A0A096NGT9_PAPAN Loading...

RAD50-interacting protein 1

AlphaFold DB , UniProt , Accession A0A096NGT9, Species PAPAN (Papio anubis, Olive baboon), Gene RINT1, Length 792 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	31.1	Very low	28.7	Very low	251 Å²	251	134.1 Å²	134.1	100%	1.236	86%	0.855	S	S	*	*				0	99.6	0	-86.3	171.7	146.6	0	0	108
2	L	27.3	Very low	28.3	Very low	168 Å²	168	130.8 Å²	130.8	88%	0.88	85%	0.849	S	S	*	*			trans	-77.6	172	156.9	-78.2	165.4	0	0	0	108.1
3	P	41.1	Very low	27.8	Very low	114 Å²	114	127.8 Å²	127.8	74%	0.74	84%	0.842	S	S	*	*			cis	-144.1	155.9	30.6	35.6	-10.9	0	0	0	116
4	A	26.5	Very low	28.2	Very low	105 Å²	105	127.6 Å²	127.6	87%	0.868	84%	0.84	S	S	*	*				79.6	135.9	93.6	0	0	0	0	0	117.4
5	G	26.7	Very low	27.8	Very low	80 Å²	80	126.7 Å²	126.7	83%	0.825	84%	0.836	S	S	*	*			trans	178.2	80.3	171.4	0	0	0	0	0	112.4
6	E	26.5	Very low	27.5	Very low	184 Å²	184	126.4 Å²	126.4	86%	0.86	84%	0.835	S	S	*	*			trans	-63.7	161.6	165.5	-66.6	172.1	146	0	0	110.8
7	I	29.3	Very low	27.3	Very low	168 Å²	168	124.7 Å²	124.7	86%	0.862	83%	0.826	S	S	*	*				178.7	142.6	83.7	-79.9	157.2	0	0	0	110.1
8	G	25.5	Very low	27.1	Very low	70 Å²	70	128 Å²	128	72%	0.722	83%	0.828	S	S	*	*			trans	129.1	128.8	137.2	0	0	0	0	0	114.7
9	A	25.5	Very low	27	Very low	103 Å²	103	127.8 Å²	127.8	85%	0.851	83%	0.83	S	S	*	*			cis	-168.9	150	-5.8	0	0	0	0	0	107.6
10	S	22.7	Very low	26.8	Very low	114 Å²	114	125.2 Å²	125.2	80%	0.797	83%	0.827	S	S	*	*			trans	-65.9	-168.7	167.3	-46.8	0	0	0	0	112.4
11	P	33.2	Very low	26.8	Very low	118 Å²	118	126.4 Å²	126.4	77%	0.766	83%	0.826	S	S	*	*			cis	-144.4	-176.8	-0.1	37	-13.7	0	0	0	117.4
12	A	23.7	Very low	26.6	Very low	95 Å²	95	124 Å²	124	79%	0.785	81%	0.812	S	S	*	*			trans	89.3	122.5	141	0	0	0	0	0	120.9
13	A	23	Very low	26.6	Very low	92 Å²	92	126.3 Å²	126.3	76%	0.76	81%	0.809	S	S	*	*			trans	-60.9	172.6	158.8	0	0	0	0	0	111.5
14	P	32.5	Very low	25.9	Very low	124 Å²	124	128.8 Å²	128.8	81%	0.805	81%	0.808	S	S	*	*				-152.4	177.9	64.3	37.5	-13.9	0	0	0	118.2
15	C	22.8	Very low	26	Very low	115 Å²	115	130.6 Å²	130.6	78%	0.777	80%	0.803	S	S	*	*			trans	-38.4	171.3	174.2	-58.6	0	0	0	0	122.9
16	C	23	Very low	26	Very low	122 Å²	122	135.3 Å²	135.3	82%	0.824	81%	0.808	S	S	*	*			trans	104.4	135.5	150.3	-63.3	0	0	0	0	115.2
17	S	23.9	Very low	26.1	Very low	97 Å²	97	135 Å²	135	68%	0.678	81%	0.807	S	S	*	*			cis	-179.2	149.2	-8.4	39.9	0	0	0	0	107.8
18	E	24	Very low	26	Very low	184 Å²	184	136.4 Å²	136.4	86%	0.86	81%	0.81	S	S	*	*			trans	69	121.7	149.3	-71.5	-178.5	161.4	0	0	123
19	S	23.9	Very low	26.1	Very low	124 Å²	124	142.7 Å²	142.7	87%	0.867	82%	0.818	S	S	*	*				101.5	130.3	128.8	75.5	0	0	0	0	121
20	G	24.2	Very low	26.1	Very low	76 Å²	76	143.6 Å²	143.6	78%	0.784	82%	0.818	S	S	*	*			trans	88.2	139	158.7	0	0	0	0	0	115
21	D	26.8	Very low	26.4	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	82%	0.819	S	S	*	*			cis	-176.2	126.8	4	-163.1	5.7	0	0	0	104.4
22	E	26.7	Very low	26.1	Very low	201 Å²	201	148.1 Å²	148.1	94%	0.939	82%	0.824	S	S	*	*			trans	-132.7	105.7	166.7	-88.3	-167.3	169.5	0	0	109.7
23	R	26.3	Very low	26.1	Very low	217 Å²	217	150.2 Å²	150.2	82%	0.819	82%	0.823	S	S	*	*			trans	-142.9	133.3	167.2	-116.1	-176.9	-178.7	-178.8	2.6	110.4
24	K	27.9	Very low	26.3	Very low	166 Å²	166	152.7 Å²	152.7	72%	0.722	83%	0.828	S	S	*	*			trans	81.7	118.6	147.9	-66.5	-175.7	173.7	-172.1	0	118.9
25	N	27.3	Very low	26	Very low	142 Å²	142	151.8 Å²	151.8	76%	0.759	82%	0.82	S	S	*	*				178.3	130.9	89.7	-91.6	-35.8	0	0	0	111.6
26	L	27.5	Very low	26.2	Very low	179 Å²	179	153.2 Å²	153.2	94%	0.937	83%	0.825	S	S	*	*			trans	-143.8	111	155.6	-106.8	152.5	0	0	0	105.7
27	E	27.8	Very low	26.4	Very low	177 Å²	177	153.6 Å²	153.6	83%	0.827	82%	0.818	S	S	*	*			trans	-97.9	130	174.1	-83.6	-174.2	154.8	0	0	109.5
28	E	26.8	Very low	26.6	Very low	199 Å²	199	156.5 Å²	156.5	93%	0.93	83%	0.825	S	S	*	*			trans	-124.7	138.2	156.2	-99.5	-175.6	162.5	0	0	108.4
29	K	28.4	Very low	26.7	Very low	202 Å²	202	150.5 Å²	150.5	88%	0.878	81%	0.812	S	S	*	*			trans	-99.6	140.7	177.3	-81.9	-179.5	173.3	177	0	110.7
30	S	25.8	Very low	26.8	Very low	122 Å²	122	150 Å²	150	85%	0.853	81%	0.808	S	S	*	*				177.3	149.4	114.5	45.9	0	0	0	0	113.1
31	D	28.8	Very low	26.9	Very low	156 Å²	156	155.6 Å²	155.6	83%	0.834	81%	0.811	S	S	*	*			trans	-77.2	163.5	-164.4	-64.2	-66.8	0	0	0	117.3
32	I	26	Very low	27.4	Very low	170 Å²	170	156.7 Å²	156.7	87%	0.872	81%	0.812	S	S	*	*				178.5	136.5	111.2	-83.3	155.5	0	0	0	112.3
33	N	25.5	Very low	27.4	Very low	140 Å²	140	154.2 Å²	154.2	75%	0.749	81%	0.81	S	S	*	*			trans	-59.8	157.3	177	-98.1	-43.8	0	0	0	117.3
34	V	27	Very low	27.5	Very low	143 Å²	143	148.6 Å²	148.6	87%	0.867	80%	0.804	S	S	*	*				-159.9	141.1	122.3	170.6	0	0	0	0	111.1
35	T	25.8	Very low	28	Very low	106 Å²	106	150.5 Å²	150.5	65%	0.65	82%	0.815	S	S	*	*			trans	-103.3	149.3	-174.1	-18.4	0	0	0	0	112.4
36	V	26.8	Very low	28.1	Very low	145 Å²	145	147 Å²	147	88%	0.879	81%	0.812	S	S	*	*			trans	-148.3	134.3	148.8	-178.5	0	0	0	0	112
37	L	26.3	Very low	28.3	Very low	129 Å²	129	144.7 Å²	144.7	68%	0.675	81%	0.806	S	S	*	*			trans	-79.8	146.7	-175	-93.9	84.3	0	0	0	115.2
38	I	29.4	Very low	28.6	Very low	159 Å²	159	143.2 Å²	143.2	82%	0.815	80%	0.804	S	S	*	*				54.4	138.3	99.6	-48.5	176.8	0	0	0	114.9
39	G	24.5	Very low	29.3	Very low	57 Å²	57	140.4 Å²	140.4	59%	0.588	80%	0.795	S	S	*	*			cis	-176.2	159.9	13	0	0	0	0	0	109.5
40	S	26.1	Very low	30.4	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	78%	0.783	S	S	*	*				58.2	145.4	107.2	76.8	0	0	0	0	116
41	K	27.6	Very low	31.7	Very low	194 Å²	194	133.7 Å²	133.7	84%	0.843	77%	0.774	S	S	*	*			cis	-172.5	166.4	8.3	-132.5	175.9	-178.7	-180	0	109.3
42	Q	37.1	Very low	33	Very low	173 Å²	173	131.2 Å²	131.2	81%	0.808	76%	0.76	S	S	*	*			trans	-49.8	155.9	168	-65.9	166.2	-42.3	0	0	116
43	V	26.8	Very low	34.7	Very low	149 Å²	149	127.7 Å²	127.7	90%	0.903	75%	0.748	S	S	*	*			trans	-147.3	137.6	138	177	0	0	0	0	110.4
44	S	28.2	Very low	36.5	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	73%	0.734	S	S	*	*			trans	-101.6	145.7	173.5	53.2	0	0	0	0	112.7
45	E	38	Very low	38.6	Very low	205 Å²	205	125.1 Å²	125.1	96%	0.958	72%	0.723	S	S	*	*			trans	29	141.7	148.6	-72.3	-175.8	158.4	0	0	124.6
46	G	29.7	Very low	40.7	Very low	68 Å²	68	123.7 Å²	123.7	70%	0.701	71%	0.714	S	S	*	*			trans	142.9	149.7	148.1	0	0	0	0	0	113.1
47	T	31.2	Very low	42.5	Very low	131 Å²	131	120.2 Å²	120.2	80%	0.804	70%	0.696	S	S	*	*			cis	-171.7	153	-10.2	-48.5	0	0	0	0	106.2
48	D	35.2	Very low	44.7	Very low	146 Å²	146	116.8 Å²	116.8	78%	0.781	69%	0.687	S	S	*	*			trans	69.9	110.1	151.6	-99.4	-24.9	0	0	0	124
49	N	41.8	Very low	46.7	Very low	140 Å²	140	112.2 Å²	112.2	75%	0.749	66%	0.661	S	S	*	*			trans	-97.7	32.6	168.8	-108.4	-15.7	0	0	0	111.8	D51 L52	N49-D51 PolarHBondContact O-N 3.08Å; N49-L52 WeakPolarHBondContact OD1-CD1 3.29Å
50	G	50	Low	48.9	Very low	60 Å²	60	114 Å²	114	62%	0.619	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-18.3	-175.2	0	0	0	0	0	115.8
51	D	53.1	Low	50.8	Low	124 Å²	124	115.3 Å²	115.3	66%	0.663	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	20.5	-169	-96.2	-28.3	0	0	0	114.6	N49 P53 S54 Y55	N49-D51 PolarHBondContact O-N 3.08Å; D51-P53 VanDerWaalsContact C-N 3.27Å; D51-P53 VanDerWaalsContact O-N 3.15Å; D51-S54 PolarHBondContact O-N 3.41Å; D51-S54 PolarHBondContact O-OG 3.41Å; D51-Y55 PolarHBondContact O-N 3.32Å
52	L	56.8	Low	52.8	Low	104 Å²	104	114.4 Å²	114.4	55%	0.545	65%	0.646	S	S	.	*	H	α-helix	trans	-48.5	-38.9	176.5	-140.2	90.5	0	0	0	114.4	N49 S54 Y55 V56	N49-L52 WeakPolarHBondContact OD1-CD1 3.29Å; L52-S54 VanDerWaalsContact C-N 3.32Å; L52-S54 PolarHBondContact O-N 3.11Å; L52-Y55 PolarHBondContact O-N 3.11Å; L52-V56 WeakPolarHBondContact O-CG2 3.39Å; L52-V56 PolarHBondContact O-N 3.46Å; L52-V56 VanDerWaalsContact O-N 3.12Å
53	P	61.8	Low	54.3	Low	95 Å²	95	109.4 Å²	109.4	62%	0.617	62%	0.623	S	S	*	*	H	α-helix	trans	-64.3	-32.4	176.9	-21.4	33.7	0	0	0	113.8	D51 S57	D51-P53 VanDerWaalsContact C-N 3.27Å; D51-P53 VanDerWaalsContact O-N 3.15Å; P53-S57 PolarHBondContact O-N 3.36Å; P53-S57 PolarHBondContact O-OG 3.06Å
54	S	63.6	Low	56	Low	66 Å²	66	103.4 Å²	103.4	46%	0.462	59%	0.586	S	S	.	*	H	α-helix	trans	-71.7	-38.8	178.5	79.1	0	0	0	0	110.9	D51 L52 S57 A58	D51-S54 PolarHBondContact O-N 3.41Å; D51-S54 PolarHBondContact O-OG 3.41Å; L52-S54 VanDerWaalsContact C-N 3.32Å; L52-S54 PolarHBondContact O-N 3.11Å; S54-S57 PolarHBondContact O-N 3.09Å; S54-A58 WeakPolarHBondContact O-CB 3.41Å; S54-A58 PolarHBondContact O-N 2.83Å; S54-A58 VanDerWaalsContact O-N 3.09Å
55	Y	71.6	Confident	57.6	Low	164 Å²	164	100.4 Å²	100.4	64%	0.643	57%	0.571	S	S	*	*	H	α-helix	trans	-65.7	-43.1	176.8	-163.2	-87	0	0	0	112.4	D51 L52 F59	D51-Y55 PolarHBondContact O-N 3.32Å; L52-Y55 PolarHBondContact O-N 3.11Å; Y55-F59 WeakPolarHBondContact O-CB 3.32Å; Y55-F59 PolarHBondContact O-N 3.18Å
56	V	68.4	Low	58.5	Low	76 Å²	76	98.7 Å²	98.7	46%	0.461	57%	0.568	S	S	.	*	H	α-helix	trans	-64.5	-41.5	178.6	174.9	0	0	0	0	111.1	L52 F59 I60	L52-V56 WeakPolarHBondContact O-CG2 3.39Å; L52-V56 PolarHBondContact O-N 3.46Å; L52-V56 VanDerWaalsContact O-N 3.12Å; V56-F59 PolarHBondContact O-N 3.46Å; V56-I60 HydrophobicContact CG1-CD1 4.36Å; V56-I60 PolarHBondContact O-N 3.42Å; V56-I60 VanDerWaalsContact O-N 3.14Å
57	S	65.7	Low	59.7	Low	71 Å²	71	100.6 Å²	100.6	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-64.1	-49.1	179.6	-58.8	0	0	0	0	111.4	P53 S54 F59 I60 E61	P53-S57 PolarHBondContact O-N 3.36Å; P53-S57 PolarHBondContact O-OG 3.06Å; S54-S57 PolarHBondContact O-N 3.09Å; S57-F59 PolarHBondContact O-N 3Å; S57-I60 PolarHBondContact O-N 2.66Å; S57-E61 PolarHBondContact O-N 3.15Å; S57-E61 VanDerWaalsContact O-N 3.15Å
58	A	71.8	Confident	60.8	Low	58 Å²	58	101.4 Å²	101.4	48%	0.479	56%	0.561	S	S	.	*	H	α-helix	trans	-61	-32.9	176.9	0	0	0	0	0	112.8	S54 K62	S54-A58 WeakPolarHBondContact O-CB 3.41Å; S54-A58 PolarHBondContact O-N 2.83Å; S54-A58 VanDerWaalsContact O-N 3.09Å; A58-K62 WeakPolarHBondContact O-CB 3.45Å; A58-K62 PolarHBondContact O-N 2.96Å; A58-K62 VanDerWaalsContact O-N 3.16Å
59	F	71.8	Confident	62.2	Low	63 Å²	63	102.8 Å²	102.8	28%	0.276	56%	0.56	S	S	.	*	H	α-helix	trans	-68.5	-46.2	177.9	-179.2	-97.7	0	0	0	112.7	Y55 V56 S57 E61 K62 E63 L77	Y55-F59 WeakPolarHBondContact O-CB 3.32Å; Y55-F59 PolarHBondContact O-N 3.18Å; V56-F59 PolarHBondContact O-N 3.46Å; S57-F59 PolarHBondContact O-N 3Å; F59-E61 VanDerWaalsContact C-N 3.33Å; F59-E61 PolarHBondContact O-N 3Å; F59-K62 PolarHBondContact O-N 3.36Å; F59-E63 HydrophobicContact CD2-CG 4.45Å; F59-E63 HydrophobicContact CE1-CG 4.27Å; F59-E63 HydrophobicContact CE2-CG 3.93Å; F59-E63 HydrophobicContact CZ-CG 3.83Å; F59-E63 PolarHBondContact O-N 3.04Å; F59-L77 HydrophobicContact CE1-CD1 4.41Å; F59-L77 HydrophobicContact CE1-CD2 4.32Å; F59-L77 HydrophobicContact CZ-CD1 4.32Å; F59-L77 HydrophobicContact CZ-CD2 3.72Å
60	I	69.7	Low	63	Low	95 Å²	95	97.6 Å²	97.6	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-63.5	-43.6	178.9	-66.9	179.9	0	0	0	110.4	V56 S57 K62 E63 V64	V56-I60 HydrophobicContact CG1-CD1 4.36Å; V56-I60 PolarHBondContact O-N 3.42Å; V56-I60 VanDerWaalsContact O-N 3.14Å; S57-I60 PolarHBondContact O-N 2.66Å; I60-K62 VanDerWaalsContact C-N 3.26Å; I60-K62 PolarHBondContact O-N 2.75Å; I60-E63 PolarHBondContact O-N 3.23Å; I60-V64 HydrophobicContact CG2-CG2 4.33Å; I60-V64 PolarHBondContact O-N 3.41Å
61	E	66.5	Low	63.6	Low	141 Å²	141	99.1 Å²	99.1	66%	0.659	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-34.2	-178.5	-151.5	156.3	-152.3	0	0	111.7	S57 F59	S57-E61 PolarHBondContact O-N 3.15Å; S57-E61 VanDerWaalsContact O-N 3.15Å; F59-E61 VanDerWaalsContact C-N 3.33Å; F59-E61 PolarHBondContact O-N 3Å
