A0A096NFP3_PAPAN Loading...

Sestrin 2

AlphaFold DB , UniProt , Accession A0A096NFP3, Species PAPAN (Papio anubis, Olive baboon), Gene SESN2, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.4	Very low	29.5	Very low	237 Å²	237	136.5 Å²	136.5	100%	1.167	75%	0.747	S	S	*	*				0	85.1	0	-126.1	175.4	73.3	0	0	107.2
2	I	24.6	Very low	30	Very low	167 Å²	167	131.3 Å²	131.3	86%	0.856	72%	0.716	S	S	*	*			trans	-124.2	116.3	174.1	-64.7	176.6	0	0	0	103.5	A4	I2-A4 PolarHBondContact O-N 3.19Å
3	V	27.9	Very low	30.1	Very low	138 Å²	138	133.3 Å²	133.3	84%	0.836	71%	0.714	S	S	*	*			trans	-75.9	112.7	-176.7	180	0	0	0	0	106.6
4	A	27.8	Very low	30.4	Very low	93 Å²	93	133.5 Å²	133.5	77%	0.769	72%	0.715	S	S	*	*			trans	-77	136.6	172.4	0	0	0	0	0	109.6	I2	I2-A4 PolarHBondContact O-N 3.19Å
5	D	27.8	Very low	30.8	Very low	113 Å²	113	135.7 Å²	135.7	60%	0.604	71%	0.711	S	S	*	*			trans	-61	137.6	-171.8	-153.5	-15.4	0	0	0	113.1	E7	D5-E7 VanDerWaalsContact C-N 3.26Å; D5-E7 PolarHBondContact O-N 3.37Å
6	S	29.3	Very low	30.9	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-13.8	-175.1	54.1	0	0	0	0	113.8
7	E	31.4	Very low	30.8	Very low	149 Å²	149	138.5 Å²	138.5	70%	0.696	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-25.5	-179.4	-71	-173.6	157.5	0	0	113.1	D5 R9 A10	D5-E7 VanDerWaalsContact C-N 3.26Å; D5-E7 PolarHBondContact O-N 3.37Å; E7-R9 PolarHBondContact O-N 3.33Å; E7-A10 PolarHBondContact O-N 3.19Å
8	C	32.2	Very low	31.1	Very low	84 Å²	84	139.7 Å²	139.7	57%	0.568	71%	0.708	S	S	*	*	H	α-helix	trans	-72.4	-15.9	178.1	-156	0	0	0	0	113.3
9	R	31.2	Very low	31.1	Very low	199 Å²	199	136.7 Å²	136.7	75%	0.751	71%	0.707	S	S	*	*	H	α-helix	trans	-81.8	-12.7	176.4	-84.8	-177.4	170.6	179.3	-2.5	114.2	E7	E7-R9 PolarHBondContact O-N 3.33Å
10	A	30.3	Very low	31	Very low	65 Å²	65	136.9 Å²	136.9	54%	0.537	72%	0.717	S	S	.	*	H	α-helix	trans	-81.8	-37.3	-178.5	0	0	0	0	0	112.1	E7 L12 K13	E7-A10 PolarHBondContact O-N 3.19Å; A10-L12 PolarHBondContact O-N 3.24Å; A10-K13 PolarHBondContact O-N 3.27Å
11	E	31.9	Very low	30.9	Very low	158 Å²	158	134.4 Å²	134.4	74%	0.738	72%	0.724	S	S	*	*	H	α-helix	trans	-75.5	-22.5	-179.2	-69.2	-177.2	160.5	0	0	113.6
12	L	35.1	Very low	30.7	Very low	73 Å²	73	126.8 Å²	126.8	38%	0.382	71%	0.707	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-14.7	175.5	-84	156.8	0	0	0	113.9	A10 L16	A10-L12 PolarHBondContact O-N 3.24Å; L12-L16 WeakPolarHBondContact O-CD1 3.35Å; L12-L16 WeakPolarHBondContact O-CG 3.32Å
13	K	31.8	Very low	31.1	Very low	158 Å²	158	126.4 Å²	126.4	69%	0.687	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-24.5	-178.4	-83.6	-177.3	174.4	-176.8	0	113.7	A10 Y15	A10-K13 PolarHBondContact O-N 3.27Å; K13-Y15 VanDerWaalsContact C-N 3.31Å
14	D	33.6	Very low	31.1	Very low	136 Å²	136	123.3 Å²	123.3	73%	0.727	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-17.9	176.4	-74.6	-26.6	0	0	0	112.6
15	Y	36.3	Very low	31.1	Very low	166 Å²	166	126.5 Å²	126.5	65%	0.651	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-13.9	174.4	-80.5	-81.1	0	0	0	114.3	K13	K13-Y15 VanDerWaalsContact C-N 3.31Å
16	L	32.8	Very low	31.1	Very low	114 Å²	114	126.6 Å²	126.6	60%	0.597	72%	0.721	S	S	*	*			trans	-105.8	46.3	-173.8	-70.9	169.9	0	0	0	113.5	L12 F18	L12-L16 WeakPolarHBondContact O-CD1 3.35Å; L12-L16 WeakPolarHBondContact O-CG 3.32Å; L16-F18 PolarHBondContact O-N 3.13Å
17	R	29.7	Very low	30.9	Very low	206 Å²	206	125.2 Å²	125.2	78%	0.777	72%	0.723	S	S	*	*			trans	-76.5	3	171.8	-111.2	-170.4	-132.1	-166.3	5.2	115.2
18	F	35	Very low	30.8	Very low	160 Å²	160	124.8 Å²	124.8	70%	0.702	73%	0.733	S	S	*	*			trans	-130.6	80.5	177.9	-68.4	-82.9	0	0	0	110.7	L16 D221	L16-F18 PolarHBondContact O-N 3.13Å; F18-D221 VanDerWaalsContact CE1-OD2 3.29Å; F18-D221 WeakPolarHBondContact CE1-OD2 3.23Å
19	A	30.9	Very low	30.5	Very low	83 Å²	83	124.5 Å²	124.5	69%	0.686	74%	0.744	S	S	*	*			trans	-158.6	131.1	156.1	0	0	0	0	0	109.2
20	P	30.6	Very low	30.4	Very low	140 Å²	140	124 Å²	124	91%	0.909	75%	0.75	S	S	*	*			trans	-86.5	137.6	-168.8	33	-32.3	0	0	0	112.1
21	G	27.7	Very low	30.4	Very low	85 Å²	85	128.1 Å²	128.1	88%	0.876	76%	0.758	S	S	*	*			trans	152.5	105.3	160.8	0	0	0	0	0	114.8
22	G	27.2	Very low	30.1	Very low	77 Å²	77	130 Å²	130	79%	0.794	77%	0.767	S	S	*	*			trans	175.2	95.5	168.2	0	0	0	0	0	112.5
23	V	32.3	Very low	29.8	Very low	159 Å²	159	137.3 Å²	137.3	96%	0.964	79%	0.789	S	S	*	*			trans	-59.8	128.9	178.9	179.2	0	0	0	0	110.8
24	G	28.2	Very low	29.7	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	80%	0.798	S	S	*	*			trans	-145.8	109.2	179.4	0	0	0	0	0	112.4
25	D	27	Very low	29.5	Very low	160 Å²	160	137.9 Å²	137.9	86%	0.856	80%	0.804	S	S	*	*			trans	-21.2	144.9	171.9	-149.8	7	0	0	0	120.4
26	S	28.2	Very low	29.2	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	82%	0.815	S	S	*	*			trans	-96	134.1	-177.1	47.4	0	0	0	0	113
27	G	25	Very low	29	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	82%	0.822	S	S	*	*			trans	-154.8	138.8	166.5	0	0	0	0	0	112
28	P	30.3	Very low	29.1	Very low	140 Å²	140	142 Å²	142	91%	0.909	83%	0.829	S	S	*	*			trans	-92.5	142.2	-159.5	35.9	-32.5	0	0	0	113.2
29	G	26.4	Very low	29.3	Very low	77 Å²	77	144.2 Å²	144.2	79%	0.794	83%	0.833	S	S	*	*			trans	-145.4	118.6	170.1	0	0	0	0	0	109.9
30	E	28	Very low	29.8	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	83%	0.826	S	S	*	*			trans	-69.8	137.7	-167.5	-69.3	169	142.8	0	0	114.8
31	E	29.6	Very low	30.7	Very low	150 Å²	150	141.9 Å²	141.9	70%	0.701	82%	0.82	S	S	*	*			trans	31.2	104.5	142.7	-62	-169.4	141	0	0	121
32	Q	26.7	Very low	32.5	Very low	197 Å²	197	146.5 Å²	146.5	92%	0.921	81%	0.811	S	S	*	*			trans	-128.6	95.6	133.4	-93.3	174.1	10.2	0	0	109.1	E34	Q32-E34 PolarHBondContact O-N 2.88Å; Q32-E34 VanDerWaalsContact O-N 3.1Å
33	R	29.2	Very low	35.1	Very low	227 Å²	227	143.2 Å²	143.2	86%	0.857	78%	0.778	S	S	*	*			trans	-75.3	86.8	171.5	-80.9	180	172.6	-172.3	0.3	109.6
34	E	28.9	Very low	37.8	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.864	73%	0.733	S	S	*	*			trans	-83	125.3	150.5	-89.9	-177.5	162.4	0	0	108.5	Q32 R36	Q32-E34 PolarHBondContact O-N 2.88Å; Q32-E34 VanDerWaalsContact O-N 3.1Å; E34-R36 VanDerWaalsContact C-N 3.29Å; E34-R36 PolarHBondContact O-N 2.78Å
35	S	29.7	Very low	40.9	Very low	122 Å²	122	132.8 Å²	132.8	85%	0.853	70%	0.7	S	S	*	*			trans	-65.4	84.5	-179.7	59.9	0	0	0	0	110.9	A37	S35-A37 PolarHBondContact O-N 3.11Å
36	R	30.9	Very low	44	Very low	236 Å²	236	126.9 Å²	126.9	89%	0.891	67%	0.674	S	S	*	*			trans	-60.8	106.7	156.8	-95.4	-179.3	169.7	-179.1	-2	106.7	E34 R38	E34-R36 VanDerWaalsContact C-N 3.29Å; E34-R36 PolarHBondContact O-N 2.78Å; R36-R38 PolarHBondContact O-N 2.83Å
37	A	28.6	Very low	47.2	Very low	90 Å²	90	122.3 Å²	122.3	74%	0.744	64%	0.639	S	S	*	*			trans	-47.9	113.1	162.6	0	0	0	0	0	107.1	S35 R39	S35-A37 PolarHBondContact O-N 3.11Å; A37-R39 VanDerWaalsContact C-N 3.34Å; A37-R39 PolarHBondContact O-N 2.95Å
38	R	30.3	Very low	50.3	Low	246 Å²	246	119.2 Å²	119.2	93%	0.928	61%	0.606	S	S	*	*			trans	-57.1	101.7	175.4	-76.1	180	173.6	-176.4	-3.2	106.4	R36 G40	R36-R38 PolarHBondContact O-N 2.83Å; R38-G40 PolarHBondContact O-N 3.07Å; R38-G40 VanDerWaalsContact O-N 3.14Å
39	R	40.5	Very low	53.2	Low	206 Å²	206	115 Å²	115	78%	0.777	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-58.9	119.4	166.3	-81.5	-174.4	174.5	-145.8	0.4	105.3	A37	A37-R39 VanDerWaalsContact C-N 3.34Å; A37-R39 PolarHBondContact O-N 2.95Å
40	G	39.8	Very low	55.9	Low	53 Å²	53	113.1 Å²	113.1	55%	0.546	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-54.5	164.4	175.6	0	0	0	0	0	111.3	R38 R42	R38-G40 PolarHBondContact O-N 3.07Å; R38-G40 VanDerWaalsContact O-N 3.14Å; G40-R42 PolarHBondContact O-N 3Å
41	P	50.9	Low	58.5	Low	121 Å²	121	111 Å²	111	79%	0.786	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-51.8	132.6	178.3	21.3	-31	0	0	0	110.1	G43	P41-G43 PolarHBondContact O-N 2.88Å
42	R	65.6	Low	60.9	Low	183 Å²	183	105.9 Å²	105.9	69%	0.691	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-67	122.1	172.3	-70.6	-177.1	-175.3	-128.7	7	106.9	G40	G40-R42 PolarHBondContact O-N 3Å
43	G	80.9	Confident	63.4	Low	8 Å²	8	96.5 Å²	96.5	8%	0.082	47%	0.474	C	S	.	.			trans	-74.6	177.7	175.6	0	0	0	0	0	112.9	P41 S45 L217	P41-G43 PolarHBondContact O-N 2.88Å; G43-S45 VanDerWaalsContact C-N 3.26Å; G43-S45 PolarHBondContact O-N 2.94Å; G43-L217 WeakPolarHBondContact O-CD1 3.43Å
44	P	88.9	Confident	65.5	Low	4 Å²	4	89.6 Å²	89.6	3%	0.026	45%	0.454	C	S	.	.	S	Bend	trans	-69.9	-17.7	-172.2	27.9	-37.3	0	0	0	114.5	V53 N78 V81 V82 L217	P44-V53 HydrophobicContact CG-CB 3.8Å; P44-V53 HydrophobicContact CG-CG1 3.43Å; P44-V53 VanDerWaalsContact CG-CG1 3.43Å; P44-V53 HydrophobicContact CG-CG2 4.23Å; P44-N78 WeakPolarHBondContact CA-OD1 3.41Å; P44-N78 HydrophobicContact CB-CB 3.72Å; P44-N78 WeakPolarHBondContact CB-OD1 3.16Å; P44-V81 HydrophobicContact CB-CB 4.34Å; P44-V81 HydrophobicContact CB-CG1 4.02Å; P44-V81 HydrophobicContact CG-CG1 3.82Å; P44-V82 HydrophobicContact CB-CG2 4.13Å; P44-V82 HydrophobicContact CG-CG2 4.31Å; P44-L217 PolarHBondContact O-N 3.2Å; P44-L217 VanDerWaalsContact O-N 3.08Å
45	S	92.9	Very high	67.4	Low	8 Å²	8	87.8 Å²	87.8	6%	0.056	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-131.4	143.4	-179	171	0	0	0	0	111.3	G43 F47 I48 C214 G215	G43-S45 VanDerWaalsContact C-N 3.26Å; G43-S45 PolarHBondContact O-N 2.94Å; S45-F47 VanDerWaalsContact C-N 3.31Å; S45-F47 PolarHBondContact OG-N 3.41Å; S45-I48 PolarHBondContact OG-N 3.48Å; S45-I48 VanDerWaalsContact OG-N 3.09Å; S45-C214 PolarHBondContact OG-O 3.27Å; S45-G215 CarbonylContact C-O 2.92Å; S45-G215 WeakPolarHBondContact CA-O 3.17Å
46	A	93.6	Very high	69.2	Low	37 Å²	37	85.6 Å²	85.6	31%	0.306	42%	0.415	S	S	.	.	S	Bend	trans	-78.3	-15	169.5	0	0	0	0	0	113.2	G215 L217 R437	A46-G215 WeakPolarHBondContact CB-O 3.37Å; A46-G215 PolarHBondContact N-O 2.97Å; A46-L217 HydrophobicContact CB-CD1 4.36Å; A46-L217 HydrophobicContact CB-CD2 4.02Å; A46-L217 HydrophobicContact CB-CG 4.16Å; A46-R437 PolarHBondContact O-NE 3.02Å; A46-R437 PolarHBondContact O-NH1 3.39Å
47	F	93.6	Very high	70.6	Confident	18 Å²	18	74.3 Å²	74.3	8%	0.079	37%	0.373	C	S	.	.	S	Bend	trans	-103.4	-36.2	-173.9	-60.1	-12.3	0	0	0	112.4	S45 F212 G213 C214 G215 T435 R437 Y440	S45-F47 VanDerWaalsContact C-N 3.31Å; S45-F47 PolarHBondContact OG-N 3.41Å; F47-F212 VanDerWaalsContact CE2-O 3.27Å; F47-F212 WeakPolarHBondContact CE2-O 3.37Å; F47-G213 WeakPolarHBondContact CD2-O 3.45Å; F47-G213 WeakPolarHBondContact CE2-O 3.17Å; F47-C214 VanDerWaalsContact CD2-C 3.48Å; F47-G215 VanDerWaalsContact CE2-CA 3.48Å; F47-G215 VanDerWaalsContact CE2-N 3.35Å; F47-T435 HydrophobicContact CE2-CG2 4.22Å; F47-T435 HydrophobicContact CZ-CG2 4.47Å; F47-R437 HydrophobicContact CD1-CB 3.77Å; F47-R437 HydrophobicContact CD1-CG 3.87Å; F47-R437 HydrophobicContact CE1-CB 3.73Å; F47-R437 HydrophobicContact CE1-CG 4.36Å; F47-Y440 HydrophobicContact CB-CD1 3.86Å; F47-Y440 HydrophobicContact CB-CD2 4.39Å; F47-Y440 HydrophobicContact CB-CE1 3.91Å; F47-Y440 HydrophobicContact CB-CE2 4.43Å; F47-Y440 HydrophobicContact CB-CG 4.11Å; F47-Y440 HydrophobicContact CD2-CD1 4.38Å; F47-Y440 AromaticContact CD2-CD2 3.73Å; F47-Y440 HydrophobicContact CD2-CD2 3.73Å; F47-Y440 HydrophobicContact CD2-CE2 4.31Å; F47-Y440 AromaticContact CD2-CG 3.77Å; F47-Y440 HydrophobicContact CD2-CG 3.77Å; F47-Y440 HydrophobicContact CE2-CD2 4.47Å; F47-Y440 HydrophobicContact CE2-CG 4.5Å; F47-Y440 HydrophobicContact CG-CD1 4.28Å; F47-Y440 HydrophobicContact CG-CD2 4.41Å; F47-Y440 HydrophobicContact CG-CG 4.1Å
48	I	91.8	Very high	72.3	Confident	5 Å²	5	72.2 Å²	72.2	3%	0.026	35%	0.351	C	S	.	.	S	Bend	trans	-100.6	134.9	-173.5	-48	170.3	0	0	0	109.8	S45 E52 V53 V82 H449 V453	S45-I48 PolarHBondContact OG-N 3.48Å; S45-I48 VanDerWaalsContact OG-N 3.09Å; I48-E52 HydrophobicContact CG2-CB 4.39Å; I48-V53 HydrophobicContact CB-CG2 3.63Å; I48-V53 HydrophobicContact CD1-CG2 4.3Å; I48-V53 HydrophobicContact CG2-CG2 3.34Å; I48-V82 HydrophobicContact CD1-CG1 4.12Å; I48-H449 HydrophobicContact CG1-CB 4.25Å; I48-H449 HydrophobicContact CG2-CB 3.68Å; I48-V453 HydrophobicContact CD1-CG2 3.59Å
49	P	89.4	Confident	73.8	Confident	51 Å²	51	65.6 Å²	65.6	33%	0.331	33%	0.33	S	S	.	.			trans	-56.4	141	173.8	-24.2	34.9	0	0	0	112.7	E51 E52 V53	P49-E51 VanDerWaalsContact C-N 3.26Å; P49-E51 PolarHBondContact O-N 2.65Å; P49-E52 HydrophobicContact CB-CB 4.5Å; P49-E52 PolarHBondContact O-N 2.99Å; P49-V53 PolarHBondContact O-N 2.91Å
50	V	84.9	Confident	74.8	Confident	39 Å²	39	56.4 Å²	56.4	24%	0.236	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-38.3	-174.3	-174.5	0	0	0	0	111.3	E52 V53 L54	V50-E52 VanDerWaalsContact C-N 3.29Å; V50-E52 PolarHBondContact O-N 2.7Å; V50-V53 PolarHBondContact O-N 3.4Å; V50-L54 HydrophobicContact CG1-CD1 3.56Å; V50-L54 HydrophobicContact CG1-CG 3.99Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 2.94Å
51	E	81.2	Confident	76.1	Confident	146 Å²	146	54 Å²	54	68%	0.682	27%	0.273	S	S	*	.	H	α-helix	trans	-65	-34.1	-178	-57.9	76.2	-165.9	0	0	112	P49 R55	P49-E51 VanDerWaalsContact C-N 3.26Å; P49-E51 PolarHBondContact O-N 2.65Å; E51-R55 WeakPolarHBondContact O-CB 3.36Å; E51-R55 PolarHBondContact O-N 3.06Å
52	E	80.8	Confident	76.6	Confident	42 Å²	42	54 Å²	54	20%	0.196	26%	0.262	C	S	.	.	H	α-helix	trans	-75.6	-43.6	178.8	-170.4	172	172.3	0	0	110.9	I48 P49 V50 E56 H449	I48-E52 HydrophobicContact CG2-CB 4.39Å; P49-E52 HydrophobicContact CB-CB 4.5Å; P49-E52 PolarHBondContact O-N 2.99Å; V50-E52 VanDerWaalsContact C-N 3.29Å; V50-E52 PolarHBondContact O-N 2.7Å; E52-E56 WeakPolarHBondContact O-CB 3.16Å; E52-E56 PolarHBondContact O-N 3.49Å; E52-H449 WeakPolarHBondContact OE1-CB 3.45Å; E52-H449 IonicContact OE1-CD2 2.69Å; E52-H449 IonicContact OE1-CG 3.63Å; E52-H449 PolarHBondContact OE1-N 3.01Å; E52-H449 IonicContact OE2-CD2 3.14Å; E52-H449 PolarHBondContact OE2-CD2 3.26Å; E52-H449 IonicContact OE2-CG 3.56Å
53	V	78.9	Confident	76.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.3	-45.3	179.7	-170.9	0	0	0	0	112	P44 I48 P49 V50 G57 V81 V82	P44-V53 HydrophobicContact CG-CB 3.8Å; P44-V53 HydrophobicContact CG-CG1 3.43Å; P44-V53 VanDerWaalsContact CG-CG1 3.43Å; P44-V53 HydrophobicContact CG-CG2 4.23Å; I48-V53 HydrophobicContact CB-CG2 3.63Å; I48-V53 HydrophobicContact CD1-CG2 4.3Å; I48-V53 HydrophobicContact CG2-CG2 3.34Å; P49-V53 PolarHBondContact O-N 2.91Å; V50-V53 PolarHBondContact O-N 3.4Å; V53-G57 VanDerWaalsContact O-CA 3.28Å; V53-G57 WeakPolarHBondContact O-CA 3.28Å; V53-G57 PolarHBondContact O-N 3.35Å; V53-V81 HydrophobicContact CG1-CG1 3.66Å; V53-V82 HydrophobicContact CG1-CG2 3.91Å
54	L	72.8	Confident	75.4	Confident	82 Å²	82	56.4 Å²	56.4	43%	0.429	28%	0.279	S	S	.	.	I	π-helix	trans	-71.7	-39.2	-173.7	-69.9	-177.2	0	0	0	112.6	V50 T58 V81	V50-L54 HydrophobicContact CG1-CD1 3.56Å; V50-L54 HydrophobicContact CG1-CG 3.99Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 2.94Å; L54-T58 WeakPolarHBondContact O-CB 3.17Å; L54-T58 PolarHBondContact O-N 3.33Å; L54-T58 PolarHBondContact O-OG1 2.84Å; L54-V81 HydrophobicContact CD2-CG1 4.39Å
55	R	68.9	Low	73.9	Confident	147 Å²	147	58.1 Å²	58.1	56%	0.555	29%	0.287	S	S	*	.	I	π-helix	trans	-67	-48.2	178.8	-171.7	-175	68.8	172.5	1.7	111.2	E51 E59	E51-R55 WeakPolarHBondContact O-CB 3.36Å; E51-R55 PolarHBondContact O-N 3.06Å; R55-E59 WeakPolarHBondContact O-CB 3.47Å; R55-E59 WeakPolarHBondContact O-CG 3.18Å
56	E	67.6	Low	71.9	Confident	75 Å²	75	59.5 Å²	59.5	35%	0.35	30%	0.303	S	S	.	.	I	π-helix	trans	-87.8	-33.4	-172.7	-66.3	176.3	-165	0	0	112.6	E52 S60 L85	E52-E56 WeakPolarHBondContact O-CB 3.16Å; E52-E56 PolarHBondContact O-N 3.49Å; E56-S60 WeakPolarHBondContact O-CB 3.41Å; E56-L85 HydrophobicContact CB-CD2 3.56Å
57	G	61.3	Low	69.5	Low	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	I	π-helix	trans	-82.8	-48.3	-177.9	0	0	0	0	0	113.9	V53 S60 L61	V53-G57 VanDerWaalsContact O-CA 3.28Å; V53-G57 WeakPolarHBondContact O-CA 3.28Å; V53-G57 PolarHBondContact O-N 3.35Å; G57-S60 PolarHBondContact O-N 2.89Å; G57-L61 VanDerWaalsContact O-CG 3.25Å; G57-L61 WeakPolarHBondContact O-CG 3.32Å; G57-L61 PolarHBondContact O-N 3.21Å
58	T	62.8	Low	67.1	Low	46 Å²	46	71.2 Å²	71.2	28%	0.282	36%	0.355	S	S	.	.	I	π-helix	trans	-71.1	-44.4	-174.7	-37	0	0	0	0	111.8	L54 S60 L61 E62	L54-T58 WeakPolarHBondContact O-CB 3.17Å; L54-T58 PolarHBondContact O-N 3.33Å; L54-T58 PolarHBondContact O-OG1 2.84Å; T58-S60 VanDerWaalsContact C-N 3.26Å; T58-S60 PolarHBondContact O-N 3.26Å; T58-L61 PolarHBondContact O-N 2.95Å; T58-E62 WeakPolarHBondContact O-CG 3.49Å; T58-E62 PolarHBondContact O-N 3.37Å
59	E	62	Low	64.9	Low	106 Å²	106	72.2 Å²	72.2	50%	0.495	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-37.7	177.5	-64.4	178.5	-174.5	0	0	111.4	R55 Q63	R55-E59 WeakPolarHBondContact O-CB 3.47Å; R55-E59 WeakPolarHBondContact O-CG 3.18Å; E59-Q63 VanDerWaalsContact O-CG 3.27Å; E59-Q63 WeakPolarHBondContact O-CG 3.32Å; E59-Q63 PolarHBondContact O-N 2.98Å
60	S	62.1	Low	62.9	Low	14 Å²	14	72.2 Å²	72.2	10%	0.098	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-44.7	175.8	168.1	0	0	0	0	112.2	E56 G57 T58 Q63 H64 G84 P87	E56-S60 WeakPolarHBondContact O-CB 3.41Å; G57-S60 PolarHBondContact O-N 2.89Å; T58-S60 VanDerWaalsContact C-N 3.26Å; T58-S60 PolarHBondContact O-N 3.26Å; S60-Q63 PolarHBondContact O-N 3.2Å; S60-H64 PolarHBondContact O-N 3.01Å; S60-H64 VanDerWaalsContact O-N 3.1Å; S60-H64 PolarHBondContact O-ND1 3.07Å; S60-G84 VanDerWaalsContact CB-O 3.28Å; S60-G84 WeakPolarHBondContact CB-O 3.23Å; S60-G84 PolarHBondContact OG-O 2.66Å; S60-P87 VanDerWaalsContact OG-CB 3.29Å; S60-P87 WeakPolarHBondContact OG-CB 3.47Å; S60-P87 WeakPolarHBondContact OG-CD 3.29Å; S60-P87 WeakPolarHBondContact OG-CG 3.39Å
61	L	66.1	Low	60.7	Low	3 Å²	3	76.9 Å²	76.9	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-43.7	176.9	-73	166.2	0	0	0	111.7	G57 T58 Q63 H64 L65 V76 F90	G57-L61 VanDerWaalsContact O-CG 3.25Å; G57-L61 WeakPolarHBondContact O-CG 3.32Å; G57-L61 PolarHBondContact O-N 3.21Å; T58-L61 PolarHBondContact O-N 2.95Å; L61-Q63 VanDerWaalsContact C-N 3.3Å; L61-Q63 PolarHBondContact O-N 2.65Å; L61-H64 PolarHBondContact O-N 2.96Å; L61-L65 HydrophobicContact CB-CD1 4.3Å; L61-L65 HydrophobicContact CD2-CD1 3.72Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 PolarHBondContact O-N 3.29Å; L61-V76 HydrophobicContact CD1-CG1 4.23Å; L61-F90 HydrophobicContact CD2-CD1 3.64Å; L61-F90 HydrophobicContact CD2-CD2 3.97Å; L61-F90 HydrophobicContact CD2-CE1 3.35Å; L61-F90 HydrophobicContact CD2-CE2 3.68Å; L61-F90 HydrophobicContact CD2-CG 3.96Å; L61-F90 HydrophobicContact CD2-CZ 3.36Å
62	E	62.8	Low	58.9	Low	120 Å²	120	74.6 Å²	74.6	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-61.7	-36.6	177.4	-72.8	179.8	176.2	0	0	112.6	T58	T58-E62 WeakPolarHBondContact O-CG 3.49Å; T58-E62 PolarHBondContact O-N 3.37Å
63	Q	61.6	Low	57.3	Low	149 Å²	149	75.6 Å²	75.6	70%	0.696	39%	0.393	S	S	*	.	H	α-helix	trans	-74.2	-35.3	179.1	-71.4	171.6	17.8	0	0	113.3	E59 S60 L61	E59-Q63 VanDerWaalsContact O-CG 3.27Å; E59-Q63 WeakPolarHBondContact O-CG 3.32Å; E59-Q63 PolarHBondContact O-N 2.98Å; S60-Q63 PolarHBondContact O-N 3.2Å; L61-Q63 VanDerWaalsContact C-N 3.3Å; L61-Q63 PolarHBondContact O-N 2.65Å
64	H	59.5	Low	55.7	Low	93 Å²	93	78.5 Å²	78.5	43%	0.431	42%	0.423	S	S	.	.	H	α-helix	trans	-98.3	-32.2	-171	-69.9	82.1	0	0	0	114.8	S60 L61 G66 P87	S60-H64 PolarHBondContact O-N 3.01Å; S60-H64 VanDerWaalsContact O-N 3.1Å; S60-H64 PolarHBondContact O-ND1 3.07Å; L61-H64 PolarHBondContact O-N 2.96Å; H64-G66 VanDerWaalsContact C-N 3.35Å; H64-P87 HydrophobicContact CB-CB 4.5Å
65	L	56.8	Low	55.3	Low	39 Å²	39	85.2 Å²	85.2	20%	0.204	44%	0.443	C	S	.	.	H	α-helix	trans	-82.2	-15	-178.7	-83.6	162.5	0	0	0	113.4	L61 A69 L70 F90 W94	L61-L65 HydrophobicContact CB-CD1 4.3Å; L61-L65 HydrophobicContact CD2-CD1 3.72Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 PolarHBondContact O-N 3.29Å; L65-A69 HydrophobicContact CB-CB 4.26Å; L65-A69 HydrophobicContact CD2-CB 3.86Å; L65-L70 HydrophobicContact CD1-CD1 4.39Å; L65-F90 HydrophobicContact CD1-CE1 3.5Å; L65-F90 HydrophobicContact CD1-CZ 3.87Å; L65-F90 HydrophobicContact CD2-CE1 3.91Å; L65-F90 HydrophobicContact CG-CE1 3.74Å; L65-W94 HydrophobicContact CD2-CG 4.37Å
66	G	51.5	Low	55.6	Low	37 Å²	37	80.3 Å²	80.3	38%	0.381	43%	0.429	S	S	.	.	H	α-helix	trans	61.7	157.4	-164.1	0	0	0	0	0	111.3	H64 E68	H64-G66 VanDerWaalsContact C-N 3.35Å; G66-E68 PolarHBondContact O-N 3.24Å; G66-E68 VanDerWaalsContact O-N 3.15Å
67	L	43.8	Very low	56.5	Low	133 Å²	133	79.1 Å²	79.1	70%	0.696	43%	0.425	S	S	*	.	H	α-helix	trans	-56.7	-30.6	178.8	-87.6	142.8	0	0	0	112.7	M71	L67-M71 HydrophobicContact CB-SD 3.85Å; L67-M71 HydrophobicContact CD2-SD 4.11Å; L67-M71 WeakPolarHBondContact O-CB 3.4Å; L67-M71 WeakPolarHBondContact O-CG 3.34Å; L67-M71 PolarHBondContact O-N 2.94Å
68	E	41.9	Very low	57.9	Low	169 Å²	169	80.4 Å²	80.4	79%	0.79	43%	0.432	S	S	*	.	H	α-helix	trans	-66.7	-41.2	-172.3	-71.9	-177.8	161	0	0	114.6	G66 M71 S72	G66-E68 PolarHBondContact O-N 3.24Å; G66-E68 VanDerWaalsContact O-N 3.15Å; E68-M71 PolarHBondContact O-N 3.44Å; E68-S72 PolarHBondContact O-N 2.88Å; E68-S72 PolarHBondContact O-OG 2.89Å
69	A	45.1	Very low	59.4	Low	25 Å²	25	78.4 Å²	78.4	21%	0.207	42%	0.42	C	S	.	.	H	α-helix	trans	-72	-40.3	179.6	0	0	0	0	0	111.9	L65 M71 S72 S73	L65-A69 HydrophobicContact CB-CB 4.26Å; L65-A69 HydrophobicContact CD2-CB 3.86Å; A69-M71 VanDerWaalsContact C-N 3.32Å; A69-M71 PolarHBondContact O-N 3.44Å; A69-S72 WeakPolarHBondContact CA-OG 3.45Å; A69-S72 PolarHBondContact O-N 2.94Å; A69-S72 PolarHBondContact O-OG 3.43Å; A69-S73 PolarHBondContact O-N 3.42Å
70	L	49.3	Very low	60.7	Low	52 Å²	52	73.4 Å²	73.4	27%	0.272	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-36.9	173.9	-146.6	90.6	0	0	0	111.7	L65 G74 V76	L65-L70 HydrophobicContact CD1-CD1 4.39Å; L70-G74 PolarHBondContact O-N 2.89Å; L70-V76 HydrophobicContact CD1-CG2 3.27Å; L70-V76 HydrophobicContact CG-CG2 4.01Å
71	M	37.8	Very low	62.1	Low	136 Å²	136	73.5 Å²	73.5	67%	0.67	40%	0.396	S	S	*	.	H	α-helix	trans	-74	-29.3	178.4	-74.5	171.2	73.5	0	0	112.9	L67 E68 A69	L67-M71 HydrophobicContact CB-SD 3.85Å; L67-M71 HydrophobicContact CD2-SD 4.11Å; L67-M71 WeakPolarHBondContact O-CB 3.4Å; L67-M71 WeakPolarHBondContact O-CG 3.34Å; L67-M71 PolarHBondContact O-N 2.94Å; E68-M71 PolarHBondContact O-N 3.44Å; A69-M71 VanDerWaalsContact C-N 3.32Å; A69-M71 PolarHBondContact O-N 3.44Å
72	S	43	Very low	63.3	Low	99 Å²	99	73.3 Å²	73.3	69%	0.692	40%	0.396	S	S	*	.	H	α-helix	trans	-74.2	-27.2	177.5	54.2	0	0	0	0	114.4	E68 A69	E68-S72 PolarHBondContact O-N 2.88Å; E68-S72 PolarHBondContact O-OG 2.89Å; A69-S72 WeakPolarHBondContact CA-OG 3.45Å; A69-S72 PolarHBondContact O-N 2.94Å; A69-S72 PolarHBondContact O-OG 3.43Å
73	S	47.4	Very low	64.8	Low	62 Å²	62	67.6 Å²	67.6	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-95	-15.9	178.2	76.2	0	0	0	0	114.3	A69 R75	A69-S73 PolarHBondContact O-N 3.42Å; S73-R75 PolarHBondContact O-N 3.47Å; S73-R75 PolarHBondContact OG-O 3.32Å
74	G	46.6	Very low	66.1	Low	61 Å²	61	60.5 Å²	60.5	63%	0.629	34%	0.336	S	S	*	.	S	Bend	trans	67.6	-5.5	176.1	0	0	0	0	0	116.2	L70	L70-G74 PolarHBondContact O-N 2.89Å
75	R	62.3	Low	67.5	Low	224 Å²	224	57 Å²	57	85%	0.845	32%	0.32	S	S	*	.	S	Bend	trans	-170.4	148.3	165.9	-102	178.5	-80.6	-177.4	0.4	108.8	S73	S73-R75 PolarHBondContact O-N 3.47Å; S73-R75 PolarHBondContact OG-O 3.32Å
76	V	75.3	Confident	69.3	Low	44 Å²	44	55.2 Å²	55.2	27%	0.267	31%	0.311	S	S	.	.			trans	-97.2	133.4	170.7	-177	0	0	0	0	108.1	L61 L70 A80 V81	L61-V76 HydrophobicContact CD1-CG1 4.23Å; L70-V76 HydrophobicContact CD1-CG2 3.27Å; L70-V76 HydrophobicContact CG-CG2 4.01Å; V76-A80 HydrophobicContact CG1-CB 3.36Å; V76-V81 HydrophobicContact CB-CG2 4.36Å; V76-V81 HydrophobicContact CG1-CG2 4.02Å
77	D	87.1	Confident	71.1	Confident	50 Å²	50	54.5 Å²	54.5	27%	0.267	30%	0.299	S	S	.	.			trans	-74.2	161.1	179	70.7	19.9	0	0	0	112.3	L79 A80 V81 Y127	D77-L79 PolarHBondContact O-N 2.92Å; D77-L79 PolarHBondContact OD1-N 2.71Å; D77-A80 PolarHBondContact O-N 3.2Å; D77-A80 VanDerWaalsContact OD1-CB 3.23Å; D77-A80 WeakPolarHBondContact OD1-CB 3.37Å; D77-A80 PolarHBondContact OD1-N 3.36Å; D77-V81 WeakPolarHBondContact O-CG2 3.27Å; D77-V81 PolarHBondContact O-N 3.15Å; D77-Y127 WeakPolarHBondContact CB-OH 3.31Å
78	N	91.2	Very high	73.3	Confident	26 Å²	26	53 Å²	53	14%	0.139	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-28.9	-177.3	-70.8	-37.1	0	0	0	112.9	P44 V82 Y127 I216 L217 E219	P44-N78 WeakPolarHBondContact CA-OD1 3.41Å; P44-N78 HydrophobicContact CB-CB 3.72Å; P44-N78 WeakPolarHBondContact CB-OD1 3.16Å; N78-V82 WeakPolarHBondContact O-CG2 3.29Å; N78-V82 PolarHBondContact O-N 3.3Å; N78-Y127 PolarHBondContact N-OH 2.99Å; N78-I216 HydrophobicContact CB-CG2 3.9Å; N78-L217 PolarHBondContact ND2-O 3.2Å; N78-E219 VanDerWaalsContact CB-OE1 3.29Å; N78-E219 WeakPolarHBondContact CB-OE1 3.26Å; N78-E219 PolarHBondContact N-OE1 3.38Å; N78-E219 VanDerWaalsContact ND2-CD 3.25Å; N78-E219 PolarHBondContact ND2-OE1 3.21Å; N78-E219 PolarHBondContact ND2-OE2 2.94Å
79	L	93.6	Very high	75.9	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-51.6	176.2	-179.9	157.3	0	0	0	110.7	D77 V81 V82 M83 F93 Y127 L128 L207 F210 V211 I216	D77-L79 PolarHBondContact O-N 2.92Å; D77-L79 PolarHBondContact OD1-N 2.71Å; L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 3.39Å; L79-V82 PolarHBondContact O-N 3.27Å; L79-M83 HydrophobicContact CD2-CE 3.67Å; L79-M83 HydrophobicContact CD2-CG 4.28Å; L79-M83 HydrophobicContact CD2-SD 3.77Å; L79-M83 HydrophobicContact CG-CE 4.34Å; L79-M83 WeakPolarHBondContact O-CG 3.29Å; L79-M83 PolarHBondContact O-N 2.7Å; L79-F93 HydrophobicContact CD2-CE1 4.13Å; L79-F93 HydrophobicContact CD2-CZ 3.78Å; L79-Y127 HydrophobicContact CB-CE1 3.84Å; L79-Y127 HydrophobicContact CD1-CE1 3.96Å; L79-Y127 PolarHBondContact N-OH 3.4Å; L79-L128 HydrophobicContact CD1-CD2 4.19Å; L79-L207 HydrophobicContact CD1-CD2 4.12Å; L79-L207 HydrophobicContact CD2-CD2 4.37Å; L79-F210 HydrophobicContact CG-CD1 4.34Å; L79-F210 HydrophobicContact CG-CE1 4.48Å; L79-V211 HydrophobicContact CD1-CG2 3.87Å; L79-I216 HydrophobicContact CB-CG2 4.38Å
80	A	90.6	Very high	78.3	Confident	2 Å²	2	43.9 Å²	43.9	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-37.1	178	0	0	0	0	0	111.6	V76 D77 V82 M83 G84 F90	V76-A80 HydrophobicContact CG1-CB 3.36Å; D77-A80 PolarHBondContact O-N 3.2Å; D77-A80 VanDerWaalsContact OD1-CB 3.23Å; D77-A80 WeakPolarHBondContact OD1-CB 3.37Å; D77-A80 PolarHBondContact OD1-N 3.36Å; A80-V82 PolarHBondContact O-N 3.16Å; A80-M83 PolarHBondContact O-N 3.35Å; A80-G84 PolarHBondContact O-N 2.88Å; A80-F90 HydrophobicContact CB-CE2 3.89Å; A80-F90 HydrophobicContact CB-CZ 4.43Å
81	V	90.1	Very high	80.2	Confident	15 Å²	15	43.6 Å²	43.6	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-57.1	-46.1	173.6	170	0	0	0	0	111.9	P44 V53 L54 V76 D77 L79 G84	P44-V81 HydrophobicContact CB-CB 4.34Å; P44-V81 HydrophobicContact CB-CG1 4.02Å; P44-V81 HydrophobicContact CG-CG1 3.82Å; V53-V81 HydrophobicContact CG1-CG1 3.66Å; L54-V81 HydrophobicContact CD2-CG1 4.39Å; V76-V81 HydrophobicContact CB-CG2 4.36Å; V76-V81 HydrophobicContact CG1-CG2 4.02Å; D77-V81 WeakPolarHBondContact O-CG2 3.27Å; D77-V81 PolarHBondContact O-N 3.15Å; L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 3.39Å; V81-G84 PolarHBondContact O-N 3.1Å
82	V	92.6	Very high	83	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-72.2	-37	178.8	176.4	0	0	0	0	111.9	P44 I48 V53 N78 L79 A80 G84 L85 F210 C214 I216 V453	P44-V82 HydrophobicContact CB-CG2 4.13Å; P44-V82 HydrophobicContact CG-CG2 4.31Å; I48-V82 HydrophobicContact CD1-CG1 4.12Å; V53-V82 HydrophobicContact CG1-CG2 3.91Å; N78-V82 WeakPolarHBondContact O-CG2 3.29Å; N78-V82 PolarHBondContact O-N 3.3Å; L79-V82 PolarHBondContact O-N 3.27Å; A80-V82 PolarHBondContact O-N 3.16Å; V82-G84 PolarHBondContact O-N 3.37Å; V82-L85 HydrophobicContact CG1-CD1 4.35Å; V82-L85 WeakPolarHBondContact O-CB 3.34Å; V82-L85 WeakPolarHBondContact O-CG 3.28Å; V82-L85 PolarHBondContact O-N 2.82Å; V82-F210 HydrophobicContact CB-CE1 4.49Å; V82-F210 HydrophobicContact CG1-CE1 4.31Å; V82-F210 HydrophobicContact CG1-CZ 3.97Å; V82-C214 HydrophobicContact CG1-CB 4.22Å; V82-I216 HydrophobicContact CB-CD1 3.72Å; V82-I216 HydrophobicContact CG1-CD1 4.07Å; V82-I216 HydrophobicContact CG2-CD1 3.48Å; V82-I216 VanDerWaalsContact CG2-CD1 3.48Å; V82-V453 HydrophobicContact CG1-CG1 4.18Å; V82-V453 HydrophobicContact CG1-CG2 3.98Å
83	M	93.1	Very high	85.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-27.9	173.3	-69.9	-167	175.1	0	0	112.6	L79 A80 L85 H86 Y89 F90 F93 L207 F210	L79-M83 HydrophobicContact CD2-CE 3.67Å; L79-M83 HydrophobicContact CD2-CG 4.28Å; L79-M83 HydrophobicContact CD2-SD 3.77Å; L79-M83 HydrophobicContact CG-CE 4.34Å; L79-M83 WeakPolarHBondContact O-CG 3.29Å; L79-M83 PolarHBondContact O-N 2.7Å; A80-M83 PolarHBondContact O-N 3.35Å; M83-L85 PolarHBondContact O-N 3.2Å; M83-L85 VanDerWaalsContact O-N 3.09Å; M83-H86 PolarHBondContact O-N 2.97Å; M83-Y89 HydrophobicContact SD-CE1 4.14Å; M83-F90 HydrophobicContact CB-CD2 3.7Å; M83-F90 HydrophobicContact CB-CE2 4.39Å; M83-F93 HydrophobicContact CE-CD2 3.98Å; M83-F93 HydrophobicContact CE-CE1 4.38Å; M83-F93 HydrophobicContact CE-CE2 3.77Å; M83-F93 HydrophobicContact CE-CG 4.39Å; M83-F93 HydrophobicContact CE-CZ 3.98Å; M83-F93 HydrophobicContact SD-CB 4.37Å; M83-F93 HydrophobicContact SD-CD1 3.35Å; M83-F93 WeakPolarHBondContact SD-CD1 3.31Å; M83-F93 HydrophobicContact SD-CD2 3.69Å; M83-F93 HydrophobicContact SD-CE1 3.4Å; M83-F93 WeakPolarHBondContact SD-CE1 3.26Å; M83-F93 HydrophobicContact SD-CE2 3.75Å; M83-F93 HydrophobicContact SD-CG 3.49Å; M83-F93 WeakPolarHBondContact SD-CG 3.18Å; M83-F93 HydrophobicContact SD-CZ 3.6Å; M83-L207 HydrophobicContact CE-CD2 3.44Å; M83-L207 VanDerWaalsContact CE-CD2 3.44Å; M83-F210 HydrophobicContact CE-CD1 3.64Å; M83-F210 HydrophobicContact CE-CD2 4.31Å; M83-F210 HydrophobicContact CE-CE1 3.77Å; M83-F210 HydrophobicContact CE-CE2 4.43Å; M83-F210 HydrophobicContact CE-CG 3.92Å; M83-F210 HydrophobicContact CE-CZ 4.16Å; M83-F210 HydrophobicContact CG-CD1 4.4Å; M83-F210 HydrophobicContact CG-CE1 3.56Å; M83-F210 HydrophobicContact CG-CE2 4.32Å; M83-F210 HydrophobicContact CG-CZ 3.51Å
84	G	89.1	Confident	87.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.9	175.7	0	0	0	0	0	115.1	S60 A80 V81 V82 H86	S60-G84 VanDerWaalsContact CB-O 3.28Å; S60-G84 WeakPolarHBondContact CB-O 3.23Å; S60-G84 PolarHBondContact OG-O 2.66Å; A80-G84 PolarHBondContact O-N 2.88Å; V81-G84 PolarHBondContact O-N 3.1Å; V82-G84 PolarHBondContact O-N 3.37Å; G84-H86 PolarHBondContact O-N 2.98Å
85	L	90.1	Very high	90.1	Very high	18 Å²	18	36.4 Å²	36.4	9%	0.094	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	170.4	-66.2	172.9	0	0	0	113	E56 V82 M83 V453	E56-L85 HydrophobicContact CB-CD2 3.56Å; V82-L85 HydrophobicContact CG1-CD1 4.35Å; V82-L85 WeakPolarHBondContact O-CB 3.34Å; V82-L85 WeakPolarHBondContact O-CG 3.28Å; V82-L85 PolarHBondContact O-N 2.82Å; M83-L85 PolarHBondContact O-N 3.2Å; M83-L85 VanDerWaalsContact O-N 3.09Å; L85-V453 HydrophobicContact CD1-CB 4.46Å; L85-V453 HydrophobicContact CD1-CG2 3.95Å
86	H	94	Very high	91.8	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.014	13%	0.129	C	C	.	.	S	Bend	trans	-129.5	76.8	178.8	-62.2	-59.9	0	0	0	111	M83 G84 D88 Y89 F90 L373 Y375 S450 H454 L457	M83-H86 PolarHBondContact O-N 2.97Å; G84-H86 PolarHBondContact O-N 2.98Å; H86-D88 VanDerWaalsContact C-N 3.33Å; H86-D88 PolarHBondContact O-N 3.1Å; H86-Y89 PolarHBondContact O-N 2.93Å; H86-Y89 VanDerWaalsContact O-N 3.1Å; H86-F90 PolarHBondContact O-N 2.85Å; H86-L373 HydrophobicContact CB-CD2 3.99Å; H86-Y375 AromaticContact CE1-CE2 3.67Å; H86-Y375 AromaticContact ND1-CE2 3.29Å; H86-Y375 VanDerWaalsContact ND1-CE2 3.29Å; H86-Y375 WeakPolarHBondContact ND1-CE2 3.48Å; H86-Y375 AromaticContact ND1-CZ 3.52Å; H86-Y375 PolarHBondContact ND1-OH 2.91Å; H86-S450 PolarHBondContact CE1-O 3.25Å; H86-S450 PolarHBondContact NE2-O 3.23Å; H86-H454 PolarHBondContact NE2-N 3.42Å; H86-L457 HydrophobicContact CB-CD1 3.76Å
87	P	90.1	Very high	92.8	Very high	22 Å²	22	24.7 Å²	24.7	14%	0.143	12%	0.121	C	C	.	.	H	α-helix	trans	-58	-37.4	-171.4	13.5	-25.3	0	0	0	115.1	S60 H64 Y89 F90 T91	S60-P87 VanDerWaalsContact OG-CB 3.29Å; S60-P87 WeakPolarHBondContact OG-CB 3.47Å; S60-P87 WeakPolarHBondContact OG-CD 3.29Å; S60-P87 WeakPolarHBondContact OG-CG 3.39Å; H64-P87 HydrophobicContact CB-CB 4.5Å; P87-Y89 VanDerWaalsContact C-N 3.31Å; P87-Y89 PolarHBondContact O-N 2.97Å; P87-F90 PolarHBondContact O-N 3.18Å; P87-T91 PolarHBondContact O-N 2.82Å; P87-T91 PolarHBondContact O-OG1 2.96Å
88	D	89.9	Confident	93.2	Very high	100 Å²	100	27.9 Å²	27.9	54%	0.535	13%	0.13	S	C	.	.	H	α-helix	trans	-61.2	-41	177.8	-65.8	-37	0	0	0	111.8	H86 L373	H86-D88 VanDerWaalsContact C-N 3.33Å; H86-D88 PolarHBondContact O-N 3.1Å; D88-L373 HydrophobicContact CB-CD1 4.16Å
89	Y	96.3	Very high	93.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-72.7	-44.9	172.7	170.1	-92.4	0	0	0	111.4	M83 H86 P87 T91 S92 F93 K366 A370 L457 E461	M83-Y89 HydrophobicContact SD-CE1 4.14Å; H86-Y89 PolarHBondContact O-N 2.93Å; H86-Y89 VanDerWaalsContact O-N 3.1Å; P87-Y89 VanDerWaalsContact C-N 3.31Å; P87-Y89 PolarHBondContact O-N 2.97Å; Y89-T91 PolarHBondContact O-N 3.05Å; Y89-S92 PolarHBondContact O-N 3.4Å; Y89-F93 HydrophobicContact CD1-CB 4.33Å; Y89-F93 HydrophobicContact CE1-CB 3.75Å; Y89-F93 HydrophobicContact CE1-CG 4.34Å; Y89-F93 PolarHBondContact O-N 3.24Å; Y89-K366 HydrophobicContact CE2-CG 4.18Å; Y89-A370 HydrophobicContact CD2-CB 3.82Å; Y89-A370 HydrophobicContact CE2-CB 3.95Å; Y89-L457 HydrophobicContact CD1-CD1 3.62Å; Y89-L457 HydrophobicContact CD1-CD2 3.68Å; Y89-L457 HydrophobicContact CD1-CG 4.2Å; Y89-L457 HydrophobicContact CD2-CD1 4.33Å; Y89-L457 HydrophobicContact CE1-CD1 4.25Å; Y89-L457 HydrophobicContact CE1-CD2 3.42Å; Y89-L457 VanDerWaalsContact CE1-CD2 3.42Å; Y89-L457 HydrophobicContact CE1-CG 4.33Å; Y89-L457 HydrophobicContact CG-CD1 3.67Å; Y89-L457 HydrophobicContact CG-CD2 4.35Å; Y89-L457 HydrophobicContact CG-CG 4.45Å; Y89-E461 HydrophobicContact CE2-CG 4.01Å; Y89-E461 WeakPolarHBondContact CE2-OE1 3.43Å; Y89-E461 PolarHBondContact OH-OE1 2.55Å
90	F	93.9	Very high	93.7	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-54.6	-39.7	-177.7	177.6	-92.7	0	0	0	112.1	L61 L65 A80 M83 H86 P87 S92 F93 W94	L61-F90 HydrophobicContact CD2-CD1 3.64Å; L61-F90 HydrophobicContact CD2-CD2 3.97Å; L61-F90 HydrophobicContact CD2-CE1 3.35Å; L61-F90 HydrophobicContact CD2-CE2 3.68Å; L61-F90 HydrophobicContact CD2-CG 3.96Å; L61-F90 HydrophobicContact CD2-CZ 3.36Å; L65-F90 HydrophobicContact CD1-CE1 3.5Å; L65-F90 HydrophobicContact CD1-CZ 3.87Å; L65-F90 HydrophobicContact CD2-CE1 3.91Å; L65-F90 HydrophobicContact CG-CE1 3.74Å; A80-F90 HydrophobicContact CB-CE2 3.89Å; A80-F90 HydrophobicContact CB-CZ 4.43Å; M83-F90 HydrophobicContact CB-CD2 3.7Å; M83-F90 HydrophobicContact CB-CE2 4.39Å; H86-F90 PolarHBondContact O-N 2.85Å; P87-F90 PolarHBondContact O-N 3.18Å; F90-S92 VanDerWaalsContact C-N 3.35Å; F90-S92 PolarHBondContact O-N 3.35Å; F90-F93 HydrophobicContact CD2-CD1 4.22Å; F90-F93 HydrophobicContact CE2-CD1 4.25Å; F90-F93 PolarHBondContact O-N 3.07Å; F90-W94 HydrophobicContact CE1-CB 4.06Å; F90-W94 HydrophobicContact CE1-CG 4.37Å; F90-W94 HydrophobicContact CE2-CE3 4.45Å; F90-W94 HydrophobicContact CZ-CB 4.18Å; F90-W94 HydrophobicContact CZ-CD2 4.23Å; F90-W94 AromaticContact CZ-CE3 3.93Å; F90-W94 HydrophobicContact CZ-CE3 3.93Å; F90-W94 HydrophobicContact CZ-CG 4.36Å; F90-W94 WeakPolarHBondContact O-CB 3.18Å; F90-W94 PolarHBondContact O-N 3.37Å
91	T	90.8	Very high	94	Very high	45 Å²	45	27.2 Å²	27.2	28%	0.276	13%	0.126	S	C	.	.	H	α-helix	trans	-57.5	-47.1	176.9	-59.1	0	0	0	0	111.8	P87 Y89 R95	P87-T91 PolarHBondContact O-N 2.82Å; P87-T91 PolarHBondContact O-OG1 2.96Å; Y89-T91 PolarHBondContact O-N 3.05Å; T91-R95 WeakPolarHBondContact O-CG 3.31Å; T91-R95 PolarHBondContact O-N 3.05Å
92	S	95.4	Very high	94.2	Very high	14 Å²	14	30.5 Å²	30.5	10%	0.098	14%	0.141	C	C	.	.	H	α-helix	trans	-70.3	-39.7	179.5	-56.3	0	0	0	0	111.7	Y89 F90 L96	Y89-S92 PolarHBondContact O-N 3.4Å; F90-S92 VanDerWaalsContact C-N 3.35Å; F90-S92 PolarHBondContact O-N 3.35Å; S92-L96 PolarHBondContact O-N 3.3Å
93	F	96.4	Very high	94.3	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-51.7	172.7	164.4	-99.8	0	0	0	111.8	L79 M83 Y89 F90 R95 L96 H97 H203 L207	L79-F93 HydrophobicContact CD2-CE1 4.13Å; L79-F93 HydrophobicContact CD2-CZ 3.78Å; M83-F93 HydrophobicContact CE-CD2 3.98Å; M83-F93 HydrophobicContact CE-CE1 4.38Å; M83-F93 HydrophobicContact CE-CE2 3.77Å; M83-F93 HydrophobicContact CE-CG 4.39Å; M83-F93 HydrophobicContact CE-CZ 3.98Å; M83-F93 HydrophobicContact SD-CB 4.37Å; M83-F93 HydrophobicContact SD-CD1 3.35Å; M83-F93 WeakPolarHBondContact SD-CD1 3.31Å; M83-F93 HydrophobicContact SD-CD2 3.69Å; M83-F93 HydrophobicContact SD-CE1 3.4Å; M83-F93 WeakPolarHBondContact SD-CE1 3.26Å; M83-F93 HydrophobicContact SD-CE2 3.75Å; M83-F93 HydrophobicContact SD-CG 3.49Å; M83-F93 WeakPolarHBondContact SD-CG 3.18Å; M83-F93 HydrophobicContact SD-CZ 3.6Å; Y89-F93 HydrophobicContact CD1-CB 4.33Å; Y89-F93 HydrophobicContact CE1-CB 3.75Å; Y89-F93 HydrophobicContact CE1-CG 4.34Å; Y89-F93 PolarHBondContact O-N 3.24Å; F90-F93 HydrophobicContact CD2-CD1 4.22Å; F90-F93 HydrophobicContact CE2-CD1 4.25Å; F90-F93 PolarHBondContact O-N 3.07Å; F93-R95 PolarHBondContact O-N 3.27Å; F93-L96 PolarHBondContact O-N 3.5Å; F93-H97 HydrophobicContact CE1-CB 4.31Å; F93-H97 HydrophobicContact CE2-CB 4.27Å; F93-H97 HydrophobicContact CZ-CB 4.05Å; F93-H97 AromaticContact CZ-CG 3.99Å; F93-H97 AromaticContact CZ-ND1 3.83Å; F93-H97 WeakPolarHBondContact O-CB 3.39Å; F93-H97 PolarHBondContact O-N 3.48Å; F93-H203 AromaticContact CE2-CE1 3.72Å; F93-L207 HydrophobicContact CE2-CD1 4.24Å; F93-L207 HydrophobicContact CE2-CD2 3.7Å; F93-L207 HydrophobicContact CE2-CG 4.38Å; F93-L207 HydrophobicContact CZ-CD2 4.22Å
94	W	93.6	Very high	94.4	Very high	66 Å²	66	40.4 Å²	40.4	25%	0.25	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-41.6	-174.9	-174.7	-104	0	0	0	111.9	L65 F90 L96 H97 Y98	L65-W94 HydrophobicContact CD2-CG 4.37Å; F90-W94 HydrophobicContact CE1-CB 4.06Å; F90-W94 HydrophobicContact CE1-CG 4.37Å; F90-W94 HydrophobicContact CE2-CE3 4.45Å; F90-W94 HydrophobicContact CZ-CB 4.18Å; F90-W94 HydrophobicContact CZ-CD2 4.23Å; F90-W94 AromaticContact CZ-CE3 3.93Å; F90-W94 HydrophobicContact CZ-CE3 3.93Å; F90-W94 HydrophobicContact CZ-CG 4.36Å; F90-W94 WeakPolarHBondContact O-CB 3.18Å; F90-W94 PolarHBondContact O-N 3.37Å; W94-L96 PolarHBondContact O-N 2.81Å; W94-H97 PolarHBondContact O-N 3.42Å; W94-Y98 VanDerWaalsContact O-CB 3.23Å; W94-Y98 WeakPolarHBondContact O-CB 3.3Å; W94-Y98 PolarHBondContact O-N 3.08Å
