37	112.3 Å²	112.3	38%	0.381	54%	0.54	S	S	.	.	H	α-helix	trans	-61.7	-28	178.8	0	0	0	0	0	114.3	K667 Y668 K669 H675	K667-G671 PolarHBondContact O-N 3.44Å; Y668-G671 PolarHBondContact O-N 3.46Å; K669-G671 PolarHBondContact O-N 3.29Å; G671-H675 WeakPolarHBondContact O-CB 3.46Å; G671-H675 PolarHBondContact O-CD2 3.37Å; G671-H675 PolarHBondContact O-N 2.86Å
672	K	53.1	Low	55.1	Low	148 Å²	148	114.5 Å²	114.5	64%	0.643	55%	0.549	S	S	*	.	H	α-helix	trans	-81	-40	174.3	-170.2	172	-177.9	176.1	0	112.2	Y668 K669 R670 H675 S676	Y668-K672 PolarHBondContact O-N 3.39Å; Y668-K672 VanDerWaalsContact O-N 3.1Å; K669-K672 PolarHBondContact O-N 2.96Å; R670-K672 PolarHBondContact O-N 3.39Å; K672-H675 PolarHBondContact O-N 3.07Å; K672-S676 PolarHBondContact O-N 2.84Å
673	D	53.1	Low	54.4	Low	68 Å²	68	118.5 Å²	118.5	36%	0.364	57%	0.567	S	S	.	*	H	α-helix	trans	-63.6	-48.9	176.2	-60.1	-22.4	0	0	0	109.8	K669 R670 H675 S676 I677	K669-D673 PolarHBondContact O-N 3.4Å; R670-D673 PolarHBondContact O-N 3.33Å; D673-H675 VanDerWaalsContact C-N 3.33Å; D673-H675 PolarHBondContact O-N 3.41Å; D673-S676 PolarHBondContact O-N 2.93Å; D673-S676 VanDerWaalsContact O-N 3.09Å; D673-S676 PolarHBondContact O-OG 3.24Å; D673-I677 WeakPolarHBondContact O-CB 3.37Å; D673-I677 VanDerWaalsContact O-CG1 3.26Å; D673-I677 WeakPolarHBondContact O-CG1 3.3Å; D673-I677 PolarHBondContact O-N 3.13Å
674	D	54.5	Low	53.5	Low	92 Å²	92	120.7 Å²	120.7	49%	0.492	58%	0.581	S	S	.	*	H	α-helix	trans	-58.9	-38.5	176.5	-66.3	-26.3	0	0	0	112.4	R670 N678	R670-D674 VanDerWaalsContact O-CB 3.3Å; R670-D674 WeakPolarHBondContact O-CB 3.13Å; R670-D674 PolarHBondContact O-N 3.14Å; D674-N678 WeakPolarHBondContact O-CB 3.49Å; D674-N678 PolarHBondContact O-N 2.86Å
675	H	52	Low	52.3	Low	145 Å²	145	124.4 Å²	124.4	67%	0.671	59%	0.591	S	S	*	*	H	α-helix	trans	-66.9	-44.3	173.1	-101	-67.6	0	0	0	112	G671 K672 D673 I677 N678 E679	G671-H675 WeakPolarHBondContact O-CB 3.46Å; G671-H675 PolarHBondContact O-CD2 3.37Å; G671-H675 PolarHBondContact O-N 2.86Å; K672-H675 PolarHBondContact O-N 3.07Å; D673-H675 VanDerWaalsContact C-N 3.33Å; D673-H675 PolarHBondContact O-N 3.41Å; H675-I677 VanDerWaalsContact C-N 3.31Å; H675-I677 PolarHBondContact O-N 2.89Å; H675-N678 PolarHBondContact O-N 2.91Å; H675-E679 VanDerWaalsContact O-CB 3.31Å; H675-E679 WeakPolarHBondContact O-CB 3.38Å; H675-E679 PolarHBondContact O-N 3.4Å