62	K	69.2	Low	64.2	Low	175 Å²	175	102.1 Å²	102.1	76%	0.761	54%	0.535	S	S	*	.	H	α-helix	trans	-74.1	-42.4	176	-171.2	-179.8	-179.7	-177.5	0	114	A58 F59 I60	A58-K62 WeakPolarHBondContact O-CB 3.45Å; A58-K62 PolarHBondContact O-N 2.96Å; A58-K62 VanDerWaalsContact O-N 3.16Å; F59-K62 PolarHBondContact O-N 3.36Å; I60-K62 VanDerWaalsContact C-N 3.26Å; I60-K62 PolarHBondContact O-N 2.75Å
63	E	68.7	Low	64.7	Low	68 Å²	68	102.9 Å²	102.9	32%	0.318	53%	0.534	S	S	.	.	H	α-helix	trans	-88.4	-35.4	-171.6	-76.3	-61.4	149.9	0	0	114.1	F59 I60 L77	F59-E63 HydrophobicContact CD2-CG 4.45Å; F59-E63 HydrophobicContact CE1-CG 4.27Å; F59-E63 HydrophobicContact CE2-CG 3.93Å; F59-E63 HydrophobicContact CZ-CG 3.83Å; F59-E63 PolarHBondContact O-N 3.04Å; I60-E63 PolarHBondContact O-N 3.23Å; E63-L77 HydrophobicContact CB-CD1 3.55Å; E63-L77 HydrophobicContact CG-CD1 3.69Å
64	V	63.3	Low	65.1	Low	23 Å²	23	101.4 Å²	101.4	14%	0.139	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-41.1	-174.2	-170.5	0	0	0	0	111.2	I60 S70 L74	I60-V64 HydrophobicContact CG2-CG2 4.33Å; I60-V64 PolarHBondContact O-N 3.41Å; V64-S70 WeakPolarHBondContact O-CB 3.31Å; V64-L74 HydrophobicContact CG2-CD1 3.44Å; V64-L74 VanDerWaalsContact CG2-CD1 3.44Å
65	G	61.7	Low	65.5	Low	36 Å²	36	104.1 Å²	104.1	37%	0.371	53%	0.53	S	S	.	.			trans	56.8	-175.8	-178.4	0	0	0	0	0	114.9
66	N	57.1	Low	65.6	Low	169 Å²	169	103.9 Å²	103.9	90%	0.904	53%	0.532	S	S	*	.	S	Bend	trans	-95.2	8.1	-166.6	-65.9	-21.3	0	0	0	115.1
67	D	55.1	Low	65.8	Low	107 Å²	107	101.8 Å²	101.8	57%	0.572	52%	0.518	S	S	*	.	S	Bend	trans	-112.2	130	-177	-172	-1.5	0	0	0	111.2	K69 S70	D67-K69 PolarHBondContact O-N 3.17Å; D67-K69 VanDerWaalsContact O-N 3.15Å; D67-S70 WeakPolarHBondContact O-CB 3.33Å; D67-S70 PolarHBondContact O-N 3.07Å; D67-S70 PolarHBondContact O-OG 3.44Å
68	L	54.6	Low	66.2	Low	148 Å²	148	103.1 Å²	103.1	78%	0.775	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.5	-166.6	-113.9	125	0	0	0	114.9
69	K	63.6	Low	66.6	Low	176 Å²	176	106.6 Å²	106.6	77%	0.765	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-18.5	173.1	-71	-178.4	179.4	175.3	0	112.7	D67	D67-K69 PolarHBondContact O-N 3.17Å; D67-K69 VanDerWaalsContact O-N 3.15Å
70	S	59	Low	66.9	Low	31 Å²	31	110.1 Å²	110.1	22%	0.217	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-79.9	-20.4	-174.1	-41.3	0	0	0	0	112.8	V64 D67 K72 K73	V64-S70 WeakPolarHBondContact O-CB 3.31Å; D67-S70 WeakPolarHBondContact O-CB 3.33Å; D67-S70 PolarHBondContact O-N 3.07Å; D67-S70 PolarHBondContact O-OG 3.44Å; S70-K72 PolarHBondContact O-N 2.96Å; S70-K72 VanDerWaalsContact O-N 3.08Å; S70-K73 WeakPolarHBondContact O-CB 3.44Å; S70-K73 PolarHBondContact O-N 3.09Å
71	L	62.1	Low	67.3	Low	92 Å²	92	112.7 Å²	112.7	48%	0.482	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-55.7	-24.6	175.7	-101.1	151.2	0	0	0	113.9	K73 L74	L71-K73 PolarHBondContact O-N 3.09Å; L71-K73 VanDerWaalsContact O-N 3.11Å; L71-L74 WeakPolarHBondContact O-CB 2.89Å; L71-L74 PolarHBondContact O-N 3.45Å; L71-L74 VanDerWaalsContact O-N 3.11Å
72	K	67.3	Low	67.9	Low	186 Å²	186	109.6 Å²	109.6	81%	0.809	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-64.9	-11.5	175.4	-69.9	-173	175.7	-174.7	0	113.9	S70	S70-K72 PolarHBondContact O-N 2.96Å; S70-K72 VanDerWaalsContact O-N 3.08Å
73	K	66.2	Low	68.5	Low	120 Å²	120	104.7 Å²	104.7	52%	0.522	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-83.8	-17.4	174.8	-65.6	-178.6	180	178.5	0	113.5	S70 L71 D75 K76 L77	S70-K73 WeakPolarHBondContact O-CB 3.44Å; S70-K73 PolarHBondContact O-N 3.09Å; L71-K73 PolarHBondContact O-N 3.09Å; L71-K73 VanDerWaalsContact O-N 3.11Å; K73-D75 PolarHBondContact O-N 2.97Å; K73-K76 PolarHBondContact O-N 3.45Å; K73-L77 PolarHBondContact O-N 3.32Å
74	L	70.9	Confident	68.9	Low	64 Å²	64	103.7 Å²	103.7	34%	0.335	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-39.6	-171.4	-155.5	80.8	0	0	0	112.4	V64 L71 K76 L77 I78	V64-L74 HydrophobicContact CG2-CD1 3.44Å; V64-L74 VanDerWaalsContact CG2-CD1 3.44Å; L71-L74 WeakPolarHBondContact O-CB 2.89Å; L71-L74 PolarHBondContact O-N 3.45Å; L71-L74 VanDerWaalsContact O-N 3.11Å; L74-K76 VanDerWaalsContact C-N 3.33Å; L74-K76 PolarHBondContact O-N 3.45Å; L74-L77 PolarHBondContact O-N 3.37Å; L74-I78 HydrophobicContact CD2-CD1 4.33Å; L74-I78 HydrophobicContact CG-CD1 4.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.08Å; L74-I78 PolarHBondContact O-N 3.22Å
75	D	70.8	Confident	69.7	Low	123 Å²	123	108.5 Å²	108.5	66%	0.658	54%	0.541	S	S	*	.	H	α-helix	trans	-63.1	-41.2	-179.8	-69.9	-35.4	0	0	0	111.8	K73 L77 I78 E79	K73-D75 PolarHBondContact O-N 2.97Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 3.46Å; D75-I78 PolarHBondContact O-N 3.4Å; D75-E79 WeakPolarHBondContact O-CB 3.47Å; D75-E79 PolarHBondContact O-N 3.02Å; D75-E79 VanDerWaalsContact O-N 3.09Å
76	K	74.8	Confident	70.6	Confident	160 Å²	160	113.4 Å²	113.4	70%	0.696	56%	0.556	S	S	*	*	H	α-helix	trans	-64.4	-34.6	178.4	-114	-177.3	178.5	-177.3	0	112.9	K73 L74 Q80	K73-K76 PolarHBondContact O-N 3.45Å; L74-K76 VanDerWaalsContact C-N 3.33Å; L74-K76 PolarHBondContact O-N 3.45Å; K76-Q80 PolarHBondContact O-N 2.92Å
77	L	71.8	Confident	71.6	Confident	32 Å²	32	110.3 Å²	110.3	17%	0.168	54%	0.536	C	S	.	.	H	α-helix	trans	-78.1	-38.2	-178.7	-88.3	168.6	0	0	0	112.7	F59 E63 K73 L74 D75 E79 R81	F59-L77 HydrophobicContact CE1-CD1 4.41Å; F59-L77 HydrophobicContact CE1-CD2 4.32Å; F59-L77 HydrophobicContact CZ-CD1 4.32Å; F59-L77 HydrophobicContact CZ-CD2 3.72Å; E63-L77 HydrophobicContact CB-CD1 3.55Å; E63-L77 HydrophobicContact CG-CD1 3.69Å; K73-L77 PolarHBondContact O-N 3.32Å; L74-L77 PolarHBondContact O-N 3.37Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 3.46Å; L77-E79 VanDerWaalsContact C-N 3.34Å; L77-R81 PolarHBondContact O-N 3.25Å
78	I	74.9	Confident	72.7	Confident	98 Å²	98	110 Å²	110	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-62.5	-47.3	174.3	-70.5	172.6	0	0	0	109.3	L74 D75 Q80 R81 T82	L74-I78 HydrophobicContact CD2-CD1 4.33Å; L74-I78 HydrophobicContact CG-CD1 4.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.08Å; L74-I78 PolarHBondContact O-N 3.22Å; D75-I78 PolarHBondContact O-N 3.4Å; I78-Q80 PolarHBondContact O-N 2.93Å; I78-R81 PolarHBondContact O-N 2.81Å; I78-T82 PolarHBondContact O-N 2.96Å; I78-T82 PolarHBondContact O-OG1 2.75Å
79	E	79.6	Confident	73.8	Confident	131 Å²	131	107.8 Å²	107.8	61%	0.612	52%	0.519	S	S	*	.	H	α-helix	trans	-60	-46.4	-179.8	-163	172.1	-153.7	0	0	111.9	D75 L77 R81 T82 V83	D75-E79 WeakPolarHBondContact O-CB 3.47Å; D75-E79 PolarHBondContact O-N 3.02Å; D75-E79 VanDerWaalsContact O-N 3.09Å; L77-E79 VanDerWaalsContact C-N 3.34Å; E79-R81 PolarHBondContact O-N 3.46Å; E79-T82 PolarHBondContact O-N 3.42Å; E79-T82 PolarHBondContact O-OG1 3.42Å; E79-T82 VanDerWaalsContact O-OG1 3.06Å; E79-V83 VanDerWaalsContact O-CG2 3.29Å; E79-V83 WeakPolarHBondContact O-CG2 2.9Å; E79-V83 PolarHBondContact O-N 3.03Å; E79-V83 VanDerWaalsContact O-N 3.09Å
80	Q	77.4	Confident	74.5	Confident	137 Å²	137	105.7 Å²	105.7	64%	0.64	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-42.5	174.8	-85.6	-175.1	-21	0	0	113.2	K76 I78 S84	K76-Q80 PolarHBondContact O-N 2.92Å; I78-Q80 PolarHBondContact O-N 2.93Å; Q80-S84 WeakPolarHBondContact O-CB 3.36Å; Q80-S84 PolarHBondContact O-N 3.18Å; Q80-S84 VanDerWaalsContact O-N 3.09Å
81	R	78.7	Confident	75.2	Confident	149 Å²	149	109.5 Å²	109.5	56%	0.562	53%	0.527	S	S	*	.	H	α-helix	trans	-71.8	-38.6	-178.5	-84.2	-69.4	-163.7	-159	2.4	112.8	L77 I78 E79 S84 K85	L77-R81 PolarHBondContact O-N 3.25Å; I78-R81 PolarHBondContact O-N 2.81Å; E79-R81 PolarHBondContact O-N 3.46Å; R81-S84 PolarHBondContact O-N 3.4Å; R81-K85 PolarHBondContact O-N 3.49Å
82	T	79.3	Confident	75.8	Confident	76 Å²	76	109.5 Å²	109.5	47%	0.466	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-41.4	175.9	32.6	0	0	0	0	112.5	I78 E79 S84 K85 M86	I78-T82 PolarHBondContact O-N 2.96Å; I78-T82 PolarHBondContact O-OG1 2.75Å; E79-T82 PolarHBondContact O-N 3.42Å; E79-T82 PolarHBondContact O-OG1 3.42Å; E79-T82 VanDerWaalsContact O-OG1 3.06Å; T82-S84 VanDerWaalsContact C-N 3.32Å; T82-S84 PolarHBondContact O-N 2.84Å; T82-K85 PolarHBondContact O-N 3.36Å; T82-M86 PolarHBondContact O-N 3.5Å
83	V	80.9	Confident	76.2	Confident	73 Å²	73	106.2 Å²	106.2	44%	0.442	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-44.1	175	170.4	0	0	0	0	110.4	E79 K85 M86 Q87	E79-V83 VanDerWaalsContact O-CG2 3.29Å; E79-V83 WeakPolarHBondContact O-CG2 2.9Å; E79-V83 PolarHBondContact O-N 3.03Å; E79-V83 VanDerWaalsContact O-N 3.09Å; V83-K85 PolarHBondContact O-N 3.3Å; V83-M86 PolarHBondContact O-N 2.77Å; V83-Q87 WeakPolarHBondContact O-CB 3.48Å; V83-Q87 VanDerWaalsContact O-CG 3.32Å; V83-Q87 WeakPolarHBondContact O-CG 3.41Å; V83-Q87 PolarHBondContact O-N 2.96Å
84	S	77.3	Confident	76.5	Confident	47 Å²	47	103.4 Å²	103.4	33%	0.329	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-37	179.4	-157.9	0	0	0	0	112.6	Q80 R81 T82 L88	Q80-S84 WeakPolarHBondContact O-CB 3.36Å; Q80-S84 PolarHBondContact O-N 3.18Å; Q80-S84 VanDerWaalsContact O-N 3.09Å; R81-S84 PolarHBondContact O-N 3.4Å; T82-S84 VanDerWaalsContact C-N 3.32Å; T82-S84 PolarHBondContact O-N 2.84Å; S84-L88 PolarHBondContact O-N 3.23Å; S84-L88 VanDerWaalsContact O-N 3.08Å
85	K	79.9	Confident	76.3	Confident	124 Å²	124	104.6 Å²	104.6	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-48.2	174.3	-178	-176.5	169	-176.4	0	112.2	R81 T82 V83 Q87 L88 E89	R81-K85 PolarHBondContact O-N 3.49Å; T82-K85 PolarHBondContact O-N 3.36Å; V83-K85 PolarHBondContact O-N 3.3Å; K85-Q87 VanDerWaalsContact C-N 3.32Å; K85-Q87 PolarHBondContact O-N 3.25Å; K85-L88 PolarHBondContact O-N 2.96Å; K85-E89 WeakPolarHBondContact CE-OE1 3.38Å; K85-E89 IonicContact NZ-OE1 3.86Å; K85-E89 PolarHBondContact O-N 2.86Å
86	M	81.6	Confident	76.2	Confident	139 Å²	139	102.1 Å²	102.1	69%	0.685	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-40.7	178.2	-76.2	-176.2	98.9	0	0	111.5	T82 V83 L88 E89 E90	T82-M86 PolarHBondContact O-N 3.5Å; V83-M86 PolarHBondContact O-N 2.77Å; M86-L88 VanDerWaalsContact C-N 3.34Å; M86-L88 PolarHBondContact O-N 3.5Å; M86-E89 PolarHBondContact O-N 3.34Å; M86-E90 VanDerWaalsContact O-CB 3.31Å; M86-E90 WeakPolarHBondContact O-CB 3.25Å; M86-E90 PolarHBondContact O-N 2.73Å
87	Q	78.4	Confident	76.1	Confident	104 Å²	104	97.3 Å²	97.3	49%	0.486	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175	-76.5	176.7	-16	0	0	112.6	V83 K85 Q91	V83-Q87 WeakPolarHBondContact O-CB 3.48Å; V83-Q87 VanDerWaalsContact O-CG 3.32Å; V83-Q87 WeakPolarHBondContact O-CG 3.41Å; V83-Q87 PolarHBondContact O-N 2.96Å; K85-Q87 VanDerWaalsContact C-N 3.32Å; K85-Q87 PolarHBondContact O-N 3.25Å; Q87-Q91 WeakPolarHBondContact O-CB 3.17Å; Q87-Q91 WeakPolarHBondContact O-CG 3.32Å; Q87-Q91 PolarHBondContact O-N 3.08Å
88	L	76.8	Confident	76.1	Confident	99 Å²	99	99.7 Å²	99.7	52%	0.518	51%	0.509	S	S	.	.	H	α-helix	trans	-69	-42.2	176.8	-82.4	160.3	0	0	0	112.4	S84 K85 M86 Q91 V92	S84-L88 PolarHBondContact O-N 3.23Å; S84-L88 VanDerWaalsContact O-N 3.08Å; K85-L88 PolarHBondContact O-N 2.96Å; M86-L88 VanDerWaalsContact C-N 3.34Å; M86-L88 PolarHBondContact O-N 3.5Å; L88-Q91 PolarHBondContact O-N 2.94Å; L88-V92 VanDerWaalsContact O-CG2 3.3Å; L88-V92 WeakPolarHBondContact O-CG2 3.21Å; L88-V92 PolarHBondContact O-N 2.84Å