95	R	96.1	Very high	94.7	Very high	126 Å²	126	42.3 Å²	42.3	48%	0.475	22%	0.215	S	C	.	.	H	α-helix	trans	-56.7	-49	175.4	-72.9	173.7	-178	176.8	3.1	111.9	T91 F93 L99 L362 E365	T91-R95 WeakPolarHBondContact O-CG 3.31Å; T91-R95 PolarHBondContact O-N 3.05Å; F93-R95 PolarHBondContact O-N 3.27Å; R95-L99 WeakPolarHBondContact O-CB 3.44Å; R95-L99 PolarHBondContact O-N 2.9Å; R95-L362 HydrophobicContact CB-CD1 4.15Å; R95-L362 HydrophobicContact CB-CD2 3.88Å; R95-E365 IonicContact NH1-OE2 2.6Å; R95-E365 PolarHBondContact NH1-OE2 3.01Å
96	L	97.4	Very high	95.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-44.1	178.4	-178.3	65.3	0	0	0	111.4	S92 F93 W94 Y98 L99 L100 V199 L362 L363 K366 M464	S92-L96 PolarHBondContact O-N 3.3Å; F93-L96 PolarHBondContact O-N 3.5Å; W94-L96 PolarHBondContact O-N 2.81Å; L96-Y98 VanDerWaalsContact C-N 3.35Å; L96-Y98 PolarHBondContact O-N 3.46Å; L96-L99 PolarHBondContact O-N 3.42Å; L96-L100 HydrophobicContact CD1-CD1 4.01Å; L96-L100 HydrophobicContact CD1-CD2 4.43Å; L96-L100 HydrophobicContact CD1-CG 4Å; L96-L100 HydrophobicContact CD2-CD1 4.39Å; L96-L100 HydrophobicContact CG-CD1 3.82Å; L96-L100 HydrophobicContact CG-CG 4.21Å; L96-L100 WeakPolarHBondContact O-CB 3.2Å; L96-L100 VanDerWaalsContact O-CG 3.24Å; L96-L100 WeakPolarHBondContact O-CG 3.27Å; L96-L100 PolarHBondContact O-N 3.35Å; L96-V199 HydrophobicContact CD1-CG1 4.49Å; L96-L362 HydrophobicContact CB-CB 4.39Å; L96-L362 HydrophobicContact CD1-CB 4.18Å; L96-L363 HydrophobicContact CD1-CD2 4.46Å; L96-L363 HydrophobicContact CD1-CG 4.3Å; L96-L363 HydrophobicContact CD2-CD2 3.61Å; L96-L363 HydrophobicContact CD2-CG 4.26Å; L96-K366 HydrophobicContact CB-CD 4.46Å; L96-K366 HydrophobicContact CD2-CD 3.78Å; L96-K366 VanDerWaalsContact CD2-CE 3.41Å; L96-M464 HydrophobicContact CD2-CE 4.48Å
97	H	96.6	Very high	95.3	Very high	22 Å²	22	44 Å²	44	10%	0.102	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-45.3	178.8	-173.7	85.1	0	0	0	111.8	F93 W94 L100 L101 H203	F93-H97 HydrophobicContact CE1-CB 4.31Å; F93-H97 HydrophobicContact CE2-CB 4.27Å; F93-H97 HydrophobicContact CZ-CB 4.05Å; F93-H97 AromaticContact CZ-CG 3.99Å; F93-H97 AromaticContact CZ-ND1 3.83Å; F93-H97 WeakPolarHBondContact O-CB 3.39Å; F93-H97 PolarHBondContact O-N 3.48Å; W94-H97 PolarHBondContact O-N 3.42Å; H97-L100 PolarHBondContact O-N 2.84Å; H97-L101 WeakPolarHBondContact CE1-CD1 3.29Å; H97-L101 PolarHBondContact O-N 3.46Å; H97-L101 VanDerWaalsContact O-N 3.11Å; H97-H203 AromaticContact ND1-NE2 3.34Å; H97-H203 PolarHBondContact ND1-NE2 3.45Å
98	Y	95.3	Very high	95.6	Very high	116 Å²	116	45.8 Å²	45.8	46%	0.455	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-42.9	176.4	-170.3	-93	0	0	0	112.3	W94 L96 L100 H102 T103	W94-Y98 VanDerWaalsContact O-CB 3.23Å; W94-Y98 WeakPolarHBondContact O-CB 3.3Å; W94-Y98 PolarHBondContact O-N 3.08Å; L96-Y98 VanDerWaalsContact C-N 3.35Å; L96-Y98 PolarHBondContact O-N 3.46Å; Y98-L100 PolarHBondContact O-N 3.47Å; Y98-H102 HydrophobicContact CD2-CB 3.77Å; Y98-H102 HydrophobicContact CE1-CB 4.45Å; Y98-H102 HydrophobicContact CE2-CB 3.7Å; Y98-H102 HydrophobicContact CG-CB 4.19Å; Y98-H102 CarbonylContact O-C 3.3Å; Y98-H102 WeakPolarHBondContact O-CA 3.45Å; Y98-H102 WeakPolarHBondContact O-CB 3.24Å; Y98-H102 PolarHBondContact O-N 3.07Å; Y98-T103 WeakPolarHBondContact CD1-OG1 3.37Å; Y98-T103 WeakPolarHBondContact CE1-OG1 3.3Å; Y98-T103 PolarHBondContact O-N 3.46Å; Y98-T103 VanDerWaalsContact O-N 3.14Å; Y98-T103 PolarHBondContact O-OG1 3.23Å
99	L	97.6	Very high	96	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-50.5	174.2	175.9	68.8	0	0	0	111.1	R95 L96 L101 T103 R112 Y356 E358 L362	R95-L99 WeakPolarHBondContact O-CB 3.44Å; R95-L99 PolarHBondContact O-N 2.9Å; L96-L99 PolarHBondContact O-N 3.42Å; L99-L101 PolarHBondContact O-N 3.27Å; L99-T103 HydrophobicContact CD1-CG2 4.07Å; L99-R112 PolarHBondContact O-NH1 3.13Å; L99-Y356 HydrophobicContact CD2-CE1 4.32Å; L99-Y356 WeakPolarHBondContact CG-OH 3.3Å; L99-E358 HydrophobicContact CD1-CB 3.93Å; L99-E358 HydrophobicContact CD2-CB 3.94Å; L99-E358 WeakPolarHBondContact CD2-O 3.5Å; L99-L362 HydrophobicContact CB-CD1 3.99Å; L99-L362 HydrophobicContact CD2-CD1 3.71Å; L99-L362 HydrophobicContact CG-CD1 4.42Å
100	L	97.9	Very high	96.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-35.5	-172.7	-70.6	176.7	0	0	0	113	L96 H97 Y98 R112 V199 L200 H203 Y356	L96-L100 HydrophobicContact CD1-CD1 4.01Å; L96-L100 HydrophobicContact CD1-CD2 4.43Å; L96-L100 HydrophobicContact CD1-CG 4Å; L96-L100 HydrophobicContact CD2-CD1 4.39Å; L96-L100 HydrophobicContact CG-CD1 3.82Å; L96-L100 HydrophobicContact CG-CG 4.21Å; L96-L100 WeakPolarHBondContact O-CB 3.2Å; L96-L100 VanDerWaalsContact O-CG 3.24Å; L96-L100 WeakPolarHBondContact O-CG 3.27Å; L96-L100 PolarHBondContact O-N 3.35Å; H97-L100 PolarHBondContact O-N 2.84Å; Y98-L100 PolarHBondContact O-N 3.47Å; L100-R112 WeakPolarHBondContact O-CD 3.17Å; L100-R112 VanDerWaalsContact O-CZ 3.24Å; L100-R112 PolarHBondContact O-NE 3.27Å; L100-R112 PolarHBondContact O-NH1 3.42Å; L100-V199 HydrophobicContact CD1-CG1 3.94Å; L100-V199 HydrophobicContact CD2-CB 4.33Å; L100-V199 HydrophobicContact CD2-CG1 3.73Å; L100-V199 HydrophobicContact CG-CG1 4.42Å; L100-L200 HydrophobicContact CB-CD2 3.9Å; L100-L200 HydrophobicContact CD2-CG 4.31Å; L100-H203 HydrophobicContact CD1-CB 4.01Å; L100-Y356 HydrophobicContact CD2-CE1 4.31Å
101	L	97.1	Very high	96.4	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-111.3	-26	-169.3	-62.7	170.8	0	0	0	113.9	H97 L99 S109 R112 L200	H97-L101 WeakPolarHBondContact CE1-CD1 3.29Å; H97-L101 PolarHBondContact O-N 3.46Å; H97-L101 VanDerWaalsContact O-N 3.11Å; L99-L101 PolarHBondContact O-N 3.27Å; L101-S109 PolarHBondContact O-OG 3.28Å; L101-R112 PolarHBondContact O-NH2 3.44Å; L101-L200 HydrophobicContact CD2-CD2 3.95Å
102	H	94.3	Very high	96.7	Very high	85 Å²	85	44.3 Å²	44.3	39%	0.394	23%	0.234	S	C	.	.	H	α-helix	trans	-123	-10.5	-169	-56.1	94.5	0	0	0	114.6	Y98	Y98-H102 HydrophobicContact CD2-CB 3.77Å; Y98-H102 HydrophobicContact CE1-CB 4.45Å; Y98-H102 HydrophobicContact CE2-CB 3.7Å; Y98-H102 HydrophobicContact CG-CB 4.19Å; Y98-H102 CarbonylContact O-C 3.3Å; Y98-H102 WeakPolarHBondContact O-CA 3.45Å; Y98-H102 WeakPolarHBondContact O-CB 3.24Å; Y98-H102 PolarHBondContact O-N 3.07Å
103	T	95.6	Very high	96.9	Very high	49 Å²	49	43.8 Å²	43.8	30%	0.301	23%	0.23	S	C	.	.	S	Bend	trans	-101.4	151.5	178.9	-54	0	0	0	0	110.7	Y98 L99 R112	Y98-T103 WeakPolarHBondContact CD1-OG1 3.37Å; Y98-T103 WeakPolarHBondContact CE1-OG1 3.3Å; Y98-T103 PolarHBondContact O-N 3.46Å; Y98-T103 VanDerWaalsContact O-N 3.14Å; Y98-T103 PolarHBondContact O-OG1 3.23Å; L99-T103 HydrophobicContact CD1-CG2 4.07Å; T103-R112 PolarHBondContact O-NH1 2.83Å; T103-R112 PolarHBondContact O-NH2 3.21Å
104	D	95.5	Very high	97	Very high	159 Å²	159	43.7 Å²	43.7	85%	0.85	23%	0.229	S	C	*	.			trans	-62	149.5	173.9	-71.6	-33.6	0	0	0	112
105	G	95.5	Very high	97.3	Very high	40 Å²	40	40.5 Å²	40.5	41%	0.412	22%	0.218	S	C	.	.			trans	-169.3	-169.2	179.8	0	0	0	0	0	113.2	L107	G105-L107 PolarHBondContact O-N 3Å; G105-L107 VanDerWaalsContact O-N 3.17Å
106	P	96.8	Very high	97.4	Very high	49 Å²	49	34.5 Å²	34.5	32%	0.318	20%	0.195	S	C	.	.	S	Bend	trans	-55.5	-31.8	-178	-28.3	33.8	0	0	0	115.1	A192 E193 Q196 Y356	P106-A192 HydrophobicContact CB-CB 4.37Å; P106-A192 HydrophobicContact CG-CB 4.11Å; P106-E193 HydrophobicContact CB-CB 4.48Å; P106-E193 HydrophobicContact CB-CG 3.95Å; P106-Q196 HydrophobicContact CG-CB 4.47Å; P106-Y356 HydrophobicContact CG-CD2 4.41Å; P106-Y356 HydrophobicContact CG-CE2 4.49Å
107	L	98.1	Very high	97.5	Very high	6 Å²	6	34.5 Å²	34.5	3%	0.031	20%	0.195	C	C	.	.	S	Bend	trans	-110	140	-179.4	-62.9	167.2	0	0	0	111.5	G105 R112 I115 W189 E193 Q196 A197 L200	G105-L107 PolarHBondContact O-N 3Å; G105-L107 VanDerWaalsContact O-N 3.17Å; L107-R112 HydrophobicContact CB-CG 3.74Å; L107-I115 HydrophobicContact CD1-CD1 3.73Å; L107-W189 HydrophobicContact CD1-CZ3 4.11Å; L107-W189 HydrophobicContact CD2-CH2 4.34Å; L107-W189 HydrophobicContact CD2-CZ3 3.82Å; L107-E193 HydrophobicContact CD2-CB 3.94Å; L107-E193 HydrophobicContact CD2-CG 3.87Å; L107-E193 HydrophobicContact CG-CB 4.31Å; L107-E193 HydrophobicContact CG-CG 4.35Å; L107-Q196 VanDerWaalsContact CB-OE1 3.28Å; L107-Q196 HydrophobicContact CD1-CB 4.38Å; L107-Q196 HydrophobicContact CD1-CG 4.46Å; L107-A197 HydrophobicContact CD1-CB 4.19Å; L107-L200 HydrophobicContact CD1-CD1 4.48Å
108	A	98.1	Very high	97.6	Very high	60 Å²	60	33.5 Å²	33.5	50%	0.496	19%	0.19	S	C	.	.			trans	-61.6	150	172.6	0	0	0	0	0	111.9	S110 W111 R112	A108-S110 PolarHBondContact O-N 2.76Å; A108-W111 WeakPolarHBondContact O-CB 3.23Å; A108-W111 PolarHBondContact O-N 2.94Å; A108-R112 PolarHBondContact O-N 2.92Å; A108-R112 VanDerWaalsContact O-N 3.16Å
109	S	98.3	Very high	97.7	Very high	36 Å²	36	28 Å²	28	25%	0.252	17%	0.168	S	C	.	.	H	α-helix	trans	-56.4	-44.8	-172.8	-138.6	0	0	0	0	114.2	L101 W111 R112 H113	L101-S109 PolarHBondContact O-OG 3.28Å; S109-W111 VanDerWaalsContact C-N 3.27Å; S109-W111 PolarHBondContact O-N 3.39Å; S109-R112 WeakPolarHBondContact O-CB 3.37Å; S109-R112 PolarHBondContact O-N 3.39Å; S109-R112 PolarHBondContact OG-NH2 3.19Å; S109-H113 PolarHBondContact O-CD2 2.98Å; S109-H113 VanDerWaalsContact O-CD2 3.22Å; S109-H113 PolarHBondContact O-N 2.85Å
110	S	98.3	Very high	97.8	Very high	20 Å²	20	27.2 Å²	27.2	14%	0.14	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-35.3	176.5	57.1	0	0	0	0	112.7	A108 Y114 F136	A108-S110 PolarHBondContact O-N 2.76Å; S110-Y114 WeakPolarHBondContact O-CB 3.39Å; S110-Y114 PolarHBondContact O-N 3.28Å; S110-F136 WeakPolarHBondContact O-CD2 3.4Å; S110-F136 WeakPolarHBondContact O-CE2 3.39Å
111	W	98.7	Very high	97.8	Very high	58 Å²	58	27.4 Å²	27.4	22%	0.22	17%	0.166	C	C	.	.	H	α-helix	trans	-67.3	-39	175.3	-73.2	54.7	0	0	0	111.5	A108 S109 Y114 I115 W145 P153 K155 L156	A108-W111 WeakPolarHBondContact O-CB 3.23Å; A108-W111 PolarHBondContact O-N 2.94Å; S109-W111 VanDerWaalsContact C-N 3.27Å; S109-W111 PolarHBondContact O-N 3.39Å; W111-Y114 PolarHBondContact O-N 3.47Å; W111-I115 WeakPolarHBondContact O-CD1 3.41Å; W111-I115 WeakPolarHBondContact O-CG1 3.35Å; W111-I115 PolarHBondContact O-N 2.97Å; W111-W145 AromaticContact CE2-CH2 3.94Å; W111-W145 HydrophobicContact CZ2-CH2 4.36Å; W111-W145 AromaticContact NE1-CH2 3.63Å; W111-P153 HydrophobicContact CH2-CB 4.15Å; W111-P153 HydrophobicContact CH2-CG 4.41Å; W111-P153 HydrophobicContact CZ2-CB 4.4Å; W111-P153 HydrophobicContact CZ2-CG 4.2Å; W111-K155 HydrophobicContact CH2-CB 3.96Å; W111-K155 HydrophobicContact CH2-CD 4.01Å; W111-K155 HydrophobicContact CH2-CG 4.33Å; W111-K155 HydrophobicContact CZ3-CB 3.89Å; W111-K155 HydrophobicContact CZ3-CD 3.74Å; W111-K155 HydrophobicContact CZ3-CG 3.9Å; W111-L156 HydrophobicContact CD2-CD1 4.08Å; W111-L156 HydrophobicContact CD2-CD2 4.39Å; W111-L156 HydrophobicContact CD2-CG 4.29Å; W111-L156 HydrophobicContact CE3-CD1 3.91Å; W111-L156 HydrophobicContact CE3-CD2 3.6Å; W111-L156 HydrophobicContact CE3-CG 3.61Å; W111-L156 HydrophobicContact CH2-CG 4.43Å; W111-L156 HydrophobicContact CZ3-CD1 4.25Å; W111-L156 HydrophobicContact CZ3-CD2 4.05Å; W111-L156 HydrophobicContact CZ3-CG 3.69Å
112	R	98.8	Very high	97.9	Very high	5 Å²	5	28 Å²	28	2%	0.019	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-45.4	179.4	-59.2	-174.6	-57.7	-174.9	-16.2	111.8	L99 L100 L101 T103 L107 A108 S109 Y114 I115 A116 L200	L99-R112 PolarHBondContact O-NH1 3.13Å; L100-R112 WeakPolarHBondContact O-CD 3.17Å; L100-R112 VanDerWaalsContact O-CZ 3.24Å; L100-R112 PolarHBondContact O-NE 3.27Å; L100-R112 PolarHBondContact O-NH1 3.42Å; L101-R112 PolarHBondContact O-NH2 3.44Å; T103-R112 PolarHBondContact O-NH1 2.83Å; T103-R112 PolarHBondContact O-NH2 3.21Å; L107-R112 HydrophobicContact CB-CG 3.74Å; A108-R112 PolarHBondContact O-N 2.92Å; A108-R112 VanDerWaalsContact O-N 3.16Å; S109-R112 WeakPolarHBondContact O-CB 3.37Å; S109-R112 PolarHBondContact O-N 3.39Å; S109-R112 PolarHBondContact OG-NH2 3.19Å; R112-Y114 VanDerWaalsContact C-N 3.34Å; R112-Y114 PolarHBondContact O-N 3.06Å; R112-I115 PolarHBondContact O-N 3.42Å; R112-A116 WeakPolarHBondContact O-CB 3.25Å; R112-A116 PolarHBondContact O-N 3.34Å; R112-L200 HydrophobicContact CB-CD1 3.75Å; R112-L200 HydrophobicContact CB-CD2 4.42Å; R112-L200 HydrophobicContact CG-CD1 3.78Å
113	H	98.8	Very high	98	Very high	2 Å²	2	24 Å²	24	1%	0.009	15%	0.149	C	C	.	.	H	α-helix	trans	-64	-38	174.3	-68.2	-63.6	0	0	0	112.1	S109 A116 I117 H132 E135 F136	S109-H113 PolarHBondContact O-CD2 2.98Å; S109-H113 VanDerWaalsContact O-CD2 3.22Å; S109-H113 PolarHBondContact O-N 2.85Å; H113-A116 WeakPolarHBondContact O-CB 3.25Å; H113-A116 PolarHBondContact O-N 3.35Å; H113-I117 WeakPolarHBondContact O-CG1 3.44Å; H113-I117 PolarHBondContact O-N 3.5Å; H113-H132 AromaticContact ND1-ND1 3.56Å; H113-E135 VanDerWaalsContact CE1-CB 3.46Å; H113-E135 WeakPolarHBondContact CE1-CB 3.24Å; H113-F136 HydrophobicContact CB-CB 3.92Å
114	Y	98.8	Very high	98	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-38.8	175.5	-161.2	-95.4	0	0	0	113	S110 W111 R112 A116 I117 M118 F136 W145 L146 L149 A152 L156 F315	S110-Y114 WeakPolarHBondContact O-CB 3.39Å; S110-Y114 PolarHBondContact O-N 3.28Å; W111-Y114 PolarHBondContact O-N 3.47Å; R112-Y114 VanDerWaalsContact C-N 3.34Å; R112-Y114 PolarHBondContact O-N 3.06Å; Y114-A116 VanDerWaalsContact C-N 3.29Å; Y114-A116 PolarHBondContact O-N 3.06Å; Y114-I117 HydrophobicContact CD2-CD1 4.32Å; Y114-I117 WeakPolarHBondContact O-CB 3.41Å; Y114-I117 PolarHBondContact O-N 3.34Å; Y114-M118 HydrophobicContact CD1-CG 4.13Å; Y114-M118 HydrophobicContact CD1-SD 3.86Å; Y114-M118 HydrophobicContact CE1-CG 4.04Å; Y114-M118 HydrophobicContact CE1-SD 3.9Å; Y114-M118 WeakPolarHBondContact O-CG 3.48Å; Y114-M118 PolarHBondContact O-N 3.2Å; Y114-F136 HydrophobicContact CD2-CD2 4.36Å; Y114-F136 HydrophobicContact CD2-CE2 4.03Å; Y114-F136 HydrophobicContact CD2-CZ 4.24Å; Y114-F136 HydrophobicContact CG-CE2 4.38Å; Y114-W145 HydrophobicContact CD1-CE3 4.29Å; Y114-W145 HydrophobicContact CD2-CB 4Å; Y114-W145 AromaticContact CD2-CE3 3.95Å; Y114-W145 HydrophobicContact CD2-CE3 3.95Å; Y114-W145 HydrophobicContact CE2-CB 3.46Å; Y114-W145 VanDerWaalsContact CE2-CB 3.46Å; Y114-W145 HydrophobicContact CE2-CE3 4.39Å; Y114-W145 VanDerWaalsContact CE2-O 3.27Å; Y114-W145 WeakPolarHBondContact CE2-O 3.35Å; Y114-W145 AromaticContact CG-CE3 3.88Å; Y114-W145 HydrophobicContact CG-CE3 3.88Å; Y114-W145 HydrophobicContact CG-CZ3 4.48Å; Y114-W145 PolarHBondContact OH-O 3.3Å; Y114-L146 HydrophobicContact CD2-CD2 4.39Å; Y114-L146 HydrophobicContact CE2-CD2 4.26Å; Y114-L149 HydrophobicContact CE1-CD1 4.31Å; Y114-A152 HydrophobicContact CD1-CB 4.49Å; Y114-A152 HydrophobicContact CE1-CB 3.6Å; Y114-L156 HydrophobicContact CD1-CD1 3.86Å; Y114-L156 HydrophobicContact CG-CD1 4.45Å; Y114-F315 HydrophobicContact CE2-CD1 4.44Å; Y114-F315 HydrophobicContact CE2-CE1 4.3Å
115	I	98.9	Very high	98.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-40.6	172.1	-68.8	163.4	0	0	0	110.4	L107 W111 R112 M118 A119 L156 L159 W189 A197 L200 L201	L107-I115 HydrophobicContact CD1-CD1 3.73Å; W111-I115 WeakPolarHBondContact O-CD1 3.41Å; W111-I115 WeakPolarHBondContact O-CG1 3.35Å; W111-I115 PolarHBondContact O-N 2.97Å; R112-I115 PolarHBondContact O-N 3.42Å; I115-M118 WeakPolarHBondContact O-CB 3.42Å; I115-M118 PolarHBondContact O-N 3.15Å; I115-A119 PolarHBondContact O-N 3.25Å; I115-L156 HydrophobicContact CD1-CD2 3.94Å; I115-L156 HydrophobicContact CG1-CD2 3.61Å; I115-L159 HydrophobicContact CD1-CD2 4.28Å; I115-L159 HydrophobicContact CG1-CD2 3.97Å; I115-L159 HydrophobicContact CG2-CD2 4.04Å; I115-W189 HydrophobicContact CD1-CH2 4.04Å; I115-A197 HydrophobicContact CD1-CB 4.13Å; I115-L200 HydrophobicContact CG2-CB 3.94Å; I115-L201 HydrophobicContact CG2-CD2 3.64Å; I115-L201 HydrophobicContact CG2-CG 3.88Å
116	A	98.9	Very high	98.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-40.1	176.3	0	0	0	0	0	112.4	R112 H113 Y114 A119 A120 H132 C204	R112-A116 WeakPolarHBondContact O-CB 3.25Å; R112-A116 PolarHBondContact O-N 3.34Å; H113-A116 WeakPolarHBondContact O-CB 3.25Å; H113-A116 PolarHBondContact O-N 3.35Å; Y114-A116 VanDerWaalsContact C-N 3.29Å; Y114-A116 PolarHBondContact O-N 3.06Å; A116-A119 PolarHBondContact O-N 3.29Å; A116-A120 WeakPolarHBondContact O-CB 3.37Å; A116-A120 PolarHBondContact O-N 2.76Å; A116-H132 HydrophobicContact CB-CB 4.28Å; A116-H132 WeakPolarHBondContact CB-CD2 3.28Å; A116-C204 WeakPolarHBondContact CB-SG 3.45Å
117	I	98.8	Very high	98.1	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59	-50.3	171.4	-66.7	165.4	0	0	0	110.4	H113 Y114 A119 A120 A121 V129 H132 M133 F136 L146 F315	H113-I117 WeakPolarHBondContact O-CG1 3.44Å; H113-I117 PolarHBondContact O-N 3.5Å; Y114-I117 HydrophobicContact CD2-CD1 4.32Å; Y114-I117 WeakPolarHBondContact O-CB 3.41Å; Y114-I117 PolarHBondContact O-N 3.34Å; I117-A119 VanDerWaalsContact C-N 3.26Å; I117-A119 PolarHBondContact O-N 2.97Å; I117-A120 PolarHBondContact O-N 3.37Å; I117-A121 VanDerWaalsContact O-CB 3.24Å; I117-A121 WeakPolarHBondContact O-CB 3.22Å; I117-A121 PolarHBondContact O-N 3.31Å; I117-V129 HydrophobicContact CG2-CG1 4.24Å; I117-H132 HydrophobicContact CD1-CB 4.48Å; I117-H132 HydrophobicContact CG1-CB 3.73Å; I117-M133 HydrophobicContact CD1-CB 4.38Å; I117-M133 HydrophobicContact CD1-CG 3.7Å; I117-M133 HydrophobicContact CG1-CG 4.24Å; I117-F136 HydrophobicContact CD1-CB 4.4Å; I117-L146 HydrophobicContact CD1-CD2 3.88Å; I117-F315 HydrophobicContact CG2-CB 4.36Å; I117-F315 HydrophobicContact CG2-CD1 3.95Å; I117-F315 HydrophobicContact CG2-CD2 4.04Å; I117-F315 HydrophobicContact CG2-CE1 4.29Å; I117-F315 HydrophobicContact CG2-CE2 4.38Å; I117-F315 HydrophobicContact CG2-CG 3.83Å
118	M	98.8	Very high	98	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.9	-39.4	179.2	-68.8	173	62.5	0	0	112	Y114 I115 L149 L159 N163	Y114-M118 HydrophobicContact CD1-CG 4.13Å; Y114-M118 HydrophobicContact CD1-SD 3.86Å; Y114-M118 HydrophobicContact CE1-CG 4.04Å; Y114-M118 HydrophobicContact CE1-SD 3.9Å; Y114-M118 WeakPolarHBondContact O-CG 3.48Å; Y114-M118 PolarHBondContact O-N 3.2Å; I115-M118 WeakPolarHBondContact O-CB 3.42Å; I115-M118 PolarHBondContact O-N 3.15Å; M118-L149 HydrophobicContact CE-CD1 3.77Å; M118-L149 HydrophobicContact CG-CD1 4.36Å; M118-L149 HydrophobicContact SD-CD1 3.94Å; M118-L159 HydrophobicContact CE-CB 4.33Å; M118-N163 VanDerWaalsContact C-ND2 3.33Å; M118-N163 PolarHBondContact O-ND2 3.36Å
119	A	98.9	Very high	98	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-69	-52.1	177.9	0	0	0	0	0	112.3	I115 A116 I117 A121 R122 L201 C204 H205	I115-A119 PolarHBondContact O-N 3.25Å; A116-A119 PolarHBondContact O-N 3.29Å; I117-A119 VanDerWaalsContact C-N 3.26Å; I117-A119 PolarHBondContact O-N 2.97Å; A119-A121 PolarHBondContact O-N 3.43Å; A119-R122 WeakPolarHBondContact O-CB 3.33Å; A119-R122 PolarHBondContact O-N 3.22Å; A119-R122 VanDerWaalsContact O-N 3.12Å; A119-L201 HydrophobicContact CB-CD2 3.8Å; A119-C204 HydrophobicContact CB-CB 3.53Å; A119-H205 PolarHBondContact O-CD2 3.44Å; A119-H205 VanDerWaalsContact O-CD2 3.31Å
120	A	98.6	Very high	97.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61	-34.5	179.9	0	0	0	0	0	112.5	A116 I117 R122 H123 Q124 C125 L128 V129	A116-A120 WeakPolarHBondContact O-CB 3.37Å; A116-A120 PolarHBondContact O-N 2.76Å; I117-A120 PolarHBondContact O-N 3.37Å; A120-R122 PolarHBondContact O-N 3.21Å; A120-H123 PolarHBondContact O-N 3.43Å; A120-Q124 PolarHBondContact O-N 2.91Å; A120-C125 HydrophobicContact CB-CB 4.28Å; A120-C125 PolarHBondContact O-N 2.85Å; A120-C125 VanDerWaalsContact O-N 3.11Å; A120-L128 HydrophobicContact CB-CB 3.61Å; A120-L128 HydrophobicContact CB-CD1 4.39Å; A120-V129 HydrophobicContact CB-CG2 3.75Å
121	A	98.3	Very high	97.7	Very high	4 Å²	4	15.4 Å²	15.4	3%	0.033	9%	0.092	C	C	.	.	H	α-helix	trans	-63.7	-24.8	177.6	0	0	0	0	0	113.4	I117 A119 H123 Q124 V129 F315 V316	I117-A121 VanDerWaalsContact O-CB 3.24Å; I117-A121 WeakPolarHBondContact O-CB 3.22Å; I117-A121 PolarHBondContact O-N 3.31Å; A119-A121 PolarHBondContact O-N 3.43Å; A121-H123 PolarHBondContact O-N 3.25Å; A121-H123 VanDerWaalsContact O-N 3.16Å; A121-Q124 PolarHBondContact O-N 3.4Å; A121-V129 HydrophobicContact CB-CG2 4.29Å; A121-F315 HydrophobicContact CB-CB 3.89Å; A121-V316 HydrophobicContact CB-CG1 3.6Å
122	R	98.1	Very high	97.6	Very high	14 Å²	14	12.9 Å²	12.9	5%	0.053	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.3	174.6	-69.6	-53.9	-49.4	172	6.2	113.3	A119 A120 N163 A167 H168 E317 D318 F321	A119-R122 WeakPolarHBondContact O-CB 3.33Å; A119-R122 PolarHBondContact O-N 3.22Å; A119-R122 VanDerWaalsContact O-N 3.12Å; A120-R122 PolarHBondContact O-N 3.21Å; R122-N163 WeakPolarHBondContact CG-OD1 3.2Å; R122-A167 HydrophobicContact CB-CB 3.83Å; R122-A167 HydrophobicContact CG-CB 3.93Å; R122-H168 PolarHBondContact NE-NE2 3.4Å; R122-H168 PolarHBondContact NH2-CD2 3.26Å; R122-H168 VanDerWaalsContact NH2-CD2 3.26Å; R122-H168 PolarHBondContact NH2-NE2 3.29Å; R122-H168 PolarHBondContact O-CE1 3.02Å; R122-E317 PolarHBondContact NH1-O 2.66Å; R122-D318 PolarHBondContact NH1-O 3.4Å; R122-D318 VanDerWaalsContact NH1-O 3.12Å; R122-D318 PolarHBondContact NH2-O 3.2Å; R122-D318 VanDerWaalsContact NH2-O 3.14Å; R122-F321 PolarHBondContact NH2-O 3.24Å
123	H	96.9	Very high	97.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	12.7	178	-65.1	-62.8	0	0	0	112.9	A120 A121 C125 H168 F212 P432 E433 R463	A120-H123 PolarHBondContact O-N 3.43Å; A121-H123 PolarHBondContact O-N 3.25Å; A121-H123 VanDerWaalsContact O-N 3.16Å; H123-C125 PolarHBondContact O-N 3.05Å; H123-C125 VanDerWaalsContact O-N 3.13Å; H123-H168 AromaticContact CE1-CE1 3.58Å; H123-H168 AromaticContact CE1-ND1 3.83Å; H123-H168 AromaticContact ND1-CE1 3.97Å; H123-F212 HydrophobicContact CB-CE2 4.45Å; H123-F212 WeakPolarHBondContact O-CE2 3.33Å; H123-P432 HydrophobicContact CB-CG 3.89Å; H123-P432 WeakPolarHBondContact ND1-CD 3.45Å; H123-P432 VanDerWaalsContact ND1-CG 3.34Å; H123-P432 WeakPolarHBondContact ND1-CG 3.47Å; H123-E433 IonicContact ND1-OE2 3.33Å; H123-R463 PolarHBondContact CE1-NH2 3.28Å; H123-R463 VanDerWaalsContact CE1-NH2 3.27Å; H123-R463 PolarHBondContact NE2-NH2 2.71Å
124	Q	96.5	Very high	97.4	Very high	58 Å²	58	16.9 Å²	16.9	27%	0.271	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	37.6	-175.5	-52.6	-174.9	26.3	0	0	112.5	A120 A121 S126 P308 M312	A120-Q124 PolarHBondContact O-N 2.91Å; A121-Q124 PolarHBondContact O-N 3.4Å; Q124-S126 PolarHBondContact O-N 2.77Å; Q124-P308 VanDerWaalsContact OE1-CA 3.23Å; Q124-M312 HydrophobicContact CB-CE 3.89Å; Q124-M312 HydrophobicContact CB-SD 4.46Å; Q124-M312 WeakPolarHBondContact O-CE 3.18Å
125	C	97.4	Very high	97.3	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.007	12%	0.123	C	C	.	.			trans	-80.2	85.3	-177.4	-170	0	0	0	0	110.3	A120 H123 Y127 L128 V129 F212	A120-C125 HydrophobicContact CB-CB 4.28Å; A120-C125 PolarHBondContact O-N 2.85Å; A120-C125 VanDerWaalsContact O-N 3.11Å; H123-C125 PolarHBondContact O-N 3.05Å; H123-C125 VanDerWaalsContact O-N 3.13Å; C125-Y127 PolarHBondContact O-N 2.65Å; C125-L128 PolarHBondContact O-N 2.82Å; C125-V129 WeakPolarHBondContact O-CG2 3.35Å; C125-V129 PolarHBondContact O-N 2.85Å; C125-F212 HydrophobicContact CB-CE2 3.83Å; C125-F212 HydrophobicContact CB-CZ 4.47Å
126	S	95.5	Very high	97.3	Very high	69 Å²	69	19.6 Å²	19.6	48%	0.483	12%	0.123	S	C	.	.	H	α-helix	trans	-59.9	-30	-177.3	58.5	0	0	0	0	113.7	Q124 G130	Q124-S126 PolarHBondContact O-N 2.77Å; S126-G130 PolarHBondContact O-N 2.97Å
127	Y	96.1	Very high	97.2	Very high	18 Å²	18	23.2 Å²	23.2	7%	0.071	14%	0.141	C	C	.	.	H	α-helix	trans	-56.3	-55.9	174.4	-175.9	-89.4	0	0	0	111.5	D77 N78 L79 C125 S131 V211 I216 L217 P218 E219	D77-Y127 WeakPolarHBondContact CB-OH 3.31Å; N78-Y127 PolarHBondContact N-OH 2.99Å; L79-Y127 HydrophobicContact CB-CE1 3.84Å; L79-Y127 HydrophobicContact CD1-CE1 3.96Å; L79-Y127 PolarHBondContact N-OH 3.4Å; C125-Y127 PolarHBondContact O-N 2.65Å; Y127-S131 WeakPolarHBondContact O-CB 3.25Å; Y127-S131 PolarHBondContact O-N 3.47Å; Y127-V211 HydrophobicContact CD1-CG2 3.84Å; Y127-V211 HydrophobicContact CE1-CG2 4.45Å; Y127-V211 HydrophobicContact CG-CG1 4.29Å; Y127-V211 HydrophobicContact CG-CG2 4.34Å; Y127-I216 HydrophobicContact CD2-CG2 4.04Å; Y127-I216 HydrophobicContact CE1-CG2 4.42Å; Y127-I216 HydrophobicContact CE2-CG2 3.67Å; Y127-L217 WeakPolarHBondContact CE2-O 3.22Å; Y127-P218 HydrophobicContact CD2-CB 4.45Å; Y127-E219 PolarHBondContact OH-OE1 3.22Å
128	L	97.3	Very high	97.1	Very high	6 Å²	6	30.1 Å²	30.1	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-75.1	-36.9	-177.6	-66.7	174.3	0	0	0	112	L79 A120 C125 H132 L207 V211	L79-L128 HydrophobicContact CD1-CD2 4.19Å; A120-L128 HydrophobicContact CB-CB 3.61Å; A120-L128 HydrophobicContact CB-CD1 4.39Å; C125-L128 PolarHBondContact O-N 2.82Å; L128-H132 WeakPolarHBondContact O-CB 3.1Å; L128-H132 PolarHBondContact O-CD2 3.16Å; L128-H132 PolarHBondContact O-N 2.97Å; L128-L207 HydrophobicContact CD1-CB 3.7Å; L128-L207 HydrophobicContact CD2-CB 4.48Å; L128-L207 HydrophobicContact CD2-CD1 4.44Å; L128-V211 HydrophobicContact CD1-CG2 4.42Å; L128-V211 HydrophobicContact CG-CG2 4.25Å
129	V	97.6	Very high	97	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-50	174.7	170.4	0	0	0	0	110.2	I117 A120 A121 C125 H132 M133 M312	I117-V129 HydrophobicContact CG2-CG1 4.24Å; A120-V129 HydrophobicContact CB-CG2 3.75Å; A121-V129 HydrophobicContact CB-CG2 4.29Å; C125-V129 WeakPolarHBondContact O-CG2 3.35Å; C125-V129 PolarHBondContact O-N 2.85Å; V129-H132 PolarHBondContact O-N 3.46Å; V129-M133 HydrophobicContact CG1-CE 4Å; V129-M133 HydrophobicContact CG1-CG 4.28Å; V129-M133 HydrophobicContact CG1-SD 3.83Å; V129-M133 WeakPolarHBondContact O-CB 3.28Å; V129-M133 WeakPolarHBondContact O-CG 3.34Å; V129-M133 PolarHBondContact O-N 2.99Å; V129-M312 HydrophobicContact CB-SD 4.23Å; V129-M312 HydrophobicContact CG1-CG 4.22Å; V129-M312 HydrophobicContact CG2-CG 4.38Å; V129-M312 HydrophobicContact CG2-SD 3.96Å
130	G	94.8	Very high	97	Very high	38 Å²	38	35.8 Å²	35.8	39%	0.392	22%	0.221	S	C	.	.	H	α-helix	trans	-62.7	-45.1	179.5	0	0	0	0	0	112.8	S126 M133 A134	S126-G130 PolarHBondContact O-N 2.97Å; G130-M133 PolarHBondContact O-N 2.89Å; G130-A134 PolarHBondContact O-N 2.68Å; G130-A134 VanDerWaalsContact O-N 3.12Å
131	S	94.7	Very high	96.9	Very high	44 Å²	44	36.1 Å²	36.1	31%	0.308	22%	0.224	S	C	.	.	H	α-helix	trans	-58	-51.9	176.2	174.7	0	0	0	0	111.5	Y127 M133 A134 E135	Y127-S131 WeakPolarHBondContact O-CB 3.25Å; Y127-S131 PolarHBondContact O-N 3.47Å; S131-M133 PolarHBondContact O-N 3.23Å; S131-A134 WeakPolarHBondContact O-CB 3.49Å; S131-A134 PolarHBondContact O-N 3.33Å; S131-E135 PolarHBondContact O-N 3.15Å; S131-E135 VanDerWaalsContact O-N 3.08Å
132	H	97.6	Very high	96.9	Very high	5 Å²	5	39.6 Å²	39.6	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-74.1	-23.6	-178.3	-65.9	-43.4	0	0	0	114.1	H113 A116 I117 L128 V129 F136	H113-H132 AromaticContact ND1-ND1 3.56Å; A116-H132 HydrophobicContact CB-CB 4.28Å; A116-H132 WeakPolarHBondContact CB-CD2 3.28Å; I117-H132 HydrophobicContact CD1-CB 4.48Å; I117-H132 HydrophobicContact CG1-CB 3.73Å; L128-H132 WeakPolarHBondContact O-CB 3.1Å; L128-H132 PolarHBondContact O-CD2 3.16Å; L128-H132 PolarHBondContact O-N 2.97Å; V129-H132 PolarHBondContact O-N 3.46Å; H132-F136 WeakPolarHBondContact O-CB 3.33Å; H132-F136 PolarHBondContact O-N 2.88Å
133	M	97.1	Very high	96.9	Very high	46 Å²	46	42.6 Å²	42.6	23%	0.227	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-44.7	167.7	-80.8	177.6	156.1	0	0	111.6	I117 V129 G130 S131 F136 L137 L146 F315	I117-M133 HydrophobicContact CD1-CB 4.38Å; I117-M133 HydrophobicContact CD1-CG 3.7Å; I117-M133 HydrophobicContact CG1-CG 4.24Å; V129-M133 HydrophobicContact CG1-CE 4Å; V129-M133 HydrophobicContact CG1-CG 4.28Å; V129-M133 HydrophobicContact CG1-SD 3.83Å; V129-M133 WeakPolarHBondContact O-CB 3.28Å; V129-M133 WeakPolarHBondContact O-CG 3.34Å; V129-M133 PolarHBondContact O-N 2.99Å; G130-M133 PolarHBondContact O-N 2.89Å; S131-M133 PolarHBondContact O-N 3.23Å; M133-F136 PolarHBondContact O-N 3.01Å; M133-L137 WeakPolarHBondContact O-CG 3.36Å; M133-L137 PolarHBondContact O-N 3.22Å; M133-L137 VanDerWaalsContact O-N 3.16Å; M133-L146 HydrophobicContact CB-CD1 4.4Å; M133-L146 HydrophobicContact CE-CD2 4.34Å; M133-L146 HydrophobicContact CG-CD1 4.34Å; M133-L146 HydrophobicContact CG-CD2 4.03Å; M133-F315 HydrophobicContact CE-CD2 4.41Å; M133-F315 HydrophobicContact CE-CE1 4.25Å; M133-F315 HydrophobicContact CE-CE2 3.26Å; M133-F315 HydrophobicContact CE-CZ 3.15Å
134	A	95.6	Very high	97	Very high	44 Å²	44	46.4 Å²	46.4	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-48.9	177.1	0	0	0	0	0	110.8	G130 S131 F136 L137 Q138	G130-A134 PolarHBondContact O-N 2.68Å; G130-A134 VanDerWaalsContact O-N 3.12Å; S131-A134 WeakPolarHBondContact O-CB 3.49Å; S131-A134 PolarHBondContact O-N 3.33Å; A134-F136 PolarHBondContact O-N 3.03Å; A134-L137 PolarHBondContact O-N 3.33Å; A134-Q138 VanDerWaalsContact O-CG 3.31Å; A134-Q138 WeakPolarHBondContact O-CG 3.34Å; A134-Q138 PolarHBondContact O-N 2.83Å
135	E	96.7	Very high	97	Very high	58 Å²	58	44.9 Å²	44.9	27%	0.271	27%	0.273	S	S	.	.	H	α-helix	trans	-65.3	-36.5	178.4	-66.6	-62.1	165.3	0	0	113.1	H113 S131 L137 Q138 T139	H113-E135 VanDerWaalsContact CE1-CB 3.46Å; H113-E135 WeakPolarHBondContact CE1-CB 3.24Å; S131-E135 PolarHBondContact O-N 3.15Å; S131-E135 VanDerWaalsContact O-N 3.08Å; E135-L137 VanDerWaalsContact C-N 3.33Å; E135-L137 PolarHBondContact O-N 3.03Å; E135-Q138 PolarHBondContact O-N 3.29Å; E135-T139 WeakPolarHBondContact O-CB 3.45Å; E135-T139 WeakPolarHBondContact O-CG2 3.37Å; E135-T139 PolarHBondContact O-N 3.19Å; E135-T139 PolarHBondContact O-OG1 2.81Å
136	F	98.3	Very high	97	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.2	-46.3	173.8	173.1	-98.3	0	0	0	111.5	S110 H113 Y114 I117 H132 M133 A134 T139 G141 D142 W145 L146	S110-F136 WeakPolarHBondContact O-CD2 3.4Å; S110-F136 WeakPolarHBondContact O-CE2 3.39Å; H113-F136 HydrophobicContact CB-CB 3.92Å; Y114-F136 HydrophobicContact CD2-CD2 4.36Å; Y114-F136 HydrophobicContact CD2-CE2 4.03Å; Y114-F136 HydrophobicContact CD2-CZ 4.24Å; Y114-F136 HydrophobicContact CG-CE2 4.38Å; I117-F136 HydrophobicContact CD1-CB 4.4Å; H132-F136 WeakPolarHBondContact O-CB 3.33Å; H132-F136 PolarHBondContact O-N 2.88Å; M133-F136 PolarHBondContact O-N 3.01Å; A134-F136 PolarHBondContact O-N 3.03Å; F136-T139 PolarHBondContact O-OG1 3.31Å; F136-G141 VanDerWaalsContact CZ-CA 3.44Å; F136-G141 VanDerWaalsContact O-CA 3.3Å; F136-G141 WeakPolarHBondContact O-CA 3.33Å; F136-G141 PolarHBondContact O-N 3.36Å; F136-D142 VanDerWaalsContact CE1-O 3.24Å; F136-D142 WeakPolarHBondContact CE1-O 3.41Å; F136-D142 WeakPolarHBondContact CZ-O 3.34Å; F136-W145 HydrophobicContact CE1-CB 4.47Å; F136-W145 HydrophobicContact CE2-CD2 4.47Å; F136-W145 AromaticContact CE2-CE3 3.69Å; F136-W145 HydrophobicContact CE2-CE3 3.69Å; F136-W145 HydrophobicContact CE2-CZ3 4.04Å; F136-W145 HydrophobicContact CZ-CB 4.04Å; F136-W145 AromaticContact CZ-CD2 3.98Å; F136-W145 HydrophobicContact CZ-CD2 3.98Å; F136-W145 AromaticContact CZ-CE3 3.65Å; F136-W145 HydrophobicContact CZ-CE3 3.65Å; F136-W145 HydrophobicContact CZ-CG 4.21Å; F136-W145 HydrophobicContact CZ-CZ3 4.33Å; F136-L146 HydrophobicContact CD1-CD1 4.13Å; F136-L146 HydrophobicContact CD1-CD2 3.77Å; F136-L146 HydrophobicContact CD1-CG 3.99Å; F136-L146 HydrophobicContact CE1-CD2 4Å; F136-L146 HydrophobicContact CE1-CG 4.03Å; F136-L146 HydrophobicContact CG-CD2 4.45Å
137	L	97.9	Very high	97	Very high	76 Å²	76	46.6 Å²	46.6	40%	0.398	28%	0.277	S	S	.	.	H	α-helix	trans	-69.3	-42.2	177.9	-66.8	173.1	0	0	0	111.8	M133 A134 E135 T139 G140 P143 L146	M133-L137 WeakPolarHBondContact O-CG 3.36Å; M133-L137 PolarHBondContact O-N 3.22Å; M133-L137 VanDerWaalsContact O-N 3.16Å; A134-L137 PolarHBondContact O-N 3.33Å; E135-L137 VanDerWaalsContact C-N 3.33Å; E135-L137 PolarHBondContact O-N 3.03Å; L137-T139 VanDerWaalsContact C-N 3.28Å; L137-T139 PolarHBondContact O-N 3.2Å; L137-G140 PolarHBondContact O-N 3.47Å; L137-P143 HydrophobicContact CD2-CB 4.01Å; L137-P143 HydrophobicContact CD2-CG 3.86Å; L137-L146 HydrophobicContact CD1-CD1 3.94Å; L137-L146 HydrophobicContact CD2-CD1 3.87Å; L137-L146 HydrophobicContact CG-CD1 3.85Å
138	Q	96.7	Very high	97	Very high	144 Å²	144	45.7 Å²	45.7	67%	0.673	27%	0.273	S	S	*	.	H	α-helix	trans	-61.8	-36.3	178.5	-73	-178.9	47	0	0	112.5	A134 E135 G140	A134-Q138 VanDerWaalsContact O-CG 3.31Å; A134-Q138 WeakPolarHBondContact O-CG 3.34Å; A134-Q138 PolarHBondContact O-N 2.83Å; E135-Q138 PolarHBondContact O-N 3.29Å; Q138-G140 PolarHBondContact O-N 3.43Å
139	T	96.6	Very high	96.9	Very high	55 Å²	55	45.8 Å²	45.8	34%	0.337	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	10.6	176.8	57.7	0	0	0	0	113.8	E135 F136 L137	E135-T139 WeakPolarHBondContact O-CB 3.45Å; E135-T139 WeakPolarHBondContact O-CG2 3.37Å; E135-T139 PolarHBondContact O-N 3.19Å; E135-T139 PolarHBondContact O-OG1 2.81Å; F136-T139 PolarHBondContact O-OG1 3.31Å; L137-T139 VanDerWaalsContact C-N 3.28Å; L137-T139 PolarHBondContact O-N 3.2Å
140	G	97.5	Very high	96.9	Very high	64 Å²	64	50.5 Å²	50.5	66%	0.66	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	23.6	175.1	0	0	0	0	0	114.7	L137 Q138	L137-G140 PolarHBondContact O-N 3.47Å; Q138-G140 PolarHBondContact O-N 3.43Å
141	G	98.1	Very high	97	Very high	7 Å²	7	55.2 Å²	55.2	7%	0.072	30%	0.301	C	S	.	.			trans	-62.7	145.9	171.7	0	0	0	0	0	112.6	F136 P143	F136-G141 VanDerWaalsContact CZ-CA 3.44Å; F136-G141 VanDerWaalsContact O-CA 3.3Å; F136-G141 WeakPolarHBondContact O-CA 3.33Å; F136-G141 PolarHBondContact O-N 3.36Å; G141-P143 VanDerWaalsContact O-CD 3.26Å; G141-P143 WeakPolarHBondContact O-CD 3.29Å
142	D	98.3	Very high	97.1	Very high	77 Å²	77	53.2 Å²	53.2	41%	0.412	29%	0.287	S	S	.	.			trans	-69.3	113.8	178.5	178.4	1.6	0	0	0	110.8	F136 E144 W145	F136-D142 VanDerWaalsContact CE1-O 3.24Å; F136-D142 WeakPolarHBondContact CE1-O 3.41Å; F136-D142 WeakPolarHBondContact CZ-O 3.34Å; D142-E144 PolarHBondContact O-N 3.42Å; D142-E144 VanDerWaalsContact O-N 3.07Å; D142-E144 WeakPolarHBondContact OD1-CB 3.39Å; D142-E144 PolarHBondContact OD1-N 3.09Å; D142-E144 VanDerWaalsContact OD1-N 3.14Å; D142-W145 HydrophobicContact CB-CD2 4.45Å; D142-W145 HydrophobicContact CB-CG 4.32Å; D142-W145 WeakPolarHBondContact O-CB 3.37Å; D142-W145 PolarHBondContact O-N 3Å; D142-W145 PolarHBondContact OD2-NE1 2.96Å
143	P	97.8	Very high	97.1	Very high	78 Å²	78	54.7 Å²	54.7	51%	0.506	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-58.2	-25.3	-175.9	-23.8	34.2	0	0	0	114.1	L137 G141 W145 L146	L137-P143 HydrophobicContact CD2-CB 4.01Å; L137-P143 HydrophobicContact CD2-CG 3.86Å; G141-P143 VanDerWaalsContact O-CD 3.26Å; G141-P143 WeakPolarHBondContact O-CD 3.29Å; P143-W145 PolarHBondContact O-N 3.3Å; P143-L146 WeakPolarHBondContact O-CB 3.3Å; P143-L146 PolarHBondContact O-N 3.34Å
144	E	97.8	Very high	97	Very high	81 Å²	81	58.3 Å²	58.3	38%	0.379	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-59.1	-29	177.3	-75.1	-67.9	127.9	0	0	112.2	D142 L146 L147 R151	D142-E144 PolarHBondContact O-N 3.42Å; D142-E144 VanDerWaalsContact O-N 3.07Å; D142-E144 WeakPolarHBondContact OD1-CB 3.39Å; D142-E144 PolarHBondContact OD1-N 3.09Å; D142-E144 VanDerWaalsContact OD1-N 3.14Å; E144-L146 PolarHBondContact O-N 3.26Å; E144-L147 WeakPolarHBondContact O-CB 3.22Å; E144-L147 PolarHBondContact O-N 3.17Å; E144-L147 VanDerWaalsContact O-N 3.12Å; E144-L147 WeakPolarHBondContact OE2-CD1 3.38Å; E144-R151 WeakPolarHBondContact O-CB 3.25Å; E144-R151 WeakPolarHBondContact O-CG 3.14Å
145	W	98.2	Very high	97.1	Very high	25 Å²	25	57.3 Å²	57.3	10%	0.095	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-66.8	-25	179.4	-60.6	13.2	0	0	0	111.8	W111 Y114 F136 D142 P143 L147 G148 P153 L156	W111-W145 AromaticContact CE2-CH2 3.94Å; W111-W145 HydrophobicContact CZ2-CH2 4.36Å; W111-W145 AromaticContact NE1-CH2 3.63Å; Y114-W145 HydrophobicContact CD1-CE3 4.29Å; Y114-W145 HydrophobicContact CD2-CB 4Å; Y114-W145 AromaticContact CD2-CE3 3.95Å; Y114-W145 HydrophobicContact CD2-CE3 3.95Å; Y114-W145 HydrophobicContact CE2-CB 3.46Å; Y114-W145 VanDerWaalsContact CE2-CB 3.46Å; Y114-W145 HydrophobicContact CE2-CE3 4.39Å; Y114-W145 VanDerWaalsContact CE2-O 3.27Å; Y114-W145 WeakPolarHBondContact CE2-O 3.35Å; Y114-W145 AromaticContact CG-CE3 3.88Å; Y114-W145 HydrophobicContact CG-CE3 3.88Å; Y114-W145 HydrophobicContact CG-CZ3 4.48Å; Y114-W145 PolarHBondContact OH-O 3.3Å; F136-W145 HydrophobicContact CE1-CB 4.47Å; F136-W145 HydrophobicContact CE2-CD2 4.47Å; F136-W145 AromaticContact CE2-CE3 3.69Å; F136-W145 HydrophobicContact CE2-CE3 3.69Å; F136-W145 HydrophobicContact CE2-CZ3 4.04Å; F136-W145 HydrophobicContact CZ-CB 4.04Å; F136-W145 AromaticContact CZ-CD2 3.98Å; F136-W145 HydrophobicContact CZ-CD2 3.98Å; F136-W145 AromaticContact CZ-CE3 3.65Å; F136-W145 HydrophobicContact CZ-CE3 3.65Å; F136-W145 HydrophobicContact CZ-CG 4.21Å; F136-W145 HydrophobicContact CZ-CZ3 4.33Å; D142-W145 HydrophobicContact CB-CD2 4.45Å; D142-W145 HydrophobicContact CB-CG 4.32Å; D142-W145 WeakPolarHBondContact O-CB 3.37Å; D142-W145 PolarHBondContact O-N 3Å; D142-W145 PolarHBondContact OD2-NE1 2.96Å; P143-W145 PolarHBondContact O-N 3.3Å; W145-L147 PolarHBondContact O-N 3.03Å; W145-G148 CarbonylContact O-C 3.59Å; W145-G148 PolarHBondContact O-N 3.41Å; W145-P153 HydrophobicContact CH2-CG 3.59Å; W145-P153 HydrophobicContact CZ2-CG 3.27Å; W145-P153 HydrophobicContact CZ3-CG 4.39Å; W145-L156 HydrophobicContact CE3-CD1 4Å; W145-L156 HydrophobicContact CH2-CD1 4.03Å; W145-L156 HydrophobicContact CZ3-CD1 3.43Å; W145-L156 VanDerWaalsContact CZ3-CD1 3.43Å
146	L	97.2	Very high	97.2	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.178	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-76.2	-9.4	177.5	-57.2	-170.9	0	0	0	113	Y114 I117 M133 F136 L137 P143 E144 G148 F315	Y114-L146 HydrophobicContact CD2-CD2 4.39Å; Y114-L146 HydrophobicContact CE2-CD2 4.26Å; I117-L146 HydrophobicContact CD1-CD2 3.88Å; M133-L146 HydrophobicContact CB-CD1 4.4Å; M133-L146 HydrophobicContact CE-CD2 4.34Å; M133-L146 HydrophobicContact CG-CD1 4.34Å; M133-L146 HydrophobicContact CG-CD2 4.03Å; F136-L146 HydrophobicContact CD1-CD1 4.13Å; F136-L146 HydrophobicContact CD1-CD2 3.77Å; F136-L146 HydrophobicContact CD1-CG 3.99Å; F136-L146 HydrophobicContact CE1-CD2 4Å; F136-L146 HydrophobicContact CE1-CG 4.03Å; F136-L146 HydrophobicContact CG-CD2 4.45Å; L137-L146 HydrophobicContact CD1-CD1 3.94Å; L137-L146 HydrophobicContact CD2-CD1 3.87Å; L137-L146 HydrophobicContact CG-CD1 3.85Å; P143-L146 WeakPolarHBondContact O-CB 3.3Å; P143-L146 PolarHBondContact O-N 3.34Å; E144-L146 PolarHBondContact O-N 3.26Å; L146-G148 PolarHBondContact O-N 2.93Å; L146-F315 VanDerWaalsContact O-CZ 3.25Å; L146-F315 WeakPolarHBondContact O-CZ 3.32Å