676	S	52.8	Low	51.3	Low	54 Å²	54	127.9 Å²	127.9	38%	0.378	60%	0.601	S	S	.	*	H	α-helix	trans	-67.4	-31.4	178	78	0	0	0	0	113.3	K672 D673 K680	K672-S676 PolarHBondContact O-N 2.84Å; D673-S676 PolarHBondContact O-N 2.93Å; D673-S676 VanDerWaalsContact O-N 3.09Å; D673-S676 PolarHBondContact O-OG 3.24Å; S676-K680 WeakPolarHBondContact O-CB 3.49Å; S676-K680 WeakPolarHBondContact O-CG 3.23Å; S676-K680 PolarHBondContact O-N 3.33Å
677	I	52.6	Low	49.9	Very low	89 Å²	89	130.8 Å²	130.8	46%	0.456	62%	0.622	S	S	.	*	H	α-helix	trans	-70.5	-48.1	175.9	-71.3	166.5	0	0	0	109.4	D673 H675 E679 K680 L681	D673-I677 WeakPolarHBondContact O-CB 3.37Å; D673-I677 VanDerWaalsContact O-CG1 3.26Å; D673-I677 WeakPolarHBondContact O-CG1 3.3Å; D673-I677 PolarHBondContact O-N 3.13Å; H675-I677 VanDerWaalsContact C-N 3.31Å; H675-I677 PolarHBondContact O-N 2.89Å; I677-E679 VanDerWaalsContact C-N 3.34Å; I677-E679 PolarHBondContact O-N 3.05Å; I677-K680 PolarHBondContact O-N 3.21Å; I677-L681 HydrophobicContact CG2-CD1 3.61Å; I677-L681 WeakPolarHBondContact O-CB 3.46Å; I677-L681 WeakPolarHBondContact O-CD1 3.49Å; I677-L681 PolarHBondContact O-N 2.99Å
678	N	47.8	Very low	48.4	Very low	106 Å²	106	127.7 Å²	127.7	57%	0.567	62%	0.619	S	S	*	*	H	α-helix	trans	-62.8	-38.5	175.5	-85.7	-34.9	0	0	0	112.7	D674 H675 L681 T682	D674-N678 WeakPolarHBondContact O-CB 3.49Å; D674-N678 PolarHBondContact O-N 2.86Å; H675-N678 PolarHBondContact O-N 2.91Å; N678-L681 PolarHBondContact O-N 3.15Å; N678-T682 WeakPolarHBondContact O-CG2 3.36Å; N678-T682 PolarHBondContact O-N 3.36Å; N678-T682 PolarHBondContact O-OG1 3.23Å; N678-T682 VanDerWaalsContact O-OG1 3.12Å
679	E	49.5	Very low	47.5	Very low	139 Å²	139	127 Å²	127	65%	0.65	62%	0.622	S	S	*	*	H	α-helix	trans	-69	-34.2	178.7	-164.6	165.8	-134.6	0	0	112.4	H675 I677 T682 H683	H675-E679 VanDerWaalsContact O-CB 3.31Å; H675-E679 WeakPolarHBondContact O-CB 3.38Å; H675-E679 PolarHBondContact O-N 3.4Å; I677-E679 VanDerWaalsContact C-N 3.34Å; I677-E679 PolarHBondContact O-N 3.05Å; E679-T682 PolarHBondContact O-OG1 3.31Å; E679-T682 VanDerWaalsContact O-OG1 3.06Å; E679-H683 PolarHBondContact O-N 2.95Å
680	K	47.7	Very low	46.5	Very low	158 Å²	158	129.4 Å²	129.4	69%	0.687	63%	0.632	S	S	*	*	H	α-helix	trans	-73.1	-35	169.9	-75.9	-175	173.4	-172.1	0	113.3	S676 I677 N684	S676-K680 WeakPolarHBondContact O-CB 3.49Å; S676-K680 WeakPolarHBondContact O-CG 3.23Å; S676-K680 PolarHBondContact O-N 3.33Å; I677-K680 PolarHBondContact O-N 3.21Å; K680-N684 PolarHBondContact O-N 3.13Å