89	E	78.5	Confident	75.8	Confident	102 Å²	102	99 Å²	99	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-41.8	177.2	-75.1	175.8	168.4	0	0	111.7	K85 M86 V92 L93	K85-E89 WeakPolarHBondContact CE-OE1 3.38Å; K85-E89 IonicContact NZ-OE1 3.86Å; K85-E89 PolarHBondContact O-N 2.86Å; M86-E89 PolarHBondContact O-N 3.34Å; E89-V92 PolarHBondContact O-N 3.38Å; E89-L93 WeakPolarHBondContact O-CB 3.36Å; E89-L93 PolarHBondContact O-N 2.82Å
90	E	77.4	Confident	75.5	Confident	132 Å²	132	96.2 Å²	96.2	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-64.4	-43.2	174.4	-172.8	175.9	-165.9	0	0	111.6	M86 V92 L93 T94	M86-E90 VanDerWaalsContact O-CB 3.31Å; M86-E90 WeakPolarHBondContact O-CB 3.25Å; M86-E90 PolarHBondContact O-N 2.73Å; E90-V92 PolarHBondContact O-N 2.79Å; E90-L93 PolarHBondContact O-N 3.46Å; E90-T94 WeakPolarHBondContact O-CB 3.43Å; E90-T94 PolarHBondContact O-N 2.75Å; E90-T94 PolarHBondContact O-OG1 3.12Å
91	Q	75	Confident	75.5	Confident	112 Å²	112	97 Å²	97	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-44.9	174.9	-78.9	176.7	12.2	0	0	111.9	Q87 L88 T94 I95	Q87-Q91 WeakPolarHBondContact O-CB 3.17Å; Q87-Q91 WeakPolarHBondContact O-CG 3.32Å; Q87-Q91 PolarHBondContact O-N 3.08Å; L88-Q91 PolarHBondContact O-N 2.94Å; Q91-T94 PolarHBondContact O-N 3.18Å; Q91-I95 HydrophobicContact CB-CD1 4.49Å; Q91-I95 WeakPolarHBondContact O-CB 3.2Å; Q91-I95 WeakPolarHBondContact O-CD1 3.19Å; Q91-I95 WeakPolarHBondContact O-CG1 3.44Å; Q91-I95 PolarHBondContact O-N 3.39Å
92	V	74.8	Confident	75.2	Confident	91 Å²	91	97.4 Å²	97.4	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-66.2	-40.2	-179.8	170.9	0	0	0	0	112	L88 E89 E90 I95 S96	L88-V92 VanDerWaalsContact O-CG2 3.3Å; L88-V92 WeakPolarHBondContact O-CG2 3.21Å; L88-V92 PolarHBondContact O-N 2.84Å; E89-V92 PolarHBondContact O-N 3.38Å; E90-V92 PolarHBondContact O-N 2.79Å; V92-I95 PolarHBondContact O-N 3.34Å; V92-S96 VanDerWaalsContact O-CB 3.26Å; V92-S96 WeakPolarHBondContact O-CB 3.07Å; V92-S96 PolarHBondContact O-N 3.41Å; V92-S96 PolarHBondContact O-OG 2.99Å
93	L	75.4	Confident	75	Confident	117 Å²	117	98.8 Å²	98.8	61%	0.613	51%	0.505	S	S	*	.	H	α-helix	trans	-67.2	-37.9	175.3	-89.2	155.8	0	0	0	112.7	E89 E90 S96 S97	E89-L93 WeakPolarHBondContact O-CB 3.36Å; E89-L93 PolarHBondContact O-N 2.82Å; E90-L93 PolarHBondContact O-N 3.46Å; L93-S96 PolarHBondContact O-OG 3.35Å; L93-S97 WeakPolarHBondContact O-CB 3.37Å; L93-S97 PolarHBondContact O-N 3.32Å; L93-S97 PolarHBondContact O-OG 2.98Å
94	T	71.5	Confident	75	Confident	62 Å²	62	102 Å²	102	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-68.3	-43.6	175.9	-50.2	0	0	0	0	110.3	E90 Q91 S97 E98	E90-T94 WeakPolarHBondContact O-CB 3.43Å; E90-T94 PolarHBondContact O-N 2.75Å; E90-T94 PolarHBondContact O-OG1 3.12Å; Q91-T94 PolarHBondContact O-N 3.18Å; T94-S97 PolarHBondContact O-N 3.4Å; T94-S97 PolarHBondContact O-OG 2.83Å; T94-E98 HydrophobicContact CG2-CG 4.25Å; T94-E98 WeakPolarHBondContact O-CB 3.3Å; T94-E98 WeakPolarHBondContact O-CG 3.11Å; T94-E98 PolarHBondContact O-N 3.49Å
95	I	68.3	Low	75.2	Confident	89 Å²	89	102.5 Å²	102.5	46%	0.456	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-44.1	177.2	-71.9	169.1	0	0	0	111.3	Q91 V92 S97 I99	Q91-I95 HydrophobicContact CB-CD1 4.49Å; Q91-I95 WeakPolarHBondContact O-CB 3.2Å; Q91-I95 WeakPolarHBondContact O-CD1 3.19Å; Q91-I95 WeakPolarHBondContact O-CG1 3.44Å; Q91-I95 PolarHBondContact O-N 3.39Å; V92-I95 PolarHBondContact O-N 3.34Å; I95-S97 VanDerWaalsContact C-N 3.32Å; I95-S97 PolarHBondContact O-N 2.74Å; I95-I99 HydrophobicContact CG2-CD1 3.36Å; I95-I99 HydrophobicContact CG2-CG1 4.07Å; I95-I99 VanDerWaalsContact O-CB 3.23Å; I95-I99 WeakPolarHBondContact O-CB 3.34Å; I95-I99 WeakPolarHBondContact O-CG1 3.26Å; I95-I99 PolarHBondContact O-N 2.75Å
96	S	67.5	Low	75.1	Confident	70 Å²	70	99.3 Å²	99.3	49%	0.49	52%	0.515	S	S	.	.	H	α-helix	trans	-70.5	-26.3	-177.8	72.1	0	0	0	0	113.5	V92 L93 P100	V92-S96 VanDerWaalsContact O-CB 3.26Å; V92-S96 WeakPolarHBondContact O-CB 3.07Å; V92-S96 PolarHBondContact O-N 3.41Å; V92-S96 PolarHBondContact O-OG 2.99Å; L93-S96 PolarHBondContact O-OG 3.35Å; S96-P100 WeakPolarHBondContact O-CD 3.34Å; S96-P100 WeakPolarHBondContact O-CG 3.2Å
97	S	72	Confident	75.2	Confident	60 Å²	60	97.5 Å²	97.5	42%	0.42	51%	0.508	S	S	.	.	H	α-helix	trans	-93.9	-31.6	177.1	64.2	0	0	0	0	113.8	L93 T94 I95 K101	L93-S97 WeakPolarHBondContact O-CB 3.37Å; L93-S97 PolarHBondContact O-N 3.32Å; L93-S97 PolarHBondContact O-OG 2.98Å; T94-S97 PolarHBondContact O-N 3.4Å; T94-S97 PolarHBondContact O-OG 2.83Å; I95-S97 VanDerWaalsContact C-N 3.32Å; I95-S97 PolarHBondContact O-N 2.74Å; S97-K101 WeakPolarHBondContact O-CG 3.44Å
98	E	72.1	Confident	75.6	Confident	82 Å²	82	98.3 Å²	98.3	38%	0.383	51%	0.51	S	S	.	.	H	α-helix	trans	-81.1	-38.3	176.4	-76.7	-162.5	156.6	0	0	113.1	T94 K101 R102	T94-E98 HydrophobicContact CG2-CG 4.25Å; T94-E98 WeakPolarHBondContact O-CB 3.3Å; T94-E98 WeakPolarHBondContact O-CG 3.11Å; T94-E98 PolarHBondContact O-N 3.49Å; E98-K101 CarbonylContact O-C 3.54Å; E98-K101 PolarHBondContact O-N 3.26Å; E98-R102 WeakPolarHBondContact O-CB 3.26Å; E98-R102 WeakPolarHBondContact O-CG 3.18Å; E98-R102 PolarHBondContact O-N 3.3Å; E98-R102 IonicContact OE2-CZ 3.69Å; E98-R102 IonicContact OE2-NE 2.75Å; E98-R102 PolarHBondContact OE2-NE 2.81Å; E98-R102 IonicContact OE2-NH2 3.36Å; E98-R102 PolarHBondContact OE2-NH2 3.19Å
99	I	69.7	Low	76	Confident	84 Å²	84	97.8 Å²	97.8	43%	0.431	51%	0.507	S	S	.	.	H	α-helix	trans	-60.4	-48.5	-175.6	-72.4	-178.9	0	0	0	112.2	I95 K101 R102 I103	I95-I99 HydrophobicContact CG2-CD1 3.36Å; I95-I99 HydrophobicContact CG2-CG1 4.07Å; I95-I99 VanDerWaalsContact O-CB 3.23Å; I95-I99 WeakPolarHBondContact O-CB 3.34Å; I95-I99 WeakPolarHBondContact O-CG1 3.26Å; I95-I99 PolarHBondContact O-N 2.75Å; I99-K101 VanDerWaalsContact C-N 3.3Å; I99-K101 PolarHBondContact O-N 2.8Å; I99-R102 PolarHBondContact O-N 3.49Å; I99-I103 HydrophobicContact CG2-CD1 3.5Å; I99-I103 HydrophobicContact CG2-CG1 4.11Å; I99-I103 WeakPolarHBondContact O-CB 3.25Å; I99-I103 VanDerWaalsContact O-CG1 3.26Å; I99-I103 WeakPolarHBondContact O-CG1 3.22Å; I99-I103 PolarHBondContact O-N 2.78Å
100	P	73.5	Confident	76.1	Confident	72 Å²	72	95.8 Å²	95.8	47%	0.468	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-37.7	177.8	-22.9	34.2	0	0	0	112.3	S96 Q104	S96-P100 WeakPolarHBondContact O-CD 3.34Å; S96-P100 WeakPolarHBondContact O-CG 3.2Å; P100-Q104 WeakPolarHBondContact O-CB 3.07Å; P100-Q104 PolarHBondContact O-N 2.79Å
101	K	76.1	Confident	76.5	Confident	152 Å²	152	94.5 Å²	94.5	66%	0.661	50%	0.502	S	S	*	.	H	α-helix	trans	-68.1	-40.3	175.9	-69.8	-179.6	-176.8	175.2	0	111.9	S97 E98 I99 Q104 S105	S97-K101 WeakPolarHBondContact O-CG 3.44Å; E98-K101 CarbonylContact O-C 3.54Å; E98-K101 PolarHBondContact O-N 3.26Å; I99-K101 VanDerWaalsContact C-N 3.3Å; I99-K101 PolarHBondContact O-N 2.8Å; K101-Q104 PolarHBondContact O-N 3.48Å; K101-S105 VanDerWaalsContact O-CB 3.25Å; K101-S105 WeakPolarHBondContact O-CB 3.36Å; K101-S105 PolarHBondContact O-N 3.06Å; K101-S105 PolarHBondContact O-OG 3.16Å
102	R	74.2	Confident	77.2	Confident	159 Å²	159	92.5 Å²	92.5	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-66.4	-44.5	175	-76.7	-173.5	-170.6	-166.9	6.7	110.8	E98 I99 S105 A106	E98-R102 WeakPolarHBondContact O-CB 3.26Å; E98-R102 WeakPolarHBondContact O-CG 3.18Å; E98-R102 PolarHBondContact O-N 3.3Å; E98-R102 IonicContact OE2-CZ 3.69Å; E98-R102 IonicContact OE2-NE 2.75Å; E98-R102 PolarHBondContact OE2-NE 2.81Å; E98-R102 IonicContact OE2-NH2 3.36Å; E98-R102 PolarHBondContact OE2-NH2 3.19Å; I99-R102 PolarHBondContact O-N 3.49Å; R102-S105 WeakPolarHBondContact CA-OG 3.26Å; R102-S105 PolarHBondContact O-N 2.82Å; R102-S105 PolarHBondContact O-OG 3.49Å; R102-A106 WeakPolarHBondContact O-CB 3.38Å; R102-A106 PolarHBondContact O-N 2.87Å
103	I	74.6	Confident	77.6	Confident	104 Å²	104	91.6 Å²	91.6	53%	0.533	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-44.6	174.7	-68.7	171.6	0	0	0	110.3	I99 A106 L107	I99-I103 HydrophobicContact CG2-CD1 3.5Å; I99-I103 HydrophobicContact CG2-CG1 4.11Å; I99-I103 WeakPolarHBondContact O-CB 3.25Å; I99-I103 VanDerWaalsContact O-CG1 3.26Å; I99-I103 WeakPolarHBondContact O-CG1 3.22Å; I99-I103 PolarHBondContact O-N 2.78Å; I103-A106 CarbonylContact O-C 3.59Å; I103-A106 PolarHBondContact O-N 3.15Å; I103-L107 VanDerWaalsContact O-CB 3.28Å; I103-L107 WeakPolarHBondContact O-CB 3.48Å; I103-L107 PolarHBondContact O-N 3.14Å
104	Q	79.6	Confident	78.2	Confident	142 Å²	142	92.7 Å²	92.7	66%	0.664	49%	0.49	S	S	*	.	H	α-helix	trans	-67.8	-37.2	178	-166.9	168.2	17	0	0	111.9	P100 K101 L107 K108	P100-Q104 WeakPolarHBondContact O-CB 3.07Å; P100-Q104 PolarHBondContact O-N 2.79Å; K101-Q104 PolarHBondContact O-N 3.48Å; Q104-L107 PolarHBondContact O-N 3.04Å; Q104-K108 VanDerWaalsContact O-CB 3.26Å; Q104-K108 WeakPolarHBondContact O-CB 3.26Å; Q104-K108 PolarHBondContact O-N 3.09Å
105	S	81.3	Confident	78.9	Confident	57 Å²	57	98 Å²	98	40%	0.399	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-38.6	171.9	75.7	0	0	0	0	111.9	K101 R102 K108 N109	K101-S105 VanDerWaalsContact O-CB 3.25Å; K101-S105 WeakPolarHBondContact O-CB 3.36Å; K101-S105 PolarHBondContact O-N 3.06Å; K101-S105 PolarHBondContact O-OG 3.16Å; R102-S105 WeakPolarHBondContact CA-OG 3.26Å; R102-S105 PolarHBondContact O-N 2.82Å; R102-S105 PolarHBondContact O-OG 3.49Å; S105-K108 PolarHBondContact O-N 3.36Å; S105-N109 VanDerWaalsContact O-CB 3.25Å; S105-N109 WeakPolarHBondContact O-CB 3.33Å; S105-N109 PolarHBondContact O-N 3.34Å; S105-N109 PolarHBondContact O-OD1 2.79Å
106	A	79.4	Confident	79.9	Confident	56 Å²	56	99 Å²	99	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-37.2	176.9	0	0	0	0	0	111.1	R102 I103 A110	R102-A106 WeakPolarHBondContact O-CB 3.38Å; R102-A106 PolarHBondContact O-N 2.87Å; I103-A106 CarbonylContact O-C 3.59Å; I103-A106 PolarHBondContact O-N 3.15Å; A106-A110 VanDerWaalsContact O-CB 3.22Å; A106-A110 WeakPolarHBondContact O-CB 3.38Å; A106-A110 PolarHBondContact O-N 3.3Å
107	L	84	Confident	80.7	Confident	101 Å²	101	100.7 Å²	100.7	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-46	174.4	-158.6	94.2	0	0	0	110.3	I103 Q104 A110 E111	I103-L107 VanDerWaalsContact O-CB 3.28Å; I103-L107 WeakPolarHBondContact O-CB 3.48Å; I103-L107 PolarHBondContact O-N 3.14Å; Q104-L107 PolarHBondContact O-N 3.04Å; L107-A110 PolarHBondContact O-N 3.31Å; L107-E111 WeakPolarHBondContact O-CB 3.2Å; L107-E111 WeakPolarHBondContact O-CG 3.23Å; L107-E111 PolarHBondContact O-N 3.27Å
108	K	86.1	Confident	81.4	Confident	122 Å²	122	101.5 Å²	101.5	53%	0.53	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-44	175.2	-169.1	-173.5	179.9	-154.2	0	111.3	Q104 S105 A110 E111 E112	Q104-K108 VanDerWaalsContact O-CB 3.26Å; Q104-K108 WeakPolarHBondContact O-CB 3.26Å; Q104-K108 PolarHBondContact O-N 3.09Å; S105-K108 PolarHBondContact O-N 3.36Å; K108-A110 VanDerWaalsContact C-N 3.34Å; K108-A110 PolarHBondContact O-N 3.45Å; K108-E111 PolarHBondContact O-N 3.19Å; K108-E112 WeakPolarHBondContact CE-OE1 3.28Å; K108-E112 IonicContact NZ-OE1 3.42Å; K108-E112 WeakPolarHBondContact O-CB 3.41Å; K108-E112 WeakPolarHBondContact O-CG 3.4Å; K108-E112 PolarHBondContact O-N 3.12Å
109	N	84.6	Confident	82.3	Confident	88 Å²	88	102.6 Å²	102.6	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-40.2	174.1	-73.2	-3.2	0	0	0	111.1	S105 E112 S113	S105-N109 VanDerWaalsContact O-CB 3.25Å; S105-N109 WeakPolarHBondContact O-CB 3.33Å; S105-N109 PolarHBondContact O-N 3.34Å; S105-N109 PolarHBondContact O-OD1 2.79Å; N109-E112 PolarHBondContact O-N 3.38Å; N109-S113 VanDerWaalsContact O-CB 3.26Å; N109-S113 WeakPolarHBondContact O-CB 3.37Å; N109-S113 PolarHBondContact O-N 3.42Å; N109-S113 PolarHBondContact O-OG 2.88Å