147	L	95.7	Very high	97.1	Very high	72 Å²	72	58.6 Å²	58.6	38%	0.377	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-75.1	-10.5	168.5	-54.9	177.6	0	0	0	112.1	E144 W145 H150 R151	E144-L147 WeakPolarHBondContact O-CB 3.22Å; E144-L147 PolarHBondContact O-N 3.17Å; E144-L147 VanDerWaalsContact O-N 3.12Å; E144-L147 WeakPolarHBondContact OE2-CD1 3.38Å; W145-L147 PolarHBondContact O-N 3.03Å; L147-H150 PolarHBondContact O-CE1 2.93Å; L147-R151 HydrophobicContact CB-CG 4.12Å
148	G	94.4	Very high	97.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.			trans	136.7	169	171	0	0	0	0	0	113.7	W145 L146 H150 R151 C314	W145-G148 CarbonylContact O-C 3.59Å; W145-G148 PolarHBondContact O-N 3.41Å; L146-G148 PolarHBondContact O-N 2.93Å; G148-H150 PolarHBondContact O-N 2.86Å; G148-R151 WeakPolarHBondContact O-CB 3.47Å; G148-R151 PolarHBondContact O-N 3.47Å; G148-C314 CarbonylContact C-O 3.58Å; G148-C314 WeakPolarHBondContact CA-O 3.48Å
149	L	96.2	Very high	97.1	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.042	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.7	-30.8	-174.1	-174.1	59.9	0	0	0	113.1	Y114 M118 R151 A152 R157 C314 E317	Y114-L149 HydrophobicContact CE1-CD1 4.31Å; M118-L149 HydrophobicContact CE-CD1 3.77Å; M118-L149 HydrophobicContact CG-CD1 4.36Å; M118-L149 HydrophobicContact SD-CD1 3.94Å; L149-R151 PolarHBondContact O-N 3.37Å; L149-A152 HydrophobicContact CD1-CB 4.48Å; L149-A152 WeakPolarHBondContact O-CB 3.41Å; L149-A152 PolarHBondContact O-N 3.16Å; L149-A152 VanDerWaalsContact O-N 3.11Å; L149-R157 HydrophobicContact CD1-CG 3.9Å; L149-R157 HydrophobicContact CG-CG 3.96Å; L149-R157 WeakPolarHBondContact O-CD 3.12Å; L149-R157 VanDerWaalsContact O-CG 3.24Å; L149-R157 WeakPolarHBondContact O-CG 3.16Å; L149-C314 WeakPolarHBondContact CB-O 3.46Å; L149-C314 PolarHBondContact N-O 3.42Å; L149-E317 HydrophobicContact CD2-CG 4Å
150	H	96.6	Very high	97.2	Very high	105 Å²	105	49.6 Å²	49.6	49%	0.486	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-63.3	-24.2	177.6	69.6	-79	0	0	0	114	L147 G148	L147-H150 PolarHBondContact O-CE1 2.93Å; G148-H150 PolarHBondContact O-N 2.86Å
151	R	97.8	Very high	97.3	Very high	137 Å²	137	49.9 Å²	49.9	52%	0.517	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-86.1	-18	175	-61.7	-59.8	-175.1	-160.9	-1.8	113.3	E144 L147 G148 L149	E144-R151 WeakPolarHBondContact O-CB 3.25Å; E144-R151 WeakPolarHBondContact O-CG 3.14Å; L147-R151 HydrophobicContact CB-CG 4.12Å; G148-R151 WeakPolarHBondContact O-CB 3.47Å; G148-R151 PolarHBondContact O-N 3.47Å; L149-R151 PolarHBondContact O-N 3.37Å
152	A	97.6	Very high	97.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.008	24%	0.235	C	C	.	.	S	Bend	trans	-71.5	155	179.7	0	0	0	0	0	112.9	Y114 L149 L156 R157	Y114-A152 HydrophobicContact CD1-CB 4.49Å; Y114-A152 HydrophobicContact CE1-CB 3.6Å; L149-A152 HydrophobicContact CD1-CB 4.48Å; L149-A152 WeakPolarHBondContact O-CB 3.41Å; L149-A152 PolarHBondContact O-N 3.16Å; L149-A152 VanDerWaalsContact O-N 3.11Å; A152-L156 HydrophobicContact CB-CB 4.5Å; A152-R157 HydrophobicContact CB-CG 4.49Å; A152-R157 PolarHBondContact O-NE 3.3Å; A152-R157 PolarHBondContact O-NH2 3.01Å
153	P	97.2	Very high	97.3	Very high	36 Å²	36	46.1 Å²	46.1	23%	0.234	22%	0.216	C	C	.	.			trans	-49.7	142.5	171.6	-28.9	33	0	0	0	112.4	W111 W145 K155 L156 R157	W111-P153 HydrophobicContact CH2-CB 4.15Å; W111-P153 HydrophobicContact CH2-CG 4.41Å; W111-P153 HydrophobicContact CZ2-CB 4.4Å; W111-P153 HydrophobicContact CZ2-CG 4.2Å; W145-P153 HydrophobicContact CH2-CG 3.59Å; W145-P153 HydrophobicContact CZ2-CG 3.27Å; W145-P153 HydrophobicContact CZ3-CG 4.39Å; P153-K155 PolarHBondContact O-N 3.4Å; P153-K155 VanDerWaalsContact O-N 3.11Å; P153-L156 PolarHBondContact O-N 3.28Å; P153-R157 PolarHBondContact O-N 3.15Å; P153-R157 VanDerWaalsContact O-N 3.12Å
154	K	95.9	Very high	97.3	Very high	123 Å²	123	43.2 Å²	43.2	54%	0.535	20%	0.195	S	C	.	.	H	α-helix	trans	-54.8	-33.8	178.4	-70.1	178	-179.7	171.9	0	112.3	L156 R157 K158	K154-L156 PolarHBondContact O-N 3.48Å; K154-R157 PolarHBondContact O-N 2.85Å; K154-K158 WeakPolarHBondContact O-CG 3.41Å; K154-K158 PolarHBondContact O-N 3.38Å; K154-K158 VanDerWaalsContact O-N 3.07Å
155	K	97.2	Very high	97.4	Very high	23 Å²	23	39.6 Å²	39.6	10%	0.1	18%	0.179	C	C	.	.	H	α-helix	trans	-56	-48.1	176.3	-170.4	168.9	170.8	171.5	0	111.8	W111 P153 H187 T188 W189 E193	W111-K155 HydrophobicContact CH2-CB 3.96Å; W111-K155 HydrophobicContact CH2-CD 4.01Å; W111-K155 HydrophobicContact CH2-CG 4.33Å; W111-K155 HydrophobicContact CZ3-CB 3.89Å; W111-K155 HydrophobicContact CZ3-CD 3.74Å; W111-K155 HydrophobicContact CZ3-CG 3.9Å; P153-K155 PolarHBondContact O-N 3.4Å; P153-K155 VanDerWaalsContact O-N 3.11Å; K155-H187 HydrophobicContact CB-CB 4.02Å; K155-T188 WeakPolarHBondContact CE-O 3.44Å; K155-T188 PolarHBondContact NZ-O 3.29Å; K155-W189 HydrophobicContact CG-CD2 4.26Å; K155-W189 HydrophobicContact CG-CG 4.42Å; K155-W189 HydrophobicContact CG-CZ2 4.04Å; K155-W189 PolarHBondContact O-NE1 3.1Å; K155-E193 IonicContact NZ-OE1 3.53Å; K155-E193 PolarHBondContact NZ-OE1 3.1Å; K155-E193 IonicContact NZ-OE2 2.8Å; K155-E193 PolarHBondContact NZ-OE2 3.36Å
156	L	97.9	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-41.6	177.8	-74.7	172.8	0	0	0	111.9	W111 Y114 I115 W145 A152 P153 K154 K158 L159 W189	W111-L156 HydrophobicContact CD2-CD1 4.08Å; W111-L156 HydrophobicContact CD2-CD2 4.39Å; W111-L156 HydrophobicContact CD2-CG 4.29Å; W111-L156 HydrophobicContact CE3-CD1 3.91Å; W111-L156 HydrophobicContact CE3-CD2 3.6Å; W111-L156 HydrophobicContact CE3-CG 3.61Å; W111-L156 HydrophobicContact CH2-CG 4.43Å; W111-L156 HydrophobicContact CZ3-CD1 4.25Å; W111-L156 HydrophobicContact CZ3-CD2 4.05Å; W111-L156 HydrophobicContact CZ3-CG 3.69Å; Y114-L156 HydrophobicContact CD1-CD1 3.86Å; Y114-L156 HydrophobicContact CG-CD1 4.45Å; I115-L156 HydrophobicContact CD1-CD2 3.94Å; I115-L156 HydrophobicContact CG1-CD2 3.61Å; W145-L156 HydrophobicContact CE3-CD1 4Å; W145-L156 HydrophobicContact CH2-CD1 4.03Å; W145-L156 HydrophobicContact CZ3-CD1 3.43Å; W145-L156 VanDerWaalsContact CZ3-CD1 3.43Å; A152-L156 HydrophobicContact CB-CB 4.5Å; P153-L156 PolarHBondContact O-N 3.28Å; K154-L156 PolarHBondContact O-N 3.48Å; L156-K158 VanDerWaalsContact C-N 3.29Å; L156-K158 PolarHBondContact O-N 3.42Å; L156-L159 WeakPolarHBondContact O-CB 3.42Å; L156-L159 PolarHBondContact O-N 2.88Å; L156-W189 HydrophobicContact CD2-CH2 4.29Å; L156-W189 HydrophobicContact CD2-CZ2 4.32Å
157	R	97.1	Very high	97.5	Very high	84 Å²	84	36.9 Å²	36.9	32%	0.317	17%	0.166	S	C	.	.	H	α-helix	trans	-57.4	-39.4	177	-72.8	-171.5	-91.4	170	-10.3	113.4	L149 A152 P153 K154 L159 S160	L149-R157 HydrophobicContact CD1-CG 3.9Å; L149-R157 HydrophobicContact CG-CG 3.96Å; L149-R157 WeakPolarHBondContact O-CD 3.12Å; L149-R157 VanDerWaalsContact O-CG 3.24Å; L149-R157 WeakPolarHBondContact O-CG 3.16Å; A152-R157 HydrophobicContact CB-CG 4.49Å; A152-R157 PolarHBondContact O-NE 3.3Å; A152-R157 PolarHBondContact O-NH2 3.01Å; P153-R157 PolarHBondContact O-N 3.15Å; P153-R157 VanDerWaalsContact O-N 3.12Å; K154-R157 PolarHBondContact O-N 2.85Å; R157-L159 PolarHBondContact O-N 3.36Å; R157-S160 VanDerWaalsContact O-CB 3.29Å; R157-S160 WeakPolarHBondContact O-CB 3.45Å; R157-S160 PolarHBondContact O-N 3.18Å; R157-S160 PolarHBondContact O-OG 3.46Å
158	K	97	Very high	97.5	Very high	76 Å²	76	33.9 Å²	33.9	33%	0.33	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.2	176.4	-70.9	175	70.6	-172.7	0	113.5	K154 L156 S160 A180 L181	K154-K158 WeakPolarHBondContact O-CG 3.41Å; K154-K158 PolarHBondContact O-N 3.38Å; K154-K158 VanDerWaalsContact O-N 3.07Å; L156-K158 VanDerWaalsContact C-N 3.29Å; L156-K158 PolarHBondContact O-N 3.42Å; K158-S160 VanDerWaalsContact C-N 3.3Å; K158-A180 WeakPolarHBondContact CE-O 3.36Å; K158-A180 PolarHBondContact NZ-O 3.33Å; K158-L181 HydrophobicContact CB-CD2 3.97Å; K158-L181 WeakPolarHBondContact O-CD2 3.38Å
159	L	98.1	Very high	97.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.6	179.4	-155.3	71.5	0	0	0	112.9	I115 M118 L156 R157 E161 I162 N163 L181 W189 L194 A197 L201	I115-L159 HydrophobicContact CD1-CD2 4.28Å; I115-L159 HydrophobicContact CG1-CD2 3.97Å; I115-L159 HydrophobicContact CG2-CD2 4.04Å; M118-L159 HydrophobicContact CE-CB 4.33Å; L156-L159 WeakPolarHBondContact O-CB 3.42Å; L156-L159 PolarHBondContact O-N 2.88Å; R157-L159 PolarHBondContact O-N 3.36Å; L159-E161 VanDerWaalsContact C-N 3.34Å; L159-E161 PolarHBondContact O-N 3.44Å; L159-I162 HydrophobicContact CD1-CG2 3.79Å; L159-I162 HydrophobicContact CG-CG2 4.12Å; L159-I162 WeakPolarHBondContact O-CG2 3.33Å; L159-I162 PolarHBondContact O-N 3.04Å; L159-N163 VanDerWaalsContact O-CB 3.23Å; L159-N163 WeakPolarHBondContact O-CB 3.44Å; L159-N163 PolarHBondContact O-N 2.96Å; L159-L181 HydrophobicContact CD1-CD1 4.47Å; L159-L181 HydrophobicContact CD1-CD2 4.4Å; L159-W189 HydrophobicContact CB-CZ2 4.32Å; L159-W189 HydrophobicContact CD1-CH2 4.37Å; L159-W189 HydrophobicContact CD1-CZ2 4.07Å; L159-W189 HydrophobicContact CD2-CH2 4.15Å; L159-W189 HydrophobicContact CD2-CZ2 4.22Å; L159-W189 HydrophobicContact CG-CZ2 4.44Å; L159-L194 HydrophobicContact CD1-CD1 4.27Å; L159-A197 HydrophobicContact CD1-CB 4.34Å; L159-A197 HydrophobicContact CD2-CB 4.07Å; L159-L201 HydrophobicContact CD1-CD1 4.42Å; L159-L201 HydrophobicContact CD2-CD1 3.95Å; L159-L201 HydrophobicContact CD2-CD2 4.32Å; L159-L201 HydrophobicContact CD2-CG 4.33Å; L159-L201 HydrophobicContact CG-CD1 3.97Å
160	S	97.9	Very high	97.8	Very high	11 Å²	11	35 Å²	35	8%	0.077	15%	0.154	C	C	.	.	H	α-helix	trans	-56	-44.2	-178.3	59	0	0	0	0	113.1	R157 K158 N163 K164 E317	R157-S160 VanDerWaalsContact O-CB 3.29Å; R157-S160 WeakPolarHBondContact O-CB 3.45Å; R157-S160 PolarHBondContact O-N 3.18Å; R157-S160 PolarHBondContact O-OG 3.46Å; K158-S160 VanDerWaalsContact C-N 3.3Å; S160-N163 WeakPolarHBondContact O-CB 3.22Å; S160-N163 PolarHBondContact O-N 3.07Å; S160-K164 WeakPolarHBondContact O-CB 3.46Å; S160-K164 PolarHBondContact O-N 3.04Å; S160-E317 VanDerWaalsContact CB-OE2 3.25Å; S160-E317 WeakPolarHBondContact CB-OE2 3.38Å; S160-E317 VanDerWaalsContact OG-CD 3.28Å; S160-E317 PolarHBondContact OG-OE2 2.9Å
161	E	98.4	Very high	97.7	Very high	69 Å²	69	31.2 Å²	31.2	32%	0.322	14%	0.135	S	C	.	.	H	α-helix	trans	-65.6	-50.5	-175.7	-174	58.8	-155.1	0	0	110.8	L159 N163 K164 L165	L159-E161 VanDerWaalsContact C-N 3.34Å; L159-E161 PolarHBondContact O-N 3.44Å; E161-N163 VanDerWaalsContact C-N 3.32Å; E161-N163 PolarHBondContact O-N 3.44Å; E161-K164 PolarHBondContact O-N 3.46Å; E161-K164 WeakPolarHBondContact OE1-CE 3.21Å; E161-K164 IonicContact OE1-NZ 2.94Å; E161-K164 PolarHBondContact OE1-NZ 3.17Å; E161-K164 IonicContact OE2-NZ 2.8Å; E161-K164 PolarHBondContact OE2-NZ 3.34Å; E161-L165 WeakPolarHBondContact O-CG 3.23Å; E161-L165 PolarHBondContact O-N 3.31Å
162	I	98.7	Very high	97.7	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-67.9	-33.4	178.8	-162.6	157.2	0	0	0	111.9	L159 L165 L166 I173 I178 L181 L198 L201	L159-I162 HydrophobicContact CD1-CG2 3.79Å; L159-I162 HydrophobicContact CG-CG2 4.12Å; L159-I162 WeakPolarHBondContact O-CG2 3.33Å; L159-I162 PolarHBondContact O-N 3.04Å; I162-L165 PolarHBondContact O-N 3.44Å; I162-L166 HydrophobicContact CG1-CD1 4.19Å; I162-L166 HydrophobicContact CG1-CG 4.26Å; I162-L166 WeakPolarHBondContact O-CB 3.5Å; I162-L166 VanDerWaalsContact O-CG 3.22Å; I162-L166 WeakPolarHBondContact O-CG 3.45Å; I162-L166 PolarHBondContact O-N 3.34Å; I162-I173 HydrophobicContact CD1-CG2 4.18Å; I162-I173 HydrophobicContact CG1-CD1 4.29Å; I162-I178 HydrophobicContact CD1-CD1 3.8Å; I162-L181 HydrophobicContact CB-CD1 4.41Å; I162-L181 HydrophobicContact CD1-CD1 4.13Å; I162-L181 HydrophobicContact CG2-CD1 3.97Å; I162-L198 HydrophobicContact CD1-CD2 3.69Å; I162-L198 HydrophobicContact CG1-CD2 4.03Å; I162-L198 HydrophobicContact CG2-CD2 4.45Å; I162-L201 HydrophobicContact CG2-CD1 4.39Å
163	N	98.9	Very high	97.7	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.011	13%	0.129	C	C	.	.	H	α-helix	trans	-58.9	-49.5	172.9	174.4	27.3	0	0	0	111.5	M118 R122 L159 S160 E161 L165 L166 A167 L201 H205	M118-N163 VanDerWaalsContact C-ND2 3.33Å; M118-N163 PolarHBondContact O-ND2 3.36Å; R122-N163 WeakPolarHBondContact CG-OD1 3.2Å; L159-N163 VanDerWaalsContact O-CB 3.23Å; L159-N163 WeakPolarHBondContact O-CB 3.44Å; L159-N163 PolarHBondContact O-N 2.96Å; S160-N163 WeakPolarHBondContact O-CB 3.22Å; S160-N163 PolarHBondContact O-N 3.07Å; E161-N163 VanDerWaalsContact C-N 3.32Å; E161-N163 PolarHBondContact O-N 3.44Å; N163-L165 VanDerWaalsContact C-N 3.34Å; N163-L165 PolarHBondContact O-N 3.1Å; N163-L166 PolarHBondContact O-N 3.39Å; N163-A167 WeakPolarHBondContact O-CB 3.31Å; N163-A167 PolarHBondContact O-N 3.13Å; N163-L201 HydrophobicContact CB-CD1 4.05Å; N163-L201 HydrophobicContact CB-CD2 3.87Å; N163-H205 PolarHBondContact O-CE1 3.19Å; N163-H205 PolarHBondContact OD1-CE1 3.03Å; N163-H205 VanDerWaalsContact OD1-CE1 3.25Å; N163-H205 PolarHBondContact OD1-NE2 2.83Å
164	K	98.4	Very high	97.7	Very high	18 Å²	18	28.9 Å²	28.9	8%	0.078	13%	0.133	C	C	.	.	H	α-helix	trans	-57.7	-45.7	175.8	177.3	-170.9	79.3	-167	0	111.8	S160 E161 H168 D318 F321	S160-K164 WeakPolarHBondContact O-CB 3.46Å; S160-K164 PolarHBondContact O-N 3.04Å; E161-K164 PolarHBondContact O-N 3.46Å; E161-K164 WeakPolarHBondContact OE1-CE 3.21Å; E161-K164 IonicContact OE1-NZ 2.94Å; E161-K164 PolarHBondContact OE1-NZ 3.17Å; E161-K164 IonicContact OE2-NZ 2.8Å; E161-K164 PolarHBondContact OE2-NZ 3.34Å; K164-H168 PolarHBondContact O-CD2 3.11Å; K164-H168 VanDerWaalsContact O-CD2 3.24Å; K164-H168 PolarHBondContact O-N 2.77Å; K164-D318 HydrophobicContact CD-CB 3.91Å; K164-D318 IonicContact NZ-OD2 3.93Å; K164-F321 HydrophobicContact CD-CB 3.81Å; K164-F321 HydrophobicContact CD-CD1 3.86Å; K164-F321 HydrophobicContact CD-CD2 3.94Å; K164-F321 HydrophobicContact CD-CE1 4.35Å; K164-F321 HydrophobicContact CD-CE2 4.44Å; K164-F321 HydrophobicContact CD-CG 3.61Å; K164-F321 HydrophobicContact CG-CB 3.96Å; K164-F321 HydrophobicContact CG-CD1 3.38Å; K164-F321 HydrophobicContact CG-CD2 4.4Å; K164-F321 HydrophobicContact CG-CE1 3.87Å; K164-F321 HydrophobicContact CG-CG 3.67Å
165	L	98.5	Very high	97.8	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-47.3	-179.9	-63.8	-177.4	0	0	0	112	E161 I162 N163 A167 H168 R169 P170 L172 I173 H177 F321	E161-L165 WeakPolarHBondContact O-CG 3.23Å; E161-L165 PolarHBondContact O-N 3.31Å; I162-L165 PolarHBondContact O-N 3.44Å; N163-L165 VanDerWaalsContact C-N 3.34Å; N163-L165 PolarHBondContact O-N 3.1Å; L165-A167 VanDerWaalsContact C-N 3.29Å; L165-A167 PolarHBondContact O-N 3.09Å; L165-H168 PolarHBondContact O-N 3.42Å; L165-R169 CarbonylContact O-C 3.57Å; L165-R169 WeakPolarHBondContact O-CA 3.47Å; L165-R169 PolarHBondContact O-N 3.16Å; L165-P170 WeakPolarHBondContact O-CA 3.36Å; L165-L172 HydrophobicContact CD2-CB 4.06Å; L165-L172 HydrophobicContact CD2-CD1 4.3Å; L165-I173 HydrophobicContact CB-CD1 4.29Å; L165-I173 HydrophobicContact CB-CG1 3.69Å; L165-I173 HydrophobicContact CD1-CG1 4.07Å; L165-H177 WeakPolarHBondContact CD1-NE2 3.45Å; L165-F321 HydrophobicContact CD2-CE1 4.26Å; L165-F321 HydrophobicContact CD2-CZ 3.86Å
166	L	98.8	Very high	97.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-55.4	-43.8	176.6	-76.6	168.2	0	0	0	112.4	I162 N163 H168 I173 L198 L201 T202 A467 A471	I162-L166 HydrophobicContact CG1-CD1 4.19Å; I162-L166 HydrophobicContact CG1-CG 4.26Å; I162-L166 WeakPolarHBondContact O-CB 3.5Å; I162-L166 VanDerWaalsContact O-CG 3.22Å; I162-L166 WeakPolarHBondContact O-CG 3.45Å; I162-L166 PolarHBondContact O-N 3.34Å; N163-L166 PolarHBondContact O-N 3.39Å; L166-H168 PolarHBondContact O-N 2.97Å; L166-I173 HydrophobicContact CD2-CD1 3.53Å; L166-I173 HydrophobicContact CG-CD1 3.78Å; L166-L198 HydrophobicContact CD1-CD2 3.71Å; L166-L201 HydrophobicContact CD1-CB 4.01Å; L166-L201 HydrophobicContact CD1-CD1 3.76Å; L166-T202 HydrophobicContact CB-CG2 4.46Å; L166-T202 HydrophobicContact CD1-CG2 4.18Å; L166-T202 HydrophobicContact CD2-CG2 3.76Å; L166-T202 HydrophobicContact CG-CG2 4.37Å; L166-A467 HydrophobicContact CD2-CB 4.08Å; L166-A467 WeakPolarHBondContact CD2-O 3.27Å; L166-A471 HydrophobicContact CD2-CB 3.97Å
167	A	98.5	Very high	97.8	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-38.5	-177	0	0	0	0	0	112.7	R122 N163 L165 R463	R122-A167 HydrophobicContact CB-CB 3.83Å; R122-A167 HydrophobicContact CG-CB 3.93Å; N163-A167 WeakPolarHBondContact O-CB 3.31Å; N163-A167 PolarHBondContact O-N 3.13Å; L165-A167 VanDerWaalsContact C-N 3.29Å; L165-A167 PolarHBondContact O-N 3.09Å; A167-R463 PolarHBondContact O-NH2 3.21Å
168	H	97.5	Very high	97.9	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-124.8	-35.7	-163	-56.4	-63	0	0	0	115.1	R122 H123 K164 L165 L166 F321	R122-H168 PolarHBondContact NE-NE2 3.4Å; R122-H168 PolarHBondContact NH2-CD2 3.26Å; R122-H168 VanDerWaalsContact NH2-CD2 3.26Å; R122-H168 PolarHBondContact NH2-NE2 3.29Å; R122-H168 PolarHBondContact O-CE1 3.02Å; H123-H168 AromaticContact CE1-CE1 3.58Å; H123-H168 AromaticContact CE1-ND1 3.83Å; H123-H168 AromaticContact ND1-CE1 3.97Å; K164-H168 PolarHBondContact O-CD2 3.11Å; K164-H168 VanDerWaalsContact O-CD2 3.24Å; K164-H168 PolarHBondContact O-N 2.77Å; L165-H168 PolarHBondContact O-N 3.42Å; L166-H168 PolarHBondContact O-N 2.97Å; H168-F321 HydrophobicContact CB-CD1 3.85Å; H168-F321 HydrophobicContact CB-CE1 3.86Å; H168-F321 AromaticContact CD2-CD1 3.83Å; H168-F321 PolarHBondContact CD2-O 3.43Å; H168-F321 PolarHBondContact NE2-O 3.03Å
169	R	97.2	Very high	97.9	Very high	32 Å²	32	30.7 Å²	30.7	12%	0.121	15%	0.146	C	C	.	.			trans	-147.4	63.6	-174	-56.6	-173.7	-152.8	179.9	3	110.9	L165 W171 L172 F321 G322 E324	L165-R169 CarbonylContact O-C 3.57Å; L165-R169 WeakPolarHBondContact O-CA 3.47Å; L165-R169 PolarHBondContact O-N 3.16Å; R169-W171 HydrophobicContact CB-CD2 4.38Å; R169-W171 HydrophobicContact CB-CH2 4.23Å; R169-W171 HydrophobicContact CB-CZ2 3.71Å; R169-W171 HydrophobicContact CG-CH2 4.14Å; R169-W171 HydrophobicContact CG-CZ2 3.67Å; R169-W171 PolarHBondContact O-N 3.22Å; R169-W171 VanDerWaalsContact O-N 3.12Å; R169-L172 HydrophobicContact CB-CD1 3.77Å; R169-L172 HydrophobicContact CB-CG 4.05Å; R169-L172 HydrophobicContact CG-CD1 4.42Å; R169-L172 WeakPolarHBondContact O-CB 3.14Å; R169-L172 PolarHBondContact O-N 2.8Å; R169-F321 HydrophobicContact CB-CE1 4.17Å; R169-F321 HydrophobicContact CB-CZ 4.22Å; R169-F321 HydrophobicContact CG-CE1 3.85Å; R169-F321 HydrophobicContact CG-CZ 3.99Å; R169-G322 VanDerWaalsContact CZ-O 3.31Å; R169-G322 PolarHBondContact NE-O 3.33Å; R169-G322 PolarHBondContact NH2-O 2.94Å; R169-E324 VanDerWaalsContact CZ-CG 3.49Å; R169-E324 IonicContact CZ-OE1 3.12Å; R169-E324 IonicContact CZ-OE2 3.48Å; R169-E324 IonicContact NH1-OE1 2.86Å; R169-E324 PolarHBondContact NH1-OE1 3.18Å; R169-E324 IonicContact NH1-OE2 3.89Å; R169-E324 PolarHBondContact NH1-OE2 3.02Å; R169-E324 IonicContact NH2-OE1 3.39Å; R169-E324 PolarHBondContact NH2-OE1 2.72Å; R169-E324 IonicContact NH2-OE2 3.9Å
170	P	97.8	Very high	97.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-62.7	-24.8	-171.6	24.2	-35.1	0	0	0	113	L165 L172 I173 F401 A467 Y470	L165-P170 WeakPolarHBondContact O-CA 3.36Å; P170-L172 PolarHBondContact O-N 3.19Å; P170-L172 VanDerWaalsContact O-N 3.14Å; P170-I173 HydrophobicContact CB-CD1 4.34Å; P170-I173 WeakPolarHBondContact O-CB 3.48Å; P170-I173 VanDerWaalsContact O-CG1 3.24Å; P170-I173 WeakPolarHBondContact O-CG1 3.43Å; P170-I173 PolarHBondContact O-N 2.97Å; P170-F401 HydrophobicContact CG-CD1 3.7Å; P170-F401 HydrophobicContact CG-CE1 4.22Å; P170-A467 HydrophobicContact CB-CB 4.19Å; P170-A467 HydrophobicContact CG-CB 4.45Å; P170-Y470 HydrophobicContact CB-CD2 3.76Å; P170-Y470 HydrophobicContact CB-CG 4.29Å; P170-Y470 HydrophobicContact CG-CD2 3.9Å; P170-Y470 HydrophobicContact CG-CE2 4.32Å; P170-Y470 VanDerWaalsContact O-CB 3.27Å; P170-Y470 WeakPolarHBondContact O-CB 3.47Å
171	W	96.3	Very high	97.7	Very high	25 Å²	25	33 Å²	33	10%	0.095	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-62.5	-16.5	174.8	58.1	81.3	0	0	0	114.7	R169 I173 Y323 F326 P334 F401 Y470	R169-W171 HydrophobicContact CB-CD2 4.38Å; R169-W171 HydrophobicContact CB-CH2 4.23Å; R169-W171 HydrophobicContact CB-CZ2 3.71Å; R169-W171 HydrophobicContact CG-CH2 4.14Å; R169-W171 HydrophobicContact CG-CZ2 3.67Å; R169-W171 PolarHBondContact O-N 3.22Å; R169-W171 VanDerWaalsContact O-N 3.12Å; W171-I173 VanDerWaalsContact C-N 3.31Å; W171-Y323 AromaticContact CH2-CD2 3.71Å; W171-Y323 HydrophobicContact CH2-CD2 3.71Å; W171-Y323 AromaticContact CH2-CE2 3.54Å; W171-Y323 HydrophobicContact CH2-CE2 3.54Å; W171-Y323 HydrophobicContact CZ3-CD2 4.3Å; W171-Y323 AromaticContact CZ3-CE2 4Å; W171-Y323 HydrophobicContact CZ3-CE2 4Å; W171-F326 AromaticContact CD2-CZ 4Å; W171-F326 HydrophobicContact CD2-CZ 4Å; W171-F326 AromaticContact CE3-CZ 3.99Å; W171-F326 HydrophobicContact CE3-CZ 3.99Å; W171-F326 HydrophobicContact CH2-CE2 4.24Å; W171-F326 HydrophobicContact CH2-CZ 4.05Å; W171-F326 HydrophobicContact CZ2-CZ 4.06Å; W171-F326 HydrophobicContact CZ3-CE2 4.33Å; W171-F326 HydrophobicContact CZ3-CZ 4.02Å; W171-P334 HydrophobicContact CG-CB 4.22Å; W171-P334 HydrophobicContact CG-CG 4.24Å; W171-F401 HydrophobicContact CE3-CD1 4.31Å; W171-F401 AromaticContact CZ3-CD1 3.77Å; W171-F401 HydrophobicContact CZ3-CD1 3.77Å; W171-F401 HydrophobicContact CZ3-CE1 4.49Å; W171-Y470 HydrophobicContact CB-CD1 4.21Å; W171-Y470 HydrophobicContact CB-CE1 3.69Å; W171-Y470 HydrophobicContact CB-CE2 4.04Å
172	L	96.3	Very high	97.6	Very high	67 Å²	67	30.6 Å²	30.6	35%	0.351	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-83.6	-5.9	175.4	-62.7	-179.6	0	0	0	113.2	L165 R169 P170 T174 H177 F321	L165-L172 HydrophobicContact CD2-CB 4.06Å; L165-L172 HydrophobicContact CD2-CD1 4.3Å; R169-L172 HydrophobicContact CB-CD1 3.77Å; R169-L172 HydrophobicContact CB-CG 4.05Å; R169-L172 HydrophobicContact CG-CD1 4.42Å; R169-L172 WeakPolarHBondContact O-CB 3.14Å; R169-L172 PolarHBondContact O-N 2.8Å; P170-L172 PolarHBondContact O-N 3.19Å; P170-L172 VanDerWaalsContact O-N 3.14Å; L172-T174 WeakPolarHBondContact O-CG2 3.39Å; L172-T174 PolarHBondContact O-N 3.11Å; L172-H177 PolarHBondContact O-CE1 3.33Å; L172-F321 HydrophobicContact CD1-CZ 4.35Å
173	I	98	Very high	97.2	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.036	19%	0.185	C	C	.	.			trans	-69.1	127.4	177.6	-59	169	0	0	0	109	I162 L165 L166 P170 W171 A471 A474	I162-I173 HydrophobicContact CD1-CG2 4.18Å; I162-I173 HydrophobicContact CG1-CD1 4.29Å; L165-I173 HydrophobicContact CB-CD1 4.29Å; L165-I173 HydrophobicContact CB-CG1 3.69Å; L165-I173 HydrophobicContact CD1-CG1 4.07Å; L166-I173 HydrophobicContact CD2-CD1 3.53Å; L166-I173 HydrophobicContact CG-CD1 3.78Å; P170-I173 HydrophobicContact CB-CD1 4.34Å; P170-I173 WeakPolarHBondContact O-CB 3.48Å; P170-I173 VanDerWaalsContact O-CG1 3.24Å; P170-I173 WeakPolarHBondContact O-CG1 3.43Å; P170-I173 PolarHBondContact O-N 2.97Å; W171-I173 VanDerWaalsContact C-N 3.31Å; I173-A471 HydrophobicContact CD1-CB 4.12Å; I173-A474 HydrophobicContact CG2-CB 3.79Å
174	T	97.6	Very high	96.2	Very high	52 Å²	52	43.9 Å²	43.9	32%	0.319	22%	0.224	S	C	.	.			trans	-125.8	167.2	-179.1	74.9	0	0	0	0	111.2	L172 E176 H177 I178	L172-T174 WeakPolarHBondContact O-CG2 3.39Å; L172-T174 PolarHBondContact O-N 3.11Å; T174-E176 WeakPolarHBondContact CB-OE2 3.5Å; T174-E176 PolarHBondContact O-N 3.29Å; T174-E176 PolarHBondContact OG1-N 3.36Å; T174-E176 PolarHBondContact OG1-OE2 3.05Å; T174-H177 PolarHBondContact N-ND1 3.32Å; T174-H177 VanDerWaalsContact N-ND1 3.11Å; T174-H177 WeakPolarHBondContact O-CB 3.44Å; T174-H177 PolarHBondContact O-N 3.31Å; T174-H177 VanDerWaalsContact O-N 3.14Å; T174-H177 PolarHBondContact OG1-ND1 3.18Å; T174-I178 PolarHBondContact O-N 3.44Å
175	K	97.6	Very high	95.2	Very high	93 Å²	93	45.4 Å²	45.4	40%	0.404	25%	0.245	S	C	.	.	H	α-helix	trans	-62.1	-25.5	178	67.1	178	-177.1	176.4	0	112.9	H177 I178 Q179 R477	K175-H177 VanDerWaalsContact C-N 3.33Å; K175-I178 WeakPolarHBondContact O-CB 3.28Å; K175-I178 PolarHBondContact O-N 3.22Å; K175-Q179 WeakPolarHBondContact O-CB 3.38Å; K175-Q179 PolarHBondContact O-N 3.02Å; K175-R477 HydrophobicContact CB-CB 4.28Å; K175-R477 WeakPolarHBondContact CD-O 3.32Å
176	E	97.9	Very high	94	Very high	97 Å²	97	53.6 Å²	53.6	45%	0.453	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-35.8	177.1	-64.6	69.1	-148.4	0	0	111.3	T174 I178 Q179 A180	T174-E176 WeakPolarHBondContact CB-OE2 3.5Å; T174-E176 PolarHBondContact O-N 3.29Å; T174-E176 PolarHBondContact OG1-N 3.36Å; T174-E176 PolarHBondContact OG1-OE2 3.05Å; E176-I178 VanDerWaalsContact C-N 3.34Å; E176-Q179 PolarHBondContact O-N 3.1Å; E176-A180 WeakPolarHBondContact O-CB 3.35Å; E176-A180 PolarHBondContact O-N 2.95Å
177	H	98	Very high	93.1	Very high	51 Å²	51	57 Å²	57	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-42.1	172.3	-60.7	98	0	0	0	110.9	L165 L172 T174 K175 A180 L181	L165-H177 WeakPolarHBondContact CD1-NE2 3.45Å; L172-H177 PolarHBondContact O-CE1 3.33Å; T174-H177 PolarHBondContact N-ND1 3.32Å; T174-H177 VanDerWaalsContact N-ND1 3.11Å; T174-H177 WeakPolarHBondContact O-CB 3.44Å; T174-H177 PolarHBondContact O-N 3.31Å; T174-H177 VanDerWaalsContact O-N 3.14Å; T174-H177 PolarHBondContact OG1-ND1 3.18Å; K175-H177 VanDerWaalsContact C-N 3.33Å; H177-A180 PolarHBondContact O-N 2.84Å; H177-L181 PolarHBondContact O-N 2.99Å
178	I	98.3	Very high	92.8	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-46.3	175.5	-53.7	-53.6	0	0	0	110.8	I162 T174 K175 E176 A180 L181 L182 L194 A474 I475 Y478	I162-I178 HydrophobicContact CD1-CD1 3.8Å; T174-I178 PolarHBondContact O-N 3.44Å; K175-I178 WeakPolarHBondContact O-CB 3.28Å; K175-I178 PolarHBondContact O-N 3.22Å; E176-I178 VanDerWaalsContact C-N 3.34Å; I178-A180 VanDerWaalsContact C-N 3.28Å; I178-A180 PolarHBondContact O-N 3Å; I178-L181 PolarHBondContact O-N 3.44Å; I178-L181 VanDerWaalsContact O-N 3.1Å; I178-L182 HydrophobicContact CG2-CD1 3.68Å; I178-L182 HydrophobicContact CG2-CG 4.28Å; I178-L182 WeakPolarHBondContact O-CG 3.38Å; I178-L182 PolarHBondContact O-N 2.86Å; I178-L194 HydrophobicContact CG2-CD2 4.29Å; I178-A474 HydrophobicContact CD1-CB 4.4Å; I178-A474 HydrophobicContact CG1-CB 3.89Å; I178-I475 HydrophobicContact CD1-CD1 4.46Å; I178-I475 HydrophobicContact CD1-CG1 3.71Å; I178-I475 HydrophobicContact CG1-CG1 3.95Å; I178-I475 HydrophobicContact CG2-CG1 3.96Å; I178-Y478 HydrophobicContact CB-CG 4.35Å; I178-Y478 HydrophobicContact CG2-CD1 3.97Å; I178-Y478 HydrophobicContact CG2-CG 3.89Å
179	Q	96.9	Very high	92.8	Very high	102 Å²	102	58.9 Å²	58.9	48%	0.477	31%	0.31	S	S	.	.	H	α-helix	trans	-57.5	-41	176.8	-177.7	178	1.9	0	0	111.7	K175 E176 L181 L182 K183 Y478	K175-Q179 WeakPolarHBondContact O-CB 3.38Å; K175-Q179 PolarHBondContact O-N 3.02Å; E176-Q179 PolarHBondContact O-N 3.1Å; Q179-L181 VanDerWaalsContact C-N 3.27Å; Q179-L181 PolarHBondContact O-N 3.3Å; Q179-L182 PolarHBondContact O-N 3.22Å; Q179-K183 VanDerWaalsContact O-CB 3.3Å; Q179-K183 WeakPolarHBondContact O-CB 3.36Å; Q179-K183 PolarHBondContact O-N 2.79Å; Q179-Y478 HydrophobicContact CB-CD2 3.86Å; Q179-Y478 HydrophobicContact CB-CE2 3.62Å; Q179-Y478 HydrophobicContact CG-CE2 3.88Å
180	A	95.9	Very high	92.8	Very high	54 Å²	54	59.9 Å²	59.9	45%	0.446	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-35.3	178.5	0	0	0	0	0	112.6	K158 E176 H177 I178	K158-A180 WeakPolarHBondContact CE-O 3.36Å; K158-A180 PolarHBondContact NZ-O 3.33Å; E176-A180 WeakPolarHBondContact O-CB 3.35Å; E176-A180 PolarHBondContact O-N 2.95Å; H177-A180 PolarHBondContact O-N 2.84Å; I178-A180 VanDerWaalsContact C-N 3.28Å; I178-A180 PolarHBondContact O-N 3Å
181	L	97.1	Very high	92.8	Very high	5 Å²	5	62.2 Å²	62.2	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-74.8	-41.6	178.4	-65.5	170	0	0	0	112.1	K158 L159 I162 H177 I178 Q179 W189 L194	K158-L181 HydrophobicContact CB-CD2 3.97Å; K158-L181 WeakPolarHBondContact O-CD2 3.38Å; L159-L181 HydrophobicContact CD1-CD1 4.47Å; L159-L181 HydrophobicContact CD1-CD2 4.4Å; I162-L181 HydrophobicContact CB-CD1 4.41Å; I162-L181 HydrophobicContact CD1-CD1 4.13Å; I162-L181 HydrophobicContact CG2-CD1 3.97Å; H177-L181 PolarHBondContact O-N 2.99Å; I178-L181 PolarHBondContact O-N 3.44Å; I178-L181 VanDerWaalsContact O-N 3.1Å; Q179-L181 VanDerWaalsContact C-N 3.27Å; Q179-L181 PolarHBondContact O-N 3.3Å; L181-W189 PolarHBondContact O-N 2.85Å; L181-L194 HydrophobicContact CB-CD2 4.4Å; L181-L194 HydrophobicContact CD1-CD1 3.61Å; L181-L194 HydrophobicContact CD1-CD2 4.29Å
182	L	95.5	Very high	92.8	Very high	19 Å²	19	62.7 Å²	62.7	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-87.4	-7.4	-176.6	-57.7	179.2	0	0	0	114.2	I178 Q179 T184 T188 W189 L191 L194 Y478	I178-L182 HydrophobicContact CG2-CD1 3.68Å; I178-L182 HydrophobicContact CG2-CG 4.28Å; I178-L182 WeakPolarHBondContact O-CG 3.38Å; I178-L182 PolarHBondContact O-N 2.86Å; Q179-L182 PolarHBondContact O-N 3.22Å; L182-T184 PolarHBondContact O-N 3.17Å; L182-T188 VanDerWaalsContact O-CG2 3.26Å; L182-T188 WeakPolarHBondContact O-CG2 3.41Å; L182-W189 HydrophobicContact CD2-CB 4.24Å; L182-W189 WeakPolarHBondContact CD2-O 2.96Å; L182-L191 HydrophobicContact CD1-CD2 3.64Å; L182-L191 HydrophobicContact CD1-CG 4.27Å; L182-L191 HydrophobicContact CD2-CD2 4.35Å; L182-L194 HydrophobicContact CD2-CD2 3.96Å; L182-L194 HydrophobicContact CG-CD2 4.24Å; L182-Y478 HydrophobicContact CB-CE1 4.43Å; L182-Y478 HydrophobicContact CD1-CD1 3.76Å; L182-Y478 HydrophobicContact CD1-CE1 3.36Å
183	K	89.8	Confident	92.9	Very high	149 Å²	149	61.3 Å²	61.3	65%	0.648	34%	0.335	S	S	*	.	S	Bend	trans	-58.4	122.9	179.7	-174.6	176.5	-177.4	179.3	0	111.3	Q179 G185 T188	Q179-K183 VanDerWaalsContact O-CB 3.3Å; Q179-K183 WeakPolarHBondContact O-CB 3.36Å; Q179-K183 PolarHBondContact O-N 2.79Å; K183-G185 PolarHBondContact O-N 2.85Å; K183-T188 WeakPolarHBondContact O-CG2 3.49Å; K183-T188 PolarHBondContact O-OG1 3.08Å
184	T	78.7	Confident	92.9	Very high	136 Å²	136	61 Å²	61	83%	0.834	33%	0.333	S	S	*	.	S	Bend	trans	-54.7	125.8	-179.8	-43.3	0	0	0	0	112.2	L182	L182-T184 PolarHBondContact O-N 3.17Å
185	G	77.7	Confident	93	Very high	50 Å²	50	58.6 Å²	58.6	52%	0.515	32%	0.318	S	S	.	.	S	Bend	trans	-177.5	-169	175.6	0	0	0	0	0	111.2	K183 H187 T188	K183-G185 PolarHBondContact O-N 2.85Å; G185-H187 PolarHBondContact O-N 3.49Å; G185-H187 VanDerWaalsContact O-N 3.16Å; G185-T188 PolarHBondContact N-OG1 3.46Å; G185-T188 PolarHBondContact O-OG1 2.83Å
186	E	72.1	Confident	93.1	Very high	176 Å²	176	54.1 Å²	54.1	82%	0.822	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.9	-176.1	-163	174.2	-170.3	0	0	113.9
187	H	80.3	Confident	93.1	Very high	74 Å²	74	49.5 Å²	49.5	34%	0.343	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	63.6	-173.3	-61.5	-42.6	0	0	0	111.3	K155 G185	K155-H187 HydrophobicContact CB-CB 4.02Å; G185-H187 PolarHBondContact O-N 3.49Å; G185-H187 VanDerWaalsContact O-N 3.16Å
188	T	92.5	Very high	93.1	Very high	42 Å²	42	47.1 Å²	47.1	26%	0.258	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-94.5	143.9	-174.2	-44.5	0	0	0	0	111.3	K155 L182 K183 G185	K155-T188 WeakPolarHBondContact CE-O 3.44Å; K155-T188 PolarHBondContact NZ-O 3.29Å; L182-T188 VanDerWaalsContact O-CG2 3.26Å; L182-T188 WeakPolarHBondContact O-CG2 3.41Å; K183-T188 WeakPolarHBondContact O-CG2 3.49Å; K183-T188 PolarHBondContact O-OG1 3.08Å; G185-T188 PolarHBondContact N-OG1 3.46Å; G185-T188 PolarHBondContact O-OG1 2.83Å
189	W	97.9	Very high	93.2	Very high	5 Å²	5	47.2 Å²	47.2	2%	0.019	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-87	134.4	168.5	-71.1	86.1	0	0	0	109.9	L107 I115 K155 L156 L159 L181 L182 E193 L194 A197	L107-W189 HydrophobicContact CD1-CZ3 4.11Å; L107-W189 HydrophobicContact CD2-CH2 4.34Å; L107-W189 HydrophobicContact CD2-CZ3 3.82Å; I115-W189 HydrophobicContact CD1-CH2 4.04Å; K155-W189 HydrophobicContact CG-CD2 4.26Å; K155-W189 HydrophobicContact CG-CG 4.42Å; K155-W189 HydrophobicContact CG-CZ2 4.04Å; K155-W189 PolarHBondContact O-NE1 3.1Å; L156-W189 HydrophobicContact CD2-CH2 4.29Å; L156-W189 HydrophobicContact CD2-CZ2 4.32Å; L159-W189 HydrophobicContact CB-CZ2 4.32Å; L159-W189 HydrophobicContact CD1-CH2 4.37Å; L159-W189 HydrophobicContact CD1-CZ2 4.07Å; L159-W189 HydrophobicContact CD2-CH2 4.15Å; L159-W189 HydrophobicContact CD2-CZ2 4.22Å; L159-W189 HydrophobicContact CG-CZ2 4.44Å; L181-W189 PolarHBondContact O-N 2.85Å; L182-W189 HydrophobicContact CD2-CB 4.24Å; L182-W189 WeakPolarHBondContact CD2-O 2.96Å; W189-E193 HydrophobicContact CE3-CB 3.69Å; W189-E193 HydrophobicContact CZ3-CB 4.06Å; W189-L194 HydrophobicContact CB-CB 4.46Å; W189-A197 HydrophobicContact CH2-CB 4.02Å; W189-A197 HydrophobicContact CZ3-CB 3.71Å
190	S	96.9	Very high	93.3	Very high	54 Å²	54	42.3 Å²	42.3	38%	0.378	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-78	163.2	161.2	68	0	0	0	0	110.4	A192 E193 L194	S190-A192 VanDerWaalsContact C-N 3.32Å; S190-A192 PolarHBondContact O-N 3.29Å; S190-E193 PolarHBondContact N-OE2 3.01Å; S190-E193 PolarHBondContact O-N 2.74Å; S190-E193 WeakPolarHBondContact OG-CB 3.18Å; S190-E193 WeakPolarHBondContact OG-CG 3.42Å; S190-E193 PolarHBondContact OG-N 2.8Å; S190-E193 PolarHBondContact OG-OE2 3.21Å; S190-L194 VanDerWaalsContact O-CB 3.29Å; S190-L194 WeakPolarHBondContact O-CB 3.12Å; S190-L194 PolarHBondContact O-N 3.4Å
191	L	97.2	Very high	93.4	Very high	48 Å²	48	39.8 Å²	39.8	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-39.4	174.6	-78.3	169.7	0	0	0	112.1	L182 L194 I195 L355 I475 M479	L182-L191 HydrophobicContact CD1-CD2 3.64Å; L182-L191 HydrophobicContact CD1-CG 4.27Å; L182-L191 HydrophobicContact CD2-CD2 4.35Å; L191-L194 PolarHBondContact O-N 3.46Å; L191-I195 WeakPolarHBondContact O-CB 3.41Å; L191-I195 VanDerWaalsContact O-CG1 3.27Å; L191-I195 WeakPolarHBondContact O-CG1 3.42Å; L191-I195 PolarHBondContact O-N 2.98Å; L191-L355 HydrophobicContact CB-CD1 4.33Å; L191-L355 HydrophobicContact CB-CD2 4.07Å; L191-L355 HydrophobicContact CD1-CD2 4.19Å; L191-L355 HydrophobicContact CD2-CD1 4.47Å; L191-I475 HydrophobicContact CD2-CG2 4.15Å; L191-M479 HydrophobicContact CD1-CE 4.22Å; L191-M479 HydrophobicContact CD1-SD 4.39Å
192	A	97.3	Very high	93.5	Very high	35 Å²	35	39.6 Å²	39.6	29%	0.289	22%	0.222	S	C	.	.	H	α-helix	trans	-64.5	-47.5	178.8	0	0	0	0	0	111.8	P106 S190 L194 I195 Q196	P106-A192 HydrophobicContact CB-CB 4.37Å; P106-A192 HydrophobicContact CG-CB 4.11Å; S190-A192 VanDerWaalsContact C-N 3.32Å; S190-A192 PolarHBondContact O-N 3.29Å; A192-L194 VanDerWaalsContact C-N 3.34Å; A192-L194 PolarHBondContact O-N 3.43Å; A192-I195 PolarHBondContact O-N 3.25Å; A192-Q196 PolarHBondContact O-N 2.83Å
193	E	98.4	Very high	93.7	Very high	39 Å²	39	38.8 Å²	38.8	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-41.9	174.8	-70.1	169.6	131.9	0	0	111.8	P106 L107 K155 W189 S190 Q196 A197	P106-E193 HydrophobicContact CB-CB 4.48Å; P106-E193 HydrophobicContact CB-CG 3.95Å; L107-E193 HydrophobicContact CD2-CB 3.94Å; L107-E193 HydrophobicContact CD2-CG 3.87Å; L107-E193 HydrophobicContact CG-CB 4.31Å; L107-E193 HydrophobicContact CG-CG 4.35Å; K155-E193 IonicContact NZ-OE1 3.53Å; K155-E193 PolarHBondContact NZ-OE1 3.1Å; K155-E193 IonicContact NZ-OE2 2.8Å; K155-E193 PolarHBondContact NZ-OE2 3.36Å; W189-E193 HydrophobicContact CE3-CB 3.69Å; W189-E193 HydrophobicContact CZ3-CB 4.06Å; S190-E193 PolarHBondContact N-OE2 3.01Å; S190-E193 PolarHBondContact O-N 2.74Å; S190-E193 WeakPolarHBondContact OG-CB 3.18Å; S190-E193 WeakPolarHBondContact OG-CG 3.42Å; S190-E193 PolarHBondContact OG-N 2.8Å; S190-E193 PolarHBondContact OG-OE2 3.21Å; E193-Q196 PolarHBondContact O-N 3.2Å; E193-A197 WeakPolarHBondContact O-CB 3.49Å; E193-A197 PolarHBondContact O-N 3.32Å
194	L	98.6	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-45.7	179.7	179	57.8	0	0	0	111	L159 I178 L181 L182 W189 S190 L191 A192 Q196 A197 L198	L159-L194 HydrophobicContact CD1-CD1 4.27Å; I178-L194 HydrophobicContact CG2-CD2 4.29Å; L181-L194 HydrophobicContact CB-CD2 4.4Å; L181-L194 HydrophobicContact CD1-CD1 3.61Å; L181-L194 HydrophobicContact CD1-CD2 4.29Å; L182-L194 HydrophobicContact CD2-CD2 3.96Å; L182-L194 HydrophobicContact CG-CD2 4.24Å; W189-L194 HydrophobicContact CB-CB 4.46Å; S190-L194 VanDerWaalsContact O-CB 3.29Å; S190-L194 WeakPolarHBondContact O-CB 3.12Å; S190-L194 PolarHBondContact O-N 3.4Å; L191-L194 PolarHBondContact O-N 3.46Å; A192-L194 VanDerWaalsContact C-N 3.34Å; A192-L194 PolarHBondContact O-N 3.43Å; L194-Q196 PolarHBondContact O-N 3.36Å; L194-A197 PolarHBondContact O-N 3.44Å; L194-L198 HydrophobicContact CD1-CD1 4.35Å; L194-L198 HydrophobicContact CD1-CD2 4.33Å; L194-L198 HydrophobicContact CD1-CG 4.09Å; L194-L198 HydrophobicContact CG-CD1 4.15Å; L194-L198 HydrophobicContact CG-CG 4.34Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 2.86Å
195	I	98.6	Very high	95.1	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-47.4	177.1	-69.9	-71.4	0	0	0	110.5	L191 A192 A197 L198 V199 I352 L355 Y356 L472 I475	L191-I195 WeakPolarHBondContact O-CB 3.41Å; L191-I195 VanDerWaalsContact O-CG1 3.27Å; L191-I195 WeakPolarHBondContact O-CG1 3.42Å; L191-I195 PolarHBondContact O-N 2.98Å; A192-I195 PolarHBondContact O-N 3.25Å; I195-A197 VanDerWaalsContact C-N 3.29Å; I195-A197 PolarHBondContact O-N 3.49Å; I195-L198 PolarHBondContact O-N 3.26Å; I195-V199 HydrophobicContact CG2-CG2 4.5Å; I195-V199 WeakPolarHBondContact O-CG2 3.23Å; I195-V199 PolarHBondContact O-N 3.37Å; I195-I352 HydrophobicContact CG2-CG1 4.35Å; I195-I352 HydrophobicContact CG2-CG2 4.21Å; I195-L355 HydrophobicContact CD1-CD1 4.08Å; I195-L355 HydrophobicContact CG1-CB 3.85Å; I195-L355 HydrophobicContact CG1-CD1 3.79Å; I195-L355 HydrophobicContact CG1-CG 4.49Å; I195-Y356 HydrophobicContact CG2-CD1 4.32Å; I195-Y356 HydrophobicContact CG2-CG 4.29Å; I195-L472 HydrophobicContact CD1-CD2 3.66Å; I195-I475 HydrophobicContact CD1-CD1 3.62Å
196	Q	98.8	Very high	96.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.7	-42.1	176.5	-169	-176.1	35.7	0	0	111.6	P106 L107 A192 E193 L194 V199 L200 Y356	P106-Q196 HydrophobicContact CG-CB 4.47Å; L107-Q196 VanDerWaalsContact CB-OE1 3.28Å; L107-Q196 HydrophobicContact CD1-CB 4.38Å; L107-Q196 HydrophobicContact CD1-CG 4.46Å; A192-Q196 PolarHBondContact O-N 2.83Å; E193-Q196 PolarHBondContact O-N 3.2Å; L194-Q196 PolarHBondContact O-N 3.36Å; Q196-V199 PolarHBondContact O-N 3Å; Q196-L200 HydrophobicContact CG-CD1 4.35Å; Q196-L200 PolarHBondContact O-N 3.49Å; Q196-Y356 HydrophobicContact CG-CE1 4.34Å; Q196-Y356 HydrophobicContact CG-CE2 4.29Å; Q196-Y356 PolarHBondContact NE2-OH 3.17Å