681	L	47.8	Very low	45.4	Very low	109 Å²	109	127.8 Å²	127.8	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-73.7	-26	177.3	-96.2	136.6	0	0	0	113.6	I677 N678	I677-L681 HydrophobicContact CG2-CD1 3.61Å; I677-L681 WeakPolarHBondContact O-CB 3.46Å; I677-L681 WeakPolarHBondContact O-CD1 3.49Å; I677-L681 PolarHBondContact O-N 2.99Å; N678-L681 PolarHBondContact O-N 3.15Å
682	T	48.6	Very low	44.5	Very low	97 Å²	97	130.6 Å²	130.6	60%	0.595	65%	0.652	S	S	*	*	H	α-helix	trans	-77.6	-38.1	170.7	50.7	0	0	0	0	112	N678 E679	N678-T682 WeakPolarHBondContact O-CG2 3.36Å; N678-T682 PolarHBondContact O-N 3.36Å; N678-T682 PolarHBondContact O-OG1 3.23Å; N678-T682 VanDerWaalsContact O-OG1 3.12Å; E679-T682 PolarHBondContact O-OG1 3.31Å; E679-T682 VanDerWaalsContact O-OG1 3.06Å
683	H	48.1	Very low	43.6	Very low	156 Å²	156	132.4 Å²	132.4	72%	0.722	66%	0.663	S	S	*	*	H	α-helix	trans	-71.5	-31.1	-177.3	-126.5	-50.9	0	0	0	114.2	E679 R685	E679-H683 PolarHBondContact O-N 2.95Å; H683-R685 VanDerWaalsContact C-N 3.3Å; H683-R685 PolarHBondContact O-N 2.99Å
684	N	44.4	Very low	42.7	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	14.9	-179.4	-83.8	-0.6	0	0	0	114.9	K680	K680-N684 PolarHBondContact O-N 3.13Å
685	R	41.2	Very low	41.6	Very low	215 Å²	215	135.3 Å²	135.3	81%	0.811	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	13.3	-174.9	-129.5	178.1	-167.9	-174.7	4.5	116.3	H683	H683-R685 VanDerWaalsContact C-N 3.3Å; H683-R685 PolarHBondContact O-N 2.99Å
686	F	34.4	Very low	40.5	Very low	191 Å²	191	136.3 Å²	136.3	84%	0.838	70%	0.695	S	S	*	*			trans	-141.3	87.2	179.3	-104.1	-88.6	0	0	0	112.8
687	N	35	Very low	39.6	Very low	162 Å²	162	138 Å²	138	87%	0.866	71%	0.706	S	S	*	*			trans	-166.3	115.1	136.4	-137.6	-6.8	0	0	0	112.6
688	P	33.3	Very low	38.5	Very low	101 Å²	101	139.8 Å²	139.8	66%	0.656	72%	0.722	S	S	*	*			trans	-114	111.7	169.2	34	-21.5	0	0	0	111.9
689	H	36.6	Very low	37.6	Very low	168 Å²	168	139.8 Å²	139.8	78%	0.778	73%	0.73	S	S	*	*			trans	169.1	135.7	135.9	-99.1	-65.8	0	0	0	113.6
690	K	34.1	Very low	36.7	Very low	150 Å²	150	140.2 Å²	140.2	65%	0.652	74%	0.736	S	S	*	*			trans	66.9	147.6	146.8	-68	-178	164.9	-88.9	0	118.8
691	E	34.1	Very low	35.9	Very low	147 Å²	147	136.4 Å²	136.4	69%	0.687	73%	0.729	S	S	*	*			cis	-172.6	146.4	-21.2	-117	158.5	-162	0	0	106.6
692	A	34.6	Very low	35.2	Very low	96 Å²	96	138 Å²	138	79%	0.793	74%	0.739	S	S	*	*			trans	61.8	151.5	160.7	0	0	0	0	0	119.4