110	A	81.5	Confident	83.2	Confident	59 Å²	59	104.9 Å²	104.9	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-38	176.3	0	0	0	0	0	112	A106 L107 K108 K114	A106-A110 VanDerWaalsContact O-CB 3.22Å; A106-A110 WeakPolarHBondContact O-CB 3.38Å; A106-A110 PolarHBondContact O-N 3.3Å; L107-A110 PolarHBondContact O-N 3.31Å; K108-A110 VanDerWaalsContact C-N 3.34Å; K108-A110 PolarHBondContact O-N 3.45Å; A110-K114 VanDerWaalsContact O-CB 3.26Å; A110-K114 WeakPolarHBondContact O-CB 3.36Å; A110-K114 PolarHBondContact O-N 3.48Å
111	E	86.2	Confident	83.8	Confident	106 Å²	106	105.2 Å²	105.2	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-42.2	173.4	-75.3	178.4	174.5	0	0	112	L107 K108 K114 R115	L107-E111 WeakPolarHBondContact O-CB 3.2Å; L107-E111 WeakPolarHBondContact O-CG 3.23Å; L107-E111 PolarHBondContact O-N 3.27Å; K108-E111 PolarHBondContact O-N 3.19Å; E111-K114 PolarHBondContact O-N 3.24Å; E111-R115 PolarHBondContact O-N 2.8Å
112	E	88.3	Confident	84.3	Confident	69 Å²	69	104.3 Å²	104.3	32%	0.322	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-46.7	173.5	-76.1	176.5	-172.6	0	0	110.7	K108 N109 K114 R115 F116	K108-E112 WeakPolarHBondContact CE-OE1 3.28Å; K108-E112 IonicContact NZ-OE1 3.42Å; K108-E112 WeakPolarHBondContact O-CB 3.41Å; K108-E112 WeakPolarHBondContact O-CG 3.4Å; K108-E112 PolarHBondContact O-N 3.12Å; N109-E112 PolarHBondContact O-N 3.38Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 3.23Å; E112-R115 WeakPolarHBondContact O-CB 3.3Å; E112-R115 PolarHBondContact O-N 2.83Å; E112-R115 VanDerWaalsContact O-N 3.12Å; E112-F116 HydrophobicContact CB-CE2 4.3Å; E112-F116 WeakPolarHBondContact O-CD2 3.49Å; E112-F116 PolarHBondContact O-N 3.38Å
113	S	83.5	Confident	85	Confident	73 Å²	73	102.3 Å²	102.3	51%	0.51	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-38.8	173.4	-66.9	0	0	0	0	112.2	N109 F116 L117	N109-S113 VanDerWaalsContact O-CB 3.26Å; N109-S113 WeakPolarHBondContact O-CB 3.37Å; N109-S113 PolarHBondContact O-N 3.42Å; N109-S113 PolarHBondContact O-OG 2.88Å; S113-F116 PolarHBondContact O-N 2.9Å; S113-L117 VanDerWaalsContact O-CB 3.31Å; S113-L117 WeakPolarHBondContact O-CB 3.41Å; S113-L117 PolarHBondContact O-N 2.83Å
114	K	87.9	Confident	85.6	Confident	139 Å²	139	103.1 Å²	103.1	60%	0.604	51%	0.514	S	S	*	.	H	α-helix	trans	-65.2	-41	173.9	-176.9	-179.4	179.3	-179.8	0	111.5	A110 E111 E112 L117 N118	A110-K114 VanDerWaalsContact O-CB 3.26Å; A110-K114 WeakPolarHBondContact O-CB 3.36Å; A110-K114 PolarHBondContact O-N 3.48Å; E111-K114 PolarHBondContact O-N 3.24Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 3.23Å; K114-L117 PolarHBondContact O-N 2.87Å; K114-N118 WeakPolarHBondContact O-CB 3.12Å; K114-N118 VanDerWaalsContact O-CG 3.25Å; K114-N118 PolarHBondContact O-N 3.43Å
115	R	87.6	Confident	85.9	Confident	174 Å²	174	100.5 Å²	100.5	66%	0.657	51%	0.508	S	S	*	.	H	α-helix	trans	-62.8	-44.6	173.1	-79.3	-174.9	-171.1	151.8	5.5	111.6	E111 E112 N118 Q119	E111-R115 PolarHBondContact O-N 2.8Å; E112-R115 WeakPolarHBondContact O-CB 3.3Å; E112-R115 PolarHBondContact O-N 2.83Å; E112-R115 VanDerWaalsContact O-N 3.12Å; R115-N118 PolarHBondContact O-N 3.37Å; R115-Q119 PolarHBondContact O-N 3.35Å
116	F	87.7	Confident	86.2	Confident	110 Å²	110	104.2 Å²	104.2	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-42.6	175.9	-72.4	-56.8	0	0	0	111.8	E112 S113 N118 Q119 F120	E112-F116 HydrophobicContact CB-CE2 4.3Å; E112-F116 WeakPolarHBondContact O-CD2 3.49Å; E112-F116 PolarHBondContact O-N 3.38Å; S113-F116 PolarHBondContact O-N 2.9Å; F116-N118 VanDerWaalsContact C-N 3.35Å; F116-N118 PolarHBondContact O-N 2.92Å; F116-Q119 CarbonylContact O-C 3.59Å; F116-Q119 WeakPolarHBondContact O-CB 3.41Å; F116-Q119 PolarHBondContact O-N 3.36Å; F116-F120 HydrophobicContact CB-CD2 4.49Å; F116-F120 HydrophobicContact CB-CE2 4.39Å; F116-F120 WeakPolarHBondContact O-CB 3.49Å; F116-F120 WeakPolarHBondContact O-CD2 3.26Å; F116-F120 WeakPolarHBondContact O-CG 3.31Å; F116-F120 PolarHBondContact O-N 2.96Å
117	L	85.1	Confident	86.6	Confident	105 Å²	105	106.7 Å²	106.7	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-44.8	175.8	-168.4	84.7	0	0	0	111.2	S113 K114 Q119 F120 L121	S113-L117 VanDerWaalsContact O-CB 3.31Å; S113-L117 WeakPolarHBondContact O-CB 3.41Å; S113-L117 PolarHBondContact O-N 2.83Å; K114-L117 PolarHBondContact O-N 2.87Å; L117-Q119 VanDerWaalsContact C-N 3.35Å; L117-F120 PolarHBondContact O-N 3.49Å; L117-L121 HydrophobicContact CD2-CD1 4.37Å; L117-L121 HydrophobicContact CG-CD1 4.22Å; L117-L121 WeakPolarHBondContact O-CB 3.49Å; L117-L121 WeakPolarHBondContact O-CG 3.2Å; L117-L121 PolarHBondContact O-N 2.75Å
118	N	87.7	Confident	86.8	Confident	78 Å²	78	108.4 Å²	108.4	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-41.1	176.1	-73.5	-6.4	0	0	0	111.5	K114 R115 F116 L121 E122	K114-N118 WeakPolarHBondContact O-CB 3.12Å; K114-N118 VanDerWaalsContact O-CG 3.25Å; K114-N118 PolarHBondContact O-N 3.43Å; R115-N118 PolarHBondContact O-N 3.37Å; F116-N118 VanDerWaalsContact C-N 3.35Å; F116-N118 PolarHBondContact O-N 2.92Å; N118-L121 PolarHBondContact O-N 3.25Å; N118-E122 WeakPolarHBondContact O-CB 3.27Å; N118-E122 WeakPolarHBondContact O-CG 3.49Å; N118-E122 PolarHBondContact O-N 3.43Å
119	Q	89.4	Confident	86.8	Confident	104 Å²	104	105.5 Å²	105.5	49%	0.486	52%	0.522	S	S	.	.	H	α-helix	trans	-62.6	-40.7	172.8	-81.3	-178	-20.6	0	0	112	R115 F116 L117 E122 Q123	R115-Q119 PolarHBondContact O-N 3.35Å; F116-Q119 CarbonylContact O-C 3.59Å; F116-Q119 WeakPolarHBondContact O-CB 3.41Å; F116-Q119 PolarHBondContact O-N 3.36Å; L117-Q119 VanDerWaalsContact C-N 3.35Å; Q119-E122 PolarHBondContact O-N 3.34Å; Q119-Q123 WeakPolarHBondContact O-CB 3.4Å; Q119-Q123 VanDerWaalsContact O-CG 3.3Å; Q119-Q123 WeakPolarHBondContact O-CG 3.45Å; Q119-Q123 PolarHBondContact O-N 2.85Å
120	F	88.1	Confident	86.9	Confident	132 Å²	132	102.9 Å²	102.9	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-37.9	175.9	-77.2	-54.4	0	0	0	112.1	F116 L117 Q123 E124	F116-F120 HydrophobicContact CB-CD2 4.49Å; F116-F120 HydrophobicContact CB-CE2 4.39Å; F116-F120 WeakPolarHBondContact O-CB 3.49Å; F116-F120 WeakPolarHBondContact O-CD2 3.26Å; F116-F120 WeakPolarHBondContact O-CG 3.31Å; F116-F120 PolarHBondContact O-N 2.96Å; L117-F120 PolarHBondContact O-N 3.49Å; F120-Q123 CarbonylContact O-C 3.6Å; F120-Q123 PolarHBondContact O-N 3.28Å; F120-E124 VanDerWaalsContact O-CB 3.26Å; F120-E124 WeakPolarHBondContact O-CB 3.45Å; F120-E124 PolarHBondContact O-N 3.48Å
121	L	87	Confident	87.2	Confident	80 Å²	80	104.1 Å²	104.1	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-40.3	172.8	-80.7	160	0	0	0	111.6	L117 N118 E124 T125	L117-L121 HydrophobicContact CD2-CD1 4.37Å; L117-L121 HydrophobicContact CG-CD1 4.22Å; L117-L121 WeakPolarHBondContact O-CB 3.49Å; L117-L121 WeakPolarHBondContact O-CG 3.2Å; L117-L121 PolarHBondContact O-N 2.75Å; N118-L121 PolarHBondContact O-N 3.25Å; L121-E124 PolarHBondContact O-N 2.9Å; L121-T125 WeakPolarHBondContact O-CB 3.23Å; L121-T125 VanDerWaalsContact O-CG2 3.28Å; L121-T125 WeakPolarHBondContact O-CG2 3.26Å; L121-T125 PolarHBondContact O-N 3.42Å; L121-T125 PolarHBondContact O-OG1 2.73Å
122	E	87.2	Confident	87.2	Confident	133 Å²	133	102 Å²	102	62%	0.621	50%	0.502	S	S	*	.	H	α-helix	trans	-64.5	-41.6	172.5	-78.9	178.5	179.5	0	0	111.5	N118 Q119 T125 H126	N118-E122 WeakPolarHBondContact O-CB 3.27Å; N118-E122 WeakPolarHBondContact O-CG 3.49Å; N118-E122 PolarHBondContact O-N 3.43Å; Q119-E122 PolarHBondContact O-N 3.34Å; E122-T125 WeakPolarHBondContact CA-OG1 3.35Å; E122-T125 PolarHBondContact O-OG1 2.83Å; E122-H126 VanDerWaalsContact O-CB 3.27Å; E122-H126 WeakPolarHBondContact O-CB 3.28Å; E122-H126 PolarHBondContact O-N 2.87Å
123	Q	88	Confident	87	Confident	117 Å²	117	101.9 Å²	101.9	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-66.1	-40	174.4	-75.9	177.7	-2.4	0	0	112.2	Q119 F120 H126 L127	Q119-Q123 WeakPolarHBondContact O-CB 3.4Å; Q119-Q123 VanDerWaalsContact O-CG 3.3Å; Q119-Q123 WeakPolarHBondContact O-CG 3.45Å; Q119-Q123 PolarHBondContact O-N 2.85Å; F120-Q123 CarbonylContact O-C 3.6Å; F120-Q123 PolarHBondContact O-N 3.28Å; Q123-H126 PolarHBondContact O-N 3.46Å; Q123-L127 WeakPolarHBondContact O-CB 3.43Å; Q123-L127 PolarHBondContact O-N 2.86Å
124	E	86.7	Confident	87.1	Confident	121 Å²	121	104.7 Å²	104.7	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-46.7	176.5	-177.8	-171.5	-173.3	0	0	110.5	F120 L121 H126 L127 F128	F120-E124 VanDerWaalsContact O-CB 3.26Å; F120-E124 WeakPolarHBondContact O-CB 3.45Å; F120-E124 PolarHBondContact O-N 3.48Å; L121-E124 PolarHBondContact O-N 2.9Å; E124-H126 VanDerWaalsContact C-N 3.34Å; E124-H126 PolarHBondContact O-N 2.82Å; E124-L127 PolarHBondContact O-N 2.86Å; E124-F128 WeakPolarHBondContact O-CB 3.09Å; E124-F128 PolarHBondContact O-N 2.76Å
125	T	86	Confident	86.9	Confident	87 Å²	87	102.3 Å²	102.3	53%	0.534	51%	0.507	S	S	.	.	H	α-helix	trans	-65	-39.6	177	50.7	0	0	0	0	111.5	L121 E122 S129	L121-T125 WeakPolarHBondContact O-CB 3.23Å; L121-T125 VanDerWaalsContact O-CG2 3.28Å; L121-T125 WeakPolarHBondContact O-CG2 3.26Å; L121-T125 PolarHBondContact O-N 3.42Å; L121-T125 PolarHBondContact O-OG1 2.73Å; E122-T125 WeakPolarHBondContact CA-OG1 3.35Å; E122-T125 PolarHBondContact O-OG1 2.83Å; T125-S129 WeakPolarHBondContact O-CB 3.21Å; T125-S129 PolarHBondContact O-N 3.38Å; T125-S129 PolarHBondContact O-OG 2.77Å
126	H	88.1	Confident	86.8	Confident	134 Å²	134	100.3 Å²	100.3	62%	0.62	51%	0.509	S	S	*	.	H	α-helix	trans	-64.4	-44	172.4	-174	-81.5	0	0	0	111.7	E122 Q123 E124 S129 A130	E122-H126 VanDerWaalsContact O-CB 3.27Å; E122-H126 WeakPolarHBondContact O-CB 3.28Å; E122-H126 PolarHBondContact O-N 2.87Å; Q123-H126 PolarHBondContact O-N 3.46Å; E124-H126 VanDerWaalsContact C-N 3.34Å; E124-H126 PolarHBondContact O-N 2.82Å; H126-S129 WeakPolarHBondContact CA-OG 3.49Å; H126-S129 PolarHBondContact O-N 3.35Å; H126-S129 PolarHBondContact O-OG 3.32Å; H126-A130 VanDerWaalsContact O-CB 3.23Å; H126-A130 WeakPolarHBondContact O-CB 3.35Å; H126-A130 PolarHBondContact O-N 2.92Å
127	L	88.1	Confident	86.6	Confident	108 Å²	108	98.8 Å²	98.8	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-65.9	-42.3	177.9	-165	78.9	0	0	0	111.1	Q123 E124 A130 I131	Q123-L127 WeakPolarHBondContact O-CB 3.43Å; Q123-L127 PolarHBondContact O-N 2.86Å; E124-L127 PolarHBondContact O-N 2.86Å; L127-A130 PolarHBondContact O-N 2.88Å; L127-I131 HydrophobicContact CD2-CD1 4.19Å; L127-I131 HydrophobicContact CG-CD1 3.92Å; L127-I131 HydrophobicContact CG-CG1 4.47Å; L127-I131 WeakPolarHBondContact O-CB 3.47Å; L127-I131 WeakPolarHBondContact O-CG1 3.2Å; L127-I131 PolarHBondContact O-N 2.57Å
128	F	87.8	Confident	86.6	Confident	137 Å²	137	94.4 Å²	94.4	60%	0.601	49%	0.488	S	S	*	.	H	α-helix	trans	-63.2	-44.3	177.2	-177.4	-100.2	0	0	0	111.4	E124 I131 N132	E124-F128 WeakPolarHBondContact O-CB 3.09Å; E124-F128 PolarHBondContact O-N 2.76Å; F128-I131 PolarHBondContact O-N 3.3Å; F128-N132 VanDerWaalsContact CD1-ND2 3.33Å; F128-N132 WeakPolarHBondContact CD1-ND2 3.37Å; F128-N132 WeakPolarHBondContact CE1-ND2 3.31Å; F128-N132 WeakPolarHBondContact CZ-ND2 3.29Å; F128-N132 WeakPolarHBondContact O-CB 3.17Å; F128-N132 PolarHBondContact O-N 2.88Å; F128-N132 PolarHBondContact O-ND2 3.16Å
129	S	85.8	Confident	86.4	Confident	62 Å²	62	94.8 Å²	94.8	43%	0.434	49%	0.487	S	S	.	.	H	α-helix	trans	-67.4	-38.4	174.3	58.9	0	0	0	0	112.3	T125 H126 N132 S133	T125-S129 WeakPolarHBondContact O-CB 3.21Å; T125-S129 PolarHBondContact O-N 3.38Å; T125-S129 PolarHBondContact O-OG 2.77Å; H126-S129 WeakPolarHBondContact CA-OG 3.49Å; H126-S129 PolarHBondContact O-N 3.35Å; H126-S129 PolarHBondContact O-OG 3.32Å; S129-N132 PolarHBondContact O-N 3.16Å; S129-S133 WeakPolarHBondContact O-CB 3.36Å; S129-S133 PolarHBondContact O-N 3.44Å