197	A	98.9	Very high	97.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-42.4	176.4	0	0	0	0	0	112.6	L107 I115 L159 W189 E193 L194 I195 V199 L200 L201	L107-A197 HydrophobicContact CD1-CB 4.19Å; I115-A197 HydrophobicContact CD1-CB 4.13Å; L159-A197 HydrophobicContact CD1-CB 4.34Å; L159-A197 HydrophobicContact CD2-CB 4.07Å; W189-A197 HydrophobicContact CH2-CB 4.02Å; W189-A197 HydrophobicContact CZ3-CB 3.71Å; E193-A197 WeakPolarHBondContact O-CB 3.49Å; E193-A197 PolarHBondContact O-N 3.32Å; L194-A197 PolarHBondContact O-N 3.44Å; I195-A197 VanDerWaalsContact C-N 3.29Å; I195-A197 PolarHBondContact O-N 3.49Å; A197-V199 VanDerWaalsContact C-N 3.32Å; A197-V199 PolarHBondContact O-N 2.95Å; A197-L200 PolarHBondContact O-N 3.41Å; A197-L201 WeakPolarHBondContact O-CB 3.4Å; A197-L201 VanDerWaalsContact O-CG 3.23Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.37Å
198	L	98.9	Very high	98.2	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-63.1	-39.9	176.7	-66.4	174.1	0	0	0	111.6	I162 L166 L194 I195 T202 L468 A471 I475	I162-L198 HydrophobicContact CD1-CD2 3.69Å; I162-L198 HydrophobicContact CG1-CD2 4.03Å; I162-L198 HydrophobicContact CG2-CD2 4.45Å; L166-L198 HydrophobicContact CD1-CD2 3.71Å; L194-L198 HydrophobicContact CD1-CD1 4.35Å; L194-L198 HydrophobicContact CD1-CD2 4.33Å; L194-L198 HydrophobicContact CD1-CG 4.09Å; L194-L198 HydrophobicContact CG-CD1 4.15Å; L194-L198 HydrophobicContact CG-CG 4.34Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 2.86Å; I195-L198 PolarHBondContact O-N 3.26Å; L198-T202 WeakPolarHBondContact O-CB 3.23Å; L198-T202 WeakPolarHBondContact O-CG2 3.45Å; L198-T202 PolarHBondContact O-N 3.31Å; L198-T202 PolarHBondContact O-OG1 3.14Å; L198-L468 HydrophobicContact CB-CD2 4.47Å; L198-A471 HydrophobicContact CD1-CB 4.18Å; L198-A471 HydrophobicContact CD2-CB 4.45Å; L198-I475 HydrophobicContact CD1-CD1 3.58Å
199	V	98.9	Very high	98.5	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.006	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-44	174.8	178.7	0	0	0	0	110.7	L96 L100 I195 Q196 A197 T202 H203 I352 L363 M464 L468	L96-V199 HydrophobicContact CD1-CG1 4.49Å; L100-V199 HydrophobicContact CD1-CG1 3.94Å; L100-V199 HydrophobicContact CD2-CB 4.33Å; L100-V199 HydrophobicContact CD2-CG1 3.73Å; L100-V199 HydrophobicContact CG-CG1 4.42Å; I195-V199 HydrophobicContact CG2-CG2 4.5Å; I195-V199 WeakPolarHBondContact O-CG2 3.23Å; I195-V199 PolarHBondContact O-N 3.37Å; Q196-V199 PolarHBondContact O-N 3Å; A197-V199 VanDerWaalsContact C-N 3.32Å; A197-V199 PolarHBondContact O-N 2.95Å; V199-T202 PolarHBondContact O-OG1 2.87Å; V199-H203 WeakPolarHBondContact O-CB 3.43Å; V199-H203 PolarHBondContact O-N 3.48Å; V199-I352 HydrophobicContact CG2-CD1 4.36Å; V199-L363 HydrophobicContact CG1-CD1 4.04Å; V199-L363 HydrophobicContact CG1-CD2 4.27Å; V199-L363 HydrophobicContact CG1-CG 4.48Å; V199-L363 HydrophobicContact CG2-CD1 3.8Å; V199-M464 HydrophobicContact CG1-CE 4.16Å; V199-L468 HydrophobicContact CG2-CD2 4.35Å
200	L	98.9	Very high	98.5	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-59.5	-48.7	174.3	-82.9	162.5	0	0	0	112.5	L100 L101 L107 R112 I115 Q196 A197 H203 C204	L100-L200 HydrophobicContact CB-CD2 3.9Å; L100-L200 HydrophobicContact CD2-CG 4.31Å; L101-L200 HydrophobicContact CD2-CD2 3.95Å; L107-L200 HydrophobicContact CD1-CD1 4.48Å; R112-L200 HydrophobicContact CB-CD1 3.75Å; R112-L200 HydrophobicContact CB-CD2 4.42Å; R112-L200 HydrophobicContact CG-CD1 3.78Å; I115-L200 HydrophobicContact CG2-CB 3.94Å; Q196-L200 HydrophobicContact CG-CD1 4.35Å; Q196-L200 PolarHBondContact O-N 3.49Å; A197-L200 PolarHBondContact O-N 3.41Å; L200-H203 PolarHBondContact O-N 3.25Å; L200-C204 PolarHBondContact O-N 3.41Å; L200-C204 PolarHBondContact O-SG 3.21Å; L200-C204 VanDerWaalsContact O-SG 3.42Å
201	L	98.9	Very high	98.6	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-58.6	-54	-179.8	-70.7	173.2	0	0	0	110.8	I115 A119 L159 I162 N163 L166 A197 H203 C204 H205	I115-L201 HydrophobicContact CG2-CD2 3.64Å; I115-L201 HydrophobicContact CG2-CG 3.88Å; A119-L201 HydrophobicContact CB-CD2 3.8Å; L159-L201 HydrophobicContact CD1-CD1 4.42Å; L159-L201 HydrophobicContact CD2-CD1 3.95Å; L159-L201 HydrophobicContact CD2-CD2 4.32Å; L159-L201 HydrophobicContact CD2-CG 4.33Å; L159-L201 HydrophobicContact CG-CD1 3.97Å; I162-L201 HydrophobicContact CG2-CD1 4.39Å; N163-L201 HydrophobicContact CB-CD1 4.05Å; N163-L201 HydrophobicContact CB-CD2 3.87Å; L166-L201 HydrophobicContact CD1-CB 4.01Å; L166-L201 HydrophobicContact CD1-CD1 3.76Å; A197-L201 WeakPolarHBondContact O-CB 3.4Å; A197-L201 VanDerWaalsContact O-CG 3.23Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.37Å; L201-H203 VanDerWaalsContact C-N 3.34Å; L201-H203 PolarHBondContact O-N 2.81Å; L201-C204 PolarHBondContact O-N 2.9Å; L201-H205 PolarHBondContact O-CD2 3.01Å; L201-H205 PolarHBondContact O-N 3.47Å; L201-H205 PolarHBondContact O-ND1 3.28Å
202	T	98.9	Very high	98.7	Very high	2 Å²	2	6.8 Å²	6.8	1%	0.012	4%	0.038	C	C	.	.	H	α-helix	trans	-66	-35.2	-178.2	53.3	0	0	0	0	112.5	L166 L198 V199 H205 S206 A467 L468	L166-T202 HydrophobicContact CB-CG2 4.46Å; L166-T202 HydrophobicContact CD1-CG2 4.18Å; L166-T202 HydrophobicContact CD2-CG2 3.76Å; L166-T202 HydrophobicContact CG-CG2 4.37Å; L198-T202 WeakPolarHBondContact O-CB 3.23Å; L198-T202 WeakPolarHBondContact O-CG2 3.45Å; L198-T202 PolarHBondContact O-N 3.31Å; L198-T202 PolarHBondContact O-OG1 3.14Å; V199-T202 PolarHBondContact O-OG1 2.87Å; T202-H205 PolarHBondContact O-N 3.25Å; T202-S206 WeakPolarHBondContact O-CB 3.4Å; T202-S206 PolarHBondContact O-N 3.41Å; T202-S206 PolarHBondContact O-OG 3.32Å; T202-A467 HydrophobicContact CG2-CB 3.77Å; T202-L468 HydrophobicContact CG2-CD2 4.19Å; T202-L468 HydrophobicContact CG2-CG 4.16Å
203	H	98.9	Very high	98.8	Very high	2 Å²	2	5.1 Å²	5.1	1%	0.009	2%	0.024	C	C	.	.	H	α-helix	trans	-60.9	-46.9	172.9	179.5	74.9	0	0	0	111.9	F93 H97 L100 V199 L200 L201 S206 L207 M464	F93-H203 AromaticContact CE2-CE1 3.72Å; H97-H203 AromaticContact ND1-NE2 3.34Å; H97-H203 PolarHBondContact ND1-NE2 3.45Å; L100-H203 HydrophobicContact CD1-CB 4.01Å; V199-H203 WeakPolarHBondContact O-CB 3.43Å; V199-H203 PolarHBondContact O-N 3.48Å; L200-H203 PolarHBondContact O-N 3.25Å; L201-H203 VanDerWaalsContact C-N 3.34Å; L201-H203 PolarHBondContact O-N 2.81Å; H203-S206 PolarHBondContact O-N 3.45Å; H203-S206 PolarHBondContact O-OG 3.29Å; H203-L207 WeakPolarHBondContact NE2-CD1 3.4Å; H203-L207 WeakPolarHBondContact O-CB 3.43Å; H203-L207 WeakPolarHBondContact O-CG 3.24Å; H203-L207 PolarHBondContact O-N 3.31Å; H203-M464 HydrophobicContact CB-CE 3.89Å
204	C	98.9	Very high	98.7	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-73.1	-30.3	179.4	-68.1	0	0	0	0	112.6	A116 A119 L200 L201 S208	A116-C204 WeakPolarHBondContact CB-SG 3.45Å; A119-C204 HydrophobicContact CB-CB 3.53Å; L200-C204 PolarHBondContact O-N 3.41Å; L200-C204 PolarHBondContact O-SG 3.21Å; L200-C204 VanDerWaalsContact O-SG 3.42Å; L201-C204 PolarHBondContact O-N 2.9Å; C204-S208 WeakPolarHBondContact O-CB 3.5Å; C204-S208 PolarHBondContact O-N 3.35Å; C204-S208 PolarHBondContact O-OG 3.32Å
205	H	98.9	Very high	98.7	Very high	4 Å²	4	3.7 Å²	3.7	2%	0.019	2%	0.02	C	C	.	.	H	α-helix	trans	-63.5	-48.4	169.8	-60.8	154.7	0	0	0	111.3	A119 N163 L201 T202 S208 S209 R463	A119-H205 PolarHBondContact O-CD2 3.44Å; A119-H205 VanDerWaalsContact O-CD2 3.31Å; N163-H205 PolarHBondContact O-CE1 3.19Å; N163-H205 PolarHBondContact OD1-CE1 3.03Å; N163-H205 VanDerWaalsContact OD1-CE1 3.25Å; N163-H205 PolarHBondContact OD1-NE2 2.83Å; L201-H205 PolarHBondContact O-CD2 3.01Å; L201-H205 PolarHBondContact O-N 3.47Å; L201-H205 PolarHBondContact O-ND1 3.28Å; T202-H205 PolarHBondContact O-N 3.25Å; H205-S208 WeakPolarHBondContact O-CB 3.35Å; H205-S208 PolarHBondContact O-N 2.92Å; H205-S209 PolarHBondContact O-N 2.9Å; H205-S209 VanDerWaalsContact O-N 3.14Å; H205-R463 PolarHBondContact O-NH1 3.3Å
206	S	98.8	Very high	98.5	Very high	1 Å²	1	4.2 Å²	4.2	1%	0.007	2%	0.022	C	C	.	.	H	α-helix	trans	-66	-37.7	178.1	64.5	0	0	0	0	112	T202 H203 S208 S209 F210 L460	T202-S206 WeakPolarHBondContact O-CB 3.4Å; T202-S206 PolarHBondContact O-N 3.41Å; T202-S206 PolarHBondContact O-OG 3.32Å; H203-S206 PolarHBondContact O-N 3.45Å; H203-S206 PolarHBondContact O-OG 3.29Å; S206-S208 VanDerWaalsContact C-N 3.32Å; S206-S208 PolarHBondContact O-N 2.92Å; S206-S209 VanDerWaalsContact O-CB 3.29Å; S206-S209 WeakPolarHBondContact O-CB 3.34Å; S206-S209 PolarHBondContact O-N 3.49Å; S206-F210 PolarHBondContact O-N 3.44Å; S206-L460 VanDerWaalsContact CB-O 3.31Å; S206-L460 WeakPolarHBondContact CB-O 3.26Å
207	L	98.8	Very high	98.2	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.005	3%	0.033	C	C	.	.	H	α-helix	trans	-65.3	-35.1	172.4	-79.4	-174	0	0	0	112.4	L79 M83 F93 L128 H203 S209 F210 V211	L79-L207 HydrophobicContact CD1-CD2 4.12Å; L79-L207 HydrophobicContact CD2-CD2 4.37Å; M83-L207 HydrophobicContact CE-CD2 3.44Å; M83-L207 VanDerWaalsContact CE-CD2 3.44Å; F93-L207 HydrophobicContact CE2-CD1 4.24Å; F93-L207 HydrophobicContact CE2-CD2 3.7Å; F93-L207 HydrophobicContact CE2-CG 4.38Å; F93-L207 HydrophobicContact CZ-CD2 4.22Å; L128-L207 HydrophobicContact CD1-CB 3.7Å; L128-L207 HydrophobicContact CD2-CB 4.48Å; L128-L207 HydrophobicContact CD2-CD1 4.44Å; H203-L207 WeakPolarHBondContact NE2-CD1 3.4Å; H203-L207 WeakPolarHBondContact O-CB 3.43Å; H203-L207 WeakPolarHBondContact O-CG 3.24Å; H203-L207 PolarHBondContact O-N 3.31Å; L207-S209 VanDerWaalsContact C-N 3.3Å; L207-S209 PolarHBondContact O-N 2.6Å; L207-F210 PolarHBondContact O-N 2.99Å; L207-F210 VanDerWaalsContact O-N 3.14Å; L207-V211 WeakPolarHBondContact O-CG2 3.5Å; L207-V211 PolarHBondContact O-N 2.87Å
208	S	98.8	Very high	97.8	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.9	-42.4	173.3	-58.9	0	0	0	0	110.5	C204 H205 S206 F210 V211 F212	C204-S208 WeakPolarHBondContact O-CB 3.5Å; C204-S208 PolarHBondContact O-N 3.35Å; C204-S208 PolarHBondContact O-OG 3.32Å; H205-S208 WeakPolarHBondContact O-CB 3.35Å; H205-S208 PolarHBondContact O-N 2.92Å; S206-S208 VanDerWaalsContact C-N 3.32Å; S206-S208 PolarHBondContact O-N 2.92Å; S208-F210 PolarHBondContact O-N 2.66Å; S208-V211 PolarHBondContact O-N 2.9Å; S208-F212 VanDerWaalsContact O-CD2 3.24Å; S208-F212 WeakPolarHBondContact O-CD2 3.49Å; S208-F212 PolarHBondContact O-N 3.07Å; S208-F212 VanDerWaalsContact O-N 3.13Å
209	S	98.7	Very high	97	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-56.6	-47.6	171.1	-76.2	0	0	0	0	112	H205 S206 L207 G213 V428 R463	H205-S209 PolarHBondContact O-N 2.9Å; H205-S209 VanDerWaalsContact O-N 3.14Å; S206-S209 VanDerWaalsContact O-CB 3.29Å; S206-S209 WeakPolarHBondContact O-CB 3.34Å; S206-S209 PolarHBondContact O-N 3.49Å; L207-S209 VanDerWaalsContact C-N 3.3Å; L207-S209 PolarHBondContact O-N 2.6Å; S209-G213 WeakPolarHBondContact O-CA 3.49Å; S209-G213 PolarHBondContact O-N 2.91Å; S209-V428 WeakPolarHBondContact CB-O 3.48Å; S209-V428 WeakPolarHBondContact O-CG1 3.43Å; S209-V428 PolarHBondContact OG-O 2.93Å; S209-R463 PolarHBondContact OG-NH1 3.21Å
210	F	98.8	Very high	95.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-44.9	179.3	-172.1	-96.5	0	0	0	112.7	L79 V82 M83 S206 L207 S208 F212 G213 C214 I216 V453 N456 L457 L460	L79-F210 HydrophobicContact CG-CD1 4.34Å; L79-F210 HydrophobicContact CG-CE1 4.48Å; V82-F210 HydrophobicContact CB-CE1 4.49Å; V82-F210 HydrophobicContact CG1-CE1 4.31Å; V82-F210 HydrophobicContact CG1-CZ 3.97Å; M83-F210 HydrophobicContact CE-CD1 3.64Å; M83-F210 HydrophobicContact CE-CD2 4.31Å; M83-F210 HydrophobicContact CE-CE1 3.77Å; M83-F210 HydrophobicContact CE-CE2 4.43Å; M83-F210 HydrophobicContact CE-CG 3.92Å; M83-F210 HydrophobicContact CE-CZ 4.16Å; M83-F210 HydrophobicContact CG-CD1 4.4Å; M83-F210 HydrophobicContact CG-CE1 3.56Å; M83-F210 HydrophobicContact CG-CE2 4.32Å; M83-F210 HydrophobicContact CG-CZ 3.51Å; S206-F210 PolarHBondContact O-N 3.44Å; L207-F210 PolarHBondContact O-N 2.99Å; L207-F210 VanDerWaalsContact O-N 3.14Å; S208-F210 PolarHBondContact O-N 2.66Å; F210-F212 PolarHBondContact O-N 2.99Å; F210-G213 PolarHBondContact O-N 3.48Å; F210-C214 HydrophobicContact CE1-CB 4.48Å; F210-C214 VanDerWaalsContact CE2-SG 3.56Å; F210-C214 WeakPolarHBondContact O-CB 3.36Å; F210-C214 PolarHBondContact O-N 3.41Å; F210-I216 HydrophobicContact CE1-CD1 4.38Å; F210-V453 HydrophobicContact CE2-CG1 3.98Å; F210-V453 HydrophobicContact CZ-CG1 4.06Å; F210-N456 HydrophobicContact CD2-CB 3.87Å; F210-N456 HydrophobicContact CE2-CB 4.16Å; F210-L457 HydrophobicContact CD2-CD2 4.12Å; F210-L457 HydrophobicContact CE2-CD2 3.57Å; F210-L457 HydrophobicContact CZ-CD2 4.4Å; F210-L460 HydrophobicContact CB-CD2 3.95Å; F210-L460 HydrophobicContact CD2-CD2 3.63Å; F210-L460 HydrophobicContact CE2-CD2 4.49Å; F210-L460 HydrophobicContact CG-CD2 4.07Å
211	V	98.7	Very high	92.7	Very high	7 Å²	7	24.2 Å²	24.2	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-55.6	-52.3	178.1	164.5	0	0	0	0	111	L79 Y127 L128 L207 S208 G215 I216	L79-V211 HydrophobicContact CD1-CG2 3.87Å; Y127-V211 HydrophobicContact CD1-CG2 3.84Å; Y127-V211 HydrophobicContact CE1-CG2 4.45Å; Y127-V211 HydrophobicContact CG-CG1 4.29Å; Y127-V211 HydrophobicContact CG-CG2 4.34Å; L128-V211 HydrophobicContact CD1-CG2 4.42Å; L128-V211 HydrophobicContact CG-CG2 4.25Å; L207-V211 WeakPolarHBondContact O-CG2 3.5Å; L207-V211 PolarHBondContact O-N 2.87Å; S208-V211 PolarHBondContact O-N 2.9Å; V211-G215 CarbonylContact O-C 3.16Å; V211-G215 WeakPolarHBondContact O-CA 3.46Å; V211-G215 PolarHBondContact O-N 2.83Å; V211-I216 HydrophobicContact CB-CB 4.5Å; V211-I216 HydrophobicContact CG1-CB 4.23Å; V211-I216 HydrophobicContact CG2-CB 4.49Å; V211-I216 PolarHBondContact O-N 2.78Å
212	F	98.6	Very high	89.7	Confident	48 Å²	48	29.5 Å²	29.5	21%	0.211	19%	0.19	C	C	.	.	H	α-helix	trans	-73.2	-39.2	-179.7	-75.4	-72	0	0	0	112.6	F47 H123 C125 S208 F210 G215 P432 E433 T435	F47-F212 VanDerWaalsContact CE2-O 3.27Å; F47-F212 WeakPolarHBondContact CE2-O 3.37Å; H123-F212 HydrophobicContact CB-CE2 4.45Å; H123-F212 WeakPolarHBondContact O-CE2 3.33Å; C125-F212 HydrophobicContact CB-CE2 3.83Å; C125-F212 HydrophobicContact CB-CZ 4.47Å; S208-F212 VanDerWaalsContact O-CD2 3.24Å; S208-F212 WeakPolarHBondContact O-CD2 3.49Å; S208-F212 PolarHBondContact O-N 3.07Å; S208-F212 VanDerWaalsContact O-N 3.13Å; F210-F212 PolarHBondContact O-N 2.99Å; F212-G215 PolarHBondContact O-N 2.87Å; F212-P432 HydrophobicContact CB-CB 3.9Å; F212-P432 WeakPolarHBondContact CB-O 3.37Å; F212-P432 HydrophobicContact CD2-CB 3.76Å; F212-P432 HydrophobicContact CD2-CG 4.36Å; F212-P432 HydrophobicContact CG-CB 4.13Å; F212-P432 VanDerWaalsContact CG-O 3.32Å; F212-P432 WeakPolarHBondContact CG-O 3.3Å; F212-E433 HydrophobicContact CE1-CB 4.46Å; F212-E433 HydrophobicContact CE2-CB 4.43Å; F212-E433 HydrophobicContact CZ-CB 4.14Å; F212-T435 WeakPolarHBondContact O-CG2 3.09Å
213	G	98.4	Very high	86.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-43.3	179.9	0	0	0	0	0	113.1	F47 S209 F210 Y424 N456	F47-G213 WeakPolarHBondContact CD2-O 3.45Å; F47-G213 WeakPolarHBondContact CE2-O 3.17Å; S209-G213 WeakPolarHBondContact O-CA 3.49Å; S209-G213 PolarHBondContact O-N 2.91Å; F210-G213 PolarHBondContact O-N 3.48Å; G213-Y424 VanDerWaalsContact C-OH 3.25Å; G213-Y424 WeakPolarHBondContact CA-OH 3.11Å; G213-Y424 PolarHBondContact O-OH 3.01Å; G213-N456 WeakPolarHBondContact CA-OD1 3.1Å
214	C	98	Very high	84.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.4	176.5	-64.1	0	0	0	0	113.4	S45 F47 V82 F210 I216	S45-C214 PolarHBondContact OG-O 3.27Å; F47-C214 VanDerWaalsContact CD2-C 3.48Å; V82-C214 HydrophobicContact CG1-CB 4.22Å; F210-C214 HydrophobicContact CE1-CB 4.48Å; F210-C214 VanDerWaalsContact CE2-SG 3.56Å; F210-C214 WeakPolarHBondContact O-CB 3.36Å; F210-C214 PolarHBondContact O-N 3.41Å; C214-I216 VanDerWaalsContact C-N 3.35Å; C214-I216 HydrophobicContact CB-CD1 3.83Å; C214-I216 HydrophobicContact CB-CG1 4.16Å; C214-I216 PolarHBondContact O-N 3.29Å
215	G	97.2	Very high	80.7	Confident	9 Å²	9	44.1 Å²	44.1	9%	0.093	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	39.9	178.9	0	0	0	0	0	113.1	S45 A46 F47 V211 F212 L217	S45-G215 CarbonylContact C-O 2.92Å; S45-G215 WeakPolarHBondContact CA-O 3.17Å; A46-G215 WeakPolarHBondContact CB-O 3.37Å; A46-G215 PolarHBondContact N-O 2.97Å; F47-G215 VanDerWaalsContact CE2-CA 3.48Å; F47-G215 VanDerWaalsContact CE2-N 3.35Å; V211-G215 CarbonylContact O-C 3.16Å; V211-G215 WeakPolarHBondContact O-CA 3.46Å; V211-G215 PolarHBondContact O-N 2.83Å; F212-G215 PolarHBondContact O-N 2.87Å; G215-L217 PolarHBondContact O-N 2.77Å
216	I	96	Very high	77.6	Confident	12 Å²	12	50 Å²	50	6%	0.062	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-60.9	132.4	-177.9	-54.6	-58.9	0	0	0	109.8	N78 L79 V82 Y127 F210 V211 C214	N78-I216 HydrophobicContact CB-CG2 3.9Å; L79-I216 HydrophobicContact CB-CG2 4.38Å; V82-I216 HydrophobicContact CB-CD1 3.72Å; V82-I216 HydrophobicContact CG1-CD1 4.07Å; V82-I216 HydrophobicContact CG2-CD1 3.48Å; V82-I216 VanDerWaalsContact CG2-CD1 3.48Å; Y127-I216 HydrophobicContact CD2-CG2 4.04Å; Y127-I216 HydrophobicContact CE1-CG2 4.42Å; Y127-I216 HydrophobicContact CE2-CG2 3.67Å; F210-I216 HydrophobicContact CE1-CD1 4.38Å; V211-I216 HydrophobicContact CB-CB 4.5Å; V211-I216 HydrophobicContact CG1-CB 4.23Å; V211-I216 HydrophobicContact CG2-CB 4.49Å; V211-I216 PolarHBondContact O-N 2.78Å; C214-I216 VanDerWaalsContact C-N 3.35Å; C214-I216 HydrophobicContact CB-CD1 3.83Å; C214-I216 HydrophobicContact CB-CG1 4.16Å; C214-I216 PolarHBondContact O-N 3.29Å
217	L	92.5	Very high	74.5	Confident	44 Å²	44	52.9 Å²	52.9	23%	0.23	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-92.3	138.9	179.8	-71.9	173.9	0	0	0	110.7	G43 P44 A46 N78 Y127 G215	G43-L217 WeakPolarHBondContact O-CD1 3.43Å; P44-L217 PolarHBondContact O-N 3.2Å; P44-L217 VanDerWaalsContact O-N 3.08Å; A46-L217 HydrophobicContact CB-CD1 4.36Å; A46-L217 HydrophobicContact CB-CD2 4.02Å; A46-L217 HydrophobicContact CB-CG 4.16Å; N78-L217 PolarHBondContact ND2-O 3.2Å; Y127-L217 WeakPolarHBondContact CE2-O 3.22Å; G215-L217 PolarHBondContact O-N 2.77Å
218	P	89.3	Confident	71.5	Confident	78 Å²	78	58.8 Å²	58.8	51%	0.506	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-55	147.6	169.3	-23.3	33.5	0	0	0	111.9	Y127 G220	Y127-P218 HydrophobicContact CD2-CB 4.45Å; P218-G220 PolarHBondContact O-N 2.84Å; P218-G220 VanDerWaalsContact O-N 3.13Å
219	E	82.8	Confident	68.3	Low	107 Å²	107	67.8 Å²	67.8	50%	0.5	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-60.7	116.5	171.9	-52.4	-49.6	142.6	0	0	108.9	N78 Y127	N78-E219 VanDerWaalsContact CB-OE1 3.29Å; N78-E219 WeakPolarHBondContact CB-OE1 3.26Å; N78-E219 PolarHBondContact N-OE1 3.38Å; N78-E219 VanDerWaalsContact ND2-CD 3.25Å; N78-E219 PolarHBondContact ND2-OE1 3.21Å; N78-E219 PolarHBondContact ND2-OE2 2.94Å; Y127-E219 PolarHBondContact OH-OE1 3.22Å
220	G	64.3	Low	65	Low	71 Å²	71	71.1 Å²	71.1	73%	0.732	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-101.1	130.9	-177.5	0	0	0	0	0	111.9	P218	P218-G220 PolarHBondContact O-N 2.84Å; P218-G220 VanDerWaalsContact O-N 3.13Å
221	D	41.9	Very low	61.7	Low	122 Å²	122	77 Å²	77	65%	0.652	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-61.6	142.1	165.6	-74.9	-35.5	0	0	0	110.7	F18 D223	F18-D221 VanDerWaalsContact CE1-OD2 3.29Å; F18-D221 WeakPolarHBondContact CE1-OD2 3.23Å; D221-D223 PolarHBondContact O-N 3.4Å
222	A	37.7	Very low	58.4	Low	111 Å²	111	82.6 Å²	82.6	92%	0.917	54%	0.537	S	S	*	.	S	Bend	trans	-67.1	8.2	174.9	0	0	0	0	0	114
223	D	36.4	Very low	55.1	Low	144 Å²	144	85.7 Å²	85.7	77%	0.77	56%	0.561	S	S	*	*	S	Bend	trans	-136.9	117.6	-176.6	-116	-19.7	0	0	0	114.6	D221 S225	D221-D223 PolarHBondContact O-N 3.4Å; D223-S225 PolarHBondContact O-N 3.48Å
224	G	42.3	Very low	51.9	Low	76 Å²	76	91.8 Å²	91.8	78%	0.784	60%	0.601	S	S	*	*				86.4	2.1	126.7	0	0	0	0	0	122.5
225	S	28.7	Very low	48.6	Very low	92 Å²	92	97 Å²	97	64%	0.643	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-97	131.6	174.4	-67.2	0	0	0	0	113.2	D223 A227	D223-S225 PolarHBondContact O-N 3.48Å; S225-A227 PolarHBondContact O-N 3Å
226	P	33.5	Very low	45.9	Very low	127 Å²	127	105.5 Å²	105.5	83%	0.825	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-70.2	116.2	179	27.8	-30.4	0	0	0	109.6
227	A	34.2	Very low	43.1	Very low	62 Å²	62	113.7 Å²	113.7	51%	0.512	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-59.3	153.9	173.9	0	0	0	0	0	111.6	S225 Q229	S225-A227 PolarHBondContact O-N 3Å; A227-Q229 PolarHBondContact O-N 2.92Å
228	P	34.6	Very low	40.3	Very low	124 Å²	124	117.3 Å²	117.3	81%	0.805	74%	0.742	S	S	*	*	S	Bend	trans	-52.8	131.5	160.5	23.3	-31.5	0	0	0	108.3	A230	P228-A230 PolarHBondContact O-N 2.8Å
229	Q	30.8	Very low	37.7	Very low	190 Å²	190	118.9 Å²	118.9	89%	0.888	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-51.7	118.6	-173.5	-67.8	-177.1	-3.9	0	0	109.8	A227	A227-Q229 PolarHBondContact O-N 2.92Å
230	A	30.6	Very low	35.3	Very low	69 Å²	69	119 Å²	119	57%	0.57	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56.6	137.1	162.1	0	0	0	0	0	107.5	P228 T232	P228-A230 PolarHBondContact O-N 2.8Å; A230-T232 PolarHBondContact O-N 3.4Å; A230-T232 VanDerWaalsContact O-N 3.12Å
231	P	29.8	Very low	33.9	Very low	124 Å²	124	121.5 Å²	121.5	81%	0.805	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.6	126.7	170.2	22	-29.8	0	0	0	107.7
232	T	28.3	Very low	33.5	Very low	125 Å²	125	120.4 Å²	120.4	77%	0.767	77%	0.77	S	S	*	*			trans	-42.6	137.6	173.7	28.1	0	0	0	0	110.2	A230	A230-T232 PolarHBondContact O-N 3.4Å; A230-T232 VanDerWaalsContact O-N 3.12Å
233	P	30.7	Very low	33.5	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	77%	0.77	S	S	*	*			trans	-56.6	138.8	171.8	25.4	-31.6	0	0	0	108.3	S235	P233-S235 PolarHBondContact O-N 3.24Å
234	P	30.3	Very low	33.3	Very low	128 Å²	128	126.2 Å²	126.2	83%	0.831	77%	0.767	S	S	*	*			trans	-56.7	130.6	170.7	22.8	-29.7	0	0	0	108.2
235	S	29.4	Very low	33	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	77%	0.768	S	S	*	*			trans	-38.5	136.7	173.3	-176.7	0	0	0	0	111.4	P233 Q237	P233-S235 PolarHBondContact O-N 3.24Å; S235-Q237 PolarHBondContact O-N 3.38Å
236	E	39.2	Very low	33.5	Very low	188 Å²	188	131.7 Å²	131.7	88%	0.879	78%	0.777	S	S	*	*	S	Bend	trans	-50.5	100.3	175.9	-64.6	-163.6	157	0	0	112
237	Q	36.9	Very low	33.9	Very low	184 Å²	184	131.8 Å²	131.8	86%	0.86	77%	0.771	S	S	*	*			trans	-143.3	70.7	150.2	-67.9	-168.3	8.3	0	0	107.5	S235	S235-Q237 PolarHBondContact O-N 3.38Å
238	S	34.4	Very low	34.2	Very low	120 Å²	120	136.5 Å²	136.5	84%	0.839	79%	0.787	S	S	*	*			trans	-144.9	96.1	164.8	-62.7	0	0	0	0	107.1
239	S	34.5	Very low	34.7	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	77%	0.77	S	S	*	*			trans	-49.1	146.1	169.1	-46.6	0	0	0	0	110
240	P	32.9	Very low	35.4	Very low	111 Å²	111	126.5 Å²	126.5	72%	0.721	75%	0.748	S	S	*	*			trans	-60.1	142.9	178.6	25.9	-32.7	0	0	0	109.5	S242	P240-S242 PolarHBondContact O-N 2.86Å
241	P	35.1	Very low	36.4	Very low	123 Å²	123	125.8 Å²	125.8	80%	0.799	75%	0.747	S	S	*	*			trans	-66.7	112.4	173.3	28.1	-29.6	0	0	0	107.1	R243	P241-R243 PolarHBondContact O-N 3.11Å
242	S	32.3	Very low	37.6	Very low	98 Å²	98	126 Å²	126	69%	0.685	74%	0.736	S	S	*	*			trans	-48.3	122.2	156.8	1.8	0	0	0	0	107	P240 D244	P240-S242 PolarHBondContact O-N 2.86Å; S242-D244 PolarHBondContact O-N 3.3Å
243	R	38.1	Very low	39.2	Very low	246 Å²	246	126.1 Å²	126.1	93%	0.928	73%	0.728	S	S	*	*			trans	-63.1	89.9	167.7	-81.3	179.3	164.5	178.5	-4.6	108	P241 P245	P241-R243 PolarHBondContact O-N 3.11Å; R243-P245 WeakPolarHBondContact O-CD 3.37Å
244	D	32	Very low	40.5	Very low	131 Å²	131	121.8 Å²	121.8	70%	0.701	70%	0.7	S	S	*	*			trans	-78.7	121.6	162.8	-87.5	-31.9	0	0	0	108.6	S242 L246	S242-D244 PolarHBondContact O-N 3.3Å; D244-L246 PolarHBondContact O-N 2.79Å
245	P	37.6	Very low	42.6	Very low	124 Å²	124	116.7 Å²	116.7	81%	0.805	67%	0.668	S	S	*	*	S	Bend	trans	-73.5	18.5	-177.4	-14.8	30.1	0	0	0	115.1	R243	R243-P245 WeakPolarHBondContact O-CD 3.37Å
246	L	39	Very low	45.1	Very low	160 Å²	160	118 Å²	118	84%	0.838	66%	0.657	S	S	*	*			trans	-134.1	61.6	-168	-76.2	149.1	0	0	0	111.2	D244	D244-L246 PolarHBondContact O-N 2.79Å
247	N	41.1	Very low	47.5	Very low	128 Å²	128	114.7 Å²	114.7	68%	0.684	64%	0.641	S	S	*	*			trans	-137.5	58.5	165	-155.9	29.9	0	0	0	111.6	S249	N247-S249 PolarHBondContact O-N 3.29Å; N247-S249 PolarHBondContact OD1-OG 3.5Å
248	N	40.2	Very low	50.1	Low	161 Å²	161	106.1 Å²	106.1	86%	0.861	60%	0.601	S	S	*	*			trans	-79.8	6.3	172.8	-118.7	16.6	0	0	0	112.9
249	S	45.9	Very low	53	Low	64 Å²	64	105 Å²	105	45%	0.448	58%	0.583	S	S	.	*	S	Bend	trans	-87.1	-32.2	-174.5	41.8	0	0	0	0	114	N247 G251 F252 E253	N247-S249 PolarHBondContact O-N 3.29Å; N247-S249 PolarHBondContact OD1-OG 3.5Å; S249-G251 PolarHBondContact O-N 2.97Å; S249-F252 PolarHBondContact O-N 3.4Å; S249-E253 PolarHBondContact O-N 3.47Å
250	G	44.8	Very low	55.9	Low	40 Å²	40	101.5 Å²	101.5	41%	0.412	56%	0.561	S	S	.	*	H	α-helix	trans	-71	-28.6	-178.9	0	0	0	0	0	114.8	F252 S254	G250-F252 VanDerWaalsContact C-N 3.29Å; G250-S254 WeakPolarHBondContact O-CB 3.38Å; G250-S254 PolarHBondContact O-N 2.97Å; G250-S254 PolarHBondContact O-OG 3.31Å
251	G	51.8	Low	58.9	Low	55 Å²	55	96.7 Å²	96.7	57%	0.567	53%	0.529	S	S	*	.	H	α-helix	trans	-72.2	-22.5	172.8	0	0	0	0	0	113.6	S249 S254	S249-G251 PolarHBondContact O-N 2.97Å; G251-S254 VanDerWaalsContact C-OG 3.23Å; G251-S254 VanDerWaalsContact CA-OG 3.28Å; G251-S254 WeakPolarHBondContact CA-OG 3.47Å; G251-S254 PolarHBondContact O-OG 3.41Å
252	F	55.9	Low	61.8	Low	127 Å²	127	93 Å²	93	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-88.6	-36	-177.1	-160.7	-119.3	0	0	0	112.1	S249 G250 R256	S249-F252 PolarHBondContact O-N 3.4Å; G250-F252 VanDerWaalsContact C-N 3.29Å; F252-R256 VanDerWaalsContact CE1-CZ 3.41Å; F252-R256 VanDerWaalsContact O-CD 3.31Å; F252-R256 WeakPolarHBondContact O-CD 3.29Å; F252-R256 WeakPolarHBondContact O-CG 3.34Å; F252-R256 PolarHBondContact O-N 3.11Å
253	E	61.4	Low	64.9	Low	129 Å²	129	91.6 Å²	91.6	60%	0.603	48%	0.484	S	S	*	.	H	α-helix	trans	-69.1	-36.5	173.3	-70.6	-178.4	165.7	0	0	112.4	S249 R256 E257	S249-E253 PolarHBondContact O-N 3.47Å; E253-R256 WeakPolarHBondContact O-CB 3.31Å; E253-R256 PolarHBondContact O-N 3.02Å; E253-E257 PolarHBondContact O-N 3.24Å
254	S	58.2	Low	67.7	Low	20 Å²	20	84 Å²	84	14%	0.14	46%	0.456	C	S	.	.	H	α-helix	trans	-67.4	-40.8	179.4	46	0	0	0	0	114.1	G250 G251 R256 H446	G250-S254 WeakPolarHBondContact O-CB 3.38Å; G250-S254 PolarHBondContact O-N 2.97Å; G250-S254 PolarHBondContact O-OG 3.31Å; G251-S254 VanDerWaalsContact C-OG 3.23Å; G251-S254 VanDerWaalsContact CA-OG 3.28Å; G251-S254 WeakPolarHBondContact CA-OG 3.47Å; G251-S254 PolarHBondContact O-OG 3.41Å; S254-R256 VanDerWaalsContact C-N 3.29Å; S254-R256 PolarHBondContact O-N 3.48Å; S254-H446 VanDerWaalsContact CB-CD2 3.42Å; S254-H446 WeakPolarHBondContact CB-CD2 3.36Å; S254-H446 WeakPolarHBondContact CB-CE1 3.4Å; S254-H446 WeakPolarHBondContact CB-ND1 3.2Å; S254-H446 WeakPolarHBondContact CB-NE2 3.37Å
255	A	73	Confident	70.8	Confident	21 Å²	21	78 Å²	78	17%	0.174	42%	0.423	C	S	.	.	H	α-helix	trans	-62.4	-38.1	172.5	0	0	0	0	0	111.8	E257 V258 E259 M380	A255-E257 PolarHBondContact O-N 3.46Å; A255-V258 PolarHBondContact O-N 3.01Å; A255-E259 WeakPolarHBondContact O-CB 3.42Å; A255-E259 VanDerWaalsContact O-CG 3.23Å; A255-E259 WeakPolarHBondContact O-CG 3.34Å; A255-E259 PolarHBondContact O-N 3.19Å; A255-M380 HydrophobicContact CB-CE 3.92Å
256	R	83.3	Confident	73.5	Confident	138 Å²	138	77.9 Å²	77.9	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-64.9	-35.9	-178.1	-74.1	167.5	170.9	-159.3	-11.4	113.9	F252 E253 S254 A260	F252-R256 VanDerWaalsContact CE1-CZ 3.41Å; F252-R256 VanDerWaalsContact O-CD 3.31Å; F252-R256 WeakPolarHBondContact O-CD 3.29Å; F252-R256 WeakPolarHBondContact O-CG 3.34Å; F252-R256 PolarHBondContact O-N 3.11Å; E253-R256 WeakPolarHBondContact O-CB 3.31Å; E253-R256 PolarHBondContact O-N 3.02Å; S254-R256 VanDerWaalsContact C-N 3.29Å; S254-R256 PolarHBondContact O-N 3.48Å; R256-A260 VanDerWaalsContact O-CB 3.24Å; R256-A260 WeakPolarHBondContact O-CB 3.2Å; R256-A260 PolarHBondContact O-N 3Å
257	E	88.6	Confident	76.1	Confident	117 Å²	117	74.9 Å²	74.9	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-67	-43.6	178.3	-71.3	-176.8	173.7	0	0	111.8	E253 A255 A260 L261	E253-E257 PolarHBondContact O-N 3.24Å; A255-E257 PolarHBondContact O-N 3.46Å; E257-A260 PolarHBondContact O-N 2.97Å; E257-L261 PolarHBondContact O-N 3.45Å
258	V	92.8	Very high	78.6	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-66.3	-44.6	176.7	-179.7	0	0	0	0	110.4	A255 A260 L261 M262 I378 A379 M380 H446 F447	A255-V258 PolarHBondContact O-N 3.01Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.36Å; V258-L261 WeakPolarHBondContact O-CB 3.35Å; V258-L261 PolarHBondContact O-N 2.93Å; V258-M262 HydrophobicContact CG1-SD 4.42Å; V258-M262 WeakPolarHBondContact O-CG 3.09Å; V258-M262 PolarHBondContact O-N 2.89Å; V258-I378 HydrophobicContact CG1-CG1 4.47Å; V258-I378 HydrophobicContact CG1-CG2 4.46Å; V258-A379 HydrophobicContact CG1-CB 4.11Å; V258-A379 HydrophobicContact CG2-CB 4.24Å; V258-M380 HydrophobicContact CB-CE 4.28Å; V258-M380 HydrophobicContact CG2-CE 4.47Å; V258-H446 HydrophobicContact CG2-CB 4.14Å; V258-F447 HydrophobicContact CG2-CE2 4.07Å
259	E	94.1	Very high	81.1	Confident	97 Å²	97	64.1 Å²	64.1	45%	0.453	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.3	-74.4	171.9	-175	0	0	112	A255 L261 M262 E263	A255-E259 WeakPolarHBondContact O-CB 3.42Å; A255-E259 VanDerWaalsContact O-CG 3.23Å; A255-E259 WeakPolarHBondContact O-CG 3.34Å; A255-E259 PolarHBondContact O-N 3.19Å; E259-L261 VanDerWaalsContact C-N 3.32Å; E259-L261 PolarHBondContact O-N 3.47Å; E259-M262 PolarHBondContact O-N 3.08Å; E259-E263 WeakPolarHBondContact O-CB 3.23Å; E259-E263 PolarHBondContact O-N 2.83Å
260	A	95.3	Very high	83.2	Confident	38 Å²	38	65.1 Å²	65.1	31%	0.314	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-35.4	176.4	0	0	0	0	0	112.3	R256 E257 V258 R264	R256-A260 VanDerWaalsContact O-CB 3.24Å; R256-A260 WeakPolarHBondContact O-CB 3.2Å; R256-A260 PolarHBondContact O-N 3Å; E257-A260 PolarHBondContact O-N 2.97Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.36Å; A260-R264 WeakPolarHBondContact O-CG 3.43Å; A260-R264 PolarHBondContact O-N 3.05Å; A260-R264 VanDerWaalsContact O-N 3.15Å; A260-R264 PolarHBondContact O-NH1 3.25Å
261	L	96.4	Very high	85.2	Confident	10 Å²	10	65 Å²	65	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-46.1	171.8	175.4	61.6	0	0	0	111.2	E257 V258 E259 E263 R264 M265 I378 L389 L416 F447	E257-L261 PolarHBondContact O-N 3.45Å; V258-L261 WeakPolarHBondContact O-CB 3.35Å; V258-L261 PolarHBondContact O-N 2.93Å; E259-L261 VanDerWaalsContact C-N 3.32Å; E259-L261 PolarHBondContact O-N 3.47Å; L261-E263 VanDerWaalsContact C-N 3.28Å; L261-E263 PolarHBondContact O-N 3.35Å; L261-R264 PolarHBondContact O-N 3.2Å; L261-M265 HydrophobicContact CD1-CG 4.41Å; L261-M265 HydrophobicContact CD1-SD 4.47Å; L261-M265 HydrophobicContact CG-SD 4.1Å; L261-M265 WeakPolarHBondContact O-CG 3.31Å; L261-M265 PolarHBondContact O-N 2.86Å; L261-I378 HydrophobicContact CD2-CD1 3.93Å; L261-I378 HydrophobicContact CG-CD1 4.37Å; L261-L389 HydrophobicContact CD2-CD2 4.3Å; L261-L416 HydrophobicContact CD1-CB 4.41Å; L261-L416 HydrophobicContact CD1-CD2 3.83Å; L261-L416 WeakPolarHBondContact CD1-O 3.4Å; L261-F447 HydrophobicContact CD2-CZ 4.01Å
262	M	96.3	Very high	86.7	Confident	45 Å²	45	66.4 Å²	66.4	22%	0.222	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-39.6	176.6	-70.9	178.4	58.8	0	0	112.3	V258 E259 M265 R266 I378 H381 V384	V258-M262 HydrophobicContact CG1-SD 4.42Å; V258-M262 WeakPolarHBondContact O-CG 3.09Å; V258-M262 PolarHBondContact O-N 2.89Å; E259-M262 PolarHBondContact O-N 3.08Å; M262-M265 WeakPolarHBondContact O-CB 3.49Å; M262-M265 PolarHBondContact O-N 3.1Å; M262-R266 PolarHBondContact O-N 3.2Å; M262-I378 HydrophobicContact CE-CG2 4.34Å; M262-I378 HydrophobicContact CG-CD1 4.2Å; M262-I378 HydrophobicContact CG-CG2 3.7Å; M262-I378 HydrophobicContact SD-CG2 3.47Å; M262-I378 WeakPolarHBondContact SD-CG2 3.27Å; M262-H381 HydrophobicContact CE-CB 4.25Å; M262-H381 HydrophobicContact SD-CB 3.96Å; M262-V384 HydrophobicContact CE-CB 4.46Å; M262-V384 HydrophobicContact CE-CG1 4.15Å; M262-V384 HydrophobicContact CE-CG2 3.42Å; M262-V384 VanDerWaalsContact CE-CG2 3.42Å; M262-V384 HydrophobicContact SD-CG2 4.37Å
263	E	96.5	Very high	88.1	Confident	69 Å²	69	67.6 Å²	67.6	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-45.1	175.9	-178	56.6	-143.3	0	0	111.6	E259 L261 M265 R266 Q267	E259-E263 WeakPolarHBondContact O-CB 3.23Å; E259-E263 PolarHBondContact O-N 2.83Å; L261-E263 VanDerWaalsContact C-N 3.28Å; L261-E263 PolarHBondContact O-N 3.35Å; E263-M265 VanDerWaalsContact C-N 3.34Å; E263-M265 PolarHBondContact O-N 3.13Å; E263-R266 PolarHBondContact O-N 2.64Å; E263-R266 IonicContact OE1-CZ 3.99Å; E263-R266 IonicContact OE1-NE 2.65Å; E263-R266 IonicContact OE1-NH2 3.23Å; E263-R266 PolarHBondContact OE1-NH2 3.14Å; E263-R266 IonicContact OE2-CZ 3.52Å; E263-R266 VanDerWaalsContact OE2-CZ 3.23Å; E263-R266 IonicContact OE2-NE 3.58Å; E263-R266 IonicContact OE2-NH2 2.7Å; E263-R266 PolarHBondContact OE2-NH2 3.47Å; E263-Q267 WeakPolarHBondContact O-CG 3.17Å; E263-Q267 PolarHBondContact O-N 3.24Å; E263-Q267 PolarHBondContact OE1-NE2 2.72Å
264	R	96.9	Very high	89.1	Confident	87 Å²	87	69.4 Å²	69.4	33%	0.328	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-40.8	174.6	-71.2	-172.4	-61.8	-86.1	3.7	112	A260 L261 R266 Q267 L268 Q415 L416	A260-R264 WeakPolarHBondContact O-CG 3.43Å; A260-R264 PolarHBondContact O-N 3.05Å; A260-R264 VanDerWaalsContact O-N 3.15Å; A260-R264 PolarHBondContact O-NH1 3.25Å; L261-R264 PolarHBondContact O-N 3.2Å; R264-R266 VanDerWaalsContact C-N 3.35Å; R264-R266 PolarHBondContact O-N 2.61Å; R264-Q267 PolarHBondContact O-N 3.01Å; R264-L268 WeakPolarHBondContact O-CG 3.48Å; R264-L268 PolarHBondContact O-N 3.17Å; R264-Q415 WeakPolarHBondContact CD-O 3.15Å; R264-Q415 PolarHBondContact NE-O 3.15Å; R264-L416 HydrophobicContact CB-CD2 4.35Å
265	M	96.6	Very high	89.7	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.015	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-44.6	175.5	-69.8	169.2	55.2	0	0	111.6	L261 M262 E263 L268 Q269 I378 V384 D385 T386 V388 L389 L416	L261-M265 HydrophobicContact CD1-CG 4.41Å; L261-M265 HydrophobicContact CD1-SD 4.47Å; L261-M265 HydrophobicContact CG-SD 4.1Å; L261-M265 WeakPolarHBondContact O-CG 3.31Å; L261-M265 PolarHBondContact O-N 2.86Å; M262-M265 WeakPolarHBondContact O-CB 3.49Å; M262-M265 PolarHBondContact O-N 3.1Å; E263-M265 VanDerWaalsContact C-N 3.34Å; E263-M265 PolarHBondContact O-N 3.13Å; M265-L268 PolarHBondContact O-N 2.92Å; M265-Q269 WeakPolarHBondContact O-CG 3.27Å; M265-Q269 PolarHBondContact O-N 3.38Å; M265-I378 HydrophobicContact SD-CD1 3.88Å; M265-V384 HydrophobicContact CE-CG1 4.31Å; M265-D385 WeakPolarHBondContact CE-O 3.46Å; M265-T386 HydrophobicContact CE-CG2 4.41Å; M265-V388 HydrophobicContact CB-CG2 3.82Å; M265-V388 HydrophobicContact CE-CG2 4.19Å; M265-V388 HydrophobicContact CG-CG2 3.89Å; M265-L389 HydrophobicContact CE-CB 4.09Å; M265-L389 HydrophobicContact SD-CB 4.08Å; M265-L389 HydrophobicContact SD-CD2 4.22Å; M265-L416 HydrophobicContact CB-CD2 4.48Å; M265-L416 HydrophobicContact CG-CD2 3.55Å
266	R	95.2	Very high	89.6	Confident	123 Å²	123	80.7 Å²	80.7	46%	0.464	38%	0.378	S	S	.	.	H	α-helix	trans	-62.8	-44.7	177.3	-175.2	-176.9	64.8	168	0.8	111.9	M262 E263 R264 L268 Q269 E270	M262-R266 PolarHBondContact O-N 3.2Å; E263-R266 PolarHBondContact O-N 2.64Å; E263-R266 IonicContact OE1-CZ 3.99Å; E263-R266 IonicContact OE1-NE 2.65Å; E263-R266 IonicContact OE1-NH2 3.23Å; E263-R266 PolarHBondContact OE1-NH2 3.14Å; E263-R266 IonicContact OE2-CZ 3.52Å; E263-R266 VanDerWaalsContact OE2-CZ 3.23Å; E263-R266 IonicContact OE2-NE 3.58Å; E263-R266 IonicContact OE2-NH2 2.7Å; E263-R266 PolarHBondContact OE2-NH2 3.47Å; R264-R266 VanDerWaalsContact C-N 3.35Å; R264-R266 PolarHBondContact O-N 2.61Å; R266-L268 VanDerWaalsContact C-N 3.32Å; R266-L268 PolarHBondContact O-N 2.73Å; R266-Q269 PolarHBondContact O-N 3.32Å; R266-E270 IonicContact NE-OE1 3.32Å; R266-E270 WeakPolarHBondContact O-CG 3.46Å; R266-E270 PolarHBondContact O-N 3.1Å
267	Q	94.4	Very high	88.7	Confident	97 Å²	97	77.3 Å²	77.3	45%	0.453	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-42.6	178.2	-72.1	169.9	6.5	0	0	111.9	E263 R264 E270 S271	E263-Q267 WeakPolarHBondContact O-CG 3.17Å; E263-Q267 PolarHBondContact O-N 3.24Å; E263-Q267 PolarHBondContact OE1-NE2 2.72Å; R264-Q267 PolarHBondContact O-N 3.01Å; Q267-E270 PolarHBondContact O-N 3.45Å; Q267-S271 PolarHBondContact O-N 3.17Å; Q267-S271 PolarHBondContact O-OG 3.27Å
268	L	93.4	Very high	88.3	Confident	12 Å²	12	73.5 Å²	73.5	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-66.8	-38.3	176.2	-70	173.8	0	0	0	112.5	R264 M265 R266 E270 S271 L272 E412 L416	R264-L268 WeakPolarHBondContact O-CG 3.48Å; R264-L268 PolarHBondContact O-N 3.17Å; M265-L268 PolarHBondContact O-N 2.92Å; R266-L268 VanDerWaalsContact C-N 3.32Å; R266-L268 PolarHBondContact O-N 2.73Å; L268-E270 VanDerWaalsContact C-N 3.34Å; L268-S271 WeakPolarHBondContact CA-OG 3.4Å; L268-S271 PolarHBondContact O-N 2.95Å; L268-S271 PolarHBondContact O-OG 2.86Å; L268-L272 WeakPolarHBondContact O-CB 3.26Å; L268-L272 WeakPolarHBondContact O-CD1 3.4Å; L268-L272 WeakPolarHBondContact O-CG 3.38Å; L268-L272 PolarHBondContact O-N 3.36Å; L268-E412 HydrophobicContact CD1-CB 4.26Å; L268-E412 HydrophobicContact CD1-CG 3.99Å; L268-E412 HydrophobicContact CD2-CG 3.94Å; L268-L416 HydrophobicContact CD1-CD1 3.74Å; L268-L416 HydrophobicContact CD1-CD2 3.93Å; L268-L416 HydrophobicContact CD1-CG 3.79Å
269	Q	92.1	Very high	88	Confident	51 Å²	51	76.5 Å²	76.5	24%	0.238	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-41.4	173.7	-73.3	171.5	-31.3	0	0	111.6	M265 R266 L273 D385 V388	M265-Q269 WeakPolarHBondContact O-CG 3.27Å; M265-Q269 PolarHBondContact O-N 3.38Å; R266-Q269 PolarHBondContact O-N 3.32Å; Q269-L273 VanDerWaalsContact O-CG 3.32Å; Q269-L273 WeakPolarHBondContact O-CG 3.47Å; Q269-L273 PolarHBondContact O-N 2.99Å; Q269-D385 PolarHBondContact NE2-OD2 3.44Å; Q269-D385 VanDerWaalsContact NE2-OD2 3.07Å; Q269-V388 HydrophobicContact CG-CG1 3.75Å; Q269-V388 HydrophobicContact CG-CG2 4.39Å
270	E	90.6	Very high	87.7	Confident	85 Å²	85	77.3 Å²	77.3	40%	0.397	40%	0.396	S	S	.	.	H	α-helix	trans	-66.1	-39.3	176.1	-71.7	177.4	-163.4	0	0	112.5	R266 Q267 L268 L273 R274	R266-E270 IonicContact NE-OE1 3.32Å; R266-E270 WeakPolarHBondContact O-CG 3.46Å; R266-E270 PolarHBondContact O-N 3.1Å; Q267-E270 PolarHBondContact O-N 3.45Å; L268-E270 VanDerWaalsContact C-N 3.34Å; E270-L273 PolarHBondContact O-N 3.24Å; E270-R274 WeakPolarHBondContact O-CG 3.42Å; E270-R274 PolarHBondContact O-N 2.86Å
271	S	87	Confident	87.4	Confident	37 Å²	37	83.1 Å²	83.1	26%	0.259	42%	0.416	S	S	.	.	H	α-helix	trans	-67.6	-39.5	177.2	65.8	0	0	0	0	112.2	Q267 L268 L273 R274 D275	Q267-S271 PolarHBondContact O-N 3.17Å; Q267-S271 PolarHBondContact O-OG 3.27Å; L268-S271 WeakPolarHBondContact CA-OG 3.4Å; L268-S271 PolarHBondContact O-N 2.95Å; L268-S271 PolarHBondContact O-OG 2.86Å; S271-L273 VanDerWaalsContact C-N 3.26Å; S271-L273 PolarHBondContact O-N 3.31Å; S271-R274 PolarHBondContact O-N 2.85Å; S271-R274 VanDerWaalsContact O-N 3.13Å; S271-D275 PolarHBondContact O-N 3.37Å