693	E	32.6	Very low	34.4	Very low	186 Å²	186	138.8 Å²	138.8	87%	0.869	75%	0.748	S	S	*	*			cis	-163.3	-177.6	-29.4	-120.4	-155.1	145.8	0	0	107.7
694	P	35.2	Very low	33.7	Very low	96 Å²	96	135.6 Å²	135.6	62%	0.623	75%	0.749	S	S	*	*			trans	-122.5	-153.1	-136	43.2	-26.6	0	0	0	116.4
695	T	32	Very low	33.2	Very low	124 Å²	124	135.9 Å²	135.9	76%	0.761	75%	0.749	S	S	*	*			trans	89.4	146.9	173.2	78.1	0	0	0	0	116.1
696	M	29	Very low	32.7	Very low	166 Å²	166	129.8 Å²	129.8	82%	0.818	74%	0.74	S	S	*	*			cis	-162.3	164.5	-3.9	-133.6	-173.6	-161.9	0	0	112.3
697	S	32.3	Very low	32.6	Very low	89 Å²	89	125.6 Å²	125.6	62%	0.622	73%	0.73	S	S	*	*			trans	57.5	112.1	144.6	65.7	0	0	0	0	120.3
698	T	29.5	Very low	32.5	Very low	127 Å²	127	123.7 Å²	123.7	78%	0.779	72%	0.724	S	S	*	*				101.9	150.4	59.8	51.3	0	0	0	0	114.7
699	S	29.3	Very low	32.4	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	73%	0.729	S	S	*	*			trans	77.1	149.1	160.5	84.2	0	0	0	0	116.2
700	L	31.7	Very low	32.4	Very low	147 Å²	147	125.7 Å²	125.7	77%	0.77	72%	0.724	S	S	*	*			cis	-149.9	134.3	8.8	-99.1	125.7	0	0	0	107.6
701	S	30.8	Very low	32.2	Very low	78 Å²	78	123.9 Å²	123.9	55%	0.545	73%	0.725	S	S	.	*				84	155.1	88.3	83	0	0	0	0	118
702	D	33.6	Very low	32.1	Very low	144 Å²	144	123 Å²	123	77%	0.77	73%	0.725	S	S	*	*			trans	76.4	108.7	162.6	-48.1	-44.9	0	0	0	118.7
703	S	29.9	Very low	32	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	72%	0.721	S	S	*	*			cis	85.4	101.3	27	-157.4	0	0	0	0	116.5
704	A	34.7	Very low	32.1	Very low	90 Å²	90	121.2 Å²	121.2	74%	0.744	71%	0.712	S	S	*	*			trans	-166.5	112.9	152.6	0	0	0	0	0	108.7
705	L	32.6	Very low	32	Very low	157 Å²	157	121.9 Å²	121.9	82%	0.822	71%	0.71	S	S	*	*				62.4	139	90.9	-92.3	80	0	0	0	114.7
706	S	32.5	Very low	32.2	Very low	88 Å²	88	123.3 Å²	123.3	62%	0.615	71%	0.708	S	S	*	*			cis	-169.9	133.1	6.3	45.9	0	0	0	0	113.7
707	T	31.7	Very low	32.6	Very low	102 Å²	102	121.2 Å²	121.2	63%	0.626	70%	0.7	S	S	*	*				67.4	132.6	128.2	-43.5	0	0	0	0	118.2
708	V	33.6	Very low	32.8	Very low	123 Å²	123	125.4 Å²	125.4	75%	0.745	71%	0.71	S	S	*	*				-156.2	114.5	72.4	166.5	0	0	0	0	108.4
709	R	30.7	Very low	33.2	Very low	202 Å²	202	125.7 Å²	125.7	76%	0.762	71%	0.707	S	S	*	*				53.5	139.1	109.3	-71	-173.8	-176.8	110.3	1.7	116.3
710	T	35.3	Very low	33.7	Very low	108 Å²	108	128.4 Å²	128.4	66%	0.663	71%	0.708	S	S	*	*			cis	-156.9	128	22.5	4.9	0	0	0	0	109.2