130	A	87.8	Confident	86.3	Confident	33 Å²	33	93.1 Å²	93.1	27%	0.273	49%	0.485	S	S	.	.	H	α-helix	trans	-64.7	-43.9	173.9	0	0	0	0	0	112	H126 L127 S133 H134	H126-A130 VanDerWaalsContact O-CB 3.23Å; H126-A130 WeakPolarHBondContact O-CB 3.35Å; H126-A130 PolarHBondContact O-N 2.92Å; L127-A130 PolarHBondContact O-N 2.88Å; A130-S133 PolarHBondContact O-N 3.37Å; A130-H134 WeakPolarHBondContact O-CB 3.06Å; A130-H134 PolarHBondContact O-CD2 2.81Å; A130-H134 VanDerWaalsContact O-CD2 3.28Å; A130-H134 PolarHBondContact O-N 2.62Å
131	I	86.5	Confident	86.1	Confident	85 Å²	85	94.2 Å²	94.2	44%	0.436	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-48.4	175.6	-71.9	166.3	0	0	0	110	L127 F128 S133 H134 L135	L127-I131 HydrophobicContact CD2-CD1 4.19Å; L127-I131 HydrophobicContact CG-CD1 3.92Å; L127-I131 HydrophobicContact CG-CG1 4.47Å; L127-I131 WeakPolarHBondContact O-CB 3.47Å; L127-I131 WeakPolarHBondContact O-CG1 3.2Å; L127-I131 PolarHBondContact O-N 2.57Å; F128-I131 PolarHBondContact O-N 3.3Å; I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 2.76Å; I131-H134 CarbonylContact O-C 3.46Å; I131-H134 PolarHBondContact O-N 3.5Å; I131-H134 VanDerWaalsContact O-N 3.16Å; I131-L135 HydrophobicContact CG2-CD1 3.87Å; I131-L135 HydrophobicContact CG2-CG 4.28Å; I131-L135 WeakPolarHBondContact O-CB 3.38Å; I131-L135 WeakPolarHBondContact O-CG 3.44Å; I131-L135 PolarHBondContact O-N 3.4Å
132	N	86.3	Confident	85.9	Confident	60 Å²	60	94.7 Å²	94.7	32%	0.321	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-38.6	177.8	-79.9	-38.5	0	0	0	112.2	F128 S129 H134 L135 L136	F128-N132 VanDerWaalsContact CD1-ND2 3.33Å; F128-N132 WeakPolarHBondContact CD1-ND2 3.37Å; F128-N132 WeakPolarHBondContact CE1-ND2 3.31Å; F128-N132 WeakPolarHBondContact CZ-ND2 3.29Å; F128-N132 WeakPolarHBondContact O-CB 3.17Å; F128-N132 PolarHBondContact O-N 2.88Å; F128-N132 PolarHBondContact O-ND2 3.16Å; S129-N132 PolarHBondContact O-N 3.16Å; N132-H134 VanDerWaalsContact C-N 3.35Å; N132-L135 PolarHBondContact O-N 2.81Å; N132-L136 VanDerWaalsContact O-CB 3.28Å; N132-L136 WeakPolarHBondContact O-CB 3.47Å; N132-L136 WeakPolarHBondContact O-CG 3.35Å; N132-L136 PolarHBondContact O-N 2.73Å
133	S	85.8	Confident	85.9	Confident	67 Å²	67	92.7 Å²	92.7	47%	0.469	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-44	172.8	-173.2	0	0	0	0	110.8	S129 A130 I131 T137	S129-S133 WeakPolarHBondContact O-CB 3.36Å; S129-S133 PolarHBondContact O-N 3.44Å; A130-S133 PolarHBondContact O-N 3.37Å; I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 2.76Å; S133-T137 VanDerWaalsContact O-CB 3.29Å; S133-T137 WeakPolarHBondContact O-CB 3.45Å; S133-T137 PolarHBondContact O-N 2.9Å; S133-T137 PolarHBondContact O-OG1 3.19Å
134	H	85.7	Confident	85.8	Confident	133 Å²	133	92.2 Å²	92.2	62%	0.616	48%	0.482	S	S	*	.	H	α-helix	trans	-64.2	-41.5	175.6	-92.4	-73	0	0	0	112.1	A130 I131 N132 T137 A138	A130-H134 WeakPolarHBondContact O-CB 3.06Å; A130-H134 PolarHBondContact O-CD2 2.81Å; A130-H134 VanDerWaalsContact O-CD2 3.28Å; A130-H134 PolarHBondContact O-N 2.62Å; I131-H134 CarbonylContact O-C 3.46Å; I131-H134 PolarHBondContact O-N 3.5Å; I131-H134 VanDerWaalsContact O-N 3.16Å; N132-H134 VanDerWaalsContact C-N 3.35Å; H134-T137 PolarHBondContact O-N 3.49Å; H134-A138 WeakPolarHBondContact O-CB 3.27Å; H134-A138 PolarHBondContact O-N 2.87Å
135	L	83.6	Confident	85.7	Confident	88 Å²	88	91.1 Å²	91.1	46%	0.461	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-45.5	176	-73.8	172.7	0	0	0	111.6	I131 N132 T137 A138 Q139	I131-L135 HydrophobicContact CG2-CD1 3.87Å; I131-L135 HydrophobicContact CG2-CG 4.28Å; I131-L135 WeakPolarHBondContact O-CB 3.38Å; I131-L135 WeakPolarHBondContact O-CG 3.44Å; I131-L135 PolarHBondContact O-N 3.4Å; N132-L135 PolarHBondContact O-N 2.81Å; L135-T137 VanDerWaalsContact C-N 3.29Å; L135-T137 PolarHBondContact O-N 2.91Å; L135-A138 CarbonylContact O-C 3.39Å; L135-A138 PolarHBondContact O-N 3.15Å; L135-A138 VanDerWaalsContact O-N 3.16Å; L135-Q139 WeakPolarHBondContact O-CB 3.34Å; L135-Q139 PolarHBondContact O-N 2.82Å
136	L	84.9	Confident	85.7	Confident	133 Å²	133	88.4 Å²	88.4	70%	0.696	47%	0.468	S	S	*	.	H	α-helix	trans	-62.2	-39.1	174.3	-81.7	163.3	0	0	0	111.7	N132 P140	N132-L136 VanDerWaalsContact O-CB 3.28Å; N132-L136 WeakPolarHBondContact O-CB 3.47Å; N132-L136 WeakPolarHBondContact O-CG 3.35Å; N132-L136 PolarHBondContact O-N 2.73Å; L136-P140 VanDerWaalsContact O-CD 3.27Å; L136-P140 WeakPolarHBondContact O-CD 3.28Å
137	T	83.9	Confident	85.8	Confident	77 Å²	77	84.3 Å²	84.3	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-66.5	-43.7	175	-51.1	0	0	0	0	109.3	S133 H134 L135 P140 W141	S133-T137 VanDerWaalsContact O-CB 3.29Å; S133-T137 WeakPolarHBondContact O-CB 3.45Å; S133-T137 PolarHBondContact O-N 2.9Å; S133-T137 PolarHBondContact O-OG1 3.19Å; H134-T137 PolarHBondContact O-N 3.49Å; L135-T137 VanDerWaalsContact C-N 3.29Å; L135-T137 PolarHBondContact O-N 2.91Å; T137-P140 VanDerWaalsContact O-CD 3.31Å; T137-P140 WeakPolarHBondContact O-CD 3.39Å; T137-W141 VanDerWaalsContact C-NE1 3.26Å; T137-W141 HydrophobicContact CG2-CZ2 4.33Å; T137-W141 PolarHBondContact O-NE1 2.78Å
138	A	83.7	Confident	85.7	Confident	14 Å²	14	84.2 Å²	84.2	12%	0.116	46%	0.456	C	S	.	.	H	α-helix	trans	-69	-29.2	-179	0	0	0	0	0	115.8	H134 L135 W141 M142	H134-A138 WeakPolarHBondContact O-CB 3.27Å; H134-A138 PolarHBondContact O-N 2.87Å; L135-A138 CarbonylContact O-C 3.39Å; L135-A138 PolarHBondContact O-N 3.15Å; L135-A138 VanDerWaalsContact O-N 3.16Å; A138-W141 VanDerWaalsContact CA-CZ2 3.48Å; A138-W141 VanDerWaalsContact CA-NE1 3.34Å; A138-W141 HydrophobicContact CB-CD2 4.36Å; A138-W141 HydrophobicContact CB-CH2 4.05Å; A138-W141 HydrophobicContact CB-CZ2 3.78Å; A138-W141 HydrophobicContact CB-CZ3 4.49Å; A138-W141 PolarHBondContact O-N 2.91Å; A138-W141 VanDerWaalsContact O-N 3.12Å; A138-M142 HydrophobicContact CB-CE 4.39Å; A138-M142 WeakPolarHBondContact O-CG 3.16Å; A138-M142 PolarHBondContact O-N 3.44Å
139	Q	84.9	Confident	85.7	Confident	86 Å²	86	81.4 Å²	81.4	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-54.9	-50	-175.5	-169.5	67.1	39.6	0	0	112.8	L135 W141 M142 D143	L135-Q139 WeakPolarHBondContact O-CB 3.34Å; L135-Q139 PolarHBondContact O-N 2.82Å; Q139-W141 VanDerWaalsContact C-N 3.32Å; Q139-W141 PolarHBondContact O-N 3.27Å; Q139-M142 PolarHBondContact O-N 2.82Å; Q139-M142 VanDerWaalsContact O-N 3.15Å; Q139-D143 PolarHBondContact NE2-OD1 2.82Å; Q139-D143 WeakPolarHBondContact O-CB 3.36Å; Q139-D143 PolarHBondContact O-N 3.12Å
140	P	87.1	Confident	85.9	Confident	69 Å²	69	81.7 Å²	81.7	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-54.1	-41.8	175.4	-20.7	21	0	0	0	114.5	L136 T137 D143 D144	L136-P140 VanDerWaalsContact O-CD 3.27Å; L136-P140 WeakPolarHBondContact O-CD 3.28Å; T137-P140 VanDerWaalsContact O-CD 3.31Å; T137-P140 WeakPolarHBondContact O-CD 3.39Å; P140-D143 PolarHBondContact O-N 3.43Å; P140-D144 WeakPolarHBondContact O-CB 2.97Å; P140-D144 PolarHBondContact O-N 2.85Å
141	W	84.3	Confident	86.1	Confident	155 Å²	155	85.7 Å²	85.7	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-77.9	-30.4	-178.8	16.9	-50.2	0	0	0	111.4	T137 A138 Q139 L145	T137-W141 VanDerWaalsContact C-NE1 3.26Å; T137-W141 HydrophobicContact CG2-CZ2 4.33Å; T137-W141 PolarHBondContact O-NE1 2.78Å; A138-W141 VanDerWaalsContact CA-CZ2 3.48Å; A138-W141 VanDerWaalsContact CA-NE1 3.34Å; A138-W141 HydrophobicContact CB-CD2 4.36Å; A138-W141 HydrophobicContact CB-CH2 4.05Å; A138-W141 HydrophobicContact CB-CZ2 3.78Å; A138-W141 HydrophobicContact CB-CZ3 4.49Å; A138-W141 PolarHBondContact O-N 2.91Å; A138-W141 VanDerWaalsContact O-N 3.12Å; Q139-W141 VanDerWaalsContact C-N 3.32Å; Q139-W141 PolarHBondContact O-N 3.27Å; W141-L145 WeakPolarHBondContact O-CB 3.33Å; W141-L145 PolarHBondContact O-N 3.36Å
142	M	82.1	Confident	86.3	Confident	90 Å²	90	86.1 Å²	86.1	44%	0.443	46%	0.464	S	S	.	.	H	α-helix	trans	-66.9	-39.3	169.7	-70.3	-168	-60.6	0	0	111.7	A138 Q139 G146	A138-M142 HydrophobicContact CB-CE 4.39Å; A138-M142 WeakPolarHBondContact O-CG 3.16Å; A138-M142 PolarHBondContact O-N 3.44Å; Q139-M142 PolarHBondContact O-N 2.82Å; Q139-M142 VanDerWaalsContact O-N 3.15Å; M142-G146 WeakPolarHBondContact O-CA 3.33Å; M142-G146 PolarHBondContact O-N 2.9Å
143	D	86.1	Confident	86.4	Confident	90 Å²	90	88.5 Å²	88.5	48%	0.481	47%	0.473	S	S	.	.	H	α-helix	trans	-67.4	-45.5	176	-65	-21.9	0	0	0	110.6	Q139 P140 G146 A147	Q139-D143 PolarHBondContact NE2-OD1 2.82Å; Q139-D143 WeakPolarHBondContact O-CB 3.36Å; Q139-D143 PolarHBondContact O-N 3.12Å; P140-D143 PolarHBondContact O-N 3.43Å; D143-G146 PolarHBondContact O-N 3.25Å; D143-A147 WeakPolarHBondContact O-CB 3.44Å; D143-A147 PolarHBondContact O-N 2.83Å
144	D	85.8	Confident	86.6	Confident	107 Å²	107	90.7 Å²	90.7	57%	0.572	48%	0.476	S	S	*	.	H	α-helix	trans	-62.9	-42.9	175.9	-74	-20.7	0	0	0	111.8	P140 A147 M148	P140-D144 WeakPolarHBondContact O-CB 2.97Å; P140-D144 PolarHBondContact O-N 2.85Å; D144-A147 PolarHBondContact O-N 2.8Å; D144-M148 WeakPolarHBondContact O-CG 3.25Å; D144-M148 PolarHBondContact O-N 2.91Å
145	L	86.4	Confident	86.9	Confident	98 Å²	98	89.6 Å²	89.6	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-71.3	-35.2	178	-164.2	134.6	0	0	0	111.3	W141 M148 I149	W141-L145 WeakPolarHBondContact O-CB 3.33Å; W141-L145 PolarHBondContact O-N 3.36Å; L145-M148 HydrophobicContact CB-CE 4.47Å; L145-M148 PolarHBondContact O-N 3.09Å; L145-I149 HydrophobicContact CD2-CD1 3.56Å; L145-I149 HydrophobicContact CD2-CG1 4.28Å; L145-I149 WeakPolarHBondContact O-CB 3.46Å; L145-I149 VanDerWaalsContact O-CG1 3.25Å; L145-I149 WeakPolarHBondContact O-CG1 3.46Å; L145-I149 PolarHBondContact O-N 2.78Å
146	G	85.9	Confident	87.2	Confident	30 Å²	30	91.2 Å²	91.2	31%	0.309	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-39.5	170.4	0	0	0	0	0	112.4	M142 D143 I149 S150	M142-G146 WeakPolarHBondContact O-CA 3.33Å; M142-G146 PolarHBondContact O-N 2.9Å; D143-G146 PolarHBondContact O-N 3.25Å; G146-I149 PolarHBondContact O-N 3.34Å; G146-S150 WeakPolarHBondContact O-CB 3.46Å; G146-S150 PolarHBondContact O-N 3.49Å; G146-S150 PolarHBondContact O-OG 3.46Å
147	A	89.1	Confident	87.4	Confident	48 Å²	48	93.5 Å²	93.5	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-65.7	-42.7	173.5	0	0	0	0	0	111.6	D143 D144 S150 Q151	D143-A147 WeakPolarHBondContact O-CB 3.44Å; D143-A147 PolarHBondContact O-N 2.83Å; D144-A147 PolarHBondContact O-N 2.8Å; A147-S150 PolarHBondContact O-N 2.91Å; A147-Q151 WeakPolarHBondContact O-CG 3.31Å; A147-Q151 PolarHBondContact O-N 3.36Å
148	M	86.9	Confident	87.7	Confident	106 Å²	106	94.9 Å²	94.9	52%	0.522	48%	0.479	S	S	.	.	H	α-helix	trans	-64.4	-42.1	174.3	-75.7	-169.3	-71.2	0	0	112.3	D144 L145 S150 Q151 I152	D144-M148 WeakPolarHBondContact O-CG 3.25Å; D144-M148 PolarHBondContact O-N 2.91Å; L145-M148 HydrophobicContact CB-CE 4.47Å; L145-M148 PolarHBondContact O-N 3.09Å; M148-S150 VanDerWaalsContact C-N 3.33Å; M148-S150 PolarHBondContact O-N 2.95Å; M148-Q151 PolarHBondContact O-N 3.35Å; M148-I152 VanDerWaalsContact O-CG1 3.31Å; M148-I152 WeakPolarHBondContact O-CG1 3.5Å; M148-I152 PolarHBondContact O-N 2.85Å