272	L	83.6	Confident	87.1	Confident	85 Å²	85	86.8 Å²	86.8	45%	0.445	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-35.2	174.3	-71.9	164	0	0	0	112	L268 V388 R391	L268-L272 WeakPolarHBondContact O-CB 3.26Å; L268-L272 WeakPolarHBondContact O-CD1 3.4Å; L268-L272 WeakPolarHBondContact O-CG 3.38Å; L268-L272 PolarHBondContact O-N 3.36Å; L272-V388 HydrophobicContact CD1-CG1 4.13Å; L272-R391 VanDerWaalsContact CD1-NH2 3.26Å
273	L	84.2	Confident	86.8	Confident	152 Å²	152	86.3 Å²	86.3	80%	0.796	43%	0.431	S	S	*	.	H	α-helix	trans	-74.1	-25.6	176.6	-71.3	169.5	0	0	0	113.2	Q269 E270 S271	Q269-L273 VanDerWaalsContact O-CG 3.32Å; Q269-L273 WeakPolarHBondContact O-CG 3.47Å; Q269-L273 PolarHBondContact O-N 2.99Å; E270-L273 PolarHBondContact O-N 3.24Å; S271-L273 VanDerWaalsContact C-N 3.26Å; S271-L273 PolarHBondContact O-N 3.31Å
274	R	81.9	Confident	86.6	Confident	166 Å²	166	86.3 Å²	86.3	63%	0.626	43%	0.431	S	S	*	.	H	α-helix	trans	-91.1	-5.3	-178.4	-70	177.9	-176.3	-144.9	4.4	114.1	E270 S271 E276	E270-R274 WeakPolarHBondContact O-CG 3.42Å; E270-R274 PolarHBondContact O-N 2.86Å; S271-R274 PolarHBondContact O-N 2.85Å; S271-R274 VanDerWaalsContact O-N 3.13Å; R274-E276 HydrophobicContact CB-CG 3.94Å; R274-E276 PolarHBondContact O-N 2.62Å
275	D	71.6	Confident	86.3	Confident	148 Å²	148	86 Å²	86	79%	0.791	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	34.1	-174.9	-158.7	24.3	0	0	0	112.5	S271 G277	S271-D275 PolarHBondContact O-N 3.37Å; D275-G277 PolarHBondContact O-N 2.72Å
276	E	70	Confident	86.2	Confident	131 Å²	131	89.1 Å²	89.1	61%	0.612	45%	0.454	S	S	*	.			trans	-77.1	67.6	173.6	-71.4	178.5	-170.3	0	0	109.1	R274	R274-E276 HydrophobicContact CB-CG 3.94Å; R274-E276 PolarHBondContact O-N 2.62Å
277	G	66.1	Low	86.1	Confident	66 Å²	66	83.3 Å²	83.3	68%	0.68	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-76.3	141.4	-172.2	0	0	0	0	0	114.5	D275	D275-G277 PolarHBondContact O-N 2.72Å
278	T	79.6	Confident	85.9	Confident	37 Å²	37	82.1 Å²	82.1	23%	0.227	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-74.1	147	166.7	-59.2	0	0	0	0	109.4	E282 M283	T278-E282 HydrophobicContact CG2-CB 3.68Å; T278-E282 HydrophobicContact CG2-CG 3.55Å; T278-E282 WeakPolarHBondContact CG2-OE2 3.18Å; T278-M283 HydrophobicContact CG2-CG 4.11Å
279	S	86.9	Confident	85.8	Confident	67 Å²	67	87.2 Å²	87.2	47%	0.469	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-61.6	150.1	177.9	74.6	0	0	0	0	111.9	E281 E282 M283	S279-E281 VanDerWaalsContact C-N 3.33Å; S279-E281 PolarHBondContact O-N 3.1Å; S279-E282 PolarHBondContact O-N 3.41Å; S279-E282 VanDerWaalsContact O-N 3.16Å; S279-E282 VanDerWaalsContact OG-CB 3.31Å; S279-E282 WeakPolarHBondContact OG-CB 3.34Å; S279-E282 PolarHBondContact OG-N 3.16Å; S279-M283 WeakPolarHBondContact O-CG 3.44Å; S279-M283 PolarHBondContact O-N 3.48Å
280	Q	86.3	Confident	85.7	Confident	115 Å²	115	85 Å²	85	54%	0.537	44%	0.443	S	S	.	.	H	α-helix	trans	-57.5	-45.2	-179.7	-172	177.9	-7.8	0	0	112.1	E282 M283 E284	Q280-E282 VanDerWaalsContact C-N 3.28Å; Q280-E282 PolarHBondContact O-N 2.68Å; Q280-M283 HydrophobicContact CB-CE 4.38Å; Q280-M283 PolarHBondContact O-N 3.2Å; Q280-M283 VanDerWaalsContact O-N 3.16Å; Q280-E284 WeakPolarHBondContact O-CG 3.42Å; Q280-E284 PolarHBondContact O-N 3.18Å
281	E	89.4	Confident	85.7	Confident	159 Å²	159	81.3 Å²	81.3	74%	0.743	43%	0.425	S	S	*	.	H	α-helix	trans	-59.4	-38.8	178.7	-173.6	175.5	-176.3	0	0	112.4	S279 E284 S285	S279-E281 VanDerWaalsContact C-N 3.33Å; S279-E281 PolarHBondContact O-N 3.1Å; E281-E284 PolarHBondContact O-N 3.31Å; E281-S285 PolarHBondContact O-N 2.87Å
282	E	90.3	Very high	85.5	Confident	87 Å²	87	82 Å²	82	41%	0.407	43%	0.43	S	S	.	.	H	α-helix	trans	-71.3	-38.2	176.5	-177.7	177.2	-179.7	0	0	112.2	T278 S279 Q280 E284 S285 R286	T278-E282 HydrophobicContact CG2-CB 3.68Å; T278-E282 HydrophobicContact CG2-CG 3.55Å; T278-E282 WeakPolarHBondContact CG2-OE2 3.18Å; S279-E282 PolarHBondContact O-N 3.41Å; S279-E282 VanDerWaalsContact O-N 3.16Å; S279-E282 VanDerWaalsContact OG-CB 3.31Å; S279-E282 WeakPolarHBondContact OG-CB 3.34Å; S279-E282 PolarHBondContact OG-N 3.16Å; Q280-E282 VanDerWaalsContact C-N 3.28Å; Q280-E282 PolarHBondContact O-N 2.68Å; E282-E284 VanDerWaalsContact C-N 3.32Å; E282-E284 PolarHBondContact O-N 3.28Å; E282-S285 PolarHBondContact O-N 2.94Å; E282-R286 WeakPolarHBondContact O-CG 3.19Å; E282-R286 PolarHBondContact O-N 2.77Å; E282-R286 IonicContact OE1-CZ 3.53Å; E282-R286 IonicContact OE1-NE 3.07Å; E282-R286 PolarHBondContact OE1-NE 2.96Å; E282-R286 IonicContact OE1-NH2 3.9Å; E282-R286 PolarHBondContact OE1-NH2 3.09Å
283	M	90.1	Very high	85.5	Confident	35 Å²	35	80.9 Å²	80.9	17%	0.172	42%	0.422	C	S	.	.	H	α-helix	trans	-61.4	-41	173.3	-68.2	-169.4	-68.5	0	0	111.8	T278 S279 Q280 R286 F287	T278-M283 HydrophobicContact CG2-CG 4.11Å; S279-M283 WeakPolarHBondContact O-CG 3.44Å; S279-M283 PolarHBondContact O-N 3.48Å; Q280-M283 HydrophobicContact CB-CE 4.38Å; Q280-M283 PolarHBondContact O-N 3.2Å; Q280-M283 VanDerWaalsContact O-N 3.16Å; M283-R286 PolarHBondContact O-N 3.19Å; M283-F287 PolarHBondContact O-N 2.99Å
284	E	91.3	Very high	85.2	Confident	69 Å²	69	77.2 Å²	77.2	32%	0.322	41%	0.41	S	S	.	.	H	α-helix	trans	-63	-42.7	174.7	-63.6	-167.5	156	0	0	111.7	Q280 E281 E282 F287 E288 R404	Q280-E284 WeakPolarHBondContact O-CG 3.42Å; Q280-E284 PolarHBondContact O-N 3.18Å; E281-E284 PolarHBondContact O-N 3.31Å; E282-E284 VanDerWaalsContact C-N 3.32Å; E282-E284 PolarHBondContact O-N 3.28Å; E284-F287 WeakPolarHBondContact O-CB 3.31Å; E284-F287 PolarHBondContact O-N 2.78Å; E284-E288 PolarHBondContact O-N 3.33Å; E284-E288 VanDerWaalsContact O-N 3.1Å; E284-R404 VanDerWaalsContact CD-NH1 3.34Å; E284-R404 VanDerWaalsContact CG-NH1 3.27Å; E284-R404 IonicContact OE1-CZ 3.82Å; E284-R404 IonicContact OE1-NH1 3.9Å; E284-R404 PolarHBondContact OE1-NH1 3.22Å; E284-R404 IonicContact OE1-NH2 3.72Å; E284-R404 PolarHBondContact OE1-NH2 2.66Å; E284-R404 IonicContact OE2-NH1 2.77Å
285	S	91.9	Very high	84.9	Confident	80 Å²	80	70 Å²	70	56%	0.559	38%	0.383	S	S	*	.	H	α-helix	trans	-62.8	-43.8	176.3	-174.5	0	0	0	0	112.4	E281 E282 F287 E288 L289	E281-S285 PolarHBondContact O-N 2.87Å; E282-S285 PolarHBondContact O-N 2.94Å; S285-F287 VanDerWaalsContact C-N 3.33Å; S285-F287 PolarHBondContact O-N 3Å; S285-E288 PolarHBondContact O-N 3.24Å; S285-L289 PolarHBondContact O-N 3.08Å
286	R	93.6	Very high	84.3	Confident	70 Å²	70	66.5 Å²	66.5	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-38.6	177	-71.8	176	-176.3	-170.3	5.9	111.8	E282 M283 L289 E290 D409	E282-R286 WeakPolarHBondContact O-CG 3.19Å; E282-R286 PolarHBondContact O-N 2.77Å; E282-R286 IonicContact OE1-CZ 3.53Å; E282-R286 IonicContact OE1-NE 3.07Å; E282-R286 PolarHBondContact OE1-NE 2.96Å; E282-R286 IonicContact OE1-NH2 3.9Å; E282-R286 PolarHBondContact OE1-NH2 3.09Å; M283-R286 PolarHBondContact O-N 3.19Å; R286-L289 PolarHBondContact O-N 2.64Å; R286-E290 WeakPolarHBondContact O-CB 3.16Å; R286-E290 PolarHBondContact O-N 2.89Å; R286-D409 VanDerWaalsContact CD-OD1 3.22Å; R286-D409 WeakPolarHBondContact CD-OD1 3.44Å; R286-D409 IonicContact CZ-OD1 2.64Å; R286-D409 IonicContact CZ-OD2 3.03Å; R286-D409 IonicContact NE-OD1 3.71Å; R286-D409 IonicContact NH1-OD1 2.61Å; R286-D409 PolarHBondContact NH1-OD1 2.83Å; R286-D409 IonicContact NH1-OD2 3.72Å; R286-D409 PolarHBondContact NH1-OD2 3.38Å
287	F	93.6	Very high	83.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-48.3	172.9	174.1	-97.3	0	0	0	112.2	M283 E284 S285 L289 E290 K291 T336 C399 I403 R404 Y410	M283-F287 PolarHBondContact O-N 2.99Å; E284-F287 WeakPolarHBondContact O-CB 3.31Å; E284-F287 PolarHBondContact O-N 2.78Å; S285-F287 VanDerWaalsContact C-N 3.33Å; S285-F287 PolarHBondContact O-N 3Å; F287-L289 VanDerWaalsContact C-N 3.3Å; F287-L289 PolarHBondContact O-N 3.17Å; F287-E290 PolarHBondContact O-N 3.2Å; F287-K291 HydrophobicContact CE1-CB 4.37Å; F287-K291 HydrophobicContact CE1-CD 3.85Å; F287-K291 HydrophobicContact CZ-CB 4.44Å; F287-K291 HydrophobicContact CZ-CD 4.04Å; F287-K291 VanDerWaalsContact O-CB 3.32Å; F287-K291 WeakPolarHBondContact O-CB 2.94Å; F287-K291 PolarHBondContact O-N 3.37Å; F287-T336 HydrophobicContact CD1-CG2 3.94Å; F287-T336 HydrophobicContact CE1-CG2 3.27Å; F287-T336 HydrophobicContact CZ-CG2 3.9Å; F287-C399 HydrophobicContact CD2-CB 4.41Å; F287-C399 HydrophobicContact CE2-CB 3.88Å; F287-C399 VanDerWaalsContact CE2-SG 3.57Å; F287-I403 WeakPolarHBondContact CE2-O 3.41Å; F287-R404 HydrophobicContact CB-CG 4.07Å; F287-R404 HydrophobicContact CD1-CB 4.06Å; F287-R404 HydrophobicContact CD1-CG 3.96Å; F287-R404 HydrophobicContact CD2-CB 3.83Å; F287-R404 HydrophobicContact CD2-CG 3.63Å; F287-R404 HydrophobicContact CE1-CB 3.91Å; F287-R404 HydrophobicContact CE1-CG 4.33Å; F287-R404 HydrophobicContact CE2-CB 3.63Å; F287-R404 HydrophobicContact CE2-CG 3.99Å; F287-R404 HydrophobicContact CG-CB 4.02Å; F287-R404 HydrophobicContact CG-CG 3.58Å; F287-R404 HydrophobicContact CZ-CB 3.67Å; F287-R404 HydrophobicContact CZ-CG 4.33Å; F287-Y410 HydrophobicContact CB-CD2 3.81Å; F287-Y410 HydrophobicContact CB-CE2 4.24Å; F287-Y410 HydrophobicContact CB-CG 4.17Å; F287-Y410 HydrophobicContact CD2-CD1 4.01Å; F287-Y410 AromaticContact CD2-CD2 3.78Å; F287-Y410 HydrophobicContact CD2-CD2 3.78Å; F287-Y410 AromaticContact CD2-CE1 3.76Å; F287-Y410 HydrophobicContact CD2-CE1 3.76Å; F287-Y410 AromaticContact CD2-CE2 3.5Å; F287-Y410 HydrophobicContact CD2-CE2 3.5Å; F287-Y410 HydrophobicContact CD2-CG 4.02Å; F287-Y410 AromaticContact CD2-CZ 3.47Å; F287-Y410 VanDerWaalsContact CD2-CZ 3.47Å; F287-Y410 HydrophobicContact CE2-CE1 4.16Å; F287-Y410 HydrophobicContact CE2-CE2 4.3Å; F287-Y410 AromaticContact CE2-CZ 3.88Å; F287-Y410 HydrophobicContact CG-CD2 4.28Å; F287-Y410 HydrophobicContact CG-CE2 4.27Å
288	E	91.1	Very high	81.9	Confident	73 Å²	73	67 Å²	67	34%	0.341	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-36.8	179.6	-69.2	-60.3	145.7	0	0	112	E284 S285 K291 S292 T336	E284-E288 PolarHBondContact O-N 3.33Å; E284-E288 VanDerWaalsContact O-N 3.1Å; S285-E288 PolarHBondContact O-N 3.24Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 IonicContact OE1-NZ 2.97Å; E288-K291 PolarHBondContact OE1-NZ 2.87Å; E288-K291 VanDerWaalsContact OE1-NZ 3.1Å; E288-K291 WeakPolarHBondContact OE2-CE 3.21Å; E288-K291 IonicContact OE2-NZ 2.85Å; E288-K291 PolarHBondContact OE2-NZ 3.23Å; E288-S292 WeakPolarHBondContact O-CB 3.37Å; E288-S292 PolarHBondContact O-N 3Å; E288-S292 PolarHBondContact O-OG 2.87Å; E288-T336 PolarHBondContact OE1-OG1 2.92Å
289	L	90.4	Very high	79.8	Confident	119 Å²	119	68.3 Å²	68.3	62%	0.623	37%	0.372	S	S	*	.	H	α-helix	trans	-62.5	-46.6	173.8	-174.4	67.6	0	0	0	111.5	S285 R286 F287 S292 E293	S285-L289 PolarHBondContact O-N 3.08Å; R286-L289 PolarHBondContact O-N 2.64Å; F287-L289 VanDerWaalsContact C-N 3.3Å; F287-L289 PolarHBondContact O-N 3.17Å; L289-S292 CarbonylContact O-C 3.57Å; L289-S292 PolarHBondContact O-N 3.46Å; L289-S292 PolarHBondContact O-OG 2.63Å; L289-E293 PolarHBondContact O-N 3.38Å
290	E	91.2	Very high	77.2	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.023	37%	0.373	C	S	.	.	H	α-helix	trans	-66.1	-44.5	-179.5	-169.1	58.2	-146.8	0	0	111.9	R286 F287 S292 E293 Y396 V413 N414 K422	R286-E290 WeakPolarHBondContact O-CB 3.16Å; R286-E290 PolarHBondContact O-N 2.89Å; F287-E290 PolarHBondContact O-N 3.2Å; E290-S292 VanDerWaalsContact C-N 3.26Å; E290-S292 PolarHBondContact O-N 3.11Å; E290-E293 WeakPolarHBondContact O-CB 3.12Å; E290-E293 PolarHBondContact O-N 3.34Å; E290-Y396 HydrophobicContact CG-CD2 4.21Å; E290-Y396 HydrophobicContact CG-CE2 4.45Å; E290-Y396 VanDerWaalsContact OE1-CD2 3.3Å; E290-Y396 WeakPolarHBondContact OE1-CD2 3.46Å; E290-Y396 WeakPolarHBondContact OE1-CE2 3.35Å; E290-V413 HydrophobicContact CG-CB 4.5Å; E290-V413 HydrophobicContact CG-CG1 4.3Å; E290-V413 WeakPolarHBondContact OE1-CG1 3.36Å; E290-N414 PolarHBondContact OE2-ND2 2.79Å; E290-N414 PolarHBondContact OE2-OD1 3.42Å; E290-K422 WeakPolarHBondContact OE1-CE 3.3Å; E290-K422 IonicContact OE1-NZ 3.74Å; E290-K422 PolarHBondContact OE1-NZ 3.44Å; E290-K422 IonicContact OE2-NZ 3.35Å; E290-K422 PolarHBondContact OE2-NZ 2.93Å
291	K	88.6	Confident	74.7	Confident	7 Å²	7	68 Å²	68	3%	0.03	39%	0.389	C	S	.	.	H	α-helix	trans	-62.4	-34.6	176.6	-174.5	-175.8	64.7	178.5	0	112	F287 E288 E293 F326 T336 C399	F287-K291 HydrophobicContact CE1-CB 4.37Å; F287-K291 HydrophobicContact CE1-CD 3.85Å; F287-K291 HydrophobicContact CZ-CB 4.44Å; F287-K291 HydrophobicContact CZ-CD 4.04Å; F287-K291 VanDerWaalsContact O-CB 3.32Å; F287-K291 WeakPolarHBondContact O-CB 2.94Å; F287-K291 PolarHBondContact O-N 3.37Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 IonicContact OE1-NZ 2.97Å; E288-K291 PolarHBondContact OE1-NZ 2.87Å; E288-K291 VanDerWaalsContact OE1-NZ 3.1Å; E288-K291 WeakPolarHBondContact OE2-CE 3.21Å; E288-K291 IonicContact OE2-NZ 2.85Å; E288-K291 PolarHBondContact OE2-NZ 3.23Å; K291-E293 VanDerWaalsContact C-N 3.33Å; K291-F326 HydrophobicContact CD-CB 4.27Å; K291-F326 HydrophobicContact CD-CD1 4.06Å; K291-F326 HydrophobicContact CD-CD2 3.9Å; K291-F326 HydrophobicContact CD-CE1 4.4Å; K291-F326 HydrophobicContact CD-CE2 4.26Å; K291-F326 HydrophobicContact CD-CG 3.82Å; K291-F326 HydrophobicContact CG-CB 4.1Å; K291-F326 HydrophobicContact CG-CD2 3.54Å; K291-F326 HydrophobicContact CG-CE2 4.1Å; K291-F326 HydrophobicContact CG-CG 3.82Å; K291-T336 PolarHBondContact NZ-OG1 2.92Å; K291-C399 VanDerWaalsContact CA-SG 3.6Å; K291-C399 PolarHBondContact N-SG 3.21Å; K291-C399 VanDerWaalsContact N-SG 3.45Å
292	S	84.4	Confident	72	Confident	51 Å²	51	67.7 Å²	67.7	36%	0.357	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	7.9	179.5	65.6	0	0	0	0	113.6	E288 L289 E290 S294 T327	E288-S292 WeakPolarHBondContact O-CB 3.37Å; E288-S292 PolarHBondContact O-N 3Å; E288-S292 PolarHBondContact O-OG 2.87Å; L289-S292 CarbonylContact O-C 3.57Å; L289-S292 PolarHBondContact O-N 3.46Å; L289-S292 PolarHBondContact O-OG 2.63Å; E290-S292 VanDerWaalsContact C-N 3.26Å; E290-S292 PolarHBondContact O-N 3.11Å; S292-S294 PolarHBondContact O-N 2.93Å; S292-T327 VanDerWaalsContact C-CG2 3.42Å; S292-T327 VanDerWaalsContact CA-CG2 3.5Å; S292-T327 WeakPolarHBondContact O-CG2 3.27Å
293	E	83.3	Confident	69.7	Low	61 Å²	61	68.3 Å²	68.3	29%	0.285	40%	0.398	S	S	.	.			trans	-76.8	110.2	174.9	-163	-167	-151.8	0	0	111.1	L289 E290 K291 L295 K422 K426	L289-E293 PolarHBondContact O-N 3.38Å; E290-E293 WeakPolarHBondContact O-CB 3.12Å; E290-E293 PolarHBondContact O-N 3.34Å; K291-E293 VanDerWaalsContact C-N 3.33Å; E293-L295 HydrophobicContact CG-CD2 4.23Å; E293-L295 HydrophobicContact CG-CG 4.07Å; E293-L295 PolarHBondContact O-N 3.42Å; E293-L295 VanDerWaalsContact OE2-CD1 3.27Å; E293-L295 WeakPolarHBondContact OE2-CD1 3.29Å; E293-L295 WeakPolarHBondContact OE2-CG 3.42Å; E293-K422 IonicContact OE1-NZ 3.59Å; E293-K422 WeakPolarHBondContact OE2-CE 3.4Å; E293-K422 IonicContact OE2-NZ 2.82Å; E293-K422 PolarHBondContact OE2-NZ 3.21Å; E293-K426 PolarHBondContact O-NZ 3Å
294	S	77.6	Confident	67	Low	76 Å²	76	74.5 Å²	74.5	53%	0.531	43%	0.43	S	S	.	.			trans	-82.6	103.1	173.1	-174.5	0	0	0	0	110.6	S292 D325	S292-S294 PolarHBondContact O-N 2.93Å; S294-D325 WeakPolarHBondContact CA-OD2 3.36Å
295	L	74.8	Confident	64.4	Low	13 Å²	13	77.5 Å²	77.5	7%	0.068	44%	0.444	C	S	.	.			trans	-100.3	4.6	178	-70.5	170.4	0	0	0	113.5	E293 V297 Y396 R419 K422 V423 K426	E293-L295 HydrophobicContact CG-CD2 4.23Å; E293-L295 HydrophobicContact CG-CG 4.07Å; E293-L295 PolarHBondContact O-N 3.42Å; E293-L295 VanDerWaalsContact OE2-CD1 3.27Å; E293-L295 WeakPolarHBondContact OE2-CD1 3.29Å; E293-L295 WeakPolarHBondContact OE2-CG 3.42Å; L295-V297 PolarHBondContact O-N 2.99Å; L295-Y396 WeakPolarHBondContact CD1-OH 3.33Å; L295-R419 HydrophobicContact CD2-CG 4.29Å; L295-K422 HydrophobicContact CD1-CB 3.44Å; L295-K422 VanDerWaalsContact CD1-CB 3.44Å; L295-K422 HydrophobicContact CD1-CD 4.44Å; L295-V423 HydrophobicContact CB-CG2 4.09Å; L295-V423 HydrophobicContact CD2-CG2 4.25Å; L295-K426 HydrophobicContact CB-CD 4.38Å
296	L	59.1	Low	61.9	Low	76 Å²	76	79 Å²	79	40%	0.398	45%	0.452	S	S	.	.			trans	-63.4	110.6	-179.7	-72.6	175.5	0	0	0	109.9	T298 Y431	L296-T298 PolarHBondContact O-N 3.41Å; L296-Y431 HydrophobicContact CD1-CE2 4.16Å; L296-Y431 HydrophobicContact CD2-CD2 3.9Å; L296-Y431 HydrophobicContact CD2-CE2 3.69Å
297	V	48.3	Very low	59.3	Low	91 Å²	91	80.4 Å²	80.4	55%	0.552	47%	0.473	S	S	*	.			trans	-69	109.3	164.2	-178.2	0	0	0	0	105.6	L295 V423	L295-V297 PolarHBondContact O-N 2.99Å; V297-V423 HydrophobicContact CG2-CG1 3.96Å
298	T	37.6	Very low	57.1	Low	115 Å²	115	83.3 Å²	83.3	71%	0.706	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-48.1	127.3	161.6	45	0	0	0	0	107	L296 S300	L296-T298 PolarHBondContact O-N 3.41Å; T298-S300 PolarHBondContact O-N 3.28Å
299	P	36.3	Very low	55.3	Low	65 Å²	65	84.9 Å²	84.9	42%	0.422	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-50.3	125	171.4	-17.5	27.6	0	0	0	106.5	A301	P299-A301 PolarHBondContact O-N 2.86Å
300	S	31.7	Very low	53.9	Low	70 Å²	70	83.6 Å²	83.6	49%	0.49	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-50.5	132	163.8	-57.6	0	0	0	0	106	T298 D302 I303	T298-S300 PolarHBondContact O-N 3.28Å; S300-D302 PolarHBondContact O-N 3.16Å; S300-I303 PolarHBondContact O-N 3.26Å; S300-I303 VanDerWaalsContact O-N 3.11Å
301	A	34.2	Very low	53.3	Low	105 Å²	105	86.9 Å²	86.9	87%	0.868	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	2.5	-171.8	0	0	0	0	0	115.2	P299	P299-A301 PolarHBondContact O-N 2.86Å
302	D	32.1	Very low	53.4	Low	153 Å²	153	87.2 Å²	87.2	82%	0.818	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-1.9	-179.1	-58.7	-35.1	0	0	0	114	S300	S300-D302 PolarHBondContact O-N 3.16Å
303	I	42.2	Very low	53.8	Low	101 Å²	101	87.7 Å²	87.7	52%	0.518	52%	0.515	S	S	.	.	S	Bend	trans	-94	101.3	169.7	-52.6	177	0	0	0	106.7	S300 E305	S300-I303 PolarHBondContact O-N 3.26Å; S300-I303 VanDerWaalsContact O-N 3.11Å; I303-E305 PolarHBondContact O-N 3.43Å
304	L	34	Very low	54.3	Low	164 Å²	164	87 Å²	87	86%	0.859	52%	0.517	S	S	*	.			trans	-44	107.8	160.9	-80.9	153.9	0	0	0	107.1	P306	L304-P306 VanDerWaalsContact O-CD 3.27Å; L304-P306 WeakPolarHBondContact O-CD 3.46Å
305	E	36.8	Very low	55.3	Low	133 Å²	133	83.5 Å²	83.5	62%	0.621	49%	0.492	S	S	*	.			trans	-53	119.9	171.5	-76.8	-155	145.2	0	0	105.7	I303 S307 K434	I303-E305 PolarHBondContact O-N 3.43Å; E305-S307 PolarHBondContact O-N 2.86Å; E305-K434 IonicContact OE1-NZ 3.7Å
306	P	40	Very low	56.3	Low	112 Å²	112	83.7 Å²	83.7	73%	0.727	49%	0.494	S	S	*	.			trans	-55.1	115.8	173.9	-19.5	30	0	0	0	105.9	L304	L304-P306 VanDerWaalsContact O-CD 3.27Å; L304-P306 WeakPolarHBondContact O-CD 3.46Å
307	S	39.1	Very low	57.9	Low	99 Å²	99	84.6 Å²	84.6	69%	0.692	50%	0.496	S	S	*	.			trans	-50.5	131.9	172.7	52.2	0	0	0	0	107.2	E305 H309	E305-S307 PolarHBondContact O-N 2.86Å; S307-H309 PolarHBondContact O-N 3.45Å
308	P	47.1	Very low	60.2	Low	60 Å²	60	83.8 Å²	83.8	39%	0.39	49%	0.488	S	S	.	.			trans	-47.5	133.4	177.6	-24.9	31.1	0	0	0	109	Q124 P310 L313	Q124-P308 VanDerWaalsContact OE1-CA 3.23Å; P308-P310 WeakPolarHBondContact O-CD 3.48Å; P308-L313 HydrophobicContact CB-CD1 4.1Å; P308-L313 HydrophobicContact CB-CD2 4.13Å; P308-L313 HydrophobicContact CB-CG 4.33Å
309	H	52.3	Low	62.8	Low	106 Å²	106	81.3 Å²	81.3	49%	0.491	47%	0.474	S	S	.	.			trans	-59.7	113.6	173.6	-148.7	-75.2	0	0	0	106.1	S307 D311 M312	S307-H309 PolarHBondContact O-N 3.45Å; H309-D311 IonicContact CE1-OD2 2.99Å; H309-D311 PolarHBondContact CE1-OD2 2.83Å; H309-D311 IonicContact ND1-OD2 2.92Å; H309-D311 PolarHBondContact ND1-OD2 3.14Å; H309-D311 PolarHBondContact O-N 3.22Å; H309-M312 HydrophobicContact CB-CE 3.53Å; H309-M312 PolarHBondContact O-N 3.14Å
310	P	61.4	Low	65.4	Low	93 Å²	93	84.5 Å²	84.5	60%	0.604	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-59.2	-23.1	-167.2	19.2	-29.7	0	0	0	112.1	P308 M312	P308-P310 WeakPolarHBondContact O-CD 3.48Å; P310-M312 PolarHBondContact O-N 3.48Å
311	D	78.2	Confident	68.4	Low	73 Å²	73	82.5 Å²	82.5	39%	0.39	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-70.3	-23.6	-176.8	-53.9	-31.9	0	0	0	115	H309 C314	H309-D311 IonicContact CE1-OD2 2.99Å; H309-D311 PolarHBondContact CE1-OD2 2.83Å; H309-D311 IonicContact ND1-OD2 2.92Å; H309-D311 PolarHBondContact ND1-OD2 3.14Å; H309-D311 PolarHBondContact O-N 3.22Å; D311-C314 PolarHBondContact O-SG 2.8Å
312	M	90.4	Very high	71.1	Confident	14 Å²	14	78.2 Å²	78.2	7%	0.069	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-91.7	-19.2	-177.6	-70	-178.2	-80.5	0	0	113.5	Q124 V129 H309 P310 C314 F315	Q124-M312 HydrophobicContact CB-CE 3.89Å; Q124-M312 HydrophobicContact CB-SD 4.46Å; Q124-M312 WeakPolarHBondContact O-CE 3.18Å; V129-M312 HydrophobicContact CB-SD 4.23Å; V129-M312 HydrophobicContact CG1-CG 4.22Å; V129-M312 HydrophobicContact CG2-CG 4.38Å; V129-M312 HydrophobicContact CG2-SD 3.96Å; H309-M312 HydrophobicContact CB-CE 3.53Å; H309-M312 PolarHBondContact O-N 3.14Å; P310-M312 PolarHBondContact O-N 3.48Å; M312-C314 PolarHBondContact O-N 3.04Å; M312-F315 PolarHBondContact O-N 3.32Å
313	L	92.7	Very high	73.9	Confident	61 Å²	61	71.1 Å²	71.1	32%	0.319	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-65.8	-24.3	-176.5	-62.3	179.4	0	0	0	112.4	P308 F315 V316 P319	P308-L313 HydrophobicContact CB-CD1 4.1Å; P308-L313 HydrophobicContact CB-CD2 4.13Å; P308-L313 HydrophobicContact CB-CG 4.33Å; L313-F315 PolarHBondContact O-N 3.4Å; L313-V316 WeakPolarHBondContact O-CG2 3.43Å; L313-V316 PolarHBondContact O-N 3.47Å; L313-P319 HydrophobicContact CD2-CB 3.78Å; L313-P319 HydrophobicContact CD2-CG 4.38Å
314	C	94.9	Very high	75.9	Confident	47 Å²	47	68.9 Å²	68.9	32%	0.318	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-70	-12.8	179.1	69.9	0	0	0	0	113.4	G148 L149 D311 M312	G148-C314 CarbonylContact C-O 3.58Å; G148-C314 WeakPolarHBondContact CA-O 3.48Å; L149-C314 WeakPolarHBondContact CB-O 3.46Å; L149-C314 PolarHBondContact N-O 3.42Å; D311-C314 PolarHBondContact O-SG 2.8Å; M312-C314 PolarHBondContact O-N 3.04Å
315	F	97.4	Very high	78	Confident	2 Å²	2	62 Å²	62	1%	0.009	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-94.2	-1.6	179	-59.3	-66.2	0	0	0	114.5	Y114 I117 A121 M133 L146 M312 L313	Y114-F315 HydrophobicContact CE2-CD1 4.44Å; Y114-F315 HydrophobicContact CE2-CE1 4.3Å; I117-F315 HydrophobicContact CG2-CB 4.36Å; I117-F315 HydrophobicContact CG2-CD1 3.95Å; I117-F315 HydrophobicContact CG2-CD2 4.04Å; I117-F315 HydrophobicContact CG2-CE1 4.29Å; I117-F315 HydrophobicContact CG2-CE2 4.38Å; I117-F315 HydrophobicContact CG2-CG 3.83Å; A121-F315 HydrophobicContact CB-CB 3.89Å; M133-F315 HydrophobicContact CE-CD2 4.41Å; M133-F315 HydrophobicContact CE-CE1 4.25Å; M133-F315 HydrophobicContact CE-CE2 3.26Å; M133-F315 HydrophobicContact CE-CZ 3.15Å; L146-F315 VanDerWaalsContact O-CZ 3.25Å; L146-F315 WeakPolarHBondContact O-CZ 3.32Å; M312-F315 PolarHBondContact O-N 3.32Å; L313-F315 PolarHBondContact O-N 3.4Å
316	V	96.4	Very high	79.8	Confident	18 Å²	18	56.7 Å²	56.7	11%	0.109	33%	0.33	C	S	.	.			trans	-130.1	146.8	-173.9	-61.8	0	0	0	0	112.1	A121 L313 P319	A121-V316 HydrophobicContact CB-CG1 3.6Å; L313-V316 WeakPolarHBondContact O-CG2 3.43Å; L313-V316 PolarHBondContact O-N 3.47Å; V316-P319 HydrophobicContact CG2-CB 3.96Å; V316-P319 HydrophobicContact CG2-CG 4.07Å
317	E	94	Very high	81	Confident	94 Å²	94	54 Å²	54	44%	0.439	31%	0.311	S	S	.	.	S	Bend	trans	-95.6	144.8	164.2	-67.2	-179	160.4	0	0	109.2	R122 L149 S160	R122-E317 PolarHBondContact NH1-O 2.66Å; L149-E317 HydrophobicContact CD2-CG 4Å; S160-E317 VanDerWaalsContact CB-OE2 3.25Å; S160-E317 WeakPolarHBondContact CB-OE2 3.38Å; S160-E317 VanDerWaalsContact OG-CD 3.28Å; S160-E317 PolarHBondContact OG-OE2 2.9Å
318	D	94.7	Very high	81.9	Confident	74 Å²	74	56.1 Å²	56.1	40%	0.396	30%	0.304	S	S	.	.	S	Bend	trans	52.1	69.6	-179.1	-167.4	4.2	0	0	0	112.7	R122 K164 T320 F321	R122-D318 PolarHBondContact NH1-O 3.4Å; R122-D318 VanDerWaalsContact NH1-O 3.12Å; R122-D318 PolarHBondContact NH2-O 3.2Å; R122-D318 VanDerWaalsContact NH2-O 3.14Å; K164-D318 HydrophobicContact CD-CB 3.91Å; K164-D318 IonicContact NZ-OD2 3.93Å; D318-T320 PolarHBondContact O-N 3.03Å; D318-F321 HydrophobicContact CB-CB 4.31Å; D318-F321 WeakPolarHBondContact O-CB 3.01Å; D318-F321 PolarHBondContact O-N 3.49Å; D318-F321 WeakPolarHBondContact OD2-CD2 3.22Å
319	P	92.4	Very high	81.9	Confident	64 Å²	64	65.5 Å²	65.5	42%	0.416	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.2	-170	-15.9	28.7	0	0	0	114	L313 V316	L313-P319 HydrophobicContact CD2-CB 3.78Å; L313-P319 HydrophobicContact CD2-CG 4.38Å; V316-P319 HydrophobicContact CG2-CB 3.96Å; V316-P319 HydrophobicContact CG2-CG 4.07Å
320	T	91.5	Very high	81.6	Confident	132 Å²	132	64.8 Å²	64.8	81%	0.81	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.8	-179.4	54.7	0	0	0	0	112.9	D318 G322	D318-T320 PolarHBondContact O-N 3.03Å; T320-G322 PolarHBondContact O-N 3.2Å
321	F	93.8	Very high	81.2	Confident	27 Å²	27	63.3 Å²	63.3	12%	0.118	35%	0.349	C	S	.	.			trans	-63.9	105.2	173	-170.1	-84.1	0	0	0	110.2	R122 K164 L165 H168 R169 L172 D318	R122-F321 PolarHBondContact NH2-O 3.24Å; K164-F321 HydrophobicContact CD-CB 3.81Å; K164-F321 HydrophobicContact CD-CD1 3.86Å; K164-F321 HydrophobicContact CD-CD2 3.94Å; K164-F321 HydrophobicContact CD-CE1 4.35Å; K164-F321 HydrophobicContact CD-CE2 4.44Å; K164-F321 HydrophobicContact CD-CG 3.61Å; K164-F321 HydrophobicContact CG-CB 3.96Å; K164-F321 HydrophobicContact CG-CD1 3.38Å; K164-F321 HydrophobicContact CG-CD2 4.4Å; K164-F321 HydrophobicContact CG-CE1 3.87Å; K164-F321 HydrophobicContact CG-CG 3.67Å; L165-F321 HydrophobicContact CD2-CE1 4.26Å; L165-F321 HydrophobicContact CD2-CZ 3.86Å; H168-F321 HydrophobicContact CB-CD1 3.85Å; H168-F321 HydrophobicContact CB-CE1 3.86Å; H168-F321 AromaticContact CD2-CD1 3.83Å; H168-F321 PolarHBondContact CD2-O 3.43Å; H168-F321 PolarHBondContact NE2-O 3.03Å; R169-F321 HydrophobicContact CB-CE1 4.17Å; R169-F321 HydrophobicContact CB-CZ 4.22Å; R169-F321 HydrophobicContact CG-CE1 3.85Å; R169-F321 HydrophobicContact CG-CZ 3.99Å; L172-F321 HydrophobicContact CD1-CZ 4.35Å; D318-F321 HydrophobicContact CB-CB 4.31Å; D318-F321 WeakPolarHBondContact O-CB 3.01Å; D318-F321 PolarHBondContact O-N 3.49Å; D318-F321 WeakPolarHBondContact OD2-CD2 3.22Å
322	G	92.2	Very high	79.9	Confident	15 Å²	15	69.1 Å²	69.1	16%	0.155	37%	0.373	C	S	.	.			trans	-115.1	-179.2	176	0	0	0	0	0	112.3	R169 T320	R169-G322 VanDerWaalsContact CZ-O 3.31Å; R169-G322 PolarHBondContact NE-O 3.33Å; R169-G322 PolarHBondContact NH2-O 2.94Å; T320-G322 PolarHBondContact O-N 3.2Å
323	Y	91.3	Very high	78.5	Confident	5 Å²	5	70.4 Å²	70.4	2%	0.02	39%	0.386	C	S	.	.			trans	-54.1	148.9	168.4	174.6	-89.4	0	0	0	110.1	W171 D325 V400 C430 Y431	W171-Y323 AromaticContact CH2-CD2 3.71Å; W171-Y323 HydrophobicContact CH2-CD2 3.71Å; W171-Y323 AromaticContact CH2-CE2 3.54Å; W171-Y323 HydrophobicContact CH2-CE2 3.54Å; W171-Y323 HydrophobicContact CZ3-CD2 4.3Å; W171-Y323 AromaticContact CZ3-CE2 4Å; W171-Y323 HydrophobicContact CZ3-CE2 4Å; Y323-D325 HydrophobicContact CE1-CB 4.13Å; Y323-D325 PolarHBondContact OH-OD1 3.37Å; Y323-V400 HydrophobicContact CE2-CG1 3.88Å; Y323-V400 WeakPolarHBondContact CE2-O 3.47Å; Y323-V400 PolarHBondContact OH-O 3.03Å; Y323-V400 VanDerWaalsContact OH-O 3.09Å; Y323-C430 HydrophobicContact CD1-CB 4.01Å; Y323-C430 HydrophobicContact CD2-CB 3.99Å; Y323-C430 WeakPolarHBondContact CD2-SG 3.49Å; Y323-C430 HydrophobicContact CG-CB 3.63Å; Y323-Y431 AromaticContact CD1-CE2 3.9Å; Y323-Y431 HydrophobicContact CD1-CE2 3.9Å; Y323-Y431 HydrophobicContact CG-CE2 4.39Å; Y323-Y431 PolarHBondContact O-OH 2.88Å
324	E	84.5	Confident	77.2	Confident	53 Å²	53	69.1 Å²	69.1	25%	0.248	38%	0.382	C	S	.	.			trans	-131.3	128.5	171.8	-91.3	179.3	-163.5	0	0	109.1	R169 R328	R169-E324 VanDerWaalsContact CZ-CG 3.49Å; R169-E324 IonicContact CZ-OE1 3.12Å; R169-E324 IonicContact CZ-OE2 3.48Å; R169-E324 IonicContact NH1-OE1 2.86Å; R169-E324 PolarHBondContact NH1-OE1 3.18Å; R169-E324 IonicContact NH1-OE2 3.89Å; R169-E324 PolarHBondContact NH1-OE2 3.02Å; R169-E324 IonicContact NH2-OE1 3.39Å; R169-E324 PolarHBondContact NH2-OE1 2.72Å; R169-E324 IonicContact NH2-OE2 3.9Å; E324-R328 VanDerWaalsContact CG-NH2 3.32Å; E324-R328 IonicContact OE1-CZ 2.8Å; E324-R328 IonicContact OE1-NH1 3.94Å; E324-R328 PolarHBondContact OE1-NH1 3.49Å; E324-R328 IonicContact OE1-NH2 2.71Å; E324-R328 PolarHBondContact OE1-NH2 3.46Å; E324-R328 IonicContact OE2-CZ 3.1Å; E324-R328 IonicContact OE2-NH1 3.26Å; E324-R328 PolarHBondContact OE2-NH1 3.48Å; E324-R328 VanDerWaalsContact OE2-NH1 3.1Å; E324-R328 IonicContact OE2-NH2 3.37Å
325	D	77.4	Confident	76.2	Confident	19 Å²	19	72.7 Å²	72.7	10%	0.102	40%	0.404	C	S	.	.			trans	-70.1	149.1	179.3	-144.3	10.6	0	0	0	111.2	S294 Y323 T327 K426	S294-D325 WeakPolarHBondContact CA-OD2 3.36Å; Y323-D325 HydrophobicContact CE1-CB 4.13Å; Y323-D325 PolarHBondContact OH-OD1 3.37Å; D325-T327 PolarHBondContact O-N 3.04Å; D325-K426 VanDerWaalsContact CG-NZ 3.28Å; D325-K426 IonicContact OD1-NZ 2.68Å; D325-K426 PolarHBondContact OD1-NZ 3.28Å; D325-K426 IonicContact OD2-NZ 3.36Å; D325-K426 PolarHBondContact OD2-NZ 2.93Å; D325-K426 VanDerWaalsContact OD2-NZ 3.1Å
326	F	75.3	Confident	75.7	Confident	23 Å²	23	74.2 Å²	74.2	10%	0.101	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	6	-177.7	-65.4	-91.5	0	0	0	113.6	W171 K291 A333 P334 V400	W171-F326 AromaticContact CD2-CZ 4Å; W171-F326 HydrophobicContact CD2-CZ 4Å; W171-F326 AromaticContact CE3-CZ 3.99Å; W171-F326 HydrophobicContact CE3-CZ 3.99Å; W171-F326 HydrophobicContact CH2-CE2 4.24Å; W171-F326 HydrophobicContact CH2-CZ 4.05Å; W171-F326 HydrophobicContact CZ2-CZ 4.06Å; W171-F326 HydrophobicContact CZ3-CE2 4.33Å; W171-F326 HydrophobicContact CZ3-CZ 4.02Å; K291-F326 HydrophobicContact CD-CB 4.27Å; K291-F326 HydrophobicContact CD-CD1 4.06Å; K291-F326 HydrophobicContact CD-CD2 3.9Å; K291-F326 HydrophobicContact CD-CE1 4.4Å; K291-F326 HydrophobicContact CD-CE2 4.26Å; K291-F326 HydrophobicContact CD-CG 3.82Å; K291-F326 HydrophobicContact CG-CB 4.1Å; K291-F326 HydrophobicContact CG-CD2 3.54Å; K291-F326 HydrophobicContact CG-CE2 4.1Å; K291-F326 HydrophobicContact CG-CG 3.82Å; F326-A333 HydrophobicContact CB-CB 4.44Å; F326-A333 HydrophobicContact CD1-CB 4.36Å; F326-P334 HydrophobicContact CD1-CG 4.03Å; F326-P334 HydrophobicContact CE1-CB 3.96Å; F326-P334 HydrophobicContact CE1-CG 3.58Å; F326-V400 WeakPolarHBondContact CE2-O 3.33Å
327	T	64.3	Low	75.5	Confident	56 Å²	56	73.6 Å²	73.6	34%	0.344	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.6	-169.6	58.1	0	0	0	0	115.1	S292 D325 R329	S292-T327 VanDerWaalsContact C-CG2 3.42Å; S292-T327 VanDerWaalsContact CA-CG2 3.5Å; S292-T327 WeakPolarHBondContact O-CG2 3.27Å; D325-T327 PolarHBondContact O-N 3.04Å; T327-R329 PolarHBondContact O-N 3.49Å
328	R	58.3	Low	75.5	Confident	143 Å²	143	73.8 Å²	73.8	54%	0.54	41%	0.406	S	S	.	.			trans	-62	107.5	-176	-78.9	-167.9	-178.1	171.9	6.7	111.2	E324 G330 A331	E324-R328 VanDerWaalsContact CG-NH2 3.32Å; E324-R328 IonicContact OE1-CZ 2.8Å; E324-R328 IonicContact OE1-NH1 3.94Å; E324-R328 PolarHBondContact OE1-NH1 3.49Å; E324-R328 IonicContact OE1-NH2 2.71Å; E324-R328 PolarHBondContact OE1-NH2 3.46Å; E324-R328 IonicContact OE2-CZ 3.1Å; E324-R328 IonicContact OE2-NH1 3.26Å; E324-R328 PolarHBondContact OE2-NH1 3.48Å; E324-R328 VanDerWaalsContact OE2-NH1 3.1Å; E324-R328 IonicContact OE2-NH2 3.37Å; R328-G330 PolarHBondContact O-N 3.44Å; R328-G330 VanDerWaalsContact O-N 3.15Å; R328-A331 HydrophobicContact CB-CB 4.32Å; R328-A331 PolarHBondContact O-N 2.89Å
329	R	46.6	Very low	75.4	Confident	257 Å²	257	70.5 Å²	70.5	97%	0.97	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	119.1	171.1	-74.7	-174.6	-173	-115.9	0.6	109.6	T327	T327-R329 PolarHBondContact O-N 3.49Å
330	G	45.6	Very low	75.4	Confident	90 Å²	90	71 Å²	71	93%	0.928	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	-10.4	174.1	0	0	0	0	0	116	R328	R328-G330 PolarHBondContact O-N 3.44Å; R328-G330 VanDerWaalsContact O-N 3.15Å
331	A	53.5	Low	75.6	Confident	63 Å²	63	69.4 Å²	69.4	52%	0.521	37%	0.373	S	S	.	.	S	Bend	trans	-97.1	134.7	166.1	0	0	0	0	0	108.9	R328 A333	R328-A331 HydrophobicContact CB-CB 4.32Å; R328-A331 PolarHBondContact O-N 2.89Å; A331-A333 PolarHBondContact O-N 3.46Å
332	Q	50.9	Low	75.8	Confident	194 Å²	194	68.6 Å²	68.6	91%	0.907	37%	0.369	S	S	*	.			trans	-64.8	109.3	173.1	-172.4	154.8	-1.2	0	0	107.9
333	A	60.8	Low	76.1	Confident	42 Å²	42	69.3 Å²	69.3	35%	0.347	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-53.6	133.3	174	0	0	0	0	0	108.2	F326 A331	F326-A333 HydrophobicContact CB-CB 4.44Å; F326-A333 HydrophobicContact CD1-CB 4.36Å; A331-A333 PolarHBondContact O-N 3.46Å
334	P	65.1	Low	76.4	Confident	34 Å²	34	69.9 Å²	69.9	22%	0.221	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-50.5	140.8	175.7	-16.6	17.3	0	0	0	110.1	W171 F326 T336	W171-P334 HydrophobicContact CG-CB 4.22Å; W171-P334 HydrophobicContact CG-CG 4.24Å; F326-P334 HydrophobicContact CD1-CG 4.03Å; F326-P334 HydrophobicContact CE1-CB 3.96Å; F326-P334 HydrophobicContact CE1-CG 3.58Å; P334-T336 PolarHBondContact O-N 3.38Å
335	P	74.2	Confident	76.9	Confident	121 Å²	121	75 Å²	75	79%	0.786	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59	135.9	-178.8	24.3	-32.7	0	0	0	109.7	F337	P335-F337 PolarHBondContact O-N 2.98Å
336	T	87.6	Confident	77.8	Confident	35 Å²	35	79.1 Å²	79.1	22%	0.215	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-54.3	127.6	173.4	-66.6	0	0	0	0	109.7	F287 E288 K291 P334 R404	F287-T336 HydrophobicContact CD1-CG2 3.94Å; F287-T336 HydrophobicContact CE1-CG2 3.27Å; F287-T336 HydrophobicContact CZ-CG2 3.9Å; E288-T336 PolarHBondContact OE1-OG1 2.92Å; K291-T336 PolarHBondContact NZ-OG1 2.92Å; P334-T336 PolarHBondContact O-N 3.38Å; T336-R404 HydrophobicContact CG2-CB 3.69Å
337	F	92.1	Very high	78.9	Confident	4 Å²	4	81.5 Å²	81.5	2%	0.018	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	113.4	176	170.3	-143.4	0	0	0	108.6	P335 A339 D341 Y342 G402 I403 R404 Y470	P335-F337 PolarHBondContact O-N 2.98Å; F337-A339 PolarHBondContact O-N 3.19Å; F337-D341 HydrophobicContact CE2-CB 4.14Å; F337-Y342 WeakPolarHBondContact CZ-O 3.47Å; F337-G402 PolarHBondContact N-O 3.14Å; F337-I403 HydrophobicContact CD1-CB 4.29Å; F337-I403 HydrophobicContact CD1-CD1 3.99Å; F337-I403 HydrophobicContact CD1-CG1 3.79Å; F337-I403 HydrophobicContact CD1-CG2 4.04Å; F337-I403 HydrophobicContact CE1-CD1 4.03Å; F337-I403 HydrophobicContact CE1-CG1 4.3Å; F337-I403 HydrophobicContact CE1-CG2 4.16Å; F337-I403 CarbonylContact O-C 3.32Å; F337-I403 WeakPolarHBondContact O-CA 3.47Å; F337-R404 PolarHBondContact O-N 3.47Å; F337-Y470 HydrophobicContact CB-CE1 3.93Å; F337-Y470 WeakPolarHBondContact CB-OH 3.12Å; F337-Y470 HydrophobicContact CD1-CD1 4.28Å; F337-Y470 AromaticContact CD1-CE1 3.58Å; F337-Y470 HydrophobicContact CD1-CE1 3.58Å; F337-Y470 HydrophobicContact CD1-CE2 4.42Å; F337-Y470 AromaticContact CD1-CZ 3.67Å; F337-Y470 HydrophobicContact CE1-CE1 4.42Å; F337-Y470 AromaticContact CG-CE1 3.95Å; F337-Y470 HydrophobicContact CG-CE1 3.95Å
338	R	93.9	Very high	80.5	Confident	99 Å²	99	78.8 Å²	78.8	37%	0.374	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	123	171.7	-64.4	174.5	69.5	-167.2	3.7	108.7	Q340 D341 D406	R338-Q340 PolarHBondContact O-N 3.34Å; R338-D341 WeakPolarHBondContact O-CB 3.37Å; R338-D341 PolarHBondContact O-N 3.44Å; R338-D406 IonicContact CZ-OD2 3.32Å; R338-D406 IonicContact NE-OD1 3.18Å; R338-D406 IonicContact NE-OD2 3.1Å; R338-D406 PolarHBondContact NE-OD2 2.95Å; R338-D406 IonicContact NH2-OD2 2.72Å; R338-D406 PolarHBondContact NH2-OD2 3.01Å
339	A	92.4	Very high	82.4	Confident	4 Å²	4	75.1 Å²	75.1	3%	0.033	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-55.8	-37.9	-176.3	0	0	0	0	0	111.8	F337 D341 Y342 T343 I403 R404 Y405	F337-A339 PolarHBondContact O-N 3.19Å; A339-D341 PolarHBondContact O-N 3.23Å; A339-Y342 CarbonylContact O-C 3.32Å; A339-Y342 PolarHBondContact O-N 2.78Å; A339-Y342 VanDerWaalsContact O-N 3.08Å; A339-T343 WeakPolarHBondContact O-CG2 3.38Å; A339-T343 PolarHBondContact O-N 3.43Å; A339-I403 HydrophobicContact CB-CG2 3.93Å; A339-R404 WeakPolarHBondContact CB-O 3.39Å; A339-R404 PolarHBondContact N-O 2.85Å; A339-Y405 HydrophobicContact CB-CD1 3.55Å; A339-Y405 HydrophobicContact CB-CE1 3.6Å; A339-Y405 HydrophobicContact CB-CG 4.18Å
340	Q	92.5	Very high	84.8	Confident	76 Å²	76	66.3 Å²	66.3	36%	0.355	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-61.6	-25	179.6	-64.9	77.6	9.1	0	0	113.4	R338 Y342 D406	R338-Q340 PolarHBondContact O-N 3.34Å; Q340-Y342 PolarHBondContact O-N 3.22Å; Q340-D406 PolarHBondContact OE1-OD2 2.89Å
341	D	95.6	Very high	87.3	Confident	98 Å²	98	62.3 Å²	62.3	52%	0.524	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-69.9	-24.3	177.8	-65.1	-17.4	0	0	0	111.8	F337 R338 A339	F337-D341 HydrophobicContact CE2-CB 4.14Å; R338-D341 WeakPolarHBondContact O-CB 3.37Å; R338-D341 PolarHBondContact O-N 3.44Å; A339-D341 PolarHBondContact O-N 3.23Å
342	Y	97.6	Very high	89.4	Confident	9 Å²	9	59.3 Å²	59.3	4%	0.035	31%	0.31	C	S	.	.	S	Bend	trans	-162.2	80.5	177.9	-160.1	-86.9	0	0	0	111.7	F337 A339 Q340 H347 L351 L469 L472 R473 T476	F337-Y342 WeakPolarHBondContact CZ-O 3.47Å; A339-Y342 CarbonylContact O-C 3.32Å; A339-Y342 PolarHBondContact O-N 2.78Å; A339-Y342 VanDerWaalsContact O-N 3.08Å; Q340-Y342 PolarHBondContact O-N 3.22Å; Y342-H347 HydrophobicContact CD1-CB 4.09Å; Y342-H347 HydrophobicContact CD2-CB 3.74Å; Y342-H347 AromaticContact CD2-CG 3.95Å; Y342-H347 HydrophobicContact CE1-CB 3.92Å; Y342-H347 HydrophobicContact CE2-CB 3.6Å; Y342-H347 HydrophobicContact CG-CB 4Å; Y342-L351 WeakPolarHBondContact OH-CD2 3.17Å; Y342-L469 HydrophobicContact CD1-CD2 4.02Å; Y342-L469 HydrophobicContact CE1-CD2 4.28Å; Y342-L472 HydrophobicContact CE1-CB 3.82Å; Y342-L472 VanDerWaalsContact OH-C 3.27Å; Y342-L472 WeakPolarHBondContact OH-CB 3.27Å; Y342-L472 PolarHBondContact OH-O 3.03Å; Y342-R473 HydrophobicContact CD1-CB 3.93Å; Y342-R473 HydrophobicContact CD1-CG 4.45Å; Y342-R473 HydrophobicContact CD2-CB 4.04Å; Y342-R473 HydrophobicContact CD2-CG 3.84Å; Y342-R473 HydrophobicContact CE1-CB 4.15Å; Y342-R473 HydrophobicContact CE2-CB 4.21Å; Y342-R473 HydrophobicContact CE2-CG 4.34Å; Y342-R473 HydrophobicContact CG-CB 3.88Å; Y342-R473 HydrophobicContact CG-CG 3.89Å; Y342-T476 HydrophobicContact CE2-CG2 4.25Å; Y342-T476 WeakPolarHBondContact CE2-OG1 3.44Å; Y342-T476 PolarHBondContact OH-OG1 2.95Å
343	T	97.8	Very high	91.6	Very high	30 Å²	30	53 Å²	53	18%	0.184	28%	0.28	C	S	.	.			trans	-78.6	160.1	177.6	56.7	0	0	0	0	112.5	A339 D346 H347 G348	A339-T343 WeakPolarHBondContact O-CG2 3.38Å; A339-T343 PolarHBondContact O-N 3.43Å; T343-D346 VanDerWaalsContact OG1-CB 3.25Å; T343-D346 WeakPolarHBondContact OG1-CB 3.32Å; T343-D346 VanDerWaalsContact OG1-CG 3.3Å; T343-D346 PolarHBondContact OG1-N 2.97Å; T343-D346 VanDerWaalsContact OG1-N 3.15Å; T343-D346 PolarHBondContact OG1-OD2 3.34Å; T343-H347 PolarHBondContact N-ND1 2.87Å; T343-H347 WeakPolarHBondContact O-CB 3.37Å; T343-H347 PolarHBondContact O-N 2.89Å; T343-G348 PolarHBondContact O-N 3.31Å