711	T	31.2	Very low	34	Very low	112 Å²	112	127.7 Å²	127.7	69%	0.687	71%	0.705	S	S	*	*				67.6	139.8	112.9	72.1	0	0	0	0	115.3
712	D	31.8	Very low	34.3	Very low	128 Å²	128	130.8 Å²	130.8	68%	0.684	72%	0.715	S	S	*	*			cis	-146.3	124.8	31.3	-86.6	-68.6	0	0	0	110.4
713	T	32.8	Very low	34.5	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	71%	0.712	S	S	*	*				65.1	140.6	106.3	62.1	0	0	0	0	116.1
714	I	34	Very low	34.6	Very low	129 Å²	129	130.4 Å²	130.4	66%	0.662	71%	0.713	S	S	*	*			cis	-157.1	146.2	10.9	-122.1	155.4	0	0	0	109.5
715	N	32.6	Very low	34.4	Very low	110 Å²	110	130.2 Å²	130.2	59%	0.588	72%	0.719	S	S	*	*			trans	40.5	171.1	154.4	-48.8	3.8	0	0	0	121.3
716	E	37.1	Very low	34.4	Very low	154 Å²	154	126.2 Å²	126.2	72%	0.72	72%	0.716	S	S	*	*			cis	-135.6	169	-4.3	-81.3	81.8	-149.6	0	0	107.2
717	D	36.2	Very low	34.3	Very low	122 Å²	122	131 Å²	131	65%	0.652	73%	0.731	S	S	*	*			cis	-168.9	178.3	-44	-83.2	-28.5	0	0	0	109
718	E	37.8	Very low	34.3	Very low	178 Å²	178	134.7 Å²	134.7	83%	0.832	74%	0.741	S	S	*	*			trans	65.5	137.3	163.4	-68.1	168	-175	0	0	119.3
719	D	37.6	Very low	34.1	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	74%	0.738	S	S	*	*			cis	-154.1	162.4	9.2	-83.8	-35.3	0	0	0	114.3
720	E	40.2	Very low	34.2	Very low	165 Å²	165	131.4 Å²	131.4	77%	0.771	74%	0.742	S	S	*	*			trans	3.4	155.2	143.1	-63	177.5	171.7	0	0	121
721	D	37.7	Very low	34	Very low	132 Å²	132	132 Å²	132	71%	0.706	74%	0.74	S	S	*	*			cis	-164.7	160.3	2.2	-114.3	-5.4	0	0	0	114
722	D	37.3	Very low	34	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	75%	0.747	S	S	*	*			trans	7.1	160.6	139.6	-100.7	20.7	0	0	0	123.4
723	V	37.4	Very low	34.2	Very low	116 Å²	116	134 Å²	134	70%	0.703	75%	0.749	S	S	*	*			cis	-160.4	-177.3	-10.3	95.9	0	0	0	0	112.8
724	T	31.6	Very low	34	Very low	132 Å²	132	139.5 Å²	139.5	81%	0.81	76%	0.757	S	S	*	*			trans	-80.2	166	-171.2	53.1	0	0	0	0	119.6
725	G	31.8	Very low	34.1	Very low	85 Å²	85	142 Å²	142	88%	0.876	77%	0.766	S	S	*	*			trans	118.2	147.4	158.5	0	0	0	0	0	113.3
726	G	31	Very low	34	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	78%	0.778	S	S	*	*			cis	163.9	120.5	1.1	0	0	0	0	0	107.5
727	M	30.7	Very low	34	Very low	189 Å²	189	142.3 Å²	142.3	93%	0.931	78%	0.779	S	S	*	*				96.5	159.4	118.1	-162.9	157.7	175.6	0	0	114.7
728	E	32.4	Very low	33.8	Very low	179 Å²	179	141.9 Å²	141.9	84%	0.836	79%	0.785	S	S	*	*			trans	66.5	155.5	-175.1	-63.6	-176.6	133	0	0	116.4