149	I	87.9	Confident	88.1	Confident	79 Å²	79	98.4 Å²	98.4	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-45.4	174.3	-72	169.3	0	0	0	110.1	L145 G146 Q151 I152 E153	L145-I149 HydrophobicContact CD2-CD1 3.56Å; L145-I149 HydrophobicContact CD2-CG1 4.28Å; L145-I149 WeakPolarHBondContact O-CB 3.46Å; L145-I149 VanDerWaalsContact O-CG1 3.25Å; L145-I149 WeakPolarHBondContact O-CG1 3.46Å; L145-I149 PolarHBondContact O-N 2.78Å; G146-I149 PolarHBondContact O-N 3.34Å; I149-Q151 VanDerWaalsContact C-N 3.3Å; I149-Q151 PolarHBondContact O-N 3.35Å; I149-I152 WeakPolarHBondContact O-CB 3.39Å; I149-I152 PolarHBondContact O-N 2.83Å; I149-I152 VanDerWaalsContact O-N 3.09Å; I149-E153 HydrophobicContact CG2-CG 4.37Å; I149-E153 WeakPolarHBondContact O-CG 3.44Å; I149-E153 PolarHBondContact O-N 2.88Å
150	S	88.9	Confident	88.3	Confident	68 Å²	68	96.3 Å²	96.3	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-39.6	177	-56.6	0	0	0	0	112	G146 A147 M148 E153 E154	G146-S150 WeakPolarHBondContact O-CB 3.46Å; G146-S150 PolarHBondContact O-N 3.49Å; G146-S150 PolarHBondContact O-OG 3.46Å; A147-S150 PolarHBondContact O-N 2.91Å; M148-S150 VanDerWaalsContact C-N 3.33Å; M148-S150 PolarHBondContact O-N 2.95Å; S150-E153 PolarHBondContact O-N 2.85Å; S150-E154 WeakPolarHBondContact O-CB 3.32Å; S150-E154 PolarHBondContact O-N 3.44Å
151	Q	92.1	Very high	88.5	Confident	117 Å²	117	96.7 Å²	96.7	55%	0.547	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-39.2	174.1	-74	176.6	5.5	0	0	112.2	A147 M148 I149 E154 I155	A147-Q151 WeakPolarHBondContact O-CG 3.31Å; A147-Q151 PolarHBondContact O-N 3.36Å; M148-Q151 PolarHBondContact O-N 3.35Å; I149-Q151 VanDerWaalsContact C-N 3.3Å; I149-Q151 PolarHBondContact O-N 3.35Å; Q151-E154 PolarHBondContact O-N 3.28Å; Q151-I155 VanDerWaalsContact O-CG1 3.27Å; Q151-I155 WeakPolarHBondContact O-CG1 3.48Å; Q151-I155 PolarHBondContact O-N 2.83Å
152	I	90.1	Very high	88.9	Confident	94 Å²	94	94.7 Å²	94.7	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-48.4	175	-70	166.3	0	0	0	109.8	M148 I149 E154 I155 E156	M148-I152 VanDerWaalsContact O-CG1 3.31Å; M148-I152 WeakPolarHBondContact O-CG1 3.5Å; M148-I152 PolarHBondContact O-N 2.85Å; I149-I152 WeakPolarHBondContact O-CB 3.39Å; I149-I152 PolarHBondContact O-N 2.83Å; I149-I152 VanDerWaalsContact O-N 3.09Å; I152-E154 VanDerWaalsContact C-N 3.29Å; I152-E154 PolarHBondContact O-N 2.88Å; I152-I155 PolarHBondContact O-N 3.4Å; I152-E156 HydrophobicContact CG2-CG 4.31Å; I152-E156 WeakPolarHBondContact O-CB 3.35Å; I152-E156 WeakPolarHBondContact O-CG 3.44Å; I152-E156 PolarHBondContact O-N 3.44Å
153	E	89.5	Confident	89.4	Confident	110 Å²	110	96.9 Å²	96.9	51%	0.514	49%	0.493	S	S	.	.	H	α-helix	trans	-58.8	-40.6	176.8	-72.2	179.8	178.4	0	0	111.8	I149 S150 E156 R157	I149-E153 HydrophobicContact CG2-CG 4.37Å; I149-E153 WeakPolarHBondContact O-CG 3.44Å; I149-E153 PolarHBondContact O-N 2.88Å; S150-E153 PolarHBondContact O-N 2.85Å; E153-E156 PolarHBondContact O-N 2.98Å; E153-R157 WeakPolarHBondContact O-CG 3.41Å; E153-R157 PolarHBondContact O-N 2.94Å
154	E	90.6	Very high	89.7	Confident	113 Å²	113	97 Å²	97	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-46.3	175.8	-175.7	174.7	-170.6	0	0	111.7	S150 Q151 I152 E156 R157 H158	S150-E154 WeakPolarHBondContact O-CB 3.32Å; S150-E154 PolarHBondContact O-N 3.44Å; Q151-E154 PolarHBondContact O-N 3.28Å; I152-E154 VanDerWaalsContact C-N 3.29Å; I152-E154 PolarHBondContact O-N 2.88Å; E154-E156 VanDerWaalsContact C-N 3.33Å; E154-E156 PolarHBondContact O-N 3.48Å; E154-R157 PolarHBondContact O-N 2.77Å; E154-H158 PolarHBondContact O-N 3.43Å; E154-H158 PolarHBondContact O-ND1 3.36Å; E154-H158 IonicContact OE1-CE1 3.59Å
155	I	91.6	Very high	90	Very high	110 Å²	110	93.7 Å²	93.7	56%	0.564	47%	0.468	S	S	*	.	H	α-helix	trans	-63.1	-41.5	176.8	-69.7	165	0	0	0	110.7	Q151 I152 R157 H158 L159	Q151-I155 VanDerWaalsContact O-CG1 3.27Å; Q151-I155 WeakPolarHBondContact O-CG1 3.48Å; Q151-I155 PolarHBondContact O-N 2.83Å; I152-I155 PolarHBondContact O-N 3.4Å; I155-R157 VanDerWaalsContact C-N 3.32Å; I155-R157 PolarHBondContact O-N 3.05Å; I155-H158 PolarHBondContact O-N 3.2Å; I155-L159 VanDerWaalsContact O-CB 3.28Å; I155-L159 WeakPolarHBondContact O-CB 3.41Å; I155-L159 PolarHBondContact O-N 3.41Å
156	E	90.3	Very high	90.3	Very high	121 Å²	121	92.3 Å²	92.3	57%	0.565	47%	0.467	S	S	*	.	H	α-helix	trans	-60.7	-40.7	176.4	-76.3	-177.5	164	0	0	111.7	I152 E153 E154 L159 A160	I152-E156 HydrophobicContact CG2-CG 4.31Å; I152-E156 WeakPolarHBondContact O-CB 3.35Å; I152-E156 WeakPolarHBondContact O-CG 3.44Å; I152-E156 PolarHBondContact O-N 3.44Å; E153-E156 PolarHBondContact O-N 2.98Å; E154-E156 VanDerWaalsContact C-N 3.33Å; E154-E156 PolarHBondContact O-N 3.48Å; E156-L159 PolarHBondContact O-N 3.26Å; E156-A160 WeakPolarHBondContact O-CB 3.28Å; E156-A160 PolarHBondContact O-N 2.93Å
157	R	88.6	Confident	90.7	Very high	181 Å²	181	94.8 Å²	94.8	68%	0.683	47%	0.47	S	S	*	.	H	α-helix	trans	-62.9	-45.8	173.7	-75.2	-176.2	72.4	137.5	3.8	112.4	E153 E154 I155 L159 A160 Y161	E153-R157 WeakPolarHBondContact O-CG 3.41Å; E153-R157 PolarHBondContact O-N 2.94Å; E154-R157 PolarHBondContact O-N 2.77Å; I155-R157 VanDerWaalsContact C-N 3.32Å; I155-R157 PolarHBondContact O-N 3.05Å; R157-L159 VanDerWaalsContact C-N 3.35Å; R157-A160 PolarHBondContact O-N 3.45Å; R157-Y161 PolarHBondContact O-N 2.8Å
158	H	90.1	Very high	90.9	Very high	107 Å²	107	92.5 Å²	92.5	50%	0.495	45%	0.451	S	S	.	.	H	α-helix	trans	-63.2	-42.5	177.3	-73.8	90.3	0	0	0	111.7	E154 I155 Y161 L162	E154-H158 PolarHBondContact O-N 3.43Å; E154-H158 PolarHBondContact O-ND1 3.36Å; E154-H158 IonicContact OE1-CE1 3.59Å; I155-H158 PolarHBondContact O-N 3.2Å; H158-Y161 WeakPolarHBondContact O-CB 3.27Å; H158-Y161 PolarHBondContact O-N 2.95Å; H158-L162 WeakPolarHBondContact O-CG 3.42Å; H158-L162 PolarHBondContact O-N 3Å
159	L	91.4	Very high	91.3	Very high	87 Å²	87	92.2 Å²	92.2	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-40.3	178.2	-177.7	138.6	0	0	0	111.7	I155 E156 R157 L162 K163	I155-L159 VanDerWaalsContact O-CB 3.28Å; I155-L159 WeakPolarHBondContact O-CB 3.41Å; I155-L159 PolarHBondContact O-N 3.41Å; E156-L159 PolarHBondContact O-N 3.26Å; R157-L159 VanDerWaalsContact C-N 3.35Å; L159-L162 PolarHBondContact O-N 3.45Å; L159-K163 HydrophobicContact CD2-CD 3.87Å; L159-K163 WeakPolarHBondContact O-CB 3.44Å; L159-K163 VanDerWaalsContact O-CG 3.32Å; L159-K163 WeakPolarHBondContact O-CG 3.38Å; L159-K163 PolarHBondContact O-N 3.04Å
160	A	89.1	Confident	91.6	Very high	43 Å²	43	94 Å²	94	36%	0.355	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-43.6	172.9	0	0	0	0	0	111.7	E156 R157 K163 W164	E156-A160 WeakPolarHBondContact O-CB 3.28Å; E156-A160 PolarHBondContact O-N 2.93Å; R157-A160 PolarHBondContact O-N 3.45Å; A160-K163 PolarHBondContact O-N 3.29Å; A160-W164 PolarHBondContact O-N 3.4Å; A160-W164 VanDerWaalsContact O-N 3.17Å
161	Y	91.6	Very high	91.8	Very high	77 Å²	77	92 Å²	92	30%	0.302	44%	0.44	S	S	.	.	H	α-helix	trans	-60.7	-46.3	176.6	-173	-88.8	0	0	0	112.2	R157 H158 K163 W164 I165 C206 L209	R157-Y161 PolarHBondContact O-N 2.8Å; H158-Y161 WeakPolarHBondContact O-CB 3.27Å; H158-Y161 PolarHBondContact O-N 2.95Å; Y161-K163 PolarHBondContact O-N 3.46Å; Y161-W164 PolarHBondContact O-N 3.49Å; Y161-I165 HydrophobicContact CD1-CD1 3.79Å; Y161-I165 HydrophobicContact CD1-CG1 4.45Å; Y161-I165 HydrophobicContact CE1-CD1 3.3Å; Y161-I165 HydrophobicContact CE1-CG1 4.17Å; Y161-I165 PolarHBondContact O-N 3.27Å; Y161-I165 VanDerWaalsContact O-N 3.14Å; Y161-C206 HydrophobicContact CE2-CB 4.24Å; Y161-L209 HydrophobicContact CD2-CB 4.47Å; Y161-L209 HydrophobicContact CD2-CD2 4.3Å; Y161-L209 HydrophobicContact CE2-CB 3.66Å; Y161-L209 HydrophobicContact CE2-CD2 4.29Å; Y161-L209 HydrophobicContact CE2-CG 4.38Å
162	L	92.4	Very high	92	Very high	112 Å²	112	87.6 Å²	87.6	59%	0.586	42%	0.421	S	S	*	.	H	α-helix	trans	-65.4	-36.5	177.5	-71.5	173.6	0	0	0	112.7	H158 L159 W164 I165 S166	H158-L162 WeakPolarHBondContact O-CG 3.42Å; H158-L162 PolarHBondContact O-N 3Å; L159-L162 PolarHBondContact O-N 3.45Å; L162-W164 VanDerWaalsContact C-N 3.31Å; L162-W164 PolarHBondContact O-N 2.91Å; L162-I165 PolarHBondContact O-N 2.99Å; L162-S166 WeakPolarHBondContact O-CB 3.33Å; L162-S166 PolarHBondContact O-N 3.47Å
163	K	92.4	Very high	92.2	Very high	137 Å²	137	87.8 Å²	87.8	60%	0.596	42%	0.423	S	S	*	.	H	α-helix	trans	-59.8	-41.8	173.7	-80.2	175.8	174.1	175	0	111.8	L159 A160 Y161 S166 Q167	L159-K163 HydrophobicContact CD2-CD 3.87Å; L159-K163 WeakPolarHBondContact O-CB 3.44Å; L159-K163 VanDerWaalsContact O-CG 3.32Å; L159-K163 WeakPolarHBondContact O-CG 3.38Å; L159-K163 PolarHBondContact O-N 3.04Å; A160-K163 PolarHBondContact O-N 3.29Å; Y161-K163 PolarHBondContact O-N 3.46Å; K163-S166 PolarHBondContact O-N 3.43Å; K163-Q167 WeakPolarHBondContact O-CB 3.49Å; K163-Q167 PolarHBondContact O-N 3.43Å
164	W	92.8	Very high	92.4	Very high	93 Å²	93	84.8 Å²	84.8	35%	0.352	41%	0.411	S	S	.	.	H	α-helix	trans	-64.1	-44.6	175.4	-73.6	117.4	0	0	0	112.1	A160 Y161 L162 S166 Q167 I168 L197 L201 L209	A160-W164 PolarHBondContact O-N 3.4Å; A160-W164 VanDerWaalsContact O-N 3.17Å; Y161-W164 PolarHBondContact O-N 3.49Å; L162-W164 VanDerWaalsContact C-N 3.31Å; L162-W164 PolarHBondContact O-N 2.91Å; W164-S166 PolarHBondContact O-N 3.24Å; W164-Q167 VanDerWaalsContact CZ3-OE1 3.28Å; W164-Q167 PolarHBondContact O-N 2.89Å; W164-I168 VanDerWaalsContact O-CG1 3.24Å; W164-I168 WeakPolarHBondContact O-CG1 3.31Å; W164-I168 PolarHBondContact O-N 3.01Å; W164-L197 HydrophobicContact CE3-CD1 4.22Å; W164-L197 HydrophobicContact CZ3-CD1 3.78Å; W164-L197 HydrophobicContact CZ3-CG 4.16Å; W164-L201 HydrophobicContact CD2-CD2 3.94Å; W164-L201 HydrophobicContact CE3-CD1 4.49Å; W164-L201 HydrophobicContact CE3-CD2 4.15Å; W164-L201 HydrophobicContact CG-CD2 4.42Å; W164-L201 HydrophobicContact CH2-CD2 4.38Å; W164-L201 HydrophobicContact CZ2-CD2 4.18Å; W164-L201 HydrophobicContact CZ3-CD2 4.36Å; W164-L209 HydrophobicContact CB-CD1 4.23Å; W164-L209 HydrophobicContact CB-CD2 3.95Å; W164-L209 HydrophobicContact CG-CD2 4.26Å
165	I	93	Very high	92.5	Very high	37 Å²	37	79.4 Å²	79.4	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-58.3	-49.4	175.3	-70	178.2	0	0	0	110.7	Y161 L162 Q167 I168 E169 L209	Y161-I165 HydrophobicContact CD1-CD1 3.79Å; Y161-I165 HydrophobicContact CD1-CG1 4.45Å; Y161-I165 HydrophobicContact CE1-CD1 3.3Å; Y161-I165 HydrophobicContact CE1-CG1 4.17Å; Y161-I165 PolarHBondContact O-N 3.27Å; Y161-I165 VanDerWaalsContact O-N 3.14Å; L162-I165 PolarHBondContact O-N 2.99Å; I165-Q167 PolarHBondContact O-N 3.14Å; I165-I168 PolarHBondContact O-N 3.26Å; I165-I168 VanDerWaalsContact O-N 3.08Å; I165-E169 HydrophobicContact CG2-CG 4.26Å; I165-E169 WeakPolarHBondContact O-CG 3.42Å; I165-E169 PolarHBondContact O-N 3.17Å; I165-L209 HydrophobicContact CG1-CD1 3.98Å
166	S	92.6	Very high	92.6	Very high	68 Å²	68	78.9 Å²	78.9	48%	0.476	38%	0.381	S	S	.	.	H	α-helix	trans	-57	-39.5	178.9	-177.7	0	0	0	0	112	L162 K163 W164 E170	L162-S166 WeakPolarHBondContact O-CB 3.33Å; L162-S166 PolarHBondContact O-N 3.47Å; K163-S166 PolarHBondContact O-N 3.43Å; W164-S166 PolarHBondContact O-N 3.24Å; S166-E170 VanDerWaalsContact O-CB 3.31Å; S166-E170 WeakPolarHBondContact O-CB 3.47Å; S166-E170 PolarHBondContact O-N 3.45Å
167	Q	93.9	Very high	92.8	Very high	82 Å²	82	79 Å²	79	38%	0.383	38%	0.381	S	S	.	.	H	α-helix	trans	-69.3	-38.7	177.5	-172.3	176.5	10.9	0	0	112.3	K163 W164 I165 E170 L171 L197	K163-Q167 WeakPolarHBondContact O-CB 3.49Å; K163-Q167 PolarHBondContact O-N 3.43Å; W164-Q167 VanDerWaalsContact CZ3-OE1 3.28Å; W164-Q167 PolarHBondContact O-N 2.89Å; I165-Q167 PolarHBondContact O-N 3.14Å; Q167-E170 PolarHBondContact O-N 3.28Å; Q167-L171 WeakPolarHBondContact O-CG 3.24Å; Q167-L171 PolarHBondContact O-N 2.95Å; Q167-L197 HydrophobicContact CG-CD1 4.13Å