344	W	97.9	Very high	93.3	Very high	18 Å²	18	58.7 Å²	58.7	7%	0.068	29%	0.293	C	S	.	.	I	π-helix	trans	-63.1	-49.6	169.2	174.5	-100.7	0	0	0	111	G348 Y349 I352 L363 D364 F367 Q465 L469 L472	W344-G348 PolarHBondContact O-N 2.73Å; W344-Y349 HydrophobicContact CZ2-CD2 4.08Å; W344-Y349 VanDerWaalsContact O-CB 3.3Å; W344-Y349 WeakPolarHBondContact O-CB 3.08Å; W344-Y349 PolarHBondContact O-N 2.65Å; W344-I352 HydrophobicContact CH2-CD1 3.94Å; W344-I352 HydrophobicContact CZ3-CD1 3.89Å; W344-L363 HydrophobicContact CH2-CB 3.77Å; W344-L363 HydrophobicContact CH2-CD1 4.15Å; W344-L363 HydrophobicContact CZ2-CB 3.89Å; W344-D364 HydrophobicContact CZ2-CB 4.18Å; W344-D364 PolarHBondContact NE1-OD1 3.36Å; W344-F367 HydrophobicContact CD2-CD2 4.01Å; W344-F367 AromaticContact CD2-CE2 3.94Å; W344-F367 HydrophobicContact CD2-CE2 3.94Å; W344-F367 AromaticContact CE2-CD2 3.69Å; W344-F367 AromaticContact CE2-CE2 3.86Å; W344-F367 HydrophobicContact CE3-CD2 4.47Å; W344-F367 AromaticContact CE3-CE2 3.93Å; W344-F367 HydrophobicContact CE3-CE2 3.93Å; W344-F367 HydrophobicContact CG-CD2 4.47Å; W344-F367 HydrophobicContact CH2-CD2 4.37Å; W344-F367 AromaticContact CH2-CE2 3.79Å; W344-F367 HydrophobicContact CH2-CE2 3.79Å; W344-F367 AromaticContact CZ2-CD2 3.89Å; W344-F367 HydrophobicContact CZ2-CD2 3.89Å; W344-F367 AromaticContact CZ2-CE2 3.8Å; W344-F367 HydrophobicContact CZ2-CE2 3.8Å; W344-F367 AromaticContact CZ3-CE2 3.86Å; W344-F367 HydrophobicContact CZ3-CE2 3.86Å; W344-F367 AromaticContact NE1-CD2 3.96Å; W344-Q465 HydrophobicContact CB-CG 4.47Å; W344-L469 HydrophobicContact CB-CD2 4.14Å; W344-L472 HydrophobicContact CZ3-CD1 4.18Å
345	E	96.1	Very high	94.8	Very high	159 Å²	159	58.5 Å²	58.5	74%	0.743	29%	0.29	S	S	*	.	I	π-helix	trans	-58.2	-50.3	-176	-173.1	174.2	-177	0	0	112.9
346	D	95.9	Very high	95.9	Very high	106 Å²	106	52.9 Å²	52.9	57%	0.567	25%	0.253	S	S	*	.	I	π-helix	trans	-86.1	-29.8	-173.5	-53	-59	0	0	0	113.1	T343	T343-D346 VanDerWaalsContact OG1-CB 3.25Å; T343-D346 WeakPolarHBondContact OG1-CB 3.32Å; T343-D346 VanDerWaalsContact OG1-CG 3.3Å; T343-D346 PolarHBondContact OG1-N 2.97Å; T343-D346 VanDerWaalsContact OG1-N 3.15Å; T343-D346 PolarHBondContact OG1-OD2 3.34Å
347	H	98.1	Very high	96.3	Very high	73 Å²	73	54 Å²	54	34%	0.338	26%	0.261	S	S	.	.	I	π-helix	trans	-124	-58.3	-168.3	-52	87.9	0	0	0	113.3	Y342 T343 S350 L351	Y342-H347 HydrophobicContact CD1-CB 4.09Å; Y342-H347 HydrophobicContact CD2-CB 3.74Å; Y342-H347 AromaticContact CD2-CG 3.95Å; Y342-H347 HydrophobicContact CE1-CB 3.92Å; Y342-H347 HydrophobicContact CE2-CB 3.6Å; Y342-H347 HydrophobicContact CG-CB 4Å; T343-H347 PolarHBondContact N-ND1 2.87Å; T343-H347 WeakPolarHBondContact O-CB 3.37Å; T343-H347 PolarHBondContact O-N 2.89Å; H347-S350 PolarHBondContact O-N 3.44Å; H347-L351 PolarHBondContact O-N 2.82Å
348	G	97.6	Very high	96.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-61.5	-48.9	-170.3	0	0	0	0	0	113.1	T343 W344 L351 I352	T343-G348 PolarHBondContact O-N 3.31Å; W344-G348 PolarHBondContact O-N 2.73Å; G348-L351 PolarHBondContact O-N 3.24Å; G348-I352 PolarHBondContact O-N 2.92Å; G348-I352 VanDerWaalsContact O-N 3.11Å
349	Y	97.9	Very high	96.4	Very high	66 Å²	66	54.6 Å²	54.6	26%	0.259	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-52.1	177.7	172.1	-111.7	0	0	0	111.2	W344 L351 I352 Q353 D364	W344-Y349 HydrophobicContact CZ2-CD2 4.08Å; W344-Y349 VanDerWaalsContact O-CB 3.3Å; W344-Y349 WeakPolarHBondContact O-CB 3.08Å; W344-Y349 PolarHBondContact O-N 2.65Å; Y349-L351 VanDerWaalsContact C-N 3.29Å; Y349-L351 PolarHBondContact O-N 3.46Å; Y349-I352 PolarHBondContact O-N 3.28Å; Y349-Q353 HydrophobicContact CE2-CB 4.48Å; Y349-Q353 VanDerWaalsContact O-CB 3.27Å; Y349-Q353 WeakPolarHBondContact O-CB 3.29Å; Y349-Q353 PolarHBondContact O-N 3.03Å; Y349-D364 HydrophobicContact CD2-CB 3.82Å; Y349-D364 HydrophobicContact CE2-CB 3.87Å
350	S	97.6	Very high	96.6	Very high	72 Å²	72	54.4 Å²	54.4	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-57.1	-41.2	179.8	-178.8	0	0	0	0	112.5	H347 R354	H347-S350 PolarHBondContact O-N 3.44Å; S350-R354 WeakPolarHBondContact O-CB 3.36Å; S350-R354 PolarHBondContact O-N 3.38Å; S350-R354 VanDerWaalsContact O-N 3.16Å
351	L	97.9	Very high	96.8	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-47.6	177.8	-178.6	61.1	0	0	0	112.2	Y342 H347 G348 Y349 R354 L355 L472 I475 M479	Y342-L351 WeakPolarHBondContact OH-CD2 3.17Å; H347-L351 PolarHBondContact O-N 2.82Å; G348-L351 PolarHBondContact O-N 3.24Å; Y349-L351 VanDerWaalsContact C-N 3.29Å; Y349-L351 PolarHBondContact O-N 3.46Å; L351-R354 VanDerWaalsContact CD1-NH2 3.33Å; L351-R354 PolarHBondContact O-N 2.96Å; L351-L355 HydrophobicContact CD1-CD1 3.63Å; L351-L355 HydrophobicContact CD1-CG 4.27Å; L351-L355 HydrophobicContact CG-CD1 4.1Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.03Å; L351-L472 HydrophobicContact CD2-CB 4.07Å; L351-L472 HydrophobicContact CD2-CD2 3.87Å; L351-L472 HydrophobicContact CG-CD2 4.34Å; L351-I475 HydrophobicContact CD2-CB 4.15Å; L351-I475 HydrophobicContact CD2-CG2 3.97Å; L351-M479 HydrophobicContact CD1-SD 4.17Å
352	I	97.8	Very high	96.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-45.7	177.7	-66.6	-170.4	0	0	0	110	I195 V199 W344 G348 Y349 R354 L355 Y356 G360 L363 L472	I195-I352 HydrophobicContact CG2-CG1 4.35Å; I195-I352 HydrophobicContact CG2-CG2 4.21Å; V199-I352 HydrophobicContact CG2-CD1 4.36Å; W344-I352 HydrophobicContact CH2-CD1 3.94Å; W344-I352 HydrophobicContact CZ3-CD1 3.89Å; G348-I352 PolarHBondContact O-N 2.92Å; G348-I352 VanDerWaalsContact O-N 3.11Å; Y349-I352 PolarHBondContact O-N 3.28Å; I352-R354 PolarHBondContact O-N 2.91Å; I352-R354 VanDerWaalsContact O-N 3.11Å; I352-L355 PolarHBondContact O-N 2.94Å; I352-Y356 CarbonylContact O-C 3.58Å; I352-Y356 VanDerWaalsContact O-C 3.3Å; I352-Y356 WeakPolarHBondContact O-CA 3.37Å; I352-Y356 PolarHBondContact O-N 3.06Å; I352-G360 VanDerWaalsContact CG2-CA 3.45Å; I352-L363 HydrophobicContact CD1-CD1 3.79Å; I352-L363 HydrophobicContact CG2-CD1 4.39Å; I352-L472 HydrophobicContact CD1-CD1 3.8Å; I352-L472 HydrophobicContact CD1-CD2 4.04Å; I352-L472 HydrophobicContact CD1-CG 4.47Å; I352-L472 HydrophobicContact CG1-CD1 3.89Å; I352-L472 HydrophobicContact CG1-CD2 3.61Å; I352-L472 HydrophobicContact CG1-CG 4.4Å
353	Q	96.6	Very high	97	Very high	61 Å²	61	51.9 Å²	51.9	29%	0.285	25%	0.253	S	S	.	.	H	α-helix	trans	-57	-31.9	-179.3	-173.4	65.6	-3.9	0	0	112.7	Y349 P357	Y349-Q353 HydrophobicContact CE2-CB 4.48Å; Y349-Q353 VanDerWaalsContact O-CB 3.27Å; Y349-Q353 WeakPolarHBondContact O-CB 3.29Å; Y349-Q353 PolarHBondContact O-N 3.03Å; Q353-P357 WeakPolarHBondContact O-CA 3.22Å; Q353-P357 WeakPolarHBondContact O-CB 3.42Å; Q353-P357 VanDerWaalsContact O-CG 3.29Å; Q353-P357 WeakPolarHBondContact O-CG 3.46Å; Q353-P357 PolarHBondContact OE1-O 3.09Å
354	R	97.3	Very high	97	Very high	162 Å²	162	53.4 Å²	53.4	61%	0.611	26%	0.259	S	S	*	.	H	α-helix	trans	-77.7	-32.8	175.7	-176.5	175.6	60.3	176.9	-2.1	113.8	S350 L351 I352	S350-R354 WeakPolarHBondContact O-CB 3.36Å; S350-R354 PolarHBondContact O-N 3.38Å; S350-R354 VanDerWaalsContact O-N 3.16Å; L351-R354 VanDerWaalsContact CD1-NH2 3.33Å; L351-R354 PolarHBondContact O-N 2.96Å; I352-R354 PolarHBondContact O-N 2.91Å; I352-R354 VanDerWaalsContact O-N 3.11Å
355	L	97.3	Very high	97	Very high	30 Å²	30	55 Å²	55	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-102.5	-22.9	-171.3	-64.1	178.6	0	0	0	114	L191 I195 L351 I352	L191-L355 HydrophobicContact CB-CD1 4.33Å; L191-L355 HydrophobicContact CB-CD2 4.07Å; L191-L355 HydrophobicContact CD1-CD2 4.19Å; L191-L355 HydrophobicContact CD2-CD1 4.47Å; I195-L355 HydrophobicContact CD1-CD1 4.08Å; I195-L355 HydrophobicContact CG1-CB 3.85Å; I195-L355 HydrophobicContact CG1-CD1 3.79Å; I195-L355 HydrophobicContact CG1-CG 4.49Å; L351-L355 HydrophobicContact CD1-CD1 3.63Å; L351-L355 HydrophobicContact CD1-CG 4.27Å; L351-L355 HydrophobicContact CG-CD1 4.1Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.03Å; I352-L355 PolarHBondContact O-N 2.94Å
356	Y	97.4	Very high	97.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.016	23%	0.232	C	C	.	.			trans	-153.7	72.7	178.6	-174.7	-130.7	0	0	0	109.7	L99 L100 P106 I195 Q196 I352 E358 G359 G360	L99-Y356 HydrophobicContact CD2-CE1 4.32Å; L99-Y356 WeakPolarHBondContact CG-OH 3.3Å; L100-Y356 HydrophobicContact CD2-CE1 4.31Å; P106-Y356 HydrophobicContact CG-CD2 4.41Å; P106-Y356 HydrophobicContact CG-CE2 4.49Å; I195-Y356 HydrophobicContact CG2-CD1 4.32Å; I195-Y356 HydrophobicContact CG2-CG 4.29Å; Q196-Y356 HydrophobicContact CG-CE1 4.34Å; Q196-Y356 HydrophobicContact CG-CE2 4.29Å; Q196-Y356 PolarHBondContact NE2-OH 3.17Å; I352-Y356 CarbonylContact O-C 3.58Å; I352-Y356 VanDerWaalsContact O-C 3.3Å; I352-Y356 WeakPolarHBondContact O-CA 3.37Å; I352-Y356 PolarHBondContact O-N 3.06Å; Y356-E358 VanDerWaalsContact C-N 3.33Å; Y356-E358 PolarHBondContact O-N 3.12Å; Y356-G359 PolarHBondContact O-N 3.09Å; Y356-G360 PolarHBondContact O-N 3.1Å
357	P	95.6	Very high	97.3	Very high	59 Å²	59	42.7 Å²	42.7	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-58.4	-39.2	-169.8	-19.3	28.4	0	0	0	113.9	Q353 G359 G360	Q353-P357 WeakPolarHBondContact O-CA 3.22Å; Q353-P357 WeakPolarHBondContact O-CB 3.42Å; Q353-P357 VanDerWaalsContact O-CG 3.29Å; Q353-P357 WeakPolarHBondContact O-CG 3.46Å; Q353-P357 PolarHBondContact OE1-O 3.09Å; P357-G359 VanDerWaalsContact C-N 3.27Å; P357-G359 PolarHBondContact O-N 3.05Å; P357-G360 PolarHBondContact O-N 3.14Å
358	E	91.8	Very high	97.3	Very high	114 Å²	114	44.6 Å²	44.6	53%	0.533	22%	0.216	S	C	.	.	H	α-helix	trans	-64.5	-35.7	-178	-55.4	81.7	-174.6	0	0	111.4	L99 Y356 L362	L99-E358 HydrophobicContact CD1-CB 3.93Å; L99-E358 HydrophobicContact CD2-CB 3.94Å; L99-E358 WeakPolarHBondContact CD2-O 3.5Å; Y356-E358 VanDerWaalsContact C-N 3.33Å; Y356-E358 PolarHBondContact O-N 3.12Å; E358-L362 WeakPolarHBondContact O-CG 3.38Å
359	G	95.7	Very high	97.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-82.5	-29	177.7	0	0	0	0	0	114.1	Y356 P357 L362 L363	Y356-G359 PolarHBondContact O-N 3.09Å; P357-G359 VanDerWaalsContact C-N 3.27Å; P357-G359 PolarHBondContact O-N 3.05Å; G359-L362 PolarHBondContact O-N 3.04Å; G359-L363 WeakPolarHBondContact O-CB 3.38Å; G359-L363 VanDerWaalsContact O-CG 3.3Å; G359-L363 WeakPolarHBondContact O-CG 3.43Å; G359-L363 PolarHBondContact O-N 3.18Å
360	G	96.8	Very high	97.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.2	-53.2	-178.3	0	0	0	0	0	112.4	I352 Y356 P357 L363 D364	I352-G360 VanDerWaalsContact CG2-CA 3.45Å; Y356-G360 PolarHBondContact O-N 3.1Å; P357-G360 PolarHBondContact O-N 3.14Å; G360-L363 PolarHBondContact O-N 3.21Å; G360-D364 PolarHBondContact O-N 2.83Å
361	Q	96.8	Very high	97.4	Very high	101 Å²	101	42.5 Å²	42.5	47%	0.472	20%	0.201	S	C	.	.	H	α-helix	trans	-61.5	-46	177.2	-177.6	178.3	-11.1	0	0	112.4	L363 D364 E365	Q361-L363 VanDerWaalsContact C-N 3.32Å; Q361-L363 PolarHBondContact O-N 2.83Å; Q361-D364 PolarHBondContact O-N 3.28Å; Q361-E365 HydrophobicContact CG-CG 4.43Å; Q361-E365 WeakPolarHBondContact CG-OE1 3.25Å; Q361-E365 PolarHBondContact NE2-OE1 3.31Å; Q361-E365 WeakPolarHBondContact O-CG 3.27Å; Q361-E365 PolarHBondContact O-N 3.02Å
362	L	98.4	Very high	97.4	Very high	30 Å²	30	45 Å²	45	16%	0.157	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-31.8	-177.6	-65.6	-176.4	0	0	0	113.1	R95 L96 L99 E358 G359 K366	R95-L362 HydrophobicContact CB-CD1 4.15Å; R95-L362 HydrophobicContact CB-CD2 3.88Å; L96-L362 HydrophobicContact CB-CB 4.39Å; L96-L362 HydrophobicContact CD1-CB 4.18Å; L99-L362 HydrophobicContact CB-CD1 3.99Å; L99-L362 HydrophobicContact CD2-CD1 3.71Å; L99-L362 HydrophobicContact CG-CD1 4.42Å; E358-L362 WeakPolarHBondContact O-CG 3.38Å; G359-L362 PolarHBondContact O-N 3.04Å; L362-K366 WeakPolarHBondContact O-CB 3.2Å; L362-K366 PolarHBondContact O-N 3.28Å
363	L	98.7	Very high	97.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.4	-44.9	172.8	-78.9	166.2	0	0	0	111.5	L96 V199 W344 I352 G359 G360 Q361 K366 F367 M464 L468	L96-L363 HydrophobicContact CD1-CD2 4.46Å; L96-L363 HydrophobicContact CD1-CG 4.3Å; L96-L363 HydrophobicContact CD2-CD2 3.61Å; L96-L363 HydrophobicContact CD2-CG 4.26Å; V199-L363 HydrophobicContact CG1-CD1 4.04Å; V199-L363 HydrophobicContact CG1-CD2 4.27Å; V199-L363 HydrophobicContact CG1-CG 4.48Å; V199-L363 HydrophobicContact CG2-CD1 3.8Å; W344-L363 HydrophobicContact CH2-CB 3.77Å; W344-L363 HydrophobicContact CH2-CD1 4.15Å; W344-L363 HydrophobicContact CZ2-CB 3.89Å; I352-L363 HydrophobicContact CD1-CD1 3.79Å; I352-L363 HydrophobicContact CG2-CD1 4.39Å; G359-L363 WeakPolarHBondContact O-CB 3.38Å; G359-L363 VanDerWaalsContact O-CG 3.3Å; G359-L363 WeakPolarHBondContact O-CG 3.43Å; G359-L363 PolarHBondContact O-N 3.18Å; G360-L363 PolarHBondContact O-N 3.21Å; Q361-L363 VanDerWaalsContact C-N 3.32Å; Q361-L363 PolarHBondContact O-N 2.83Å; L363-K366 PolarHBondContact O-N 3.02Å; L363-F367 HydrophobicContact CB-CE2 4.24Å; L363-F367 HydrophobicContact CD2-CE2 4.5Å; L363-F367 HydrophobicContact CD2-CZ 4.27Å; L363-F367 WeakPolarHBondContact O-CD2 3.39Å; L363-F367 WeakPolarHBondContact O-CG 3.19Å; L363-F367 PolarHBondContact O-N 3.2Å; L363-M464 HydrophobicContact CD2-CE 3.52Å; L363-M464 HydrophobicContact CD2-SD 4.34Å; L363-L468 HydrophobicContact CD1-CD1 4.33Å; L363-L468 HydrophobicContact CD2-CD1 4.32Å
364	D	98.5	Very high	97.5	Very high	61 Å²	61	44.5 Å²	44.5	33%	0.326	22%	0.219	S	C	.	.	H	α-helix	trans	-61.5	-49.4	178.3	-169.9	62.8	0	0	0	111.5	W344 Y349 G360 Q361 K366 F367 Q368	W344-D364 HydrophobicContact CZ2-CB 4.18Å; W344-D364 PolarHBondContact NE1-OD1 3.36Å; Y349-D364 HydrophobicContact CD2-CB 3.82Å; Y349-D364 HydrophobicContact CE2-CB 3.87Å; G360-D364 PolarHBondContact O-N 2.83Å; Q361-D364 PolarHBondContact O-N 3.28Å; D364-K366 VanDerWaalsContact C-N 3.28Å; D364-K366 PolarHBondContact O-N 2.98Å; D364-F367 PolarHBondContact O-N 3.47Å; D364-Q368 WeakPolarHBondContact O-CB 3.33Å; D364-Q368 PolarHBondContact O-N 3.19Å
365	E	98.3	Very high	97.5	Very high	53 Å²	53	41.4 Å²	41.4	25%	0.248	21%	0.208	C	C	.	.	H	α-helix	trans	-55.4	-43.1	174.4	-73.7	178	-164.9	0	0	111.5	R95 Q361 Q368 A369	R95-E365 IonicContact NH1-OE2 2.6Å; R95-E365 PolarHBondContact NH1-OE2 3.01Å; Q361-E365 HydrophobicContact CG-CG 4.43Å; Q361-E365 WeakPolarHBondContact CG-OE1 3.25Å; Q361-E365 PolarHBondContact NE2-OE1 3.31Å; Q361-E365 WeakPolarHBondContact O-CG 3.27Å; Q361-E365 PolarHBondContact O-N 3.02Å; E365-Q368 PolarHBondContact O-N 3.3Å; E365-A369 WeakPolarHBondContact O-CB 3.38Å; E365-A369 PolarHBondContact O-N 2.96Å
366	K	98.5	Very high	97.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-42.9	-179	-169.4	-174.9	67.8	117.3	0	112.8	Y89 L96 L362 L363 D364 Q368 A369 A370 E461 M464	Y89-K366 HydrophobicContact CE2-CG 4.18Å; L96-K366 HydrophobicContact CB-CD 4.46Å; L96-K366 HydrophobicContact CD2-CD 3.78Å; L96-K366 VanDerWaalsContact CD2-CE 3.41Å; L362-K366 WeakPolarHBondContact O-CB 3.2Å; L362-K366 PolarHBondContact O-N 3.28Å; L363-K366 PolarHBondContact O-N 3.02Å; D364-K366 VanDerWaalsContact C-N 3.28Å; D364-K366 PolarHBondContact O-N 2.98Å; K366-Q368 VanDerWaalsContact C-N 3.34Å; K366-A369 PolarHBondContact O-N 3.26Å; K366-A370 PolarHBondContact O-N 3.16Å; K366-A370 VanDerWaalsContact O-N 3.07Å; K366-E461 WeakPolarHBondContact CD-OE1 3.41Å; K366-E461 VanDerWaalsContact CE-OE1 3.25Å; K366-E461 WeakPolarHBondContact CE-OE1 3.47Å; K366-E461 WeakPolarHBondContact CE-OE2 3.47Å; K366-E461 IonicContact NZ-OE1 2.83Å; K366-E461 PolarHBondContact NZ-OE1 3.12Å; K366-E461 IonicContact NZ-OE2 2.65Å; K366-E461 PolarHBondContact NZ-OE2 3.25Å; K366-M464 PolarHBondContact NZ-SD 3.22Å
367	F	98.7	Very high	97.4	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-61.5	-45.1	174.4	-67.6	-39.1	0	0	0	111	W344 L363 D364 A370 Y371 W394 E461 M464 Q465 L468	W344-F367 HydrophobicContact CD2-CD2 4.01Å; W344-F367 AromaticContact CD2-CE2 3.94Å; W344-F367 HydrophobicContact CD2-CE2 3.94Å; W344-F367 AromaticContact CE2-CD2 3.69Å; W344-F367 AromaticContact CE2-CE2 3.86Å; W344-F367 HydrophobicContact CE3-CD2 4.47Å; W344-F367 AromaticContact CE3-CE2 3.93Å; W344-F367 HydrophobicContact CE3-CE2 3.93Å; W344-F367 HydrophobicContact CG-CD2 4.47Å; W344-F367 HydrophobicContact CH2-CD2 4.37Å; W344-F367 AromaticContact CH2-CE2 3.79Å; W344-F367 HydrophobicContact CH2-CE2 3.79Å; W344-F367 AromaticContact CZ2-CD2 3.89Å; W344-F367 HydrophobicContact CZ2-CD2 3.89Å; W344-F367 AromaticContact CZ2-CE2 3.8Å; W344-F367 HydrophobicContact CZ2-CE2 3.8Å; W344-F367 AromaticContact CZ3-CE2 3.86Å; W344-F367 HydrophobicContact CZ3-CE2 3.86Å; W344-F367 AromaticContact NE1-CD2 3.96Å; L363-F367 HydrophobicContact CB-CE2 4.24Å; L363-F367 HydrophobicContact CD2-CE2 4.5Å; L363-F367 HydrophobicContact CD2-CZ 4.27Å; L363-F367 WeakPolarHBondContact O-CD2 3.39Å; L363-F367 WeakPolarHBondContact O-CG 3.19Å; L363-F367 PolarHBondContact O-N 3.2Å; D364-F367 PolarHBondContact O-N 3.47Å; F367-A370 PolarHBondContact O-N 3.04Å; F367-Y371 VanDerWaalsContact O-CB 3.3Å; F367-Y371 WeakPolarHBondContact O-CB 3.47Å; F367-Y371 PolarHBondContact O-N 2.79Å; F367-W394 HydrophobicContact CD1-CH2 4.47Å; F367-E461 HydrophobicContact CD1-CB 4.14Å; F367-E461 WeakPolarHBondContact CD1-OE2 3.43Å; F367-E461 WeakPolarHBondContact CE1-OE2 3.24Å; F367-M464 HydrophobicContact CE1-CB 4.3Å; F367-M464 HydrophobicContact CE1-CG 4.37Å; F367-M464 HydrophobicContact CZ-CG 4.42Å; F367-Q465 HydrophobicContact CD1-CB 4.28Å; F367-Q465 HydrophobicContact CE1-CB 3.8Å; F367-Q465 HydrophobicContact CE2-CB 4.3Å; F367-Q465 HydrophobicContact CE2-CG 4.22Å; F367-Q465 HydrophobicContact CZ-CB 3.81Å; F367-Q465 HydrophobicContact CZ-CG 4.23Å; F367-L468 HydrophobicContact CZ-CD1 4.16Å
368	Q	98.4	Very high	97.4	Very high	112 Å²	112	42 Å²	42	52%	0.523	21%	0.21	S	C	.	.	H	α-helix	trans	-66.2	-41.9	178.6	-173.5	60.2	16.5	0	0	111.9	D364 E365 K366 A370 Y371 S372	D364-Q368 WeakPolarHBondContact O-CB 3.33Å; D364-Q368 PolarHBondContact O-N 3.19Å; E365-Q368 PolarHBondContact O-N 3.3Å; K366-Q368 VanDerWaalsContact C-N 3.34Å; Q368-A370 PolarHBondContact O-N 3.47Å; Q368-Y371 PolarHBondContact O-N 3.42Å; Q368-S372 VanDerWaalsContact O-CB 3.28Å; Q368-S372 WeakPolarHBondContact O-CB 3.29Å; Q368-S372 PolarHBondContact O-N 3.22Å; Q368-S372 PolarHBondContact O-OG 2.95Å
369	A	98.1	Very high	97.5	Very high	19 Å²	19	36.8 Å²	36.8	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-47.9	177.2	0	0	0	0	0	111.1	E365 K366 L373	E365-A369 WeakPolarHBondContact O-CB 3.38Å; E365-A369 PolarHBondContact O-N 2.96Å; K366-A369 PolarHBondContact O-N 3.26Å; A369-L373 VanDerWaalsContact O-CB 3.26Å; A369-L373 WeakPolarHBondContact O-CB 3.41Å; A369-L373 PolarHBondContact O-N 3.06Å; A369-L373 VanDerWaalsContact O-N 3.08Å
370	A	98.4	Very high	97.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-45.1	177.7	0	0	0	0	0	112.9	Y89 K366 F367 Q368 S372 L373 L458 E461	Y89-A370 HydrophobicContact CD2-CB 3.82Å; Y89-A370 HydrophobicContact CE2-CB 3.95Å; K366-A370 PolarHBondContact O-N 3.16Å; K366-A370 VanDerWaalsContact O-N 3.07Å; F367-A370 PolarHBondContact O-N 3.04Å; Q368-A370 PolarHBondContact O-N 3.47Å; A370-S372 VanDerWaalsContact C-N 3.35Å; A370-S372 PolarHBondContact O-N 3.31Å; A370-L373 PolarHBondContact O-N 3.29Å; A370-L458 VanDerWaalsContact O-CD2 3.31Å; A370-L458 WeakPolarHBondContact O-CD2 3.34Å; A370-E461 HydrophobicContact CB-CB 4.08Å; A370-E461 HydrophobicContact CB-CG 3.48Å; A370-E461 VanDerWaalsContact CB-CG 3.48Å
371	Y	98.3	Very high	97.1	Very high	76 Å²	76	44.1 Å²	44.1	30%	0.298	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-39.2	-176.5	-172	-102	0	0	0	111.8	F367 Q368 R390 R391 W394	F367-Y371 VanDerWaalsContact O-CB 3.3Å; F367-Y371 WeakPolarHBondContact O-CB 3.47Å; F367-Y371 PolarHBondContact O-N 2.79Å; Q368-Y371 PolarHBondContact O-N 3.42Å; Y371-R390 PolarHBondContact O-NH1 2.91Å; Y371-R391 WeakPolarHBondContact OH-CG 3.35Å; Y371-W394 HydrophobicContact CD2-CB 4.27Å; Y371-W394 AromaticContact CD2-CD2 3.61Å; Y371-W394 HydrophobicContact CD2-CD2 3.61Å; Y371-W394 AromaticContact CD2-CE3 3.65Å; Y371-W394 HydrophobicContact CD2-CE3 3.65Å; Y371-W394 AromaticContact CD2-CG 3.89Å; Y371-W394 HydrophobicContact CD2-CG 3.89Å; Y371-W394 HydrophobicContact CD2-CZ3 4.2Å; Y371-W394 HydrophobicContact CE2-CB 3.92Å; Y371-W394 AromaticContact CE2-CD2 3.99Å; Y371-W394 HydrophobicContact CE2-CD2 3.99Å; Y371-W394 HydrophobicContact CE2-CE3 4.42Å; Y371-W394 AromaticContact CE2-CG 3.75Å; Y371-W394 HydrophobicContact CE2-CG 3.75Å
372	S	98.2	Very high	97	Very high	56 Å²	56	44 Å²	44	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-87	-14.5	-178.4	67.5	0	0	0	0	114.4	Q368 A370 T374	Q368-S372 VanDerWaalsContact O-CB 3.28Å; Q368-S372 WeakPolarHBondContact O-CB 3.29Å; Q368-S372 PolarHBondContact O-N 3.22Å; Q368-S372 PolarHBondContact O-OG 2.95Å; A370-S372 VanDerWaalsContact C-N 3.35Å; A370-S372 PolarHBondContact O-N 3.31Å; S372-T374 PolarHBondContact O-N 2.87Å
373	L	98.1	Very high	96.9	Very high	9 Å²	9	46.1 Å²	46.1	5%	0.047	26%	0.26	C	S	.	.			trans	-53.8	123.9	-178.4	-174.8	63.6	0	0	0	111	H86 D88 A369 A370 Y375 R390 H454 L457	H86-L373 HydrophobicContact CB-CD2 3.99Å; D88-L373 HydrophobicContact CB-CD1 4.16Å; A369-L373 VanDerWaalsContact O-CB 3.26Å; A369-L373 WeakPolarHBondContact O-CB 3.41Å; A369-L373 PolarHBondContact O-N 3.06Å; A369-L373 VanDerWaalsContact O-N 3.08Å; A370-L373 PolarHBondContact O-N 3.29Å; L373-Y375 HydrophobicContact CD1-CE2 4.33Å; L373-Y375 HydrophobicContact CG-CE2 4.35Å; L373-R390 WeakPolarHBondContact O-CD 3.45Å; L373-R390 PolarHBondContact O-NE 3.2Å; L373-H454 PolarHBondContact O-CE1 3.26Å; L373-H454 PolarHBondContact O-NE2 2.86Å; L373-L457 HydrophobicContact CD2-CD1 4.13Å
374	T	98.1	Very high	96.8	Very high	42 Å²	42	47 Å²	47	26%	0.258	27%	0.266	S	S	.	.			trans	-155.8	138.8	173.7	-179.7	0	0	0	0	109.4	S372 N376 T386	S372-T374 PolarHBondContact O-N 2.87Å; T374-N376 VanDerWaalsContact C-N 3.34Å; T374-N376 WeakPolarHBondContact CG2-OD1 3.45Å; T374-N376 PolarHBondContact OG1-N 3.13Å; T374-N376 PolarHBondContact OG1-OD1 3.18Å; T374-N376 VanDerWaalsContact OG1-OD1 3.11Å; T374-T386 PolarHBondContact OG1-OG1 3.46Å
375	Y	96.7	Very high	96.7	Very high	98 Å²	98	47.7 Å²	47.7	38%	0.384	27%	0.27	S	S	.	.			trans	-98.3	6.4	168.2	-57.2	-73.1	0	0	0	111.6	H86 L373 T377	H86-Y375 AromaticContact CE1-CE2 3.67Å; H86-Y375 AromaticContact ND1-CE2 3.29Å; H86-Y375 VanDerWaalsContact ND1-CE2 3.29Å; H86-Y375 WeakPolarHBondContact ND1-CE2 3.48Å; H86-Y375 AromaticContact ND1-CZ 3.52Å; H86-Y375 PolarHBondContact ND1-OH 2.91Å; L373-Y375 HydrophobicContact CD1-CE2 4.33Å; L373-Y375 HydrophobicContact CG-CE2 4.35Å; Y375-T377 WeakPolarHBondContact O-CG2 3.27Å; Y375-T377 PolarHBondContact O-N 2.75Å
376	N	97.3	Very high	96.7	Very high	77 Å²	77	45.7 Å²	45.7	41%	0.412	26%	0.261	S	S	.	.	S	Bend	trans	51.1	39.4	-171.6	-57.5	-42.1	0	0	0	112.2	T374 S382 G383 V384	T374-N376 VanDerWaalsContact C-N 3.34Å; T374-N376 WeakPolarHBondContact CG2-OD1 3.45Å; T374-N376 PolarHBondContact OG1-N 3.13Å; T374-N376 PolarHBondContact OG1-OD1 3.18Å; T374-N376 VanDerWaalsContact OG1-OD1 3.11Å; N376-S382 CarbonylContact O-C 3.56Å; N376-G383 PolarHBondContact O-N 2.8Å; N376-V384 CarbonylContact C-O 3.54Å; N376-V384 VanDerWaalsContact C-O 3.32Å; N376-V384 WeakPolarHBondContact CA-O 3.42Å; N376-V384 PolarHBondContact O-N 2.69Å
377	T	96	Very high	96.7	Very high	25 Å²	25	47.6 Å²	47.6	15%	0.153	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.9	178.8	57.4	0	0	0	0	110.5	Y375 H381 R448	Y375-T377 WeakPolarHBondContact O-CG2 3.27Å; Y375-T377 PolarHBondContact O-N 2.75Å; T377-H381 CarbonylContact C-O 3.47Å; T377-H381 WeakPolarHBondContact CA-O 3.21Å; T377-H381 WeakPolarHBondContact CB-O 3.35Å; T377-R448 PolarHBondContact OG1-NH2 3.23Å
378	I	95.2	Very high	96.6	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	113.2	169.1	-166.4	173.8	0	0	0	108.7	V258 L261 M262 M265 M380 H381 V384 L389 F447	V258-I378 HydrophobicContact CG1-CG1 4.47Å; V258-I378 HydrophobicContact CG1-CG2 4.46Å; L261-I378 HydrophobicContact CD2-CD1 3.93Å; L261-I378 HydrophobicContact CG-CD1 4.37Å; M262-I378 HydrophobicContact CE-CG2 4.34Å; M262-I378 HydrophobicContact CG-CD1 4.2Å; M262-I378 HydrophobicContact CG-CG2 3.7Å; M262-I378 HydrophobicContact SD-CG2 3.47Å; M262-I378 WeakPolarHBondContact SD-CG2 3.27Å; M265-I378 HydrophobicContact SD-CD1 3.88Å; I378-M380 PolarHBondContact O-N 3.08Å; I378-H381 HydrophobicContact CG2-CB 3.93Å; I378-H381 PolarHBondContact N-O 2.84Å; I378-H381 PolarHBondContact O-N 3.2Å; I378-V384 HydrophobicContact CG2-CB 4.15Å; I378-V384 HydrophobicContact CG2-CG1 4.06Å; I378-V384 HydrophobicContact CG2-CG2 3.96Å; I378-L389 HydrophobicContact CD1-CD2 4.1Å; I378-F447 HydrophobicContact CD1-CE1 4.16Å; I378-F447 HydrophobicContact CD1-CZ 4.11Å; I378-F447 HydrophobicContact CG1-CD1 4.47Å; I378-F447 HydrophobicContact CG1-CE1 3.47Å; I378-F447 VanDerWaalsContact CG1-CE1 3.47Å; I378-F447 HydrophobicContact CG1-CZ 3.76Å
379	A	93.6	Very high	96.6	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	-111.2	-172	0	0	0	0	0	111.7	V258 H446 F447 R448 E451	V258-A379 HydrophobicContact CG1-CB 4.11Å; V258-A379 HydrophobicContact CG2-CB 4.24Å; A379-H446 WeakPolarHBondContact CB-O 3.4Å; A379-F447 HydrophobicContact CB-CD1 4.39Å; A379-F447 HydrophobicContact CB-CD2 4.33Å; A379-F447 HydrophobicContact CB-CG 4.21Å; A379-R448 PolarHBondContact O-NE 3.39Å; A379-E451 WeakPolarHBondContact CA-OE2 3.4Å; A379-E451 PolarHBondContact N-OE1 2.83Å; A379-E451 PolarHBondContact N-OE2 3.06Å
380	M	91	Very high	96.6	Very high	105 Å²	105	42.7 Å²	42.7	52%	0.517	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.5	178.6	62.8	-72.5	-167.5	0	0	114.3	A255 V258 I378	A255-M380 HydrophobicContact CB-CE 3.92Å; V258-M380 HydrophobicContact CB-CE 4.28Å; V258-M380 HydrophobicContact CG2-CE 4.47Å; I378-M380 PolarHBondContact O-N 3.08Å
381	H	93.8	Very high	96.6	Very high	50 Å²	50	45.9 Å²	45.9	23%	0.231	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	144.6	-177.6	-60.9	-93.7	0	0	0	111.6	M262 T377 I378 V384	M262-H381 HydrophobicContact CE-CB 4.25Å; M262-H381 HydrophobicContact SD-CB 3.96Å; T377-H381 CarbonylContact C-O 3.47Å; T377-H381 WeakPolarHBondContact CA-O 3.21Å; T377-H381 WeakPolarHBondContact CB-O 3.35Å; I378-H381 HydrophobicContact CG2-CB 3.93Å; I378-H381 PolarHBondContact N-O 2.84Å; I378-H381 PolarHBondContact O-N 3.2Å; H381-V384 HydrophobicContact CB-CG2 4.12Å
382	S	95.4	Very high	96.7	Very high	98 Å²	98	42.2 Å²	42.2	69%	0.685	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	159.8	176.8	-58.7	0	0	0	0	110.6	N376	N376-S382 CarbonylContact O-C 3.56Å
383	G	96	Very high	96.7	Very high	74 Å²	74	39.7 Å²	39.7	76%	0.763	23%	0.228	S	C	*	.	S	Bend	trans	75.1	28.7	-178.6	0	0	0	0	0	113.7	N376	N376-G383 PolarHBondContact O-N 2.8Å
384	V	96.8	Very high	96.7	Very high	20 Å²	20	39.7 Å²	39.7	12%	0.121	23%	0.227	C	C	.	.			trans	-110.3	125.4	-176.8	-174.7	0	0	0	0	110	M262 M265 N376 I378 H381 T386	M262-V384 HydrophobicContact CE-CB 4.46Å; M262-V384 HydrophobicContact CE-CG1 4.15Å; M262-V384 HydrophobicContact CE-CG2 3.42Å; M262-V384 VanDerWaalsContact CE-CG2 3.42Å; M262-V384 HydrophobicContact SD-CG2 4.37Å; M265-V384 HydrophobicContact CE-CG1 4.31Å; N376-V384 CarbonylContact C-O 3.54Å; N376-V384 VanDerWaalsContact C-O 3.32Å; N376-V384 WeakPolarHBondContact CA-O 3.42Å; N376-V384 PolarHBondContact O-N 2.69Å; I378-V384 HydrophobicContact CG2-CB 4.15Å; I378-V384 HydrophobicContact CG2-CG1 4.06Å; I378-V384 HydrophobicContact CG2-CG2 3.96Å; H381-V384 HydrophobicContact CB-CG2 4.12Å; V384-T386 PolarHBondContact O-N 2.92Å
385	D	96.8	Very high	96.7	Very high	74 Å²	74	38.1 Å²	38.1	40%	0.396	22%	0.217	S	C	.	.			trans	-74.8	116.6	170.1	179	14.6	0	0	0	110.3	M265 Q269 S387	M265-D385 WeakPolarHBondContact CE-O 3.46Å; Q269-D385 PolarHBondContact NE2-OD2 3.44Å; Q269-D385 VanDerWaalsContact NE2-OD2 3.07Å; D385-S387 VanDerWaalsContact CG-OG 3.23Å; D385-S387 WeakPolarHBondContact OD1-CB 3.4Å; D385-S387 PolarHBondContact OD1-N 2.86Å; D385-S387 PolarHBondContact OD1-OG 2.8Å; D385-S387 PolarHBondContact OD2-OG 3.25Å
386	T	97.8	Very high	96.8	Very high	11 Å²	11	33.6 Å²	33.6	7%	0.067	20%	0.199	C	C	.	.			trans	-98.7	6.2	-178.6	60.2	0	0	0	0	113.8	M265 T374 V384 V388 L389 R390	M265-T386 HydrophobicContact CE-CG2 4.41Å; T374-T386 PolarHBondContact OG1-OG1 3.46Å; V384-T386 PolarHBondContact O-N 2.92Å; T386-V388 VanDerWaalsContact C-N 3.35Å; T386-V388 PolarHBondContact O-N 3.25Å; T386-L389 PolarHBondContact O-N 3.41Å; T386-L389 VanDerWaalsContact O-N 3.07Å; T386-R390 PolarHBondContact O-N 3.31Å; T386-R390 PolarHBondContact OG1-NE 3.11Å
387	S	97.5	Very high	96.8	Very high	41 Å²	41	30 Å²	30	29%	0.287	18%	0.18	S	C	.	.	H	α-helix	trans	-50.2	-48.7	-176.1	58.8	0	0	0	0	113.5	D385 L389 R390 R391	D385-S387 VanDerWaalsContact CG-OG 3.23Å; D385-S387 WeakPolarHBondContact OD1-CB 3.4Å; D385-S387 PolarHBondContact OD1-N 2.86Å; D385-S387 PolarHBondContact OD1-OG 2.8Å; D385-S387 PolarHBondContact OD2-OG 3.25Å; S387-L389 PolarHBondContact O-N 2.92Å; S387-R390 PolarHBondContact O-N 2.77Å; S387-R391 VanDerWaalsContact O-CB 3.29Å; S387-R391 WeakPolarHBondContact O-CB 3.27Å; S387-R391 PolarHBondContact O-N 2.8Å
388	V	97.7	Very high	96.9	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-38.5	179.3	-64	0	0	0	0	112.7	M265 Q269 L272 T386 A392 L416	M265-V388 HydrophobicContact CB-CG2 3.82Å; M265-V388 HydrophobicContact CE-CG2 4.19Å; M265-V388 HydrophobicContact CG-CG2 3.89Å; Q269-V388 HydrophobicContact CG-CG1 3.75Å; Q269-V388 HydrophobicContact CG-CG2 4.39Å; L272-V388 HydrophobicContact CD1-CG1 4.13Å; T386-V388 VanDerWaalsContact C-N 3.35Å; T386-V388 PolarHBondContact O-N 3.25Å; V388-A392 WeakPolarHBondContact O-CB 3.37Å; V388-A392 PolarHBondContact O-N 2.86Å; V388-L416 HydrophobicContact CB-CD1 4.35Å; V388-L416 HydrophobicContact CG2-CD1 4.41Å
389	L	98.4	Very high	97	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-69.3	-44.6	178.1	179.8	61.5	0	0	0	111.5	L261 M265 I378 T386 S387 A392 I393 L416 L417 W444	L261-L389 HydrophobicContact CD2-CD2 4.3Å; M265-L389 HydrophobicContact CE-CB 4.09Å; M265-L389 HydrophobicContact SD-CB 4.08Å; M265-L389 HydrophobicContact SD-CD2 4.22Å; I378-L389 HydrophobicContact CD1-CD2 4.1Å; T386-L389 PolarHBondContact O-N 3.41Å; T386-L389 VanDerWaalsContact O-N 3.07Å; S387-L389 PolarHBondContact O-N 2.92Å; L389-A392 PolarHBondContact O-N 3.46Å; L389-I393 WeakPolarHBondContact O-CG1 3.29Å; L389-I393 PolarHBondContact O-N 3.27Å; L389-L416 HydrophobicContact CD1-CB 4.04Å; L389-L417 HydrophobicContact CD1-CD1 4.34Å; L389-W444 HydrophobicContact CD1-CZ2 4.29Å; L389-W444 HydrophobicContact CD2-CH2 4.11Å; L389-W444 HydrophobicContact CD2-CZ2 3.99Å; L389-W444 HydrophobicContact CG-CZ2 4.44Å
390	R	98.6	Very high	97	Very high	24 Å²	24	28.7 Å²	28.7	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-42.4	177.2	-68.9	-176.2	-77	112.1	-3	111.4	Y371 L373 T386 S387 A392 I393 W394 L458	Y371-R390 PolarHBondContact O-NH1 2.91Å; L373-R390 WeakPolarHBondContact O-CD 3.45Å; L373-R390 PolarHBondContact O-NE 3.2Å; T386-R390 PolarHBondContact O-N 3.31Å; T386-R390 PolarHBondContact OG1-NE 3.11Å; S387-R390 PolarHBondContact O-N 2.77Å; R390-A392 VanDerWaalsContact C-N 3.33Å; R390-A392 PolarHBondContact O-N 3.05Å; R390-I393 PolarHBondContact O-N 2.74Å; R390-W394 PolarHBondContact O-N 2.93Å; R390-L458 HydrophobicContact CB-CD1 4.07Å; R390-L458 HydrophobicContact CG-CD1 3.9Å
391	R	98.4	Very high	97.2	Very high	66 Å²	66	23.8 Å²	23.8	25%	0.249	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-41.7	174	-176.3	172.4	68	-167.2	6.1	111.7	L272 Y371 S387 I393 W394 N395 Y408 E412	L272-R391 VanDerWaalsContact CD1-NH2 3.26Å; Y371-R391 WeakPolarHBondContact OH-CG 3.35Å; S387-R391 VanDerWaalsContact O-CB 3.29Å; S387-R391 WeakPolarHBondContact O-CB 3.27Å; S387-R391 PolarHBondContact O-N 2.8Å; R391-I393 PolarHBondContact O-N 2.81Å; R391-W394 PolarHBondContact O-N 3.4Å; R391-N395 VanDerWaalsContact O-CB 3.29Å; R391-N395 WeakPolarHBondContact O-CB 3.37Å; R391-N395 VanDerWaalsContact O-CG 3.31Å; R391-N395 PolarHBondContact O-N 3.31Å; R391-Y408 HydrophobicContact CG-CD2 4.41Å; R391-Y408 HydrophobicContact CG-CE2 4.03Å; R391-E412 IonicContact NH2-OE1 3.4Å; R391-E412 IonicContact NH2-OE2 3.5Å; R391-E412 PolarHBondContact NH2-OE2 3.34Å
392	A	98.6	Very high	97.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-38.8	176.9	0	0	0	0	0	113	V388 L389 R390 Y396 Y408 L416 L417	V388-A392 WeakPolarHBondContact O-CB 3.37Å; V388-A392 PolarHBondContact O-N 2.86Å; L389-A392 PolarHBondContact O-N 3.46Å; R390-A392 VanDerWaalsContact C-N 3.33Å; R390-A392 PolarHBondContact O-N 3.05Å; A392-Y396 WeakPolarHBondContact O-CB 3.43Å; A392-Y396 PolarHBondContact O-N 3.33Å; A392-Y408 VanDerWaalsContact CA-OH 3.23Å; A392-Y408 WeakPolarHBondContact CA-OH 3.24Å; A392-Y408 VanDerWaalsContact CB-OH 3.3Å; A392-Y408 WeakPolarHBondContact CB-OH 3.38Å; A392-L416 HydrophobicContact CB-CB 4.32Å; A392-L416 HydrophobicContact CB-CD1 3.88Å; A392-L417 HydrophobicContact CB-CD1 3.47Å; A392-L417 VanDerWaalsContact CB-CD1 3.47Å
393	I	98.8	Very high	97.4	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.015	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-54.2	171.7	-68.7	166.4	0	0	0	110.4	L389 R390 R391 N395 Y396 I397 L417 I425 W444 V455 L458	L389-I393 WeakPolarHBondContact O-CG1 3.29Å; L389-I393 PolarHBondContact O-N 3.27Å; R390-I393 PolarHBondContact O-N 2.74Å; R391-I393 PolarHBondContact O-N 2.81Å; I393-N395 PolarHBondContact O-N 2.88Å; I393-Y396 PolarHBondContact O-N 3.3Å; I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 VanDerWaalsContact O-CD1 3.31Å; I393-I397 WeakPolarHBondContact O-CD1 2.85Å; I393-I397 WeakPolarHBondContact O-CG1 3.46Å; I393-I397 PolarHBondContact O-N 3.05Å; I393-I397 VanDerWaalsContact O-N 3.1Å; I393-L417 HydrophobicContact CG1-CD1 4.35Å; I393-L417 HydrophobicContact CG1-CD2 4.21Å; I393-L417 HydrophobicContact CG1-CG 4.31Å; I393-I425 HydrophobicContact CG1-CD1 4.36Å; I393-I425 HydrophobicContact CG2-CD1 4.08Å; I393-W444 HydrophobicContact CD1-CH2 4.03Å; I393-W444 HydrophobicContact CD1-CZ2 4.46Å; I393-V455 HydrophobicContact CD1-CG2 4.16Å; I393-L458 HydrophobicContact CB-CD1 4.46Å; I393-L458 HydrophobicContact CD1-CD1 4.32Å; I393-L458 HydrophobicContact CG2-CB 4.06Å; I393-L458 HydrophobicContact CG2-CD1 4.23Å
394	W	98.8	Very high	97.4	Very high	9 Å²	9	14.3 Å²	14.3	3%	0.034	7%	0.072	C	C	.	.	H	α-helix	trans	-56.4	-50.9	-179.4	-171.6	-81.9	0	0	0	112.3	F367 Y371 R390 R391 Y396 I397 H398 L458 E461 A462 Q465	F367-W394 HydrophobicContact CD1-CH2 4.47Å; Y371-W394 HydrophobicContact CD2-CB 4.27Å; Y371-W394 AromaticContact CD2-CD2 3.61Å; Y371-W394 HydrophobicContact CD2-CD2 3.61Å; Y371-W394 AromaticContact CD2-CE3 3.65Å; Y371-W394 HydrophobicContact CD2-CE3 3.65Å; Y371-W394 AromaticContact CD2-CG 3.89Å; Y371-W394 HydrophobicContact CD2-CG 3.89Å; Y371-W394 HydrophobicContact CD2-CZ3 4.2Å; Y371-W394 HydrophobicContact CE2-CB 3.92Å; Y371-W394 AromaticContact CE2-CD2 3.99Å; Y371-W394 HydrophobicContact CE2-CD2 3.99Å; Y371-W394 HydrophobicContact CE2-CE3 4.42Å; Y371-W394 AromaticContact CE2-CG 3.75Å; Y371-W394 HydrophobicContact CE2-CG 3.75Å; R390-W394 PolarHBondContact O-N 2.93Å; R391-W394 PolarHBondContact O-N 3.4Å; W394-Y396 VanDerWaalsContact C-N 3.33Å; W394-Y396 PolarHBondContact O-N 3.34Å; W394-I397 PolarHBondContact O-N 3.44Å; W394-H398 AromaticContact NE1-CE1 3.32Å; W394-H398 PolarHBondContact NE1-CE1 3.4Å; W394-H398 VanDerWaalsContact NE1-CE1 3.32Å; W394-H398 AromaticContact NE1-ND1 3.73Å; W394-H398 AromaticContact NE1-NE2 3.59Å; W394-H398 PolarHBondContact O-N 3.44Å; W394-L458 HydrophobicContact CE3-CD2 4.24Å; W394-E461 HydrophobicContact CH2-CB 3.85Å; W394-E461 HydrophobicContact CZ3-CB 3.72Å; W394-A462 HydrophobicContact CD2-CB 3.67Å; W394-A462 HydrophobicContact CE3-CB 3.76Å; W394-A462 HydrophobicContact CG-CB 4.16Å; W394-A462 HydrophobicContact CH2-CB 4.34Å; W394-A462 HydrophobicContact CZ2-CB 4.24Å; W394-A462 HydrophobicContact CZ3-CB 4.12Å; W394-Q465 HydrophobicContact CZ2-CB 4.37Å
395	N	98.4	Very high	97.4	Very high	9 Å²	9	15.6 Å²	15.6	5%	0.048	8%	0.075	C	C	.	.	H	α-helix	trans	-69.2	-31.9	-177.3	-70.9	3.9	0	0	0	112	R391 I393 H398 C399 Y405 Y408 Y410	R391-N395 VanDerWaalsContact O-CB 3.29Å; R391-N395 WeakPolarHBondContact O-CB 3.37Å; R391-N395 VanDerWaalsContact O-CG 3.31Å; R391-N395 PolarHBondContact O-N 3.31Å; I393-N395 PolarHBondContact O-N 2.88Å; N395-H398 PolarHBondContact O-N 3.24Å; N395-C399 VanDerWaalsContact O-CB 3.28Å; N395-C399 WeakPolarHBondContact O-CB 3.43Å; N395-C399 PolarHBondContact O-N 3.38Å; N395-Y405 HydrophobicContact CB-CD2 4.44Å; N395-Y405 WeakPolarHBondContact OD1-CE2 3.35Å; N395-Y408 HydrophobicContact CB-CD1 3.95Å; N395-Y408 HydrophobicContact CB-CE1 3.7Å; N395-Y408 VanDerWaalsContact ND2-CD1 3.35Å; N395-Y408 WeakPolarHBondContact ND2-CD1 3.44Å; N395-Y408 WeakPolarHBondContact ND2-CD2 3.2Å; N395-Y410 HydrophobicContact CB-CE1 4.31Å
396	Y	98.4	Very high	97.1	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.008	6%	0.064	C	C	.	.	H	α-helix	trans	-63.8	-43.8	172.2	175	-116.3	0	0	0	111.8	E290 L295 A392 I393 W394 C399 V400 V413 L417 K422 I425	E290-Y396 HydrophobicContact CG-CD2 4.21Å; E290-Y396 HydrophobicContact CG-CE2 4.45Å; E290-Y396 VanDerWaalsContact OE1-CD2 3.3Å; E290-Y396 WeakPolarHBondContact OE1-CD2 3.46Å; E290-Y396 WeakPolarHBondContact OE1-CE2 3.35Å; L295-Y396 WeakPolarHBondContact CD1-OH 3.33Å; A392-Y396 WeakPolarHBondContact O-CB 3.43Å; A392-Y396 PolarHBondContact O-N 3.33Å; I393-Y396 PolarHBondContact O-N 3.3Å; W394-Y396 VanDerWaalsContact C-N 3.33Å; W394-Y396 PolarHBondContact O-N 3.34Å; Y396-C399 VanDerWaalsContact O-CB 3.31Å; Y396-C399 WeakPolarHBondContact O-CB 3.48Å; Y396-C399 PolarHBondContact O-N 2.81Å; Y396-V400 HydrophobicContact CE1-CG2 4.24Å; Y396-V400 HydrophobicContact CE2-CG2 4.04Å; Y396-V400 WeakPolarHBondContact O-CG2 3.38Å; Y396-V400 PolarHBondContact O-N 3.5Å; Y396-V413 HydrophobicContact CD2-CG1 3.66Å; Y396-V413 HydrophobicContact CE2-CG1 4.48Å; Y396-V413 HydrophobicContact CG-CG1 3.95Å; Y396-L417 HydrophobicContact CD1-CD2 3.95Å; Y396-L417 HydrophobicContact CG-CD2 4.05Å; Y396-K422 HydrophobicContact CE1-CB 4.03Å; Y396-K422 HydrophobicContact CE1-CG 4.31Å; Y396-I425 HydrophobicContact CD1-CB 4.41Å; Y396-I425 HydrophobicContact CD1-CD1 4.39Å; Y396-I425 HydrophobicContact CD1-CG2 3.77Å; Y396-I425 HydrophobicContact CE1-CB 4.15Å; Y396-I425 HydrophobicContact CE1-CG2 3.76Å