729	C	29.5	Very low	33.9	Very low	102 Å²	102	138.9 Å²	138.9	69%	0.689	78%	0.781	S	S	*	*			cis	168.9	153.1	-39.2	-105.7	0	0	0	0	105.9
730	D	32	Very low	33.7	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	79%	0.79	S	S	*	*			trans	65.8	155	160	-54.4	-10.3	0	0	0	117.8
731	D	32.2	Very low	33.4	Very low	119 Å²	119	139.3 Å²	139.3	64%	0.636	79%	0.792	S	S	*	*			cis	-162.6	166.7	-30.7	-166.2	-1.6	0	0	0	107.8
732	Y	30.9	Very low	32.9	Very low	213 Å²	213	137.7 Å²	137.7	84%	0.835	79%	0.789	S	S	*	*			trans	60.6	152.8	165.5	-69.4	-67.6	0	0	0	121
733	G	35	Very low	32.7	Very low	70 Å²	70	142.3 Å²	142.3	72%	0.722	80%	0.798	S	S	*	*			trans	143.4	29.4	140.5	0	0	0	0	0	123.2
734	R	29.3	Very low	32.3	Very low	231 Å²	231	145.3 Å²	145.3	87%	0.872	80%	0.798	S	S	*	*			trans	28.7	114.7	137.7	-170.2	-162.1	-143.3	170.7	8.1	119.2
735	Q	35.6	Very low	32.4	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	80%	0.803	S	S	*	*				178.4	130.9	124.8	-98.5	165.5	21.6	0	0	114.6
736	N	30.8	Very low	32.3	Very low	157 Å²	157	149.6 Å²	149.6	84%	0.84	79%	0.794	S	S	*	*			trans	-92.1	152.7	156.5	-86.4	-24.4	0	0	0	108.4
737	P	37.2	Very low	32.5	Very low	115 Å²	115	152.9 Å²	152.9	75%	0.747	80%	0.799	S	S	*	*				-146.7	129.9	97.5	37.4	-20.5	0	0	0	113.7
738	S	32.8	Very low	32.6	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	79%	0.794	S	S	*	*				84.8	153.5	96.7	82.8	0	0	0	0	116.3
739	P	38.8	Very low	32.7	Very low	115 Å²	115	152.4 Å²	152.4	75%	0.747	79%	0.79	S	S	*	*			trans	-115.5	164.1	-158.6	41.3	-31.9	0	0	0	115.3
740	E	33.2	Very low	32.9	Very low	192 Å²	192	152.3 Å²	152.3	90%	0.897	79%	0.791	S	S	*	*			trans	-168.6	168.1	155.2	-120.2	167.6	-153.8	0	0	117.8
741	S	34.3	Very low	32.9	Very low	115 Å²	115	149.7 Å²	149.7	80%	0.804	79%	0.785	S	S	*	*			trans	69.4	109	178.1	73.4	0	0	0	0	117
742	C	27.1	Very low	32.9	Very low	97 Å²	97	149.7 Å²	149.7	66%	0.655	79%	0.794	S	S	*	*			cis	87.7	117.1	27.4	-161.5	0	0	0	0	115.3
743	Y	32.9	Very low	33	Very low	240 Å²	240	143.7 Å²	143.7	94%	0.941	79%	0.788	S	S	*	*			trans	-159.5	140	130.3	-105.9	-69.8	0	0	0	112.1
744	Y	30.1	Very low	32.7	Very low	179 Å²	179	146 Å²	146	70%	0.702	79%	0.788	S	S	*	*			trans	-90.5	159.2	-171	-107.2	-98	0	0	0	114.1	K746	Y744-K746 HydrophobicContact CD1-CB 4.22Å; Y744-K746 HydrophobicContact CE1-CD 4.41Å
745	T	33.7	Very low	32.8	Very low	151 Å²	151	146 Å²	146	93%	0.926	79%	0.79	S	S	*	*				-161.2	156.7	124.2	14	0	0	0	0	111.3