168	I	94.1	Very high	93.1	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-65.3	-44.3	176.4	-64.4	166.8	0	0	0	110.3	W164 I165 L171 S172 L197 L209 F212 M213 T216	W164-I168 VanDerWaalsContact O-CG1 3.24Å; W164-I168 WeakPolarHBondContact O-CG1 3.31Å; W164-I168 PolarHBondContact O-N 3.01Å; I165-I168 PolarHBondContact O-N 3.26Å; I165-I168 VanDerWaalsContact O-N 3.08Å; I168-L171 PolarHBondContact O-N 3.45Å; I168-S172 WeakPolarHBondContact O-CB 3.46Å; I168-S172 PolarHBondContact O-N 3.28Å; I168-L197 HydrophobicContact CD1-CD2 4.34Å; I168-L197 HydrophobicContact CG1-CD2 3.78Å; I168-L209 HydrophobicContact CD1-CD1 3.86Å; I168-F212 HydrophobicContact CB-CE1 4.14Å; I168-F212 HydrophobicContact CD1-CD1 4.16Å; I168-F212 HydrophobicContact CD1-CE1 4.39Å; I168-F212 HydrophobicContact CG2-CD1 4.17Å; I168-F212 HydrophobicContact CG2-CE1 3.6Å; I168-F212 HydrophobicContact CG2-CZ 4.37Å; I168-M213 HydrophobicContact CB-SD 4.33Å; I168-M213 HydrophobicContact CD1-CB 4.09Å; I168-M213 HydrophobicContact CD1-CG 4.33Å; I168-M213 HydrophobicContact CD1-SD 3.6Å; I168-M213 HydrophobicContact CG1-SD 3.53Å; I168-M213 VanDerWaalsContact CG1-SD 3.53Å; I168-M213 HydrophobicContact CG2-SD 3.87Å; I168-T216 HydrophobicContact CG2-CG2 4.08Å
169	E	93.9	Very high	93.1	Very high	100 Å²	100	70.7 Å²	70.7	47%	0.467	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-44.1	176.1	-72.1	-178.9	158.2	0	0	111.4	I165 L171 S172 D173	I165-E169 HydrophobicContact CG2-CG 4.26Å; I165-E169 WeakPolarHBondContact O-CG 3.42Å; I165-E169 PolarHBondContact O-N 3.17Å; E169-L171 PolarHBondContact O-N 3Å; E169-S172 CarbonylContact O-C 3.5Å; E169-S172 WeakPolarHBondContact O-CA 3.44Å; E169-S172 VanDerWaalsContact O-CB 3.31Å; E169-S172 WeakPolarHBondContact O-CB 3.48Å; E169-S172 PolarHBondContact O-N 3.2Å; E169-S172 VanDerWaalsContact O-N 3.08Å; E169-D173 PolarHBondContact O-N 3.26Å
170	E	94.5	Very high	93.1	Very high	117 Å²	117	74.1 Å²	74.1	55%	0.547	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-44.6	176	-175.3	-176.1	175.8	0	0	112	S166 Q167 S172 D173 N174	S166-E170 VanDerWaalsContact O-CB 3.31Å; S166-E170 WeakPolarHBondContact O-CB 3.47Å; S166-E170 PolarHBondContact O-N 3.45Å; Q167-E170 PolarHBondContact O-N 3.28Å; E170-S172 VanDerWaalsContact C-N 3.31Å; E170-S172 PolarHBondContact O-N 3.49Å; E170-D173 PolarHBondContact O-N 3.34Å; E170-N174 WeakPolarHBondContact O-CB 3.49Å; E170-N174 PolarHBondContact O-N 2.96Å; E170-N174 PolarHBondContact O-ND2 2.82Å
171	L	94.1	Very high	93.2	Very high	27 Å²	27	76.6 Å²	76.6	14%	0.141	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-39.2	174.8	-70.7	172.1	0	0	0	111.7	Q167 I168 E169 I175 T190 M194 L197	Q167-L171 WeakPolarHBondContact O-CG 3.24Å; Q167-L171 PolarHBondContact O-N 2.95Å; I168-L171 PolarHBondContact O-N 3.45Å; E169-L171 PolarHBondContact O-N 3Å; L171-I175 VanDerWaalsContact O-CG1 3.3Å; L171-I175 WeakPolarHBondContact O-CG1 3.39Å; L171-I175 PolarHBondContact O-N 3.15Å; L171-I175 VanDerWaalsContact O-N 3.08Å; L171-T190 HydrophobicContact CB-CG2 4.36Å; L171-T190 HydrophobicContact CD2-CG2 3.75Å; L171-M194 HydrophobicContact CB-CE 3.52Å; L171-M194 HydrophobicContact CD1-CB 4.29Å; L171-L197 HydrophobicContact CD1-CD1 4.38Å
172	S	95	Very high	92.9	Very high	24 Å²	24	78.2 Å²	78.2	17%	0.168	39%	0.389	C	S	.	.	H	α-helix	trans	-63.6	-47.4	176.7	-179.4	0	0	0	0	112	I168 E169 E170 N174 I175 Q176 W220	I168-S172 WeakPolarHBondContact O-CB 3.46Å; I168-S172 PolarHBondContact O-N 3.28Å; E169-S172 CarbonylContact O-C 3.5Å; E169-S172 WeakPolarHBondContact O-CA 3.44Å; E169-S172 VanDerWaalsContact O-CB 3.31Å; E169-S172 WeakPolarHBondContact O-CB 3.48Å; E169-S172 PolarHBondContact O-N 3.2Å; E169-S172 VanDerWaalsContact O-N 3.08Å; E170-S172 VanDerWaalsContact C-N 3.31Å; E170-S172 PolarHBondContact O-N 3.49Å; S172-N174 VanDerWaalsContact C-N 3.33Å; S172-N174 PolarHBondContact O-N 2.88Å; S172-I175 PolarHBondContact O-N 3.1Å; S172-Q176 PolarHBondContact O-N 3.11Å; S172-W220 WeakPolarHBondContact O-CZ2 3.38Å; S172-W220 WeakPolarHBondContact OG-CZ2 3.13Å; S172-W220 PolarHBondContact OG-NE1 3.19Å
173	D	94.4	Very high	92.8	Very high	98 Å²	98	75.2 Å²	75.2	52%	0.524	37%	0.373	S	S	.	.	H	α-helix	trans	-63.3	-40.2	178.6	-73.9	-12.6	0	0	0	111.4	E169 E170 Q176 Q177	E169-D173 PolarHBondContact O-N 3.26Å; E170-D173 PolarHBondContact O-N 3.34Å; D173-Q176 WeakPolarHBondContact O-CB 3.43Å; D173-Q176 PolarHBondContact O-N 3.41Å; D173-Q177 WeakPolarHBondContact O-CB 3.48Å; D173-Q177 PolarHBondContact O-N 3.29Å
174	N	94.2	Very high	92.7	Very high	47 Å²	47	69.2 Å²	69.2	25%	0.251	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-46.4	174.3	-76.5	-39.8	0	0	0	111.8	E170 S172 Q176 Q177 Y178 T190	E170-N174 WeakPolarHBondContact O-CB 3.49Å; E170-N174 PolarHBondContact O-N 2.96Å; E170-N174 PolarHBondContact O-ND2 2.82Å; S172-N174 VanDerWaalsContact C-N 3.33Å; S172-N174 PolarHBondContact O-N 2.88Å; N174-Q176 VanDerWaalsContact C-N 3.31Å; N174-Q176 PolarHBondContact O-N 3.32Å; N174-Q177 PolarHBondContact O-N 3.46Å; N174-Y178 HydrophobicContact CB-CE2 4.2Å; N174-Y178 WeakPolarHBondContact O-CD2 3.3Å; N174-Y178 PolarHBondContact O-N 3.24Å; N174-T190 HydrophobicContact CB-CG2 4.14Å
175	I	93.4	Very high	92.6	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-45.4	175.8	-67.5	166	0	0	0	110.2	L171 S172 Q177 Y178 L179 A187 T190 L191 M194 W220 L224	L171-I175 VanDerWaalsContact O-CG1 3.3Å; L171-I175 WeakPolarHBondContact O-CG1 3.39Å; L171-I175 PolarHBondContact O-N 3.15Å; L171-I175 VanDerWaalsContact O-N 3.08Å; S172-I175 PolarHBondContact O-N 3.1Å; I175-Q177 PolarHBondContact O-N 3.34Å; I175-Y178 PolarHBondContact O-N 3.15Å; I175-L179 HydrophobicContact CG2-CD1 4.07Å; I175-L179 WeakPolarHBondContact O-CG 3.01Å; I175-L179 PolarHBondContact O-N 3Å; I175-A187 HydrophobicContact CG2-CB 4.39Å; I175-T190 HydrophobicContact CD1-CG2 4.23Å; I175-T190 HydrophobicContact CG1-CG2 3.68Å; I175-L191 HydrophobicContact CD1-CB 4.16Å; I175-L191 HydrophobicContact CD1-CD1 4.41Å; I175-M194 HydrophobicContact CD1-CE 3.79Å; I175-M194 HydrophobicContact CD1-SD 4.26Å; I175-W220 HydrophobicContact CB-CD2 4.19Å; I175-W220 HydrophobicContact CB-CE3 4.4Å; I175-W220 HydrophobicContact CD1-CB 4.19Å; I175-W220 HydrophobicContact CD1-CD2 4.45Å; I175-W220 HydrophobicContact CD1-CG 3.93Å; I175-W220 HydrophobicContact CG2-CB 4.46Å; I175-W220 HydrophobicContact CG2-CD2 3.61Å; I175-W220 HydrophobicContact CG2-CE3 3.45Å; I175-W220 VanDerWaalsContact CG2-CE3 3.45Å; I175-W220 HydrophobicContact CG2-CG 4.07Å; I175-W220 HydrophobicContact CG2-CH2 4.49Å; I175-W220 HydrophobicContact CG2-CZ3 3.94Å; I175-L224 HydrophobicContact CG2-CD1 4.38Å
176	Q	93.9	Very high	92.5	Very high	99 Å²	99	68.7 Å²	68.7	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-59.6	-47.1	177.7	-173.3	172.5	-23.8	0	0	111.7	S172 D173 N174 L179 M180 W220	S172-Q176 PolarHBondContact O-N 3.11Å; D173-Q176 WeakPolarHBondContact O-CB 3.43Å; D173-Q176 PolarHBondContact O-N 3.41Å; N174-Q176 VanDerWaalsContact C-N 3.31Å; N174-Q176 PolarHBondContact O-N 3.32Å; Q176-L179 PolarHBondContact O-N 3.06Å; Q176-M180 WeakPolarHBondContact O-CG 3.47Å; Q176-M180 PolarHBondContact O-N 3.09Å; Q176-W220 HydrophobicContact CB-CH2 3.69Å; Q176-W220 HydrophobicContact CB-CZ2 4.13Å; Q176-W220 HydrophobicContact CG-CH2 4.22Å
177	Q	93.6	Very high	92.5	Very high	123 Å²	123	65.4 Å²	65.4	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-63.3	-42.8	-179.9	-174.1	177.7	-3.5	0	0	112.2	D173 N174 I175 L179 M180 T181	D173-Q177 WeakPolarHBondContact O-CB 3.48Å; D173-Q177 PolarHBondContact O-N 3.29Å; N174-Q177 PolarHBondContact O-N 3.46Å; I175-Q177 PolarHBondContact O-N 3.34Å; Q177-L179 VanDerWaalsContact C-N 3.33Å; Q177-L179 PolarHBondContact O-N 2.97Å; Q177-M180 PolarHBondContact O-N 3.47Å; Q177-T181 PolarHBondContact O-N 3.37Å; Q177-T181 VanDerWaalsContact O-N 3.11Å; Q177-T181 PolarHBondContact O-OG1 3Å
178	Y	93.9	Very high	92.4	Very high	79 Å²	79	61.5 Å²	61.5	31%	0.31	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-38.8	175.3	-70.6	-48.6	0	0	0	111.9	N174 I175 T181 N182 N183 E186	N174-Y178 HydrophobicContact CB-CE2 4.2Å; N174-Y178 WeakPolarHBondContact O-CD2 3.3Å; N174-Y178 PolarHBondContact O-N 3.24Å; I175-Y178 PolarHBondContact O-N 3.15Å; Y178-T181 WeakPolarHBondContact CA-OG1 3.4Å; Y178-T181 CarbonylContact O-C 3.53Å; Y178-T181 PolarHBondContact O-N 3.48Å; Y178-T181 PolarHBondContact O-OG1 2.85Å; Y178-T181 VanDerWaalsContact O-OG1 3.1Å; Y178-N182 PolarHBondContact O-N 2.72Å; Y178-N182 VanDerWaalsContact O-N 3.15Å; Y178-N183 HydrophobicContact CD1-CB 4.28Å; Y178-N183 PolarHBondContact O-N 3.27Å; Y178-E186 HydrophobicContact CD1-CB 3.88Å; Y178-E186 HydrophobicContact CD2-CB 4.09Å; Y178-E186 HydrophobicContact CE1-CB 4Å; Y178-E186 HydrophobicContact CE1-CG 4.46Å; Y178-E186 HydrophobicContact CE2-CB 4.21Å; Y178-E186 HydrophobicContact CG-CB 3.95Å
179	L	91.3	Very high	92.3	Very high	35 Å²	35	63.5 Å²	63.5	18%	0.183	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-38.9	174.7	-75	175	0	0	0	112.9	I175 Q176 Q177 T181 N182 A187 W220 I223 L224	I175-L179 HydrophobicContact CG2-CD1 4.07Å; I175-L179 WeakPolarHBondContact O-CG 3.01Å; I175-L179 PolarHBondContact O-N 3Å; Q176-L179 PolarHBondContact O-N 3.06Å; Q177-L179 VanDerWaalsContact C-N 3.33Å; Q177-L179 PolarHBondContact O-N 2.97Å; L179-T181 VanDerWaalsContact C-N 3.27Å; L179-T181 PolarHBondContact O-N 3.11Å; L179-N182 PolarHBondContact O-N 3.42Å; L179-N182 VanDerWaalsContact O-N 3.15Å; L179-A187 HydrophobicContact CD2-CB 4.3Å; L179-A187 HydrophobicContact CG-CB 4.2Å; L179-W220 HydrophobicContact CD1-CE3 4.18Å; L179-W220 HydrophobicContact CD1-CZ3 3.83Å; L179-I223 HydrophobicContact CD1-CG2 4.15Å; L179-L224 HydrophobicContact CD2-CD2 3.75Å; L179-L224 HydrophobicContact CG-CD2 4.47Å
180	M	90.9	Very high	92.3	Very high	158 Å²	158	59.7 Å²	59.7	78%	0.778	31%	0.309	S	S	*	.	H	α-helix	trans	-65.8	-30	176.2	-69	-163.5	81	0	0	113	Q176 Q177 N182	Q176-M180 WeakPolarHBondContact O-CG 3.47Å; Q176-M180 PolarHBondContact O-N 3.09Å; Q177-M180 PolarHBondContact O-N 3.47Å; M180-N182 VanDerWaalsContact C-N 3.32Å
181	T	90.6	Very high	92.2	Very high	95 Å²	95	54.1 Å²	54.1	58%	0.583	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	5.6	176	53.6	0	0	0	0	113.3	Q177 Y178 L179 N183	Q177-T181 PolarHBondContact O-N 3.37Å; Q177-T181 VanDerWaalsContact O-N 3.11Å; Q177-T181 PolarHBondContact O-OG1 3Å; Y178-T181 WeakPolarHBondContact CA-OG1 3.4Å; Y178-T181 CarbonylContact O-C 3.53Å; Y178-T181 PolarHBondContact O-N 3.48Å; Y178-T181 PolarHBondContact O-OG1 2.85Å; Y178-T181 VanDerWaalsContact O-OG1 3.1Å; L179-T181 VanDerWaalsContact C-N 3.27Å; L179-T181 PolarHBondContact O-N 3.11Å; T181-N183 PolarHBondContact O-N 2.87Å
182	N	86.8	Confident	92.1	Very high	112 Å²	112	54.2 Å²	54.2	60%	0.599	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	25.6	-175.2	-157.2	44.1	0	0	0	114.6	Y178 L179 M180 V184 K227	Y178-N182 PolarHBondContact O-N 2.72Å; Y178-N182 VanDerWaalsContact O-N 3.15Å; L179-N182 PolarHBondContact O-N 3.42Å; L179-N182 VanDerWaalsContact O-N 3.15Å; M180-N182 VanDerWaalsContact C-N 3.32Å; N182-V184 VanDerWaalsContact C-N 3.35Å; N182-V184 PolarHBondContact O-N 3.48Å; N182-K227 PolarHBondContact OD1-NZ 2.95Å
183	N	90.1	Very high	92	Very high	48 Å²	48	55.8 Å²	55.8	26%	0.257	30%	0.296	S	S	.	.			trans	-89.6	70.3	175	-161.6	-3.9	0	0	0	111.3	Y178 T181 P185 E186 A187	Y178-N183 HydrophobicContact CD1-CB 4.28Å; Y178-N183 PolarHBondContact O-N 3.27Å; T181-N183 PolarHBondContact O-N 2.87Å; N183-P185 VanDerWaalsContact C-CD 3.45Å; N183-P185 WeakPolarHBondContact OD1-CD 3.46Å; N183-E186 PolarHBondContact ND2-OE1 3.37Å; N183-E186 PolarHBondContact O-N 3.27Å; N183-E186 PolarHBondContact OD1-OE1 3.5Å; N183-E186 PolarHBondContact OD1-OE2 2.96Å; N183-A187 PolarHBondContact O-N 3.42Å