397	I	98.1	Very high	96.7	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-63.7	-45.1	176.6	-67.5	148.8	0	0	0	110.7	I393 W394 C399 V400 F401 I425 L459 A462 R463	I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 VanDerWaalsContact O-CD1 3.31Å; I393-I397 WeakPolarHBondContact O-CD1 2.85Å; I393-I397 WeakPolarHBondContact O-CG1 3.46Å; I393-I397 PolarHBondContact O-N 3.05Å; I393-I397 VanDerWaalsContact O-N 3.1Å; W394-I397 PolarHBondContact O-N 3.44Å; I397-C399 VanDerWaalsContact C-N 3.29Å; I397-C399 PolarHBondContact O-N 3.1Å; I397-V400 WeakPolarHBondContact O-CB 3.49Å; I397-V400 PolarHBondContact O-N 3.39Å; I397-V400 VanDerWaalsContact O-N 3.13Å; I397-F401 HydrophobicContact CG2-CD2 4.2Å; I397-F401 HydrophobicContact CG2-CE2 4.16Å; I397-F401 VanDerWaalsContact O-CD2 3.27Å; I397-F401 WeakPolarHBondContact O-CD2 3.49Å; I397-F401 PolarHBondContact O-N 2.83Å; I397-F401 VanDerWaalsContact O-N 3.15Å; I397-I425 HydrophobicContact CD1-CG2 4.03Å; I397-I425 HydrophobicContact CG1-CG2 3.42Å; I397-I425 VanDerWaalsContact CG1-CG2 3.42Å; I397-L459 VanDerWaalsContact CD1-CA 3.49Å; I397-L459 HydrophobicContact CD1-CB 3.9Å; I397-L459 HydrophobicContact CD1-CG 4.17Å; I397-A462 HydrophobicContact CB-CB 3.98Å; I397-A462 HydrophobicContact CD1-CB 4.16Å; I397-A462 HydrophobicContact CG2-CB 3.74Å; I397-R463 HydrophobicContact CG2-CB 4.5Å
398	H	98.1	Very high	96.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.8	-38.2	173.8	-86.6	-155.4	0	0	0	112.6	W394 N395 F401 G402 I403 Y405 A462 Q465	W394-H398 AromaticContact NE1-CE1 3.32Å; W394-H398 PolarHBondContact NE1-CE1 3.4Å; W394-H398 VanDerWaalsContact NE1-CE1 3.32Å; W394-H398 AromaticContact NE1-ND1 3.73Å; W394-H398 AromaticContact NE1-NE2 3.59Å; W394-H398 PolarHBondContact O-N 3.44Å; N395-H398 PolarHBondContact O-N 3.24Å; H398-F401 CarbonylContact O-C 3.56Å; H398-F401 VanDerWaalsContact O-C 3.32Å; H398-F401 WeakPolarHBondContact O-CA 3.36Å; H398-F401 PolarHBondContact O-N 2.96Å; H398-G402 PolarHBondContact O-N 3.05Å; H398-G402 VanDerWaalsContact O-N 3.1Å; H398-I403 CarbonylContact C-O 3.57Å; H398-I403 HydrophobicContact CB-CB 4.05Å; H398-I403 PolarHBondContact O-N 3.36Å; H398-Y405 HydrophobicContact CB-CE2 4.07Å; H398-Y405 PolarHBondContact CE1-OH 2.93Å; H398-Y405 AromaticContact ND1-CE2 3.52Å; H398-Y405 AromaticContact ND1-CZ 3.54Å; H398-Y405 PolarHBondContact ND1-OH 2.93Å; H398-A462 PolarHBondContact CD2-O 3.32Å; H398-A462 PolarHBondContact NE2-O 3.39Å; H398-Q465 PolarHBondContact CE1-OE1 3.31Å; H398-Q465 VanDerWaalsContact CE1-OE1 3.31Å
399	C	96.3	Very high	96.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.3	-42.8	172.3	179.5	0	0	0	0	112.4	F287 K291 N395 Y396 I397 F401 G402 Y410	F287-C399 HydrophobicContact CD2-CB 4.41Å; F287-C399 HydrophobicContact CE2-CB 3.88Å; F287-C399 VanDerWaalsContact CE2-SG 3.57Å; K291-C399 VanDerWaalsContact CA-SG 3.6Å; K291-C399 PolarHBondContact N-SG 3.21Å; K291-C399 VanDerWaalsContact N-SG 3.45Å; N395-C399 VanDerWaalsContact O-CB 3.28Å; N395-C399 WeakPolarHBondContact O-CB 3.43Å; N395-C399 PolarHBondContact O-N 3.38Å; Y396-C399 VanDerWaalsContact O-CB 3.31Å; Y396-C399 WeakPolarHBondContact O-CB 3.48Å; Y396-C399 PolarHBondContact O-N 2.81Å; I397-C399 VanDerWaalsContact C-N 3.29Å; I397-C399 PolarHBondContact O-N 3.1Å; C399-F401 PolarHBondContact O-N 3.18Å; C399-G402 WeakPolarHBondContact O-CA 3.34Å; C399-G402 PolarHBondContact O-N 3.11Å; C399-Y410 HydrophobicContact CB-CD1 4.22Å; C399-Y410 HydrophobicContact CB-CE1 3.68Å
400	V	94.6	Very high	96.2	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.03	9%	0.087	C	C	.	.	H	α-helix	trans	-58.5	-28.7	172.6	171.1	0	0	0	0	111.7	Y323 F326 Y396 I397 K426 C430	Y323-V400 HydrophobicContact CE2-CG1 3.88Å; Y323-V400 WeakPolarHBondContact CE2-O 3.47Å; Y323-V400 PolarHBondContact OH-O 3.03Å; Y323-V400 VanDerWaalsContact OH-O 3.09Å; F326-V400 WeakPolarHBondContact CE2-O 3.33Å; Y396-V400 HydrophobicContact CE1-CG2 4.24Å; Y396-V400 HydrophobicContact CE2-CG2 4.04Å; Y396-V400 WeakPolarHBondContact O-CG2 3.38Å; Y396-V400 PolarHBondContact O-N 3.5Å; I397-V400 WeakPolarHBondContact O-CB 3.49Å; I397-V400 PolarHBondContact O-N 3.39Å; I397-V400 VanDerWaalsContact O-N 3.13Å; V400-K426 HydrophobicContact CG1-CG 4.32Å; V400-K426 HydrophobicContact CG2-CD 4.29Å; V400-K426 HydrophobicContact CG2-CG 4.41Å; V400-C430 WeakPolarHBondContact CG1-SG 3.38Å
401	F	95.3	Very high	96	Very high	3 Å²	3	18 Å²	18	1%	0.013	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	13.1	172.8	-69.4	-78.4	0	0	0	114.2	P170 W171 I397 H398 C399 A429 R463 A466 Y470	P170-F401 HydrophobicContact CG-CD1 3.7Å; P170-F401 HydrophobicContact CG-CE1 4.22Å; W171-F401 HydrophobicContact CE3-CD1 4.31Å; W171-F401 AromaticContact CZ3-CD1 3.77Å; W171-F401 HydrophobicContact CZ3-CD1 3.77Å; W171-F401 HydrophobicContact CZ3-CE1 4.49Å; I397-F401 HydrophobicContact CG2-CD2 4.2Å; I397-F401 HydrophobicContact CG2-CE2 4.16Å; I397-F401 VanDerWaalsContact O-CD2 3.27Å; I397-F401 WeakPolarHBondContact O-CD2 3.49Å; I397-F401 PolarHBondContact O-N 2.83Å; I397-F401 VanDerWaalsContact O-N 3.15Å; H398-F401 CarbonylContact O-C 3.56Å; H398-F401 VanDerWaalsContact O-C 3.32Å; H398-F401 WeakPolarHBondContact O-CA 3.36Å; H398-F401 PolarHBondContact O-N 2.96Å; C399-F401 PolarHBondContact O-N 3.18Å; F401-A429 HydrophobicContact CE2-CB 4.3Å; F401-R463 HydrophobicContact CE2-CB 4.26Å; F401-R463 HydrophobicContact CE2-CG 3.94Å; F401-R463 HydrophobicContact CZ-CG 3.91Å; F401-A466 HydrophobicContact CB-CB 4.02Å; F401-A466 HydrophobicContact CD2-CB 4.34Å; F401-A466 HydrophobicContact CG-CB 4.24Å; F401-Y470 WeakPolarHBondContact O-CE2 3.33Å; F401-Y470 PolarHBondContact O-OH 2.95Å
402	G	95.4	Very high	95.9	Very high	2 Å²	2	15.3 Å²	15.3	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	18	174.3	0	0	0	0	0	115.5	F337 H398 C399	F337-G402 PolarHBondContact N-O 3.14Å; H398-G402 PolarHBondContact O-N 3.05Å; H398-G402 VanDerWaalsContact O-N 3.1Å; C399-G402 WeakPolarHBondContact O-CA 3.34Å; C399-G402 PolarHBondContact O-N 3.11Å
403	I	96.9	Very high	95.7	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.3	178.8	-45	-166.7	0	0	0	109.8	F287 F337 A339 H398 Y410 A466 Y470	F287-I403 WeakPolarHBondContact CE2-O 3.41Å; F337-I403 HydrophobicContact CD1-CB 4.29Å; F337-I403 HydrophobicContact CD1-CD1 3.99Å; F337-I403 HydrophobicContact CD1-CG1 3.79Å; F337-I403 HydrophobicContact CD1-CG2 4.04Å; F337-I403 HydrophobicContact CE1-CD1 4.03Å; F337-I403 HydrophobicContact CE1-CG1 4.3Å; F337-I403 HydrophobicContact CE1-CG2 4.16Å; F337-I403 CarbonylContact O-C 3.32Å; F337-I403 WeakPolarHBondContact O-CA 3.47Å; A339-I403 HydrophobicContact CB-CG2 3.93Å; H398-I403 CarbonylContact C-O 3.57Å; H398-I403 HydrophobicContact CB-CB 4.05Å; H398-I403 PolarHBondContact O-N 3.36Å; I403-Y410 PolarHBondContact O-OH 3.42Å; I403-A466 HydrophobicContact CD1-CB 3.63Å; I403-Y470 HydrophobicContact CD1-CE2 4.08Å; I403-Y470 HydrophobicContact CG1-CE2 4.04Å
404	R	96.4	Very high	95.5	Very high	20 Å²	20	19.1 Å²	19.1	8%	0.075	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130	179.2	-171.1	-179.5	74.8	-173.1	13.3	111.4	E284 F287 T336 F337 A339 D406 Y410	E284-R404 VanDerWaalsContact CD-NH1 3.34Å; E284-R404 VanDerWaalsContact CG-NH1 3.27Å; E284-R404 IonicContact OE1-CZ 3.82Å; E284-R404 IonicContact OE1-NH1 3.9Å; E284-R404 PolarHBondContact OE1-NH1 3.22Å; E284-R404 IonicContact OE1-NH2 3.72Å; E284-R404 PolarHBondContact OE1-NH2 2.66Å; E284-R404 IonicContact OE2-NH1 2.77Å; F287-R404 HydrophobicContact CB-CG 4.07Å; F287-R404 HydrophobicContact CD1-CB 4.06Å; F287-R404 HydrophobicContact CD1-CG 3.96Å; F287-R404 HydrophobicContact CD2-CB 3.83Å; F287-R404 HydrophobicContact CD2-CG 3.63Å; F287-R404 HydrophobicContact CE1-CB 3.91Å; F287-R404 HydrophobicContact CE1-CG 4.33Å; F287-R404 HydrophobicContact CE2-CB 3.63Å; F287-R404 HydrophobicContact CE2-CG 3.99Å; F287-R404 HydrophobicContact CG-CB 4.02Å; F287-R404 HydrophobicContact CG-CG 3.58Å; F287-R404 HydrophobicContact CZ-CB 3.67Å; F287-R404 HydrophobicContact CZ-CG 4.33Å; T336-R404 HydrophobicContact CG2-CB 3.69Å; F337-R404 PolarHBondContact O-N 3.47Å; A339-R404 WeakPolarHBondContact CB-O 3.39Å; A339-R404 PolarHBondContact N-O 2.85Å; R404-D406 IonicContact CZ-OD1 3.1Å; R404-D406 IonicContact NE-OD1 2.8Å; R404-D406 PolarHBondContact NE-OD1 3.23Å; R404-D406 IonicContact NH2-OD1 2.83Å; R404-D406 PolarHBondContact NH2-OD1 3.15Å; R404-Y410 WeakPolarHBondContact CA-OH 3.27Å; R404-Y410 HydrophobicContact CG-CE2 3.95Å
405	Y	95.4	Very high	95.3	Very high	47 Å²	47	22.3 Å²	22.3	18%	0.184	12%	0.115	C	C	.	.			trans	-93.6	114.5	165.8	-65.4	-83.2	0	0	0	109.5	A339 N395 H398 D407 Y408 Y410	A339-Y405 HydrophobicContact CB-CD1 3.55Å; A339-Y405 HydrophobicContact CB-CE1 3.6Å; A339-Y405 HydrophobicContact CB-CG 4.18Å; N395-Y405 HydrophobicContact CB-CD2 4.44Å; N395-Y405 WeakPolarHBondContact OD1-CE2 3.35Å; H398-Y405 HydrophobicContact CB-CE2 4.07Å; H398-Y405 PolarHBondContact CE1-OH 2.93Å; H398-Y405 AromaticContact ND1-CE2 3.52Å; H398-Y405 AromaticContact ND1-CZ 3.54Å; H398-Y405 PolarHBondContact ND1-OH 2.93Å; Y405-D407 PolarHBondContact O-N 3.14Å; Y405-Y408 PolarHBondContact O-N 3.41Å; Y405-Y410 PolarHBondContact N-OH 3.37Å; Y405-Y410 VanDerWaalsContact N-OH 3.1Å
406	D	91.3	Very high	95.2	Very high	28 Å²	28	22 Å²	22	15%	0.15	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.1	-176.4	-68.3	-22.5	0	0	0	115	R338 Q340 R404	R338-D406 IonicContact CZ-OD2 3.32Å; R338-D406 IonicContact NE-OD1 3.18Å; R338-D406 IonicContact NE-OD2 3.1Å; R338-D406 PolarHBondContact NE-OD2 2.95Å; R338-D406 IonicContact NH2-OD2 2.72Å; R338-D406 PolarHBondContact NH2-OD2 3.01Å; Q340-D406 PolarHBondContact OE1-OD2 2.89Å; R404-D406 IonicContact CZ-OD1 3.1Å; R404-D406 IonicContact NE-OD1 2.8Å; R404-D406 PolarHBondContact NE-OD1 3.23Å; R404-D406 IonicContact NH2-OD1 2.83Å; R404-D406 PolarHBondContact NH2-OD1 3.15Å
407	D	90.6	Very high	95.2	Very high	135 Å²	135	22.1 Å²	22.1	72%	0.722	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	8.5	179.5	63	-36.9	0	0	0	113.4	Y405	Y405-D407 PolarHBondContact O-N 3.14Å
408	Y	93.9	Very high	95	Very high	7 Å²	7	25.4 Å²	25.4	3%	0.027	13%	0.129	C	C	.	.			trans	-116.3	127.7	-176.8	-175.2	-105.5	0	0	0	112.6	R391 A392 N395 Y405 Y410 E412 V413	R391-Y408 HydrophobicContact CG-CD2 4.41Å; R391-Y408 HydrophobicContact CG-CE2 4.03Å; A392-Y408 VanDerWaalsContact CA-OH 3.23Å; A392-Y408 WeakPolarHBondContact CA-OH 3.24Å; A392-Y408 VanDerWaalsContact CB-OH 3.3Å; A392-Y408 WeakPolarHBondContact CB-OH 3.38Å; N395-Y408 HydrophobicContact CB-CD1 3.95Å; N395-Y408 HydrophobicContact CB-CE1 3.7Å; N395-Y408 VanDerWaalsContact ND2-CD1 3.35Å; N395-Y408 WeakPolarHBondContact ND2-CD1 3.44Å; N395-Y408 WeakPolarHBondContact ND2-CD2 3.2Å; Y405-Y408 PolarHBondContact O-N 3.41Å; Y408-Y410 HydrophobicContact CD1-CD1 4.06Å; Y408-Y410 AromaticContact CD1-CD2 3.86Å; Y408-Y410 HydrophobicContact CD1-CD2 3.86Å; Y408-Y410 AromaticContact CD1-CE1 4Å; Y408-Y410 HydrophobicContact CD1-CE1 4Å; Y408-Y410 AromaticContact CD1-CE2 3.82Å; Y408-Y410 HydrophobicContact CD1-CE2 3.82Å; Y408-Y410 AromaticContact CD1-CG 4Å; Y408-Y410 HydrophobicContact CD1-CG 4Å; Y408-Y410 AromaticContact CD1-CZ 3.91Å; Y408-Y410 HydrophobicContact CE1-CD1 4.08Å; Y408-Y410 HydrophobicContact CE1-CE1 4.23Å; Y408-Y410 HydrophobicContact CE1-CG 4.27Å; Y408-Y410 WeakPolarHBondContact O-CD2 3.35Å; Y408-Y410 PolarHBondContact O-N 2.95Å; Y408-E412 HydrophobicContact CE2-CB 4.42Å; Y408-E412 WeakPolarHBondContact CE2-OE2 3.43Å; Y408-E412 WeakPolarHBondContact OH-CB 3.35Å; Y408-V413 HydrophobicContact CE1-CG2 4.04Å
409	D	94.3	Very high	94.9	Very high	25 Å²	25	34 Å²	34	13%	0.134	16%	0.162	C	C	.	.			trans	-80.1	102.8	173.2	-179.1	7.1	0	0	0	110.7	R286 G411 E412	R286-D409 VanDerWaalsContact CD-OD1 3.22Å; R286-D409 WeakPolarHBondContact CD-OD1 3.44Å; R286-D409 IonicContact CZ-OD1 2.64Å; R286-D409 IonicContact CZ-OD2 3.03Å; R286-D409 IonicContact NE-OD1 3.71Å; R286-D409 IonicContact NH1-OD1 2.61Å; R286-D409 PolarHBondContact NH1-OD1 2.83Å; R286-D409 IonicContact NH1-OD2 3.72Å; R286-D409 PolarHBondContact NH1-OD2 3.38Å; D409-G411 PolarHBondContact O-N 2.91Å; D409-G411 WeakPolarHBondContact OD1-CA 3.24Å; D409-G411 PolarHBondContact OD1-N 3.31Å; D409-E412 HydrophobicContact CB-CG 4.31Å; D409-E412 VanDerWaalsContact O-CB 3.25Å; D409-E412 WeakPolarHBondContact O-CB 3.32Å; D409-E412 WeakPolarHBondContact O-CG 3.16Å; D409-E412 PolarHBondContact O-N 3.33Å
410	Y	94.9	Very high	94.9	Very high	2 Å²	2	37 Å²	37	1%	0.008	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.6	177.1	-76.5	-89.1	0	0	0	113.9	F287 N395 C399 I403 R404 Y405 Y408 E412 V413	F287-Y410 HydrophobicContact CB-CD2 3.81Å; F287-Y410 HydrophobicContact CB-CE2 4.24Å; F287-Y410 HydrophobicContact CB-CG 4.17Å; F287-Y410 HydrophobicContact CD2-CD1 4.01Å; F287-Y410 AromaticContact CD2-CD2 3.78Å; F287-Y410 HydrophobicContact CD2-CD2 3.78Å; F287-Y410 AromaticContact CD2-CE1 3.76Å; F287-Y410 HydrophobicContact CD2-CE1 3.76Å; F287-Y410 AromaticContact CD2-CE2 3.5Å; F287-Y410 HydrophobicContact CD2-CE2 3.5Å; F287-Y410 HydrophobicContact CD2-CG 4.02Å; F287-Y410 AromaticContact CD2-CZ 3.47Å; F287-Y410 VanDerWaalsContact CD2-CZ 3.47Å; F287-Y410 HydrophobicContact CE2-CE1 4.16Å; F287-Y410 HydrophobicContact CE2-CE2 4.3Å; F287-Y410 AromaticContact CE2-CZ 3.88Å; F287-Y410 HydrophobicContact CG-CD2 4.28Å; F287-Y410 HydrophobicContact CG-CE2 4.27Å; N395-Y410 HydrophobicContact CB-CE1 4.31Å; C399-Y410 HydrophobicContact CB-CD1 4.22Å; C399-Y410 HydrophobicContact CB-CE1 3.68Å; I403-Y410 PolarHBondContact O-OH 3.42Å; R404-Y410 WeakPolarHBondContact CA-OH 3.27Å; R404-Y410 HydrophobicContact CG-CE2 3.95Å; Y405-Y410 PolarHBondContact N-OH 3.37Å; Y405-Y410 VanDerWaalsContact N-OH 3.1Å; Y408-Y410 HydrophobicContact CD1-CD1 4.06Å; Y408-Y410 AromaticContact CD1-CD2 3.86Å; Y408-Y410 HydrophobicContact CD1-CD2 3.86Å; Y408-Y410 AromaticContact CD1-CE1 4Å; Y408-Y410 HydrophobicContact CD1-CE1 4Å; Y408-Y410 AromaticContact CD1-CE2 3.82Å; Y408-Y410 HydrophobicContact CD1-CE2 3.82Å; Y408-Y410 AromaticContact CD1-CG 4Å; Y408-Y410 HydrophobicContact CD1-CG 4Å; Y408-Y410 AromaticContact CD1-CZ 3.91Å; Y408-Y410 HydrophobicContact CE1-CD1 4.08Å; Y408-Y410 HydrophobicContact CE1-CE1 4.23Å; Y408-Y410 HydrophobicContact CE1-CG 4.27Å; Y408-Y410 WeakPolarHBondContact O-CD2 3.35Å; Y408-Y410 PolarHBondContact O-N 2.95Å; Y410-E412 PolarHBondContact O-N 2.97Å; Y410-V413 HydrophobicContact CD1-CG2 4.16Å; Y410-V413 WeakPolarHBondContact O-CB 3.23Å; Y410-V413 PolarHBondContact O-N 3.46Å
411	G	93.8	Very high	95.1	Very high	13 Å²	13	36.7 Å²	36.7	13%	0.134	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-28.9	165.1	0	0	0	0	0	113.3	D409 V413 N414 Q415	D409-G411 PolarHBondContact O-N 2.91Å; D409-G411 WeakPolarHBondContact OD1-CA 3.24Å; D409-G411 PolarHBondContact OD1-N 3.31Å; G411-V413 PolarHBondContact O-N 3.13Å; G411-N414 PolarHBondContact O-N 3.2Å; G411-Q415 WeakPolarHBondContact O-CG 3.23Å; G411-Q415 PolarHBondContact O-N 3.16Å
412	E	95.2	Very high	95.2	Very high	10 Å²	10	36.7 Å²	36.7	5%	0.047	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-33.3	175	-68.4	-178.6	-143.2	0	0	111.7	L268 R391 Y408 D409 Y410 N414 Q415 L416	L268-E412 HydrophobicContact CD1-CB 4.26Å; L268-E412 HydrophobicContact CD1-CG 3.99Å; L268-E412 HydrophobicContact CD2-CG 3.94Å; R391-E412 IonicContact NH2-OE1 3.4Å; R391-E412 IonicContact NH2-OE2 3.5Å; R391-E412 PolarHBondContact NH2-OE2 3.34Å; Y408-E412 HydrophobicContact CE2-CB 4.42Å; Y408-E412 WeakPolarHBondContact CE2-OE2 3.43Å; Y408-E412 WeakPolarHBondContact OH-CB 3.35Å; D409-E412 HydrophobicContact CB-CG 4.31Å; D409-E412 VanDerWaalsContact O-CB 3.25Å; D409-E412 WeakPolarHBondContact O-CB 3.32Å; D409-E412 WeakPolarHBondContact O-CG 3.16Å; D409-E412 PolarHBondContact O-N 3.33Å; Y410-E412 PolarHBondContact O-N 2.97Å; E412-N414 PolarHBondContact O-N 3.27Å; E412-Q415 PolarHBondContact O-N 2.83Å; E412-L416 WeakPolarHBondContact O-CB 3.47Å; E412-L416 WeakPolarHBondContact O-CG 3.49Å; E412-L416 PolarHBondContact O-N 2.84Å
413	V	96	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-48.8	179.2	176.8	0	0	0	0	110.6	E290 Y396 Y408 Y410 G411 Q415 L416 L417	E290-V413 HydrophobicContact CG-CB 4.5Å; E290-V413 HydrophobicContact CG-CG1 4.3Å; E290-V413 WeakPolarHBondContact OE1-CG1 3.36Å; Y396-V413 HydrophobicContact CD2-CG1 3.66Å; Y396-V413 HydrophobicContact CE2-CG1 4.48Å; Y396-V413 HydrophobicContact CG-CG1 3.95Å; Y408-V413 HydrophobicContact CE1-CG2 4.04Å; Y410-V413 HydrophobicContact CD1-CG2 4.16Å; Y410-V413 WeakPolarHBondContact O-CB 3.23Å; Y410-V413 PolarHBondContact O-N 3.46Å; G411-V413 PolarHBondContact O-N 3.13Å; V413-Q415 VanDerWaalsContact C-N 3.3Å; V413-Q415 PolarHBondContact O-N 3.47Å; V413-L416 PolarHBondContact O-N 3.08Å; V413-L417 HydrophobicContact CG1-CD2 4.19Å; V413-L417 WeakPolarHBondContact O-CB 3.34Å; V413-L417 PolarHBondContact O-N 3.21Å
414	N	92.8	Very high	95.3	Very high	82 Å²	82	37.2 Å²	37.2	44%	0.439	18%	0.178	S	C	.	.	H	α-helix	trans	-72.9	-23.6	-179.1	-71	-50.9	0	0	0	113.3	E290 G411 E412 K422	E290-N414 PolarHBondContact OE2-ND2 2.79Å; E290-N414 PolarHBondContact OE2-OD1 3.42Å; G411-N414 PolarHBondContact O-N 3.2Å; E412-N414 PolarHBondContact O-N 3.27Å; N414-K422 PolarHBondContact OD1-NZ 2.87Å
415	Q	94.6	Very high	95.4	Very high	76 Å²	76	36.3 Å²	36.3	36%	0.355	18%	0.175	S	C	.	.	H	α-helix	trans	-76.3	-33.9	175	-67.6	-179.3	66.3	0	0	112	R264 G411 E412 V413	R264-Q415 WeakPolarHBondContact CD-O 3.15Å; R264-Q415 PolarHBondContact NE-O 3.15Å; G411-Q415 WeakPolarHBondContact O-CG 3.23Å; G411-Q415 PolarHBondContact O-N 3.16Å; E412-Q415 PolarHBondContact O-N 2.83Å; V413-Q415 VanDerWaalsContact C-N 3.3Å; V413-Q415 PolarHBondContact O-N 3.47Å
416	L	97.4	Very high	95.4	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-102.6	-36.4	-171.4	-64.8	178.4	0	0	0	113.8	L261 R264 M265 L268 V388 L389 A392 E412 V413	L261-L416 HydrophobicContact CD1-CB 4.41Å; L261-L416 HydrophobicContact CD1-CD2 3.83Å; L261-L416 WeakPolarHBondContact CD1-O 3.4Å; R264-L416 HydrophobicContact CB-CD2 4.35Å; M265-L416 HydrophobicContact CB-CD2 4.48Å; M265-L416 HydrophobicContact CG-CD2 3.55Å; L268-L416 HydrophobicContact CD1-CD1 3.74Å; L268-L416 HydrophobicContact CD1-CD2 3.93Å; L268-L416 HydrophobicContact CD1-CG 3.79Å; V388-L416 HydrophobicContact CB-CD1 4.35Å; V388-L416 HydrophobicContact CG2-CD1 4.41Å; L389-L416 HydrophobicContact CD1-CB 4.04Å; A392-L416 HydrophobicContact CB-CB 4.32Å; A392-L416 HydrophobicContact CB-CD1 3.88Å; E412-L416 WeakPolarHBondContact O-CB 3.47Å; E412-L416 WeakPolarHBondContact O-CG 3.49Å; E412-L416 PolarHBondContact O-N 2.84Å; V413-L416 PolarHBondContact O-N 3.08Å
417	L	97.6	Very high	95.7	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	16%	0.164	C	C	.	.	S	Bend	trans	-99.6	112.4	-174.5	-74.2	61.7	0	0	0	110.3	L389 A392 I393 Y396 V413 L421 K422 I425	L389-L417 HydrophobicContact CD1-CD1 4.34Å; A392-L417 HydrophobicContact CB-CD1 3.47Å; A392-L417 VanDerWaalsContact CB-CD1 3.47Å; I393-L417 HydrophobicContact CG1-CD1 4.35Å; I393-L417 HydrophobicContact CG1-CD2 4.21Å; I393-L417 HydrophobicContact CG1-CG 4.31Å; Y396-L417 HydrophobicContact CD1-CD2 3.95Å; Y396-L417 HydrophobicContact CG-CD2 4.05Å; V413-L417 HydrophobicContact CG1-CD2 4.19Å; V413-L417 WeakPolarHBondContact O-CB 3.34Å; V413-L417 PolarHBondContact O-N 3.21Å; L417-L421 HydrophobicContact CB-CD2 4.23Å; L417-L421 HydrophobicContact CG-CD2 3.93Å; L417-K422 HydrophobicContact CB-CD 4.32Å; L417-K422 HydrophobicContact CB-CG 3.77Å; L417-K422 HydrophobicContact CD2-CG 4.44Å; L417-I425 HydrophobicContact CD2-CD1 4.2Å
418	E	94.8	Very high	96.1	Very high	69 Å²	69	27.1 Å²	27.1	32%	0.322	13%	0.129	S	C	.	.			trans	-62.7	153.8	173.1	64.8	173.9	-155.7	0	0	111.9	N420 L421 K422 F443 W444	E418-N420 VanDerWaalsContact C-N 3.29Å; E418-N420 PolarHBondContact O-N 3.12Å; E418-L421 HydrophobicContact CG-CB 3.65Å; E418-L421 WeakPolarHBondContact O-CB 3.32Å; E418-L421 PolarHBondContact O-N 3.4Å; E418-K422 PolarHBondContact O-N 3.03Å; E418-F443 WeakPolarHBondContact OE1-CA 3.08Å; E418-F443 WeakPolarHBondContact OE1-CB 3.12Å; E418-W444 PolarHBondContact OE1-N 3.48Å
419	R	95.2	Very high	96.3	Very high	182 Å²	182	26.9 Å²	26.9	69%	0.687	13%	0.129	S	C	*	.	H	α-helix	trans	-54.1	-42.4	-177.2	-174	179	178.2	-145.7	-0.5	113.5	L295 L421 K422 V423	L295-R419 HydrophobicContact CD2-CG 4.29Å; R419-L421 VanDerWaalsContact C-N 3.31Å; R419-L421 PolarHBondContact O-N 3.45Å; R419-K422 PolarHBondContact O-N 3.34Å; R419-V423 HydrophobicContact CG-CG2 4.46Å; R419-V423 VanDerWaalsContact O-CG2 3.26Å; R419-V423 WeakPolarHBondContact O-CG2 3.48Å; R419-V423 PolarHBondContact O-N 3.43Å
420	N	96.8	Very high	96.4	Very high	61 Å²	61	25.8 Å²	25.8	33%	0.326	12%	0.123	S	C	.	.	H	α-helix	trans	-66.1	-35	-179.6	-67.9	-31.2	0	0	0	112.1	E418 Y424 L442 F443	E418-N420 VanDerWaalsContact C-N 3.29Å; E418-N420 PolarHBondContact O-N 3.12Å; N420-Y424 WeakPolarHBondContact O-CB 3.2Å; N420-Y424 PolarHBondContact O-N 2.87Å; N420-L442 PolarHBondContact ND2-O 3.01Å; N420-F443 HydrophobicContact CB-CB 3.75Å
421	L	97.8	Very high	96.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.3	-45.1	174.3	175.9	64.1	0	0	0	110.6	L417 E418 R419 V423 Y424 I425 F443 W444 V455	L417-L421 HydrophobicContact CB-CD2 4.23Å; L417-L421 HydrophobicContact CG-CD2 3.93Å; E418-L421 HydrophobicContact CG-CB 3.65Å; E418-L421 WeakPolarHBondContact O-CB 3.32Å; E418-L421 PolarHBondContact O-N 3.4Å; R419-L421 VanDerWaalsContact C-N 3.31Å; R419-L421 PolarHBondContact O-N 3.45Å; L421-V423 PolarHBondContact O-N 2.94Å; L421-Y424 PolarHBondContact O-N 3.04Å; L421-I425 HydrophobicContact CD1-CD1 3.77Å; L421-I425 HydrophobicContact CD1-CG1 4.02Å; L421-I425 HydrophobicContact CD2-CD1 4.4Å; L421-I425 HydrophobicContact CG-CD1 3.74Å; L421-I425 HydrophobicContact CG-CG1 4.37Å; L421-I425 WeakPolarHBondContact O-CB 3.47Å; L421-I425 WeakPolarHBondContact O-CG1 3.26Å; L421-I425 PolarHBondContact O-N 2.92Å; L421-F443 HydrophobicContact CB-CB 4.26Å; L421-F443 HydrophobicContact CB-CD2 4.33Å; L421-F443 HydrophobicContact CD1-CD2 3.61Å; L421-F443 HydrophobicContact CD1-CE2 3.78Å; L421-F443 HydrophobicContact CD1-CG 4.35Å; L421-W444 HydrophobicContact CD2-CH2 4.43Å; L421-W444 HydrophobicContact CD2-CZ2 3.59Å; L421-V455 HydrophobicContact CD1-CG1 4.1Å
422	K	97.4	Very high	96.7	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.013	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-44.8	176	-60.3	177.8	74.4	-179.2	0	111.8	E290 E293 L295 Y396 N414 L417 E418 R419 I425 K426	E290-K422 WeakPolarHBondContact OE1-CE 3.3Å; E290-K422 IonicContact OE1-NZ 3.74Å; E290-K422 PolarHBondContact OE1-NZ 3.44Å; E290-K422 IonicContact OE2-NZ 3.35Å; E290-K422 PolarHBondContact OE2-NZ 2.93Å; E293-K422 IonicContact OE1-NZ 3.59Å; E293-K422 WeakPolarHBondContact OE2-CE 3.4Å; E293-K422 IonicContact OE2-NZ 2.82Å; E293-K422 PolarHBondContact OE2-NZ 3.21Å; L295-K422 HydrophobicContact CD1-CB 3.44Å; L295-K422 VanDerWaalsContact CD1-CB 3.44Å; L295-K422 HydrophobicContact CD1-CD 4.44Å; Y396-K422 HydrophobicContact CE1-CB 4.03Å; Y396-K422 HydrophobicContact CE1-CG 4.31Å; N414-K422 PolarHBondContact OD1-NZ 2.87Å; L417-K422 HydrophobicContact CB-CD 4.32Å; L417-K422 HydrophobicContact CB-CG 3.77Å; L417-K422 HydrophobicContact CD2-CG 4.44Å; E418-K422 PolarHBondContact O-N 3.03Å; R419-K422 PolarHBondContact O-N 3.34Å; K422-I425 PolarHBondContact O-N 3.34Å; K422-K426 WeakPolarHBondContact O-CB 3.4Å; K422-K426 PolarHBondContact O-N 3.3Å
423	V	96.6	Very high	96.6	Very high	12 Å²	12	29.6 Å²	29.6	7%	0.073	14%	0.136	C	C	.	.	H	α-helix	trans	-58.3	-49.6	174.2	169.1	0	0	0	0	110.7	L295 V297 R419 L421 T427 M439	L295-V423 HydrophobicContact CB-CG2 4.09Å; L295-V423 HydrophobicContact CD2-CG2 4.25Å; V297-V423 HydrophobicContact CG2-CG1 3.96Å; R419-V423 HydrophobicContact CG-CG2 4.46Å; R419-V423 VanDerWaalsContact O-CG2 3.26Å; R419-V423 WeakPolarHBondContact O-CG2 3.48Å; R419-V423 PolarHBondContact O-N 3.43Å; L421-V423 PolarHBondContact O-N 2.94Å; V423-T427 WeakPolarHBondContact O-CB 3.34Å; V423-T427 PolarHBondContact O-N 2.92Å; V423-T427 PolarHBondContact O-OG1 2.98Å; V423-M439 HydrophobicContact CG1-CE 3.51Å
424	Y	98.4	Very high	96.6	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-50.5	178.3	175.3	-97.1	0	0	0	111.9	G213 N420 L421 K426 T427 V428 T435 M439 Y440 F443 N456	G213-Y424 VanDerWaalsContact C-OH 3.25Å; G213-Y424 WeakPolarHBondContact CA-OH 3.11Å; G213-Y424 PolarHBondContact O-OH 3.01Å; N420-Y424 WeakPolarHBondContact O-CB 3.2Å; N420-Y424 PolarHBondContact O-N 2.87Å; L421-Y424 PolarHBondContact O-N 3.04Å; Y424-K426 PolarHBondContact O-N 3.24Å; Y424-T427 PolarHBondContact O-N 3.22Å; Y424-V428 HydrophobicContact CD1-CG2 4.3Å; Y424-V428 HydrophobicContact CD2-CG2 4.05Å; Y424-V428 HydrophobicContact CE1-CG2 3.96Å; Y424-V428 HydrophobicContact CE2-CG2 3.69Å; Y424-V428 HydrophobicContact CG-CG2 4.35Å; Y424-V428 WeakPolarHBondContact O-CG2 3.3Å; Y424-V428 PolarHBondContact O-N 3.13Å; Y424-T435 HydrophobicContact CE2-CG2 4.01Å; Y424-M439 HydrophobicContact CD2-CB 4.4Å; Y424-Y440 HydrophobicContact CE2-CD2 4.11Å; Y424-F443 HydrophobicContact CD1-CD1 4.01Å; Y424-F443 AromaticContact CD1-CE1 3.4Å; Y424-F443 HydrophobicContact CD1-CE1 3.4Å; Y424-F443 VanDerWaalsContact CD1-CE1 3.4Å; Y424-F443 HydrophobicContact CD1-CE2 4.43Å; Y424-F443 AromaticContact CD1-CZ 3.66Å; Y424-F443 HydrophobicContact CD1-CZ 3.66Å; Y424-F443 AromaticContact CD2-CD1 3.95Å; Y424-F443 HydrophobicContact CD2-CD1 3.95Å; Y424-F443 AromaticContact CD2-CE1 3.54Å; Y424-F443 HydrophobicContact CD2-CE1 3.54Å; Y424-F443 AromaticContact CE1-CE1 3.6Å; Y424-F443 HydrophobicContact CE1-CE1 3.6Å; Y424-F443 AromaticContact CE1-CZ 3.62Å; Y424-F443 HydrophobicContact CE1-CZ 3.62Å; Y424-F443 AromaticContact CE2-CE1 3.73Å; Y424-F443 HydrophobicContact CE2-CE1 3.73Å; Y424-F443 HydrophobicContact CE2-CZ 4.48Å; Y424-F443 AromaticContact CG-CD1 3.63Å; Y424-F443 HydrophobicContact CG-CD1 3.63Å; Y424-F443 AromaticContact CG-CE1 3.36Å; Y424-F443 HydrophobicContact CG-CE1 3.36Å; Y424-F443 HydrophobicContact CG-CZ 4.11Å; Y424-F443 AromaticContact CZ-CE1 3.74Å; Y424-N456 PolarHBondContact OH-ND2 2.87Å; Y424-N456 PolarHBondContact OH-OD1 3.04Å
425	I	98.4	Very high	96.8	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-56.8	-51.4	178.5	-73.9	170	0	0	0	110.8	I393 Y396 I397 L417 L421 K422 T427 V428 A429 V455 L459	I393-I425 HydrophobicContact CG1-CD1 4.36Å; I393-I425 HydrophobicContact CG2-CD1 4.08Å; Y396-I425 HydrophobicContact CD1-CB 4.41Å; Y396-I425 HydrophobicContact CD1-CD1 4.39Å; Y396-I425 HydrophobicContact CD1-CG2 3.77Å; Y396-I425 HydrophobicContact CE1-CB 4.15Å; Y396-I425 HydrophobicContact CE1-CG2 3.76Å; I397-I425 HydrophobicContact CD1-CG2 4.03Å; I397-I425 HydrophobicContact CG1-CG2 3.42Å; I397-I425 VanDerWaalsContact CG1-CG2 3.42Å; L417-I425 HydrophobicContact CD2-CD1 4.2Å; L421-I425 HydrophobicContact CD1-CD1 3.77Å; L421-I425 HydrophobicContact CD1-CG1 4.02Å; L421-I425 HydrophobicContact CD2-CD1 4.4Å; L421-I425 HydrophobicContact CG-CD1 3.74Å; L421-I425 HydrophobicContact CG-CG1 4.37Å; L421-I425 WeakPolarHBondContact O-CB 3.47Å; L421-I425 WeakPolarHBondContact O-CG1 3.26Å; L421-I425 PolarHBondContact O-N 2.92Å; K422-I425 PolarHBondContact O-N 3.34Å; I425-T427 VanDerWaalsContact C-N 3.3Å; I425-T427 PolarHBondContact O-N 2.97Å; I425-V428 PolarHBondContact O-N 3.11Å; I425-A429 VanDerWaalsContact O-CB 3.27Å; I425-A429 WeakPolarHBondContact O-CB 3.4Å; I425-A429 PolarHBondContact O-N 3.38Å; I425-V455 HydrophobicContact CD1-CG1 4.34Å; I425-V455 HydrophobicContact CG1-CG1 4.15Å; I425-L459 HydrophobicContact CB-CD1 4.14Å; I425-L459 HydrophobicContact CG1-CD1 4.25Å; I425-L459 HydrophobicContact CG2-CD1 3.91Å; I425-L459 WeakPolarHBondContact O-CD1 3.48Å
426	K	96.8	Very high	96.8	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.013	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-36.4	-178.8	-169.2	163.3	179.9	166.6	0	111.3	E293 L295 D325 V400 K422 Y424 C430	E293-K426 PolarHBondContact O-NZ 3Å; L295-K426 HydrophobicContact CB-CD 4.38Å; D325-K426 VanDerWaalsContact CG-NZ 3.28Å; D325-K426 IonicContact OD1-NZ 2.68Å; D325-K426 PolarHBondContact OD1-NZ 3.28Å; D325-K426 IonicContact OD2-NZ 3.36Å; D325-K426 PolarHBondContact OD2-NZ 2.93Å; D325-K426 VanDerWaalsContact OD2-NZ 3.1Å; V400-K426 HydrophobicContact CG1-CG 4.32Å; V400-K426 HydrophobicContact CG2-CD 4.29Å; V400-K426 HydrophobicContact CG2-CG 4.41Å; K422-K426 WeakPolarHBondContact O-CB 3.4Å; K422-K426 PolarHBondContact O-N 3.3Å; Y424-K426 PolarHBondContact O-N 3.24Å; K426-C430 WeakPolarHBondContact O-CB 3.22Å; K426-C430 PolarHBondContact O-N 3.27Å
427	T	97.4	Very high	96.7	Very high	14 Å²	14	36.5 Å²	36.5	9%	0.086	16%	0.163	C	C	.	.	H	α-helix	trans	-65.6	-51.9	173.2	-64	0	0	0	0	111.9	V423 Y424 I425 A429 C430 Y431 P432 K434 M439	V423-T427 WeakPolarHBondContact O-CB 3.34Å; V423-T427 PolarHBondContact O-N 2.92Å; V423-T427 PolarHBondContact O-OG1 2.98Å; Y424-T427 PolarHBondContact O-N 3.22Å; I425-T427 VanDerWaalsContact C-N 3.3Å; I425-T427 PolarHBondContact O-N 2.97Å; T427-A429 VanDerWaalsContact C-N 3.29Å; T427-A429 PolarHBondContact O-N 3.07Å; T427-C430 PolarHBondContact O-N 3.31Å; T427-Y431 CarbonylContact O-C 2.98Å; T427-Y431 WeakPolarHBondContact O-CA 3.42Å; T427-Y431 PolarHBondContact O-N 3.36Å; T427-P432 VanDerWaalsContact O-N 3.14Å; T427-K434 HydrophobicContact CG2-CB 4.25Å; T427-M439 HydrophobicContact CG2-CE 3.94Å; T427-M439 HydrophobicContact CG2-SD 4.27Å; T427-M439 WeakPolarHBondContact OG1-CE 3.49Å
428	V	98.6	Very high	96.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-33.5	-177.9	-179.9	0	0	0	0	111.8	S209 Y424 I425 P432 T435 L459	S209-V428 WeakPolarHBondContact CB-O 3.48Å; S209-V428 WeakPolarHBondContact O-CG1 3.43Å; S209-V428 PolarHBondContact OG-O 2.93Å; Y424-V428 HydrophobicContact CD1-CG2 4.3Å; Y424-V428 HydrophobicContact CD2-CG2 4.05Å; Y424-V428 HydrophobicContact CE1-CG2 3.96Å; Y424-V428 HydrophobicContact CE2-CG2 3.69Å; Y424-V428 HydrophobicContact CG-CG2 4.35Å; Y424-V428 WeakPolarHBondContact O-CG2 3.3Å; Y424-V428 PolarHBondContact O-N 3.13Å; I425-V428 PolarHBondContact O-N 3.11Å; V428-P432 WeakPolarHBondContact O-CB 3.45Å; V428-T435 HydrophobicContact CG2-CG2 3.97Å; V428-L459 HydrophobicContact CB-CD1 3.87Å; V428-L459 HydrophobicContact CB-CD2 4.29Å; V428-L459 HydrophobicContact CG1-CD1 4.07Å; V428-L459 HydrophobicContact CG1-CD2 3.68Å
429	A	97.9	Very high	96.7	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-76	-39.3	178.2	0	0	0	0	0	113.4	F401 I425 T427 L459 R463	F401-A429 HydrophobicContact CE2-CB 4.3Å; I425-A429 VanDerWaalsContact O-CB 3.27Å; I425-A429 WeakPolarHBondContact O-CB 3.4Å; I425-A429 PolarHBondContact O-N 3.38Å; T427-A429 VanDerWaalsContact C-N 3.29Å; T427-A429 PolarHBondContact O-N 3.07Å; A429-L459 HydrophobicContact CB-CD1 4.31Å; A429-L459 HydrophobicContact CB-CD2 4.43Å; A429-L459 HydrophobicContact CB-CG 4.37Å; A429-R463 WeakPolarHBondContact O-CD 3.25Å; A429-R463 PolarHBondContact O-NE 3.25Å
430	C	96.4	Very high	96.8	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-108	-31	-168.7	-59.1	0	0	0	0	114.7	Y323 V400 K426 T427	Y323-C430 HydrophobicContact CD1-CB 4.01Å; Y323-C430 HydrophobicContact CD2-CB 3.99Å; Y323-C430 WeakPolarHBondContact CD2-SG 3.49Å; Y323-C430 HydrophobicContact CG-CB 3.63Å; V400-C430 WeakPolarHBondContact CG1-SG 3.38Å; K426-C430 WeakPolarHBondContact O-CB 3.22Å; K426-C430 PolarHBondContact O-N 3.27Å; T427-C430 PolarHBondContact O-N 3.31Å
431	Y	96.5	Very high	96.8	Very high	39 Å²	39	35.4 Å²	35.4	15%	0.153	16%	0.158	C	C	.	.			trans	-141	56.2	-177.3	-54.3	-80.9	0	0	0	110.6	L296 Y323 T427 E433 K434	L296-Y431 HydrophobicContact CD1-CE2 4.16Å; L296-Y431 HydrophobicContact CD2-CD2 3.9Å; L296-Y431 HydrophobicContact CD2-CE2 3.69Å; Y323-Y431 AromaticContact CD1-CE2 3.9Å; Y323-Y431 HydrophobicContact CD1-CE2 3.9Å; Y323-Y431 HydrophobicContact CG-CE2 4.39Å; Y323-Y431 PolarHBondContact O-OH 2.88Å; T427-Y431 CarbonylContact O-C 2.98Å; T427-Y431 WeakPolarHBondContact O-CA 3.42Å; T427-Y431 PolarHBondContact O-N 3.36Å; Y431-E433 VanDerWaalsContact C-OE2 3.28Å; Y431-E433 WeakPolarHBondContact CA-OE1 3.45Å; Y431-E433 PolarHBondContact O-N 3.18Å; Y431-E433 VanDerWaalsContact O-N 3.11Å; Y431-K434 WeakPolarHBondContact O-CB 3.46Å; Y431-K434 PolarHBondContact O-N 3.28Å
432	P	97.6	Very high	96.7	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-55.2	-33.6	-172.8	22.5	-34.5	0	0	0	112.9	H123 F212 T427 V428 K434 T435	H123-P432 HydrophobicContact CB-CG 3.89Å; H123-P432 WeakPolarHBondContact ND1-CD 3.45Å; H123-P432 VanDerWaalsContact ND1-CG 3.34Å; H123-P432 WeakPolarHBondContact ND1-CG 3.47Å; F212-P432 HydrophobicContact CB-CB 3.9Å; F212-P432 WeakPolarHBondContact CB-O 3.37Å; F212-P432 HydrophobicContact CD2-CB 3.76Å; F212-P432 HydrophobicContact CD2-CG 4.36Å; F212-P432 HydrophobicContact CG-CB 4.13Å; F212-P432 VanDerWaalsContact CG-O 3.32Å; F212-P432 WeakPolarHBondContact CG-O 3.3Å; T427-P432 VanDerWaalsContact O-N 3.14Å; V428-P432 WeakPolarHBondContact O-CB 3.45Å; P432-K434 PolarHBondContact O-N 3.47Å; P432-T435 VanDerWaalsContact O-CB 3.23Å; P432-T435 WeakPolarHBondContact O-CB 3.44Å; P432-T435 PolarHBondContact O-N 3.04Å; P432-T435 PolarHBondContact O-OG1 2.97Å
433	E	94.2	Very high	96.6	Very high	66 Å²	66	37.8 Å²	37.8	31%	0.308	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-58.3	-19.1	175.9	68.9	-72.5	167	0	0	114.5	H123 F212 Y431	H123-E433 IonicContact ND1-OE2 3.33Å; F212-E433 HydrophobicContact CE1-CB 4.46Å; F212-E433 HydrophobicContact CE2-CB 4.43Å; F212-E433 HydrophobicContact CZ-CB 4.14Å; Y431-E433 VanDerWaalsContact C-OE2 3.28Å; Y431-E433 WeakPolarHBondContact CA-OE1 3.45Å; Y431-E433 PolarHBondContact O-N 3.18Å; Y431-E433 VanDerWaalsContact O-N 3.11Å
434	K	95.6	Very high	96.5	Very high	101 Å²	101	38 Å²	38	44%	0.439	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-93.6	3.5	176.7	-59.8	-168.2	174.2	-164.9	0	113.5	E305 T427 Y431 P432	E305-K434 IonicContact OE1-NZ 3.7Å; T427-K434 HydrophobicContact CG2-CB 4.25Å; Y431-K434 WeakPolarHBondContact O-CB 3.46Å; Y431-K434 PolarHBondContact O-N 3.28Å; P432-K434 PolarHBondContact O-N 3.47Å
435	T	96.3	Very high	96.3	Very high	17 Å²	17	45.6 Å²	45.6	10%	0.104	20%	0.199	C	C	.	.			trans	-68	133	179	-53.4	0	0	0	0	110.6	F47 F212 Y424 V428 P432	F47-T435 HydrophobicContact CE2-CG2 4.22Å; F47-T435 HydrophobicContact CZ-CG2 4.47Å; F212-T435 WeakPolarHBondContact O-CG2 3.09Å; Y424-T435 HydrophobicContact CE2-CG2 4.01Å; V428-T435 HydrophobicContact CG2-CG2 3.97Å; P432-T435 VanDerWaalsContact O-CB 3.23Å; P432-T435 WeakPolarHBondContact O-CB 3.44Å; P432-T435 PolarHBondContact O-N 3.04Å; P432-T435 PolarHBondContact O-OG1 2.97Å
436	T	96.2	Very high	96	Very high	53 Å²	53	49.2 Å²	49.2	33%	0.325	22%	0.216	S	C	.	.			trans	-126.3	155.4	179.5	67.1	0	0	0	0	112	R438 M439 Y440	T436-R438 PolarHBondContact O-N 3.29Å; T436-M439 PolarHBondContact O-N 2.87Å; T436-M439 VanDerWaalsContact O-N 3.08Å; T436-M439 WeakPolarHBondContact OG1-CG 3.43Å; T436-M439 PolarHBondContact OG1-N 3.12Å; T436-Y440 PolarHBondContact O-N 3.16Å
437	R	95.2	Very high	96	Very high	136 Å²	136	50.2 Å²	50.2	51%	0.513	22%	0.22	S	C	.	.	H	α-helix	trans	-56	-34.2	172.6	-170.6	172.2	-168	168	6	112.4	A46 F47 Y440 N441	A46-R437 PolarHBondContact O-NE 3.02Å; A46-R437 PolarHBondContact O-NH1 3.39Å; F47-R437 HydrophobicContact CD1-CB 3.77Å; F47-R437 HydrophobicContact CD1-CG 3.87Å; F47-R437 HydrophobicContact CE1-CB 3.73Å; F47-R437 HydrophobicContact CE1-CG 4.36Å; R437-Y440 PolarHBondContact O-N 3.44Å; R437-N441 WeakPolarHBondContact O-CB 3.3Å; R437-N441 VanDerWaalsContact O-CG 3.29Å; R437-N441 PolarHBondContact O-N 2.92Å
438	R	95.9	Very high	95.8	Very high	185 Å²	185	54.4 Å²	54.4	70%	0.698	24%	0.235	S	C	*	.	H	α-helix	trans	-63.3	-47.5	176.4	-176.8	179.1	177	-175.6	-0.6	111	T436 Y440 N441 L442	T436-R438 PolarHBondContact O-N 3.29Å; R438-Y440 VanDerWaalsContact C-N 3.33Å; R438-Y440 PolarHBondContact O-N 2.77Å; R438-N441 PolarHBondContact O-N 3.48Å; R438-L442 HydrophobicContact CG-CD1 3.86Å; R438-L442 HydrophobicContact CG-CG 4.3Å; R438-L442 WeakPolarHBondContact O-CB 3.35Å; R438-L442 WeakPolarHBondContact O-CG 3.31Å; R438-L442 PolarHBondContact O-N 3.36Å
439	M	96.1	Very high	95.7	Very high	35 Å²	35	56.4 Å²	56.4	17%	0.172	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-46.1	175.9	-68.2	171.9	93.9	0	0	110.8	V423 Y424 T427 T436 N441 L442 F443	V423-M439 HydrophobicContact CG1-CE 3.51Å; Y424-M439 HydrophobicContact CD2-CB 4.4Å; T427-M439 HydrophobicContact CG2-CE 3.94Å; T427-M439 HydrophobicContact CG2-SD 4.27Å; T427-M439 WeakPolarHBondContact OG1-CE 3.49Å; T436-M439 PolarHBondContact O-N 2.87Å; T436-M439 VanDerWaalsContact O-N 3.08Å; T436-M439 WeakPolarHBondContact OG1-CG 3.43Å; T436-M439 PolarHBondContact OG1-N 3.12Å; M439-N441 VanDerWaalsContact C-N 3.34Å; M439-N441 PolarHBondContact O-N 3.16Å; M439-L442 PolarHBondContact O-N 2.77Å; M439-F443 WeakPolarHBondContact O-CD1 3.36Å
440	Y	97.3	Very high	95.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-42.2	177.5	179.5	-87.8	0	0	0	113.2	F47 Y424 T436 R437 R438 F443 H449 K452	F47-Y440 HydrophobicContact CB-CD1 3.86Å; F47-Y440 HydrophobicContact CB-CD2 4.39Å; F47-Y440 HydrophobicContact CB-CE1 3.91Å; F47-Y440 HydrophobicContact CB-CE2 4.43Å; F47-Y440 HydrophobicContact CB-CG 4.11Å; F47-Y440 HydrophobicContact CD2-CD1 4.38Å; F47-Y440 AromaticContact CD2-CD2 3.73Å; F47-Y440 HydrophobicContact CD2-CD2 3.73Å; F47-Y440 HydrophobicContact CD2-CE2 4.31Å; F47-Y440 AromaticContact CD2-CG 3.77Å; F47-Y440 HydrophobicContact CD2-CG 3.77Å; F47-Y440 HydrophobicContact CE2-CD2 4.47Å; F47-Y440 HydrophobicContact CE2-CG 4.5Å; F47-Y440 HydrophobicContact CG-CD1 4.28Å; F47-Y440 HydrophobicContact CG-CD2 4.41Å; F47-Y440 HydrophobicContact CG-CG 4.1Å; Y424-Y440 HydrophobicContact CE2-CD2 4.11Å; T436-Y440 PolarHBondContact O-N 3.16Å; R437-Y440 PolarHBondContact O-N 3.44Å; R438-Y440 VanDerWaalsContact C-N 3.33Å; R438-Y440 PolarHBondContact O-N 2.77Å; Y440-F443 HydrophobicContact CD2-CE1 4.33Å; Y440-F443 WeakPolarHBondContact O-CD1 3.42Å; Y440-F443 WeakPolarHBondContact O-CE1 3.44Å; Y440-H449 AromaticContact CE1-CE1 3.81Å; Y440-H449 AromaticContact CE1-ND1 3.46Å; Y440-H449 WeakPolarHBondContact CE1-ND1 3.49Å; Y440-H449 AromaticContact CZ-ND1 3.64Å; Y440-H449 PolarHBondContact OH-ND1 3.07Å; Y440-K452 HydrophobicContact CD1-CD 4.43Å; Y440-K452 HydrophobicContact CD2-CD 4.47Å; Y440-K452 HydrophobicContact CE1-CD 3.83Å; Y440-K452 HydrophobicContact CE2-CB 3.8Å; Y440-K452 HydrophobicContact CE2-CD 3.88Å; Y440-K452 HydrophobicContact CE2-CG 4.48Å; Y440-K452 PolarHBondContact O-NZ 2.84Å
441	N	95.4	Very high	95.6	Very high	73 Å²	73	57.9 Å²	57.9	39%	0.39	25%	0.252	S	S	.	.	H	α-helix	trans	-76.9	-22.8	179.8	-71.3	-13.1	0	0	0	113.7	R437 R438 M439	R437-N441 WeakPolarHBondContact O-CB 3.3Å; R437-N441 VanDerWaalsContact O-CG 3.29Å; R437-N441 PolarHBondContact O-N 2.92Å; R438-N441 PolarHBondContact O-N 3.48Å; M439-N441 VanDerWaalsContact C-N 3.34Å; M439-N441 PolarHBondContact O-N 3.16Å