746	K	29.9	Very low	32.5	Very low	157 Å²	157	144.5 Å²	144.5	68%	0.683	79%	0.787	S	S	*	*			trans	-152.7	123.1	-150.7	167.5	-164.3	179.8	-178.5	0	112.9	Y744	Y744-K746 HydrophobicContact CD1-CB 4.22Å; Y744-K746 HydrophobicContact CE1-CD 4.41Å
747	T	35	Very low	32.7	Very low	141 Å²	141	143.6 Å²	143.6	87%	0.865	79%	0.787	S	S	*	*			trans	-166.7	107.8	153.4	40.9	0	0	0	0	106.7
748	R	31.6	Very low	32.2	Very low	216 Å²	216	146.6 Å²	146.6	82%	0.815	79%	0.791	S	S	*	*				86.3	137	57	-158.6	-174.8	-171	152.2	6	112.2
749	D	35.2	Very low	32.3	Very low	143 Å²	143	146.4 Å²	146.4	77%	0.765	79%	0.79	S	S	*	*			trans	89.4	136.9	179.1	-55.7	-17	0	0	0	116.5
750	S	33.7	Very low	32.2	Very low	99 Å²	99	149.2 Å²	149.2	69%	0.692	79%	0.793	S	S	*	*			cis	-164.3	153.4	-21.4	48.2	0	0	0	0	110.8
751	S	31	Very low	32.2	Very low	101 Å²	101	151.3 Å²	151.3	71%	0.706	81%	0.809	S	S	*	*			trans	48	108.7	152.6	53.8	0	0	0	0	121.5
752	S	32.1	Very low	32.1	Very low	118 Å²	118	153.1 Å²	153.1	83%	0.825	81%	0.81	S	S	*	*				137.8	138.2	109.6	-76.4	0	0	0	0	118.3
753	A	33.3	Very low	32.3	Very low	87 Å²	87	156.1 Å²	156.1	72%	0.719	82%	0.818	S	S	*	*			trans	68.5	77	151.8	0	0	0	0	0	119.7
754	T	29	Very low	32.3	Very low	118 Å²	118	151.4 Å²	151.4	72%	0.724	81%	0.811	S	S	*	*				-3.4	125.1	120	-43.6	0	0	0	0	116.6
755	Y	32.1	Very low	32.4	Very low	231 Å²	231	149.8 Å²	149.8	91%	0.906	82%	0.817	S	S	*	*			trans	-154.4	128.9	135.4	-91	-64.7	0	0	0	111
756	L	28.2	Very low	32.4	Very low	151 Å²	151	149.7 Å²	149.7	79%	0.791	81%	0.811	S	S	*	*			trans	-98.4	130.4	177.2	-85	155	0	0	0	110.7
757	T	36	Very low	32.5	Very low	137 Å²	137	149.2 Å²	149.2	84%	0.84	82%	0.819	S	S	*	*			trans	-168.2	110.1	151.7	35.9	0	0	0	0	104.9
758	Q	27.3	Very low	32.4	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	82%	0.816	S	S	*	*			cis	57	129.6	47.3	-156	169.5	10.1	0	0	114.2
759	S	34.1	Very low	32.4	Very low	109 Å²	109	144.7 Å²	144.7	76%	0.762	82%	0.816	S	S	*	*			trans	83.4	132.4	176.3	90.4	0	0	0	0	115.9
760	Q	35.4	Very low	32.2	Very low	173 Å²	173	144.8 Å²	144.8	81%	0.808	82%	0.82	S	S	*	*			cis	-147.4	162.8	-21.4	-58.1	-163.5	-71.3	0	0	109.8
761	L	33.8	Very low	32	Very low	236 Å²	236	149 Å²	149	100%	1.236	83%	0.832	S	S	*	*			trans	55.1	0	152.7	-79.4	155.2	0	0	0	119.3

Retrieved 761 of 761 residues in 190.5 ms (Link to these results)

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