442	L	95.8	Very high	95.7	Very high	54 Å²	54	56.4 Å²	56.4	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-75.9	-33.2	-173	-85.8	171.2	0	0	0	113.7	N420 R438 M439 R445	N420-L442 PolarHBondContact ND2-O 3.01Å; R438-L442 HydrophobicContact CG-CD1 3.86Å; R438-L442 HydrophobicContact CG-CG 4.3Å; R438-L442 WeakPolarHBondContact O-CB 3.35Å; R438-L442 WeakPolarHBondContact O-CG 3.31Å; R438-L442 PolarHBondContact O-N 3.36Å; M439-L442 PolarHBondContact O-N 2.77Å; L442-R445 PolarHBondContact O-NE 2.96Å
443	F	95.7	Very high	95.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-89.6	149.8	177.8	83	-90.8	0	0	0	111.3	E418 N420 L421 Y424 M439 Y440 R445 K452	E418-F443 WeakPolarHBondContact OE1-CA 3.08Å; E418-F443 WeakPolarHBondContact OE1-CB 3.12Å; N420-F443 HydrophobicContact CB-CB 3.75Å; L421-F443 HydrophobicContact CB-CB 4.26Å; L421-F443 HydrophobicContact CB-CD2 4.33Å; L421-F443 HydrophobicContact CD1-CD2 3.61Å; L421-F443 HydrophobicContact CD1-CE2 3.78Å; L421-F443 HydrophobicContact CD1-CG 4.35Å; Y424-F443 HydrophobicContact CD1-CD1 4.01Å; Y424-F443 AromaticContact CD1-CE1 3.4Å; Y424-F443 HydrophobicContact CD1-CE1 3.4Å; Y424-F443 VanDerWaalsContact CD1-CE1 3.4Å; Y424-F443 HydrophobicContact CD1-CE2 4.43Å; Y424-F443 AromaticContact CD1-CZ 3.66Å; Y424-F443 HydrophobicContact CD1-CZ 3.66Å; Y424-F443 AromaticContact CD2-CD1 3.95Å; Y424-F443 HydrophobicContact CD2-CD1 3.95Å; Y424-F443 AromaticContact CD2-CE1 3.54Å; Y424-F443 HydrophobicContact CD2-CE1 3.54Å; Y424-F443 AromaticContact CE1-CE1 3.6Å; Y424-F443 HydrophobicContact CE1-CE1 3.6Å; Y424-F443 AromaticContact CE1-CZ 3.62Å; Y424-F443 HydrophobicContact CE1-CZ 3.62Å; Y424-F443 AromaticContact CE2-CE1 3.73Å; Y424-F443 HydrophobicContact CE2-CE1 3.73Å; Y424-F443 HydrophobicContact CE2-CZ 4.48Å; Y424-F443 AromaticContact CG-CD1 3.63Å; Y424-F443 HydrophobicContact CG-CD1 3.63Å; Y424-F443 AromaticContact CG-CE1 3.36Å; Y424-F443 HydrophobicContact CG-CE1 3.36Å; Y424-F443 HydrophobicContact CG-CZ 4.11Å; Y424-F443 AromaticContact CZ-CE1 3.74Å; M439-F443 WeakPolarHBondContact O-CD1 3.36Å; Y440-F443 HydrophobicContact CD2-CE1 4.33Å; Y440-F443 WeakPolarHBondContact O-CD1 3.42Å; Y440-F443 WeakPolarHBondContact O-CE1 3.44Å; F443-R445 VanDerWaalsContact C-N 3.31Å; F443-R445 PolarHBondContact O-N 3.36Å; F443-K452 HydrophobicContact CE1-CD 4.36Å; F443-K452 HydrophobicContact CE2-CB 4.45Å; F443-K452 HydrophobicContact CE2-CD 4.06Å; F443-K452 HydrophobicContact CE2-CG 3.81Å; F443-K452 HydrophobicContact CZ-CB 4.09Å; F443-K452 HydrophobicContact CZ-CD 3.78Å; F443-K452 HydrophobicContact CZ-CG 3.77Å; F443-K452 VanDerWaalsContact O-CE 3.23Å; F443-K452 WeakPolarHBondContact O-CE 3.36Å; F443-K452 PolarHBondContact O-NZ 2.99Å
444	W	95.4	Very high	96	Very high	17 Å²	17	54.2 Å²	54.2	6%	0.064	24%	0.236	C	C	.	.	S	Bend	trans	43.8	56	174.4	-77	4.5	0	0	0	112.6	L389 I393 E418 L421 H446 F447 K452 V455	L389-W444 HydrophobicContact CD1-CZ2 4.29Å; L389-W444 HydrophobicContact CD2-CH2 4.11Å; L389-W444 HydrophobicContact CD2-CZ2 3.99Å; L389-W444 HydrophobicContact CG-CZ2 4.44Å; I393-W444 HydrophobicContact CD1-CH2 4.03Å; I393-W444 HydrophobicContact CD1-CZ2 4.46Å; E418-W444 PolarHBondContact OE1-N 3.48Å; L421-W444 HydrophobicContact CD2-CH2 4.43Å; L421-W444 HydrophobicContact CD2-CZ2 3.59Å; W444-H446 PolarHBondContact O-N 3.01Å; W444-H446 VanDerWaalsContact O-N 3.09Å; W444-F447 HydrophobicContact CB-CB 3.88Å; W444-F447 HydrophobicContact CB-CD2 3.47Å; W444-F447 VanDerWaalsContact CB-CD2 3.47Å; W444-F447 HydrophobicContact CB-CE2 4.14Å; W444-F447 HydrophobicContact CB-CG 3.73Å; W444-F447 AromaticContact CD1-CE2 3.87Å; W444-F447 AromaticContact CD2-CD1 3.79Å; W444-F447 HydrophobicContact CD2-CD1 3.79Å; W444-F447 AromaticContact CD2-CD2 3.96Å; W444-F447 HydrophobicContact CD2-CD2 3.96Å; W444-F447 AromaticContact CD2-CE1 3.84Å; W444-F447 HydrophobicContact CD2-CE1 3.84Å; W444-F447 HydrophobicContact CD2-CE2 4.04Å; W444-F447 AromaticContact CD2-CG 3.84Å; W444-F447 HydrophobicContact CD2-CG 3.84Å; W444-F447 AromaticContact CD2-CZ 3.98Å; W444-F447 HydrophobicContact CD2-CZ 3.98Å; W444-F447 AromaticContact CE2-CE1 3.99Å; W444-F447 AromaticContact CE2-CZ 3.95Å; W444-F447 HydrophobicContact CE3-CB 4.17Å; W444-F447 AromaticContact CE3-CD1 3.47Å; W444-F447 HydrophobicContact CE3-CD1 3.47Å; W444-F447 VanDerWaalsContact CE3-CD1 3.47Å; W444-F447 HydrophobicContact CE3-CD2 4.36Å; W444-F447 AromaticContact CE3-CE1 3.82Å; W444-F447 HydrophobicContact CE3-CE1 3.82Å; W444-F447 AromaticContact CE3-CG 3.76Å; W444-F447 HydrophobicContact CE3-CG 3.76Å; W444-F447 HydrophobicContact CE3-CZ 4.44Å; W444-F447 HydrophobicContact CG-CB 4.49Å; W444-F447 HydrophobicContact CG-CD1 4.3Å; W444-F447 AromaticContact CG-CD2 3.59Å; W444-F447 HydrophobicContact CG-CD2 3.59Å; W444-F447 HydrophobicContact CG-CE1 4.44Å; W444-F447 AromaticContact CG-CE2 3.79Å; W444-F447 HydrophobicContact CG-CE2 3.79Å; W444-F447 AromaticContact CG-CG 3.88Å; W444-F447 HydrophobicContact CG-CG 3.88Å; W444-F447 HydrophobicContact CG-CZ 4.21Å; W444-F447 HydrophobicContact CH2-CE1 4.19Å; W444-F447 HydrophobicContact CZ2-CE1 4.2Å; W444-F447 HydrophobicContact CZ2-CZ 4.42Å; W444-F447 AromaticContact CZ3-CD1 3.86Å; W444-F447 HydrophobicContact CZ3-CD1 3.86Å; W444-F447 AromaticContact CZ3-CE1 3.99Å; W444-F447 HydrophobicContact CZ3-CE1 3.99Å; W444-F447 PolarHBondContact O-N 2.94Å; W444-F447 VanDerWaalsContact O-N 3.13Å; W444-K452 VanDerWaalsContact O-CE 3.26Å; W444-K452 WeakPolarHBondContact O-CE 3.1Å; W444-V455 HydrophobicContact CE3-CG2 4.04Å; W444-V455 HydrophobicContact CH2-CG2 3.68Å; W444-V455 HydrophobicContact CZ3-CG2 3.28Å
445	R	93.4	Very high	96.1	Very high	161 Å²	161	49.5 Å²	49.5	61%	0.608	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.2	-172.9	-63.1	178.4	-174.7	174	0	113.6	L442 F443	L442-R445 PolarHBondContact O-NE 2.96Å; F443-R445 VanDerWaalsContact C-N 3.31Å; F443-R445 PolarHBondContact O-N 3.36Å
446	H	92.8	Very high	96.3	Very high	77 Å²	77	48.7 Å²	48.7	36%	0.356	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-0	-176.2	-54.5	-50.3	0	0	0	113.3	S254 V258 A379 W444	S254-H446 VanDerWaalsContact CB-CD2 3.42Å; S254-H446 WeakPolarHBondContact CB-CD2 3.36Å; S254-H446 WeakPolarHBondContact CB-CE1 3.4Å; S254-H446 WeakPolarHBondContact CB-ND1 3.2Å; S254-H446 WeakPolarHBondContact CB-NE2 3.37Å; V258-H446 HydrophobicContact CG2-CB 4.14Å; A379-H446 WeakPolarHBondContact CB-O 3.4Å; W444-H446 PolarHBondContact O-N 3.01Å; W444-H446 VanDerWaalsContact O-N 3.09Å
447	F	95.5	Very high	96.4	Very high	24 Å²	24	46.2 Å²	46.2	11%	0.105	20%	0.196	C	C	.	.	S	Bend	trans	-88.9	155.4	175.8	-70.2	-118.1	0	0	0	110.2	V258 L261 I378 A379 W444 E451	V258-F447 HydrophobicContact CG2-CE2 4.07Å; L261-F447 HydrophobicContact CD2-CZ 4.01Å; I378-F447 HydrophobicContact CD1-CE1 4.16Å; I378-F447 HydrophobicContact CD1-CZ 4.11Å; I378-F447 HydrophobicContact CG1-CD1 4.47Å; I378-F447 HydrophobicContact CG1-CE1 3.47Å; I378-F447 VanDerWaalsContact CG1-CE1 3.47Å; I378-F447 HydrophobicContact CG1-CZ 3.76Å; A379-F447 HydrophobicContact CB-CD1 4.39Å; A379-F447 HydrophobicContact CB-CD2 4.33Å; A379-F447 HydrophobicContact CB-CG 4.21Å; W444-F447 HydrophobicContact CB-CB 3.88Å; W444-F447 HydrophobicContact CB-CD2 3.47Å; W444-F447 VanDerWaalsContact CB-CD2 3.47Å; W444-F447 HydrophobicContact CB-CE2 4.14Å; W444-F447 HydrophobicContact CB-CG 3.73Å; W444-F447 AromaticContact CD1-CE2 3.87Å; W444-F447 AromaticContact CD2-CD1 3.79Å; W444-F447 HydrophobicContact CD2-CD1 3.79Å; W444-F447 AromaticContact CD2-CD2 3.96Å; W444-F447 HydrophobicContact CD2-CD2 3.96Å; W444-F447 AromaticContact CD2-CE1 3.84Å; W444-F447 HydrophobicContact CD2-CE1 3.84Å; W444-F447 HydrophobicContact CD2-CE2 4.04Å; W444-F447 AromaticContact CD2-CG 3.84Å; W444-F447 HydrophobicContact CD2-CG 3.84Å; W444-F447 AromaticContact CD2-CZ 3.98Å; W444-F447 HydrophobicContact CD2-CZ 3.98Å; W444-F447 AromaticContact CE2-CE1 3.99Å; W444-F447 AromaticContact CE2-CZ 3.95Å; W444-F447 HydrophobicContact CE3-CB 4.17Å; W444-F447 AromaticContact CE3-CD1 3.47Å; W444-F447 HydrophobicContact CE3-CD1 3.47Å; W444-F447 VanDerWaalsContact CE3-CD1 3.47Å; W444-F447 HydrophobicContact CE3-CD2 4.36Å; W444-F447 AromaticContact CE3-CE1 3.82Å; W444-F447 HydrophobicContact CE3-CE1 3.82Å; W444-F447 AromaticContact CE3-CG 3.76Å; W444-F447 HydrophobicContact CE3-CG 3.76Å; W444-F447 HydrophobicContact CE3-CZ 4.44Å; W444-F447 HydrophobicContact CG-CB 4.49Å; W444-F447 HydrophobicContact CG-CD1 4.3Å; W444-F447 AromaticContact CG-CD2 3.59Å; W444-F447 HydrophobicContact CG-CD2 3.59Å; W444-F447 HydrophobicContact CG-CE1 4.44Å; W444-F447 AromaticContact CG-CE2 3.79Å; W444-F447 HydrophobicContact CG-CE2 3.79Å; W444-F447 AromaticContact CG-CG 3.88Å; W444-F447 HydrophobicContact CG-CG 3.88Å; W444-F447 HydrophobicContact CG-CZ 4.21Å; W444-F447 HydrophobicContact CH2-CE1 4.19Å; W444-F447 HydrophobicContact CZ2-CE1 4.2Å; W444-F447 HydrophobicContact CZ2-CZ 4.42Å; W444-F447 AromaticContact CZ3-CD1 3.86Å; W444-F447 HydrophobicContact CZ3-CD1 3.86Å; W444-F447 AromaticContact CZ3-CE1 3.99Å; W444-F447 HydrophobicContact CZ3-CE1 3.99Å; W444-F447 PolarHBondContact O-N 2.94Å; W444-F447 VanDerWaalsContact O-N 3.13Å; F447-E451 HydrophobicContact CB-CB 4.36Å; F447-E451 HydrophobicContact CD1-CB 4.29Å
448	R	94.7	Very high	96.6	Very high	102 Å²	102	39.8 Å²	39.8	39%	0.385	17%	0.172	S	C	.	.			trans	-71.2	157.9	177.7	-65.4	173.4	-67.9	-175.1	1.3	111.1	T377 A379 S450 E451 K452	T377-R448 PolarHBondContact OG1-NH2 3.23Å; A379-R448 PolarHBondContact O-NE 3.39Å; R448-S450 VanDerWaalsContact C-N 3.27Å; R448-S450 PolarHBondContact O-N 3.14Å; R448-E451 HydrophobicContact CB-CG 4.41Å; R448-E451 IonicContact CZ-OE1 3.99Å; R448-E451 PolarHBondContact N-OE2 2.9Å; R448-E451 IonicContact NE-OE1 2.7Å; R448-E451 IonicContact NE-OE2 2.66Å; R448-E451 IonicContact NH2-OE1 3.95Å; R448-E451 PolarHBondContact NH2-OE1 3.43Å; R448-E451 VanDerWaalsContact NH2-OE1 3.07Å; R448-E451 PolarHBondContact O-N 3.23Å; R448-E451 VanDerWaalsContact O-N 3.16Å; R448-K452 PolarHBondContact O-N 3.31Å
449	H	95.6	Very high	96.7	Very high	42 Å²	42	31 Å²	31	19%	0.194	14%	0.138	C	C	.	.	H	α-helix	trans	-65.7	-34.2	177.2	-69.1	-83.4	0	0	0	111.7	I48 E52 Y440 E451 K452 V453	I48-H449 HydrophobicContact CG1-CB 4.25Å; I48-H449 HydrophobicContact CG2-CB 3.68Å; E52-H449 WeakPolarHBondContact OE1-CB 3.45Å; E52-H449 IonicContact OE1-CD2 2.69Å; E52-H449 IonicContact OE1-CG 3.63Å; E52-H449 PolarHBondContact OE1-N 3.01Å; E52-H449 IonicContact OE2-CD2 3.14Å; E52-H449 PolarHBondContact OE2-CD2 3.26Å; E52-H449 IonicContact OE2-CG 3.56Å; Y440-H449 AromaticContact CE1-CE1 3.81Å; Y440-H449 AromaticContact CE1-ND1 3.46Å; Y440-H449 WeakPolarHBondContact CE1-ND1 3.49Å; Y440-H449 AromaticContact CZ-ND1 3.64Å; Y440-H449 PolarHBondContact OH-ND1 3.07Å; H449-E451 VanDerWaalsContact C-N 3.29Å; H449-E451 PolarHBondContact O-N 3.03Å; H449-K452 WeakPolarHBondContact O-CA 3.46Å; H449-K452 WeakPolarHBondContact O-CB 3.38Å; H449-K452 PolarHBondContact O-N 3.24Å; H449-V453 WeakPolarHBondContact O-CG2 3.47Å; H449-V453 PolarHBondContact O-N 2.8Å
450	S	95.4	Very high	96.8	Very high	17 Å²	17	29.4 Å²	29.4	12%	0.119	13%	0.131	C	C	.	.	H	α-helix	trans	-56.6	-40.7	171.9	58.4	0	0	0	0	112.2	H86 R448 K452 V453 H454	H86-S450 PolarHBondContact CE1-O 3.25Å; H86-S450 PolarHBondContact NE2-O 3.23Å; R448-S450 VanDerWaalsContact C-N 3.27Å; R448-S450 PolarHBondContact O-N 3.14Å; S450-K452 VanDerWaalsContact C-N 3.31Å; S450-K452 PolarHBondContact O-N 2.9Å; S450-V453 PolarHBondContact O-N 3.02Å; S450-V453 VanDerWaalsContact O-N 3.15Å; S450-H454 PolarHBondContact O-N 2.99Å
451	E	97.9	Very high	96.9	Very high	16 Å²	16	29.4 Å²	29.4	8%	0.075	13%	0.131	C	C	.	.	H	α-helix	trans	-67.3	-32.2	176.5	-66.1	167.9	139.4	0	0	112.1	A379 F447 R448 H449 H454 V455	A379-E451 WeakPolarHBondContact CA-OE2 3.4Å; A379-E451 PolarHBondContact N-OE1 2.83Å; A379-E451 PolarHBondContact N-OE2 3.06Å; F447-E451 HydrophobicContact CB-CB 4.36Å; F447-E451 HydrophobicContact CD1-CB 4.29Å; R448-E451 HydrophobicContact CB-CG 4.41Å; R448-E451 IonicContact CZ-OE1 3.99Å; R448-E451 PolarHBondContact N-OE2 2.9Å; R448-E451 IonicContact NE-OE1 2.7Å; R448-E451 IonicContact NE-OE2 2.66Å; R448-E451 IonicContact NH2-OE1 3.95Å; R448-E451 PolarHBondContact NH2-OE1 3.43Å; R448-E451 VanDerWaalsContact NH2-OE1 3.07Å; R448-E451 PolarHBondContact O-N 3.23Å; R448-E451 VanDerWaalsContact O-N 3.16Å; H449-E451 VanDerWaalsContact C-N 3.29Å; H449-E451 PolarHBondContact O-N 3.03Å; E451-H454 WeakPolarHBondContact O-CB 3.33Å; E451-H454 PolarHBondContact O-N 2.63Å; E451-V455 WeakPolarHBondContact O-CG2 3.24Å; E451-V455 PolarHBondContact O-N 2.8Å
452	K	98.5	Very high	97.1	Very high	9 Å²	9	26 Å²	26	4%	0.039	11%	0.112	C	C	.	.	H	α-helix	trans	-70.7	-34.5	171.8	-63.9	-173.4	171.6	-172.9	0	112.5	Y440 F443 W444 R448 H449 S450 V455 N456	Y440-K452 HydrophobicContact CD1-CD 4.43Å; Y440-K452 HydrophobicContact CD2-CD 4.47Å; Y440-K452 HydrophobicContact CE1-CD 3.83Å; Y440-K452 HydrophobicContact CE2-CB 3.8Å; Y440-K452 HydrophobicContact CE2-CD 3.88Å; Y440-K452 HydrophobicContact CE2-CG 4.48Å; Y440-K452 PolarHBondContact O-NZ 2.84Å; F443-K452 HydrophobicContact CE1-CD 4.36Å; F443-K452 HydrophobicContact CE2-CB 4.45Å; F443-K452 HydrophobicContact CE2-CD 4.06Å; F443-K452 HydrophobicContact CE2-CG 3.81Å; F443-K452 HydrophobicContact CZ-CB 4.09Å; F443-K452 HydrophobicContact CZ-CD 3.78Å; F443-K452 HydrophobicContact CZ-CG 3.77Å; F443-K452 VanDerWaalsContact O-CE 3.23Å; F443-K452 WeakPolarHBondContact O-CE 3.36Å; F443-K452 PolarHBondContact O-NZ 2.99Å; W444-K452 VanDerWaalsContact O-CE 3.26Å; W444-K452 WeakPolarHBondContact O-CE 3.1Å; R448-K452 PolarHBondContact O-N 3.31Å; H449-K452 WeakPolarHBondContact O-CA 3.46Å; H449-K452 WeakPolarHBondContact O-CB 3.38Å; H449-K452 PolarHBondContact O-N 3.24Å; S450-K452 VanDerWaalsContact C-N 3.31Å; S450-K452 PolarHBondContact O-N 2.9Å; K452-V455 PolarHBondContact O-N 3.04Å; K452-N456 PolarHBondContact O-N 2.98Å; K452-N456 PolarHBondContact O-ND2 3.24Å
453	V	98.4	Very high	97.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.6	-42.6	171	177	0	0	0	0	109.7	I48 V82 L85 F210 H449 S450 V455 N456 L457	I48-V453 HydrophobicContact CD1-CG2 3.59Å; V82-V453 HydrophobicContact CG1-CG1 4.18Å; V82-V453 HydrophobicContact CG1-CG2 3.98Å; L85-V453 HydrophobicContact CD1-CB 4.46Å; L85-V453 HydrophobicContact CD1-CG2 3.95Å; F210-V453 HydrophobicContact CE2-CG1 3.98Å; F210-V453 HydrophobicContact CZ-CG1 4.06Å; H449-V453 WeakPolarHBondContact O-CG2 3.47Å; H449-V453 PolarHBondContact O-N 2.8Å; S450-V453 PolarHBondContact O-N 3.02Å; S450-V453 VanDerWaalsContact O-N 3.15Å; V453-V455 VanDerWaalsContact C-N 3.32Å; V453-V455 PolarHBondContact O-N 3.36Å; V453-N456 CarbonylContact O-C 3.53Å; V453-N456 WeakPolarHBondContact O-CA 3.48Å; V453-N456 VanDerWaalsContact O-CB 3.3Å; V453-N456 WeakPolarHBondContact O-CB 3.33Å; V453-N456 PolarHBondContact O-N 3.07Å; V453-L457 WeakPolarHBondContact O-CG 3.49Å; V453-L457 PolarHBondContact O-N 3.07Å
454	H	98.6	Very high	97.3	Very high	19 Å²	19	23.7 Å²	23.7	9%	0.088	10%	0.1	C	C	.	.	H	α-helix	trans	-57.4	-41	174.8	-167.4	178.8	0	0	0	112.6	H86 L373 S450 E451 N456 L457 L458	H86-H454 PolarHBondContact NE2-N 3.42Å; L373-H454 PolarHBondContact O-CE1 3.26Å; L373-H454 PolarHBondContact O-NE2 2.86Å; S450-H454 PolarHBondContact O-N 2.99Å; E451-H454 WeakPolarHBondContact O-CB 3.33Å; E451-H454 PolarHBondContact O-N 2.63Å; H454-N456 VanDerWaalsContact C-N 3.27Å; H454-N456 PolarHBondContact O-N 2.94Å; H454-L457 WeakPolarHBondContact O-CB 3.23Å; H454-L457 PolarHBondContact O-N 3.1Å; H454-L457 VanDerWaalsContact O-N 3.1Å; H454-L458 PolarHBondContact O-N 3.07Å
455	V	98.8	Very high	97.5	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-58.1	-40.3	171.2	173.4	0	0	0	0	111.6	I393 L421 I425 W444 E451 K452 V453 L457 L458 L459	I393-V455 HydrophobicContact CD1-CG2 4.16Å; L421-V455 HydrophobicContact CD1-CG1 4.1Å; I425-V455 HydrophobicContact CD1-CG1 4.34Å; I425-V455 HydrophobicContact CG1-CG1 4.15Å; W444-V455 HydrophobicContact CE3-CG2 4.04Å; W444-V455 HydrophobicContact CH2-CG2 3.68Å; W444-V455 HydrophobicContact CZ3-CG2 3.28Å; E451-V455 WeakPolarHBondContact O-CG2 3.24Å; E451-V455 PolarHBondContact O-N 2.8Å; K452-V455 PolarHBondContact O-N 3.04Å; V453-V455 VanDerWaalsContact C-N 3.32Å; V453-V455 PolarHBondContact O-N 3.36Å; V455-L457 VanDerWaalsContact C-N 3.32Å; V455-L457 PolarHBondContact O-N 2.79Å; V455-L458 PolarHBondContact O-N 3.33Å; V455-L459 VanDerWaalsContact O-CB 3.23Å; V455-L459 WeakPolarHBondContact O-CB 3.47Å; V455-L459 PolarHBondContact O-N 3.39Å
456	N	98.9	Very high	97.8	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66.7	-32.3	176.7	-77.3	-87.3	0	0	0	112.5	F210 G213 Y424 K452 V453 H454 L459 L460	F210-N456 HydrophobicContact CD2-CB 3.87Å; F210-N456 HydrophobicContact CE2-CB 4.16Å; G213-N456 WeakPolarHBondContact CA-OD1 3.1Å; Y424-N456 PolarHBondContact OH-ND2 2.87Å; Y424-N456 PolarHBondContact OH-OD1 3.04Å; K452-N456 PolarHBondContact O-N 2.98Å; K452-N456 PolarHBondContact O-ND2 3.24Å; V453-N456 CarbonylContact O-C 3.53Å; V453-N456 WeakPolarHBondContact O-CA 3.48Å; V453-N456 VanDerWaalsContact O-CB 3.3Å; V453-N456 WeakPolarHBondContact O-CB 3.33Å; V453-N456 PolarHBondContact O-N 3.07Å; H454-N456 VanDerWaalsContact C-N 3.27Å; H454-N456 PolarHBondContact O-N 2.94Å; N456-L459 PolarHBondContact O-N 3.07Å; N456-L460 WeakPolarHBondContact O-CB 3.29Å; N456-L460 WeakPolarHBondContact O-CD2 3.41Å; N456-L460 PolarHBondContact O-N 3.23Å
457	L	98.9	Very high	98	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.4	-49.6	173.9	-56.9	-173.8	0	0	0	111.5	H86 Y89 F210 L373 V453 H454 V455 L459 L460 E461	H86-L457 HydrophobicContact CB-CD1 3.76Å; Y89-L457 HydrophobicContact CD1-CD1 3.62Å; Y89-L457 HydrophobicContact CD1-CD2 3.68Å; Y89-L457 HydrophobicContact CD1-CG 4.2Å; Y89-L457 HydrophobicContact CD2-CD1 4.33Å; Y89-L457 HydrophobicContact CE1-CD1 4.25Å; Y89-L457 HydrophobicContact CE1-CD2 3.42Å; Y89-L457 VanDerWaalsContact CE1-CD2 3.42Å; Y89-L457 HydrophobicContact CE1-CG 4.33Å; Y89-L457 HydrophobicContact CG-CD1 3.67Å; Y89-L457 HydrophobicContact CG-CD2 4.35Å; Y89-L457 HydrophobicContact CG-CG 4.45Å; F210-L457 HydrophobicContact CD2-CD2 4.12Å; F210-L457 HydrophobicContact CE2-CD2 3.57Å; F210-L457 HydrophobicContact CZ-CD2 4.4Å; L373-L457 HydrophobicContact CD2-CD1 4.13Å; V453-L457 WeakPolarHBondContact O-CG 3.49Å; V453-L457 PolarHBondContact O-N 3.07Å; H454-L457 WeakPolarHBondContact O-CB 3.23Å; H454-L457 PolarHBondContact O-N 3.1Å; H454-L457 VanDerWaalsContact O-N 3.1Å; V455-L457 VanDerWaalsContact C-N 3.32Å; V455-L457 PolarHBondContact O-N 2.79Å; L457-L459 PolarHBondContact O-N 3.24Å; L457-L460 HydrophobicContact CD2-CD2 4.06Å; L457-L460 PolarHBondContact O-N 3.21Å; L457-E461 WeakPolarHBondContact O-CG 3.46Å; L457-E461 PolarHBondContact O-N 3.11Å; L457-E461 VanDerWaalsContact O-N 3.17Å
458	L	98.9	Very high	98.2	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.01	5%	0.052	C	C	.	.	H	α-helix	trans	-57.9	-42.1	174	-68.5	169	0	0	0	111.2	A370 R390 I393 W394 H454 V455 A462	A370-L458 VanDerWaalsContact O-CD2 3.31Å; A370-L458 WeakPolarHBondContact O-CD2 3.34Å; R390-L458 HydrophobicContact CB-CD1 4.07Å; R390-L458 HydrophobicContact CG-CD1 3.9Å; I393-L458 HydrophobicContact CB-CD1 4.46Å; I393-L458 HydrophobicContact CD1-CD1 4.32Å; I393-L458 HydrophobicContact CG2-CB 4.06Å; I393-L458 HydrophobicContact CG2-CD1 4.23Å; W394-L458 HydrophobicContact CE3-CD2 4.24Å; H454-L458 PolarHBondContact O-N 3.07Å; V455-L458 PolarHBondContact O-N 3.33Å; L458-A462 VanDerWaalsContact O-CB 3.23Å; L458-A462 WeakPolarHBondContact O-CB 3.45Å; L458-A462 PolarHBondContact O-N 3.12Å
459	L	98.7	Very high	98.4	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-63.3	-49.7	-179.2	178.9	149.9	0	0	0	113.5	I397 I425 V428 A429 V455 N456 L457 E461 R463	I397-L459 VanDerWaalsContact CD1-CA 3.49Å; I397-L459 HydrophobicContact CD1-CB 3.9Å; I397-L459 HydrophobicContact CD1-CG 4.17Å; I425-L459 HydrophobicContact CB-CD1 4.14Å; I425-L459 HydrophobicContact CG1-CD1 4.25Å; I425-L459 HydrophobicContact CG2-CD1 3.91Å; I425-L459 WeakPolarHBondContact O-CD1 3.48Å; V428-L459 HydrophobicContact CB-CD1 3.87Å; V428-L459 HydrophobicContact CB-CD2 4.29Å; V428-L459 HydrophobicContact CG1-CD1 4.07Å; V428-L459 HydrophobicContact CG1-CD2 3.68Å; A429-L459 HydrophobicContact CB-CD1 4.31Å; A429-L459 HydrophobicContact CB-CD2 4.43Å; A429-L459 HydrophobicContact CB-CG 4.37Å; V455-L459 VanDerWaalsContact O-CB 3.23Å; V455-L459 WeakPolarHBondContact O-CB 3.47Å; V455-L459 PolarHBondContact O-N 3.39Å; N456-L459 PolarHBondContact O-N 3.07Å; L457-L459 PolarHBondContact O-N 3.24Å; L459-E461 VanDerWaalsContact C-N 3.3Å; L459-E461 PolarHBondContact O-N 3.11Å; L459-R463 WeakPolarHBondContact O-CB 3.33Å; L459-R463 PolarHBondContact O-N 2.88Å
460	L	98.6	Very high	98.5	Very high	2 Å²	2	5.1 Å²	5.1	1%	0.01	3%	0.027	C	C	.	.	H	α-helix	trans	-67.7	-37.3	-175.5	84.4	87.5	0	0	0	110.3	S206 F210 N456 L457 M464	S206-L460 VanDerWaalsContact CB-O 3.31Å; S206-L460 WeakPolarHBondContact CB-O 3.26Å; F210-L460 HydrophobicContact CB-CD2 3.95Å; F210-L460 HydrophobicContact CD2-CD2 3.63Å; F210-L460 HydrophobicContact CE2-CD2 4.49Å; F210-L460 HydrophobicContact CG-CD2 4.07Å; N456-L460 WeakPolarHBondContact O-CB 3.29Å; N456-L460 WeakPolarHBondContact O-CD2 3.41Å; N456-L460 PolarHBondContact O-N 3.23Å; L457-L460 HydrophobicContact CD2-CD2 4.06Å; L457-L460 PolarHBondContact O-N 3.21Å; L460-M464 VanDerWaalsContact O-CB 3.29Å; L460-M464 WeakPolarHBondContact O-CB 3.42Å; L460-M464 PolarHBondContact O-N 2.71Å
461	E	98.9	Very high	98.7	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-72.6	-46	179.1	-68.2	-50.4	151.2	0	0	112.9	Y89 K366 F367 A370 W394 L457 L459 R463 M464 Q465	Y89-E461 HydrophobicContact CE2-CG 4.01Å; Y89-E461 WeakPolarHBondContact CE2-OE1 3.43Å; Y89-E461 PolarHBondContact OH-OE1 2.55Å; K366-E461 WeakPolarHBondContact CD-OE1 3.41Å; K366-E461 VanDerWaalsContact CE-OE1 3.25Å; K366-E461 WeakPolarHBondContact CE-OE1 3.47Å; K366-E461 WeakPolarHBondContact CE-OE2 3.47Å; K366-E461 IonicContact NZ-OE1 2.83Å; K366-E461 PolarHBondContact NZ-OE1 3.12Å; K366-E461 IonicContact NZ-OE2 2.65Å; K366-E461 PolarHBondContact NZ-OE2 3.25Å; F367-E461 HydrophobicContact CD1-CB 4.14Å; F367-E461 WeakPolarHBondContact CD1-OE2 3.43Å; F367-E461 WeakPolarHBondContact CE1-OE2 3.24Å; A370-E461 HydrophobicContact CB-CB 4.08Å; A370-E461 HydrophobicContact CB-CG 3.48Å; A370-E461 VanDerWaalsContact CB-CG 3.48Å; W394-E461 HydrophobicContact CH2-CB 3.85Å; W394-E461 HydrophobicContact CZ3-CB 3.72Å; L457-E461 WeakPolarHBondContact O-CG 3.46Å; L457-E461 PolarHBondContact O-N 3.11Å; L457-E461 VanDerWaalsContact O-N 3.17Å; L459-E461 VanDerWaalsContact C-N 3.3Å; L459-E461 PolarHBondContact O-N 3.11Å; E461-R463 VanDerWaalsContact C-N 3.29Å; E461-R463 PolarHBondContact O-N 2.71Å; E461-M464 PolarHBondContact O-N 2.78Å; E461-Q465 WeakPolarHBondContact O-CB 3.33Å; E461-Q465 PolarHBondContact O-N 2.88Å
462	A	98.9	Very high	98.7	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-59.9	-42.6	174.9	0	0	0	0	0	111	W394 I397 H398 L458 Q465 A466	W394-A462 HydrophobicContact CD2-CB 3.67Å; W394-A462 HydrophobicContact CE3-CB 3.76Å; W394-A462 HydrophobicContact CG-CB 4.16Å; W394-A462 HydrophobicContact CH2-CB 4.34Å; W394-A462 HydrophobicContact CZ2-CB 4.24Å; W394-A462 HydrophobicContact CZ3-CB 4.12Å; I397-A462 HydrophobicContact CB-CB 3.98Å; I397-A462 HydrophobicContact CD1-CB 4.16Å; I397-A462 HydrophobicContact CG2-CB 3.74Å; H398-A462 PolarHBondContact CD2-O 3.32Å; H398-A462 PolarHBondContact NE2-O 3.39Å; L458-A462 VanDerWaalsContact O-CB 3.23Å; L458-A462 WeakPolarHBondContact O-CB 3.45Å; L458-A462 PolarHBondContact O-N 3.12Å; A462-Q465 PolarHBondContact O-N 3.1Å; A462-A466 WeakPolarHBondContact O-CB 3.24Å; A462-A466 PolarHBondContact O-N 3.21Å
463	R	98.6	Very high	98.7	Very high	4 Å²	4	5.1 Å²	5.1	2%	0.015	2%	0.023	C	C	.	.	H	α-helix	trans	-61	-47.6	174.9	178.8	179.5	-178	-153.6	-4	111.9	H123 A167 H205 S209 I397 F401 A429 L459 E461 A466 A467	H123-R463 PolarHBondContact CE1-NH2 3.28Å; H123-R463 VanDerWaalsContact CE1-NH2 3.27Å; H123-R463 PolarHBondContact NE2-NH2 2.71Å; A167-R463 PolarHBondContact O-NH2 3.21Å; H205-R463 PolarHBondContact O-NH1 3.3Å; S209-R463 PolarHBondContact OG-NH1 3.21Å; I397-R463 HydrophobicContact CG2-CB 4.5Å; F401-R463 HydrophobicContact CE2-CB 4.26Å; F401-R463 HydrophobicContact CE2-CG 3.94Å; F401-R463 HydrophobicContact CZ-CG 3.91Å; A429-R463 WeakPolarHBondContact O-CD 3.25Å; A429-R463 PolarHBondContact O-NE 3.25Å; L459-R463 WeakPolarHBondContact O-CB 3.33Å; L459-R463 PolarHBondContact O-N 2.88Å; E461-R463 VanDerWaalsContact C-N 3.29Å; E461-R463 PolarHBondContact O-N 2.71Å; R463-A466 PolarHBondContact O-N 3.28Å; R463-A467 PolarHBondContact O-N 3.12Å; R463-A467 VanDerWaalsContact O-N 3.11Å
464	M	98.9	Very high	98.7	Very high	2 Å²	2	5.2 Å²	5.2	1%	0.01	2%	0.024	C	C	.	.	H	α-helix	trans	-62.5	-45.1	-180	-175.1	175.1	-177	0	0	111.2	L96 V199 H203 L363 K366 F367 L460 E461 A467 L468	L96-M464 HydrophobicContact CD2-CE 4.48Å; V199-M464 HydrophobicContact CG1-CE 4.16Å; H203-M464 HydrophobicContact CB-CE 3.89Å; L363-M464 HydrophobicContact CD2-CE 3.52Å; L363-M464 HydrophobicContact CD2-SD 4.34Å; K366-M464 PolarHBondContact NZ-SD 3.22Å; F367-M464 HydrophobicContact CE1-CB 4.3Å; F367-M464 HydrophobicContact CE1-CG 4.37Å; F367-M464 HydrophobicContact CZ-CG 4.42Å; L460-M464 VanDerWaalsContact O-CB 3.29Å; L460-M464 WeakPolarHBondContact O-CB 3.42Å; L460-M464 PolarHBondContact O-N 2.71Å; E461-M464 PolarHBondContact O-N 2.78Å; M464-A467 PolarHBondContact O-N 3.14Å; M464-L468 HydrophobicContact CE-CD1 4.11Å; M464-L468 HydrophobicContact CG-CD1 4.16Å; M464-L468 WeakPolarHBondContact O-CB 3.29Å; M464-L468 WeakPolarHBondContact O-CG 3.41Å; M464-L468 PolarHBondContact O-N 3.17Å
465	Q	98.8	Very high	98.7	Very high	18 Å²	18	4.3 Å²	4.3	8%	0.084	2%	0.02	C	C	.	.	H	α-helix	trans	-61.5	-47.8	178.2	-170.5	178.2	93.3	0	0	111.1	W344 F367 W394 H398 E461 A462 A467 L468 L469	W344-Q465 HydrophobicContact CB-CG 4.47Å; F367-Q465 HydrophobicContact CD1-CB 4.28Å; F367-Q465 HydrophobicContact CE1-CB 3.8Å; F367-Q465 HydrophobicContact CE2-CB 4.3Å; F367-Q465 HydrophobicContact CE2-CG 4.22Å; F367-Q465 HydrophobicContact CZ-CB 3.81Å; F367-Q465 HydrophobicContact CZ-CG 4.23Å; W394-Q465 HydrophobicContact CZ2-CB 4.37Å; H398-Q465 PolarHBondContact CE1-OE1 3.31Å; H398-Q465 VanDerWaalsContact CE1-OE1 3.31Å; E461-Q465 WeakPolarHBondContact O-CB 3.33Å; E461-Q465 PolarHBondContact O-N 2.88Å; A462-Q465 PolarHBondContact O-N 3.1Å; Q465-A467 PolarHBondContact O-N 3.27Å; Q465-L468 PolarHBondContact O-N 3.12Å; Q465-L469 HydrophobicContact CG-CD1 4.02Å; Q465-L469 HydrophobicContact CG-CG 4.26Å; Q465-L469 WeakPolarHBondContact O-CB 3.27Å; Q465-L469 VanDerWaalsContact O-CG 3.27Å; Q465-L469 WeakPolarHBondContact O-CG 3.39Å; Q465-L469 PolarHBondContact O-N 3.11Å
466	A	98.6	Very high	98.6	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-56.9	-48.1	177.2	0	0	0	0	0	112.3	F401 I403 A462 R463 L468 L469 Y470	F401-A466 HydrophobicContact CB-CB 4.02Å; F401-A466 HydrophobicContact CD2-CB 4.34Å; F401-A466 HydrophobicContact CG-CB 4.24Å; I403-A466 HydrophobicContact CD1-CB 3.63Å; A462-A466 WeakPolarHBondContact O-CB 3.24Å; A462-A466 PolarHBondContact O-N 3.21Å; R463-A466 PolarHBondContact O-N 3.28Å; A466-L468 PolarHBondContact O-N 3.43Å; A466-L469 PolarHBondContact O-N 2.94Å; A466-Y470 WeakPolarHBondContact O-CD2 3.48Å; A466-Y470 PolarHBondContact O-N 3.28Å
467	A	98.7	Very high	98.5	Very high	5 Å²	5	12.4 Å²	12.4	4%	0.041	6%	0.055	C	C	.	.	H	α-helix	trans	-62.8	-43.2	179.4	0	0	0	0	0	112.4	L166 P170 T202 R463 M464 Q465 A471	L166-A467 HydrophobicContact CD2-CB 4.08Å; L166-A467 WeakPolarHBondContact CD2-O 3.27Å; P170-A467 HydrophobicContact CB-CB 4.19Å; P170-A467 HydrophobicContact CG-CB 4.45Å; T202-A467 HydrophobicContact CG2-CB 3.77Å; R463-A467 PolarHBondContact O-N 3.12Å; R463-A467 VanDerWaalsContact O-N 3.11Å; M464-A467 PolarHBondContact O-N 3.14Å; Q465-A467 PolarHBondContact O-N 3.27Å; A467-A471 PolarHBondContact O-N 3.02Å
468	L	98.8	Very high	98.5	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-63.5	-46.4	175.6	-79.2	174.1	0	0	0	111.8	L198 V199 T202 L363 F367 M464 Q465 A466 Y470 A471 L472	L198-L468 HydrophobicContact CB-CD2 4.47Å; V199-L468 HydrophobicContact CG2-CD2 4.35Å; T202-L468 HydrophobicContact CG2-CD2 4.19Å; T202-L468 HydrophobicContact CG2-CG 4.16Å; L363-L468 HydrophobicContact CD1-CD1 4.33Å; L363-L468 HydrophobicContact CD2-CD1 4.32Å; F367-L468 HydrophobicContact CZ-CD1 4.16Å; M464-L468 HydrophobicContact CE-CD1 4.11Å; M464-L468 HydrophobicContact CG-CD1 4.16Å; M464-L468 WeakPolarHBondContact O-CB 3.29Å; M464-L468 WeakPolarHBondContact O-CG 3.41Å; M464-L468 PolarHBondContact O-N 3.17Å; Q465-L468 PolarHBondContact O-N 3.12Å; A466-L468 PolarHBondContact O-N 3.43Å; L468-Y470 VanDerWaalsContact C-N 3.31Å; L468-Y470 PolarHBondContact O-N 3.41Å; L468-A471 PolarHBondContact O-N 2.99Å; L468-A471 VanDerWaalsContact O-N 3.11Å; L468-L472 HydrophobicContact CB-CD1 4.29Å; L468-L472 VanDerWaalsContact O-CB 3.31Å; L468-L472 WeakPolarHBondContact O-CB 3.25Å; L468-L472 WeakPolarHBondContact O-CG 3.39Å; L468-L472 PolarHBondContact O-N 2.92Å
469	L	98.7	Very high	98.2	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-57.2	-43	-179.2	-73.1	174.4	0	0	0	112.2	Y342 W344 Q465 A466 R473	Y342-L469 HydrophobicContact CD1-CD2 4.02Å; Y342-L469 HydrophobicContact CE1-CD2 4.28Å; W344-L469 HydrophobicContact CB-CD2 4.14Å; Q465-L469 HydrophobicContact CG-CD1 4.02Å; Q465-L469 HydrophobicContact CG-CG 4.26Å; Q465-L469 WeakPolarHBondContact O-CB 3.27Å; Q465-L469 VanDerWaalsContact O-CG 3.27Å; Q465-L469 WeakPolarHBondContact O-CG 3.39Å; Q465-L469 PolarHBondContact O-N 3.11Å; A466-L469 PolarHBondContact O-N 2.94Å; L469-R473 WeakPolarHBondContact O-CB 3.41Å; L469-R473 PolarHBondContact O-N 3.27Å
470	Y	98.7	Very high	97.8	Very high	6 Å²	6	27.5 Å²	27.5	2%	0.024	13%	0.134	C	C	.	.	H	α-helix	trans	-63	-43.9	175.8	-78	-63.6	0	0	0	113	P170 W171 F337 F401 I403 A466 L468 A474	P170-Y470 HydrophobicContact CB-CD2 3.76Å; P170-Y470 HydrophobicContact CB-CG 4.29Å; P170-Y470 HydrophobicContact CG-CD2 3.9Å; P170-Y470 HydrophobicContact CG-CE2 4.32Å; P170-Y470 VanDerWaalsContact O-CB 3.27Å; P170-Y470 WeakPolarHBondContact O-CB 3.47Å; W171-Y470 HydrophobicContact CB-CD1 4.21Å; W171-Y470 HydrophobicContact CB-CE1 3.69Å; W171-Y470 HydrophobicContact CB-CE2 4.04Å; F337-Y470 HydrophobicContact CB-CE1 3.93Å; F337-Y470 WeakPolarHBondContact CB-OH 3.12Å; F337-Y470 HydrophobicContact CD1-CD1 4.28Å; F337-Y470 AromaticContact CD1-CE1 3.58Å; F337-Y470 HydrophobicContact CD1-CE1 3.58Å; F337-Y470 HydrophobicContact CD1-CE2 4.42Å; F337-Y470 AromaticContact CD1-CZ 3.67Å; F337-Y470 HydrophobicContact CE1-CE1 4.42Å; F337-Y470 AromaticContact CG-CE1 3.95Å; F337-Y470 HydrophobicContact CG-CE1 3.95Å; F401-Y470 WeakPolarHBondContact O-CE2 3.33Å; F401-Y470 PolarHBondContact O-OH 2.95Å; I403-Y470 HydrophobicContact CD1-CE2 4.08Å; I403-Y470 HydrophobicContact CG1-CE2 4.04Å; A466-Y470 WeakPolarHBondContact O-CD2 3.48Å; A466-Y470 PolarHBondContact O-N 3.28Å; L468-Y470 VanDerWaalsContact C-N 3.31Å; L468-Y470 PolarHBondContact O-N 3.41Å; Y470-A474 PolarHBondContact O-N 3.04Å; Y470-A474 VanDerWaalsContact O-N 3.09Å
471	A	98.6	Very high	97.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.5	-43	179.1	0	0	0	0	0	112.5	L166 I173 L198 A467 L468 A474 I475	L166-A471 HydrophobicContact CD2-CB 3.97Å; I173-A471 HydrophobicContact CD1-CB 4.12Å; L198-A471 HydrophobicContact CD1-CB 4.18Å; L198-A471 HydrophobicContact CD2-CB 4.45Å; A467-A471 PolarHBondContact O-N 3.02Å; L468-A471 PolarHBondContact O-N 2.99Å; L468-A471 VanDerWaalsContact O-N 3.11Å; A471-A474 WeakPolarHBondContact O-CB 3.38Å; A471-A474 PolarHBondContact O-N 3.2Å; A471-I475 WeakPolarHBondContact O-CG1 3.14Å; A471-I475 PolarHBondContact O-N 3.43Å
472	L	98.6	Very high	97.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-41.9	177	-67.4	172.8	0	0	0	111.2	I195 Y342 W344 L351 I352 L468 A474 I475 T476	I195-L472 HydrophobicContact CD1-CD2 3.66Å; Y342-L472 HydrophobicContact CE1-CB 3.82Å; Y342-L472 VanDerWaalsContact OH-C 3.27Å; Y342-L472 WeakPolarHBondContact OH-CB 3.27Å; Y342-L472 PolarHBondContact OH-O 3.03Å; W344-L472 HydrophobicContact CZ3-CD1 4.18Å; L351-L472 HydrophobicContact CD2-CB 4.07Å; L351-L472 HydrophobicContact CD2-CD2 3.87Å; L351-L472 HydrophobicContact CG-CD2 4.34Å; I352-L472 HydrophobicContact CD1-CD1 3.8Å; I352-L472 HydrophobicContact CD1-CD2 4.04Å; I352-L472 HydrophobicContact CD1-CG 4.47Å; I352-L472 HydrophobicContact CG1-CD1 3.89Å; I352-L472 HydrophobicContact CG1-CD2 3.61Å; I352-L472 HydrophobicContact CG1-CG 4.4Å; L468-L472 HydrophobicContact CB-CD1 4.29Å; L468-L472 VanDerWaalsContact O-CB 3.31Å; L468-L472 WeakPolarHBondContact O-CB 3.25Å; L468-L472 WeakPolarHBondContact O-CG 3.39Å; L468-L472 PolarHBondContact O-N 2.92Å; L472-A474 VanDerWaalsContact C-N 3.27Å; L472-A474 PolarHBondContact O-N 3.26Å; L472-I475 HydrophobicContact CD2-CD1 4.46Å; L472-I475 WeakPolarHBondContact O-CB 3.47Å; L472-I475 PolarHBondContact O-N 2.77Å; L472-I475 VanDerWaalsContact O-N 3.08Å; L472-T476 PolarHBondContact O-N 2.91Å; L472-T476 PolarHBondContact O-OG1 3.37Å
473	R	98.3	Very high	97.6	Very high	42 Å²	42	31.9 Å²	31.9	16%	0.158	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-40.6	172.6	-168.2	-175.4	83.8	-177.9	4.4	111.6	Y342 L469 T476 R477	Y342-R473 HydrophobicContact CD1-CB 3.93Å; Y342-R473 HydrophobicContact CD1-CG 4.45Å; Y342-R473 HydrophobicContact CD2-CB 4.04Å; Y342-R473 HydrophobicContact CD2-CG 3.84Å; Y342-R473 HydrophobicContact CE1-CB 4.15Å; Y342-R473 HydrophobicContact CE2-CB 4.21Å; Y342-R473 HydrophobicContact CE2-CG 4.34Å; Y342-R473 HydrophobicContact CG-CB 3.88Å; Y342-R473 HydrophobicContact CG-CG 3.89Å; L469-R473 WeakPolarHBondContact O-CB 3.41Å; L469-R473 PolarHBondContact O-N 3.27Å; R473-T476 PolarHBondContact O-N 3.3Å; R473-R477 WeakPolarHBondContact O-CB 3.19Å; R473-R477 VanDerWaalsContact O-CG 3.29Å; R473-R477 WeakPolarHBondContact O-CG 3.48Å; R473-R477 PolarHBondContact O-N 3.27Å
474	A	98.3	Very high	97.6	Very high	2 Å²	2	33.6 Å²	33.6	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-36.9	175.3	0	0	0	0	0	112.5	I173 I178 Y470 A471 L472 R477 Y478	I173-A474 HydrophobicContact CG2-CB 3.79Å; I178-A474 HydrophobicContact CD1-CB 4.4Å; I178-A474 HydrophobicContact CG1-CB 3.89Å; Y470-A474 PolarHBondContact O-N 3.04Å; Y470-A474 VanDerWaalsContact O-N 3.09Å; A471-A474 WeakPolarHBondContact O-CB 3.38Å; A471-A474 PolarHBondContact O-N 3.2Å; L472-A474 VanDerWaalsContact C-N 3.27Å; L472-A474 PolarHBondContact O-N 3.26Å; A474-R477 PolarHBondContact O-N 3.42Å; A474-Y478 PolarHBondContact O-N 3.5Å
475	I	98.3	Very high	97.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-47.6	173.6	-68.1	166	0	0	0	110.6	I178 L191 I195 L198 L351 A471 L472 R477 Y478 M479	I178-I475 HydrophobicContact CD1-CD1 4.46Å; I178-I475 HydrophobicContact CD1-CG1 3.71Å; I178-I475 HydrophobicContact CG1-CG1 3.95Å; I178-I475 HydrophobicContact CG2-CG1 3.96Å; L191-I475 HydrophobicContact CD2-CG2 4.15Å; I195-I475 HydrophobicContact CD1-CD1 3.62Å; L198-I475 HydrophobicContact CD1-CD1 3.58Å; L351-I475 HydrophobicContact CD2-CB 4.15Å; L351-I475 HydrophobicContact CD2-CG2 3.97Å; A471-I475 WeakPolarHBondContact O-CG1 3.14Å; A471-I475 PolarHBondContact O-N 3.43Å; L472-I475 HydrophobicContact CD2-CD1 4.46Å; L472-I475 WeakPolarHBondContact O-CB 3.47Å; L472-I475 PolarHBondContact O-N 2.77Å; L472-I475 VanDerWaalsContact O-N 3.08Å; I475-R477 VanDerWaalsContact C-N 3.3Å; I475-R477 PolarHBondContact O-N 3.17Å; I475-Y478 WeakPolarHBondContact O-CB 3.42Å; I475-Y478 PolarHBondContact O-N 2.95Å; I475-M479 HydrophobicContact CG2-CG 4.32Å; I475-M479 HydrophobicContact CG2-SD 3.95Å; I475-M479 WeakPolarHBondContact O-CG 3.37Å; I475-M479 PolarHBondContact O-N 3.23Å
476	T	97.9	Very high	97.4	Very high	46 Å²	46	36.7 Å²	36.7	28%	0.282	18%	0.179	S	C	.	.	H	α-helix	trans	-55.6	-47.1	175.7	-60.7	0	0	0	0	110.8	Y342 L472 R473 Y478 M479 T480	Y342-T476 HydrophobicContact CE2-CG2 4.25Å; Y342-T476 WeakPolarHBondContact CE2-OG1 3.44Å; Y342-T476 PolarHBondContact OH-OG1 2.95Å; L472-T476 PolarHBondContact O-N 2.91Å; L472-T476 PolarHBondContact O-OG1 3.37Å; R473-T476 PolarHBondContact O-N 3.3Å; T476-Y478 PolarHBondContact O-N 2.93Å; T476-M479 PolarHBondContact O-N 3.31Å; T476-M479 VanDerWaalsContact O-N 3.14Å; T476-T480 PolarHBondContact O-N 3.36Å; T476-T480 VanDerWaalsContact O-N 3.1Å; T476-T480 PolarHBondContact O-OG1 3.43Å
477	R	97.1	Very high	97.3	Very high	127 Å²	127	39.4 Å²	39.4	48%	0.479	19%	0.192	S	C	.	.	H	α-helix	trans	-65.8	-18.7	176.5	-73	176.4	178.2	-174.9	-0.7	115	K175 R473 A474 I475 T480	K175-R477 HydrophobicContact CB-CB 4.28Å; K175-R477 WeakPolarHBondContact CD-O 3.32Å; R473-R477 WeakPolarHBondContact O-CB 3.19Å; R473-R477 VanDerWaalsContact O-CG 3.29Å; R473-R477 WeakPolarHBondContact O-CG 3.48Å; R473-R477 PolarHBondContact O-N 3.27Å; A474-R477 PolarHBondContact O-N 3.42Å; I475-R477 VanDerWaalsContact C-N 3.3Å; I475-R477 PolarHBondContact O-N 3.17Å; R477-T480 VanDerWaalsContact O-OXT 3.12Å
478	Y	97.1	Very high	97.2	Very high	86 Å²	86	42 Å²	42	34%	0.337	20%	0.203	S	C	.	.	H	α-helix	trans	-84.3	-35.2	172.9	170.3	-97.1	0	0	0	111.4	I178 Q179 L182 A474 I475 T476	I178-Y478 HydrophobicContact CB-CG 4.35Å; I178-Y478 HydrophobicContact CG2-CD1 3.97Å; I178-Y478 HydrophobicContact CG2-CG 3.89Å; Q179-Y478 HydrophobicContact CB-CD2 3.86Å; Q179-Y478 HydrophobicContact CB-CE2 3.62Å; Q179-Y478 HydrophobicContact CG-CE2 3.88Å; L182-Y478 HydrophobicContact CB-CE1 4.43Å; L182-Y478 HydrophobicContact CD1-CD1 3.76Å; L182-Y478 HydrophobicContact CD1-CE1 3.36Å; A474-Y478 PolarHBondContact O-N 3.5Å; I475-Y478 WeakPolarHBondContact O-CB 3.42Å; I475-Y478 PolarHBondContact O-N 2.95Å; T476-Y478 PolarHBondContact O-N 2.93Å
479	M	94.3	Very high	97.1	Very high	85 Å²	85	45.4 Å²	45.4	42%	0.419	22%	0.22	S	C	.	.	H	α-helix	trans	-76.5	-23	-179.9	-66.6	-179.3	75.1	0	0	113.4	L191 L351 I475 T476	L191-M479 HydrophobicContact CD1-CE 4.22Å; L191-M479 HydrophobicContact CD1-SD 4.39Å; L351-M479 HydrophobicContact CD1-SD 4.17Å; I475-M479 HydrophobicContact CG2-CG 4.32Å; I475-M479 HydrophobicContact CG2-SD 3.95Å; I475-M479 WeakPolarHBondContact O-CG 3.37Å; I475-M479 PolarHBondContact O-N 3.23Å; T476-M479 PolarHBondContact O-N 3.31Å; T476-M479 VanDerWaalsContact O-N 3.14Å
480	T	89.1	Confident	96.9	Very high	147 Å²	147	49.2 Å²	49.2	90%	0.902	24%	0.238	S	C	*	.			trans	-96.3	0	172.3	60.1	0	0	0	0	110.9	T476 R477	T476-T480 PolarHBondContact O-N 3.36Å; T476-T480 VanDerWaalsContact O-N 3.1Å; T476-T480 PolarHBondContact O-OG1 3.43Å; R477-T480 VanDerWaalsContact O-OXT 3.12Å

Retrieved 480 of 480 residues in 3545.7 ms (Link to these results)

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