184	V	90.5	Very high	92	Very high	11 Å²	11	51.1 Å²	51.1	7%	0.067	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-38.8	-177.1	-171.1	0	0	0	0	114.8	N182 E186 A187 A188 L224 L228	N182-V184 VanDerWaalsContact C-N 3.35Å; N182-V184 PolarHBondContact O-N 3.48Å; V184-E186 VanDerWaalsContact C-N 3.27Å; V184-E186 PolarHBondContact O-N 3Å; V184-A187 PolarHBondContact O-N 3.25Å; V184-A188 PolarHBondContact O-N 2.87Å; V184-L224 HydrophobicContact CG1-CD2 4.15Å; V184-L228 HydrophobicContact CG1-CD1 4.36Å; V184-L228 HydrophobicContact CG1-CD2 3.65Å; V184-L228 HydrophobicContact CG1-CG 4.12Å
185	P	89.9	Confident	91.9	Very high	40 Å²	40	48.9 Å²	48.9	26%	0.26	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-33.7	179.9	6	-6.8	0	0	0	113.5	N183 S189 Q273	N183-P185 VanDerWaalsContact C-CD 3.45Å; N183-P185 WeakPolarHBondContact OD1-CD 3.46Å; P185-S189 PolarHBondContact O-N 3.25Å; P185-S189 VanDerWaalsContact O-N 3.09Å; P185-S189 PolarHBondContact O-OG 3.07Å; P185-Q273 HydrophobicContact CB-CG 4.23Å; P185-Q273 VanDerWaalsContact CD-NE2 3.28Å; P185-Q273 VanDerWaalsContact CG-NE2 3.29Å
186	E	91.4	Very high	91.8	Very high	79 Å²	79	53.3 Å²	53.3	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-76.3	-42.8	179.7	-82.1	77	137.3	0	0	109.8	Y178 N183 V184 A188 S189 T190	Y178-E186 HydrophobicContact CD1-CB 3.88Å; Y178-E186 HydrophobicContact CD2-CB 4.09Å; Y178-E186 HydrophobicContact CE1-CB 4Å; Y178-E186 HydrophobicContact CE1-CG 4.46Å; Y178-E186 HydrophobicContact CE2-CB 4.21Å; Y178-E186 HydrophobicContact CG-CB 3.95Å; N183-E186 PolarHBondContact ND2-OE1 3.37Å; N183-E186 PolarHBondContact O-N 3.27Å; N183-E186 PolarHBondContact OD1-OE1 3.5Å; N183-E186 PolarHBondContact OD1-OE2 2.96Å; V184-E186 VanDerWaalsContact C-N 3.27Å; V184-E186 PolarHBondContact O-N 3Å; E186-A188 VanDerWaalsContact C-N 3.31Å; E186-A188 PolarHBondContact O-N 3.39Å; E186-S189 WeakPolarHBondContact O-CB 3.44Å; E186-S189 PolarHBondContact O-N 3.46Å; E186-T190 PolarHBondContact O-N 3.29Å; E186-T190 PolarHBondContact O-OG1 3.21Å; E186-T190 VanDerWaalsContact O-OG1 3.11Å
187	A	92.9	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-44.7	171.7	0	0	0	0	0	112.2	I175 L179 N183 V184 S189 T190 L191 L224	I175-A187 HydrophobicContact CG2-CB 4.39Å; L179-A187 HydrophobicContact CD2-CB 4.3Å; L179-A187 HydrophobicContact CG-CB 4.2Å; N183-A187 PolarHBondContact O-N 3.42Å; V184-A187 PolarHBondContact O-N 3.25Å; A187-S189 VanDerWaalsContact C-N 3.33Å; A187-S189 PolarHBondContact O-N 2.81Å; A187-T190 PolarHBondContact O-N 3.25Å; A187-L191 PolarHBondContact O-N 3.08Å; A187-L224 HydrophobicContact CB-CD1 4.45Å; A187-L224 HydrophobicContact CB-CD2 4.04Å
188	A	91.2	Very high	91.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-38.5	175.8	0	0	0	0	0	112	V184 E186 L191 V192 K276	V184-A188 PolarHBondContact O-N 2.87Å; E186-A188 VanDerWaalsContact C-N 3.31Å; E186-A188 PolarHBondContact O-N 3.39Å; A188-L191 PolarHBondContact O-N 2.97Å; A188-V192 WeakPolarHBondContact O-CG2 3.33Å; A188-V192 PolarHBondContact O-N 2.99Å; A188-V192 VanDerWaalsContact O-N 3.11Å; A188-K276 HydrophobicContact CB-CB 4.41Å; A188-K276 HydrophobicContact CB-CD 4.35Å
189	S	92.4	Very high	91.4	Very high	42 Å²	42	43.4 Å²	43.4	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-68.7	-38.9	177.9	-51	0	0	0	0	111.9	P185 E186 A187 L191 V192 S193 K276	P185-S189 PolarHBondContact O-N 3.25Å; P185-S189 VanDerWaalsContact O-N 3.09Å; P185-S189 PolarHBondContact O-OG 3.07Å; E186-S189 WeakPolarHBondContact O-CB 3.44Å; E186-S189 PolarHBondContact O-N 3.46Å; A187-S189 VanDerWaalsContact C-N 3.33Å; A187-S189 PolarHBondContact O-N 2.81Å; S189-L191 VanDerWaalsContact C-N 3.33Å; S189-V192 WeakPolarHBondContact O-CB 3.47Å; S189-V192 PolarHBondContact O-N 2.89Å; S189-S193 PolarHBondContact O-N 2.98Å; S189-S193 PolarHBondContact O-OG 3.4Å; S189-K276 PolarHBondContact OG-NZ 3.26Å
190	T	92.8	Very high	91.3	Very high	19 Å²	19	48.8 Å²	48.8	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-36.1	174.2	-52.4	0	0	0	0	111.8	L171 N174 I175 E186 A187 V192 S193 M194	L171-T190 HydrophobicContact CB-CG2 4.36Å; L171-T190 HydrophobicContact CD2-CG2 3.75Å; N174-T190 HydrophobicContact CB-CG2 4.14Å; I175-T190 HydrophobicContact CD1-CG2 4.23Å; I175-T190 HydrophobicContact CG1-CG2 3.68Å; E186-T190 PolarHBondContact O-N 3.29Å; E186-T190 PolarHBondContact O-OG1 3.21Å; E186-T190 VanDerWaalsContact O-OG1 3.11Å; A187-T190 PolarHBondContact O-N 3.25Å; T190-V192 VanDerWaalsContact C-N 3.33Å; T190-V192 PolarHBondContact O-N 3.25Å; T190-S193 WeakPolarHBondContact O-CB 3.38Å; T190-S193 PolarHBondContact O-N 3.08Å; T190-M194 PolarHBondContact O-N 3.08Å
191	L	93	Very high	91.2	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-34.2	173.7	-178.8	60.4	0	0	0	112.4	I175 A187 A188 S189 M194 A195 V217 W220 H221 L224 L277	I175-L191 HydrophobicContact CD1-CB 4.16Å; I175-L191 HydrophobicContact CD1-CD1 4.41Å; A187-L191 PolarHBondContact O-N 3.08Å; A188-L191 PolarHBondContact O-N 2.97Å; S189-L191 VanDerWaalsContact C-N 3.33Å; L191-M194 HydrophobicContact CD1-CB 4.39Å; L191-M194 HydrophobicContact CD1-SD 4.27Å; L191-M194 CarbonylContact O-C 3.59Å; L191-M194 WeakPolarHBondContact O-CB 3.31Å; L191-M194 PolarHBondContact O-N 3.08Å; L191-A195 PolarHBondContact O-N 2.89Å; L191-V217 HydrophobicContact CD1-CG1 4.49Å; L191-W220 HydrophobicContact CD1-CB 3.91Å; L191-H221 HydrophobicContact CD2-CB 4.08Å; L191-L224 HydrophobicContact CB-CD1 4.07Å; L191-L224 HydrophobicContact CD2-CD1 3.66Å; L191-L224 HydrophobicContact CG-CD1 4.49Å; L191-L277 HydrophobicContact CD2-CD2 3.46Å; L191-L277 VanDerWaalsContact CD2-CD2 3.46Å; L191-L277 HydrophobicContact CG-CD2 4.41Å
192	V	92.6	Very high	91	Very high	29 Å²	29	41.6 Å²	41.6	18%	0.176	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-49.5	171.4	173.7	0	0	0	0	110.4	A188 S189 T190 M194 A195 E196 K276	A188-V192 WeakPolarHBondContact O-CG2 3.33Å; A188-V192 PolarHBondContact O-N 2.99Å; A188-V192 VanDerWaalsContact O-N 3.11Å; S189-V192 WeakPolarHBondContact O-CB 3.47Å; S189-V192 PolarHBondContact O-N 2.89Å; T190-V192 VanDerWaalsContact C-N 3.33Å; T190-V192 PolarHBondContact O-N 3.25Å; V192-M194 PolarHBondContact O-N 3.35Å; V192-A195 PolarHBondContact O-N 3.42Å; V192-E196 HydrophobicContact CG1-CG 4.49Å; V192-E196 WeakPolarHBondContact O-CG 3.29Å; V192-E196 PolarHBondContact O-N 3.4Å; V192-K276 HydrophobicContact CG2-CB 4.02Å; V192-K276 WeakPolarHBondContact CG2-O 3.25Å
193	S	92.8	Very high	91	Very high	57 Å²	57	45.4 Å²	45.4	40%	0.399	23%	0.232	S	C	.	.	H	α-helix	trans	-58.1	-36.4	175.9	-54.2	0	0	0	0	112.3	S189 T190 L197	S189-S193 PolarHBondContact O-N 2.98Å; S189-S193 PolarHBondContact O-OG 3.4Å; T190-S193 WeakPolarHBondContact O-CB 3.38Å; T190-S193 PolarHBondContact O-N 3.08Å; S193-L197 WeakPolarHBondContact O-CB 3.29Å; S193-L197 PolarHBondContact O-N 3.3Å; S193-L197 VanDerWaalsContact O-N 3.08Å
194	M	93.5	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-46	174.3	-167.3	-176.9	-83.7	0	0	111.1	L171 I175 T190 L191 V192 E196 L197 D198 M213 T216 V217	L171-M194 HydrophobicContact CB-CE 3.52Å; L171-M194 HydrophobicContact CD1-CB 4.29Å; I175-M194 HydrophobicContact CD1-CE 3.79Å; I175-M194 HydrophobicContact CD1-SD 4.26Å; T190-M194 PolarHBondContact O-N 3.08Å; L191-M194 HydrophobicContact CD1-CB 4.39Å; L191-M194 HydrophobicContact CD1-SD 4.27Å; L191-M194 CarbonylContact O-C 3.59Å; L191-M194 WeakPolarHBondContact O-CB 3.31Å; L191-M194 PolarHBondContact O-N 3.08Å; V192-M194 PolarHBondContact O-N 3.35Å; M194-E196 VanDerWaalsContact C-N 3.35Å; M194-E196 PolarHBondContact O-N 2.89Å; M194-L197 WeakPolarHBondContact O-CB 3.45Å; M194-L197 PolarHBondContact O-N 3.18Å; M194-L197 VanDerWaalsContact O-N 3.13Å; M194-D198 PolarHBondContact O-N 3.02Å; M194-M213 HydrophobicContact CB-CE 4.27Å; M194-M213 HydrophobicContact CG-CE 3.33Å; M194-M213 HydrophobicContact CG-SD 4.32Å; M194-M213 WeakPolarHBondContact O-CE 3.48Å; M194-T216 HydrophobicContact CE-CG2 3.95Å; M194-T216 HydrophobicContact SD-CG2 3.83Å; M194-V217 HydrophobicContact CG-CG2 3.76Å; M194-V217 HydrophobicContact SD-CG2 4.09Å
195	A	91.9	Very high	90.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-40.5	176	0	0	0	0	0	112.6	L191 V192 L197 D198 I199 T279 L283	L191-A195 PolarHBondContact O-N 2.89Å; V192-A195 PolarHBondContact O-N 3.42Å; A195-L197 VanDerWaalsContact C-N 3.29Å; A195-L197 PolarHBondContact O-N 3.01Å; A195-D198 WeakPolarHBondContact O-CB 3.43Å; A195-D198 PolarHBondContact O-N 3.47Å; A195-I199 WeakPolarHBondContact O-CG1 3.41Å; A195-I199 PolarHBondContact O-N 3.43Å; A195-T279 HydrophobicContact CB-CG2 4.34Å; A195-L283 HydrophobicContact CB-CD1 4Å
196	E	91.7	Very high	90.8	Very high	92 Å²	92	49.2 Å²	49.2	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-37.4	173.5	-71.5	178.9	-175.6	0	0	112.5	V192 M194 I199 K200	V192-E196 HydrophobicContact CG1-CG 4.49Å; V192-E196 WeakPolarHBondContact O-CG 3.29Å; V192-E196 PolarHBondContact O-N 3.4Å; M194-E196 VanDerWaalsContact C-N 3.35Å; M194-E196 PolarHBondContact O-N 2.89Å; E196-I199 PolarHBondContact O-N 2.88Å; E196-K200 WeakPolarHBondContact O-CG 3.49Å; E196-K200 PolarHBondContact O-N 3.2Å
197	L	91.1	Very high	90.8	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-37.8	175.7	-170.1	131.9	0	0	0	111.3	W164 Q167 I168 L171 S193 M194 A195 K200 L201 M213	W164-L197 HydrophobicContact CE3-CD1 4.22Å; W164-L197 HydrophobicContact CZ3-CD1 3.78Å; W164-L197 HydrophobicContact CZ3-CG 4.16Å; Q167-L197 HydrophobicContact CG-CD1 4.13Å; I168-L197 HydrophobicContact CD1-CD2 4.34Å; I168-L197 HydrophobicContact CG1-CD2 3.78Å; L171-L197 HydrophobicContact CD1-CD1 4.38Å; S193-L197 WeakPolarHBondContact O-CB 3.29Å; S193-L197 PolarHBondContact O-N 3.3Å; S193-L197 VanDerWaalsContact O-N 3.08Å; M194-L197 WeakPolarHBondContact O-CB 3.45Å; M194-L197 PolarHBondContact O-N 3.18Å; M194-L197 VanDerWaalsContact O-N 3.13Å; A195-L197 VanDerWaalsContact C-N 3.29Å; A195-L197 PolarHBondContact O-N 3.01Å; L197-K200 PolarHBondContact O-N 2.89Å; L197-L201 HydrophobicContact CD2-CD1 3.59Å; L197-L201 HydrophobicContact CD2-CG 4.44Å; L197-L201 HydrophobicContact CG-CD1 4.3Å; L197-L201 WeakPolarHBondContact O-CB 3.22Å; L197-L201 VanDerWaalsContact O-CG 3.29Å; L197-L201 WeakPolarHBondContact O-CG 3.49Å; L197-L201 PolarHBondContact O-N 3.46Å; L197-M213 HydrophobicContact CB-CE 3.9Å; L197-M213 HydrophobicContact CD2-CE 3.42Å; L197-M213 VanDerWaalsContact CD2-CE 3.42Å; L197-M213 HydrophobicContact CD2-CG 4.41Å; L197-M213 HydrophobicContact CD2-SD 3.67Å; L197-M213 HydrophobicContact CG-CE 4.28Å
198	D	91.6	Very high	90.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-40.4	174.3	179.8	78.4	0	0	0	111.8	M194 A195 L201 Q202 M213 R214 V217	M194-D198 PolarHBondContact O-N 3.02Å; A195-D198 WeakPolarHBondContact O-CB 3.43Å; A195-D198 PolarHBondContact O-N 3.47Å; D198-L201 PolarHBondContact O-N 3.47Å; D198-Q202 WeakPolarHBondContact O-CG 3.46Å; D198-Q202 PolarHBondContact O-N 2.9Å; D198-Q202 PolarHBondContact O-NE2 2.67Å; D198-Q202 PolarHBondContact OD2-NE2 2.97Å; D198-M213 HydrophobicContact CB-CE 3.83Å; D198-M213 HydrophobicContact CB-CG 3.73Å; D198-M213 WeakPolarHBondContact OD1-CG 3.42Å; D198-R214 IonicContact OD1-NE 3.96Å; D198-R214 PolarHBondContact OD1-NE 3.1Å; D198-R214 IonicContact OD1-NH2 2.84Å; D198-R214 IonicContact OD2-CZ 3.3Å; D198-R214 IonicContact OD2-NE 2.67Å; D198-R214 PolarHBondContact OD2-NE 3.32Å; D198-R214 IonicContact OD2-NH2 3.7Å; D198-R214 PolarHBondContact OD2-NH2 3.44Å; D198-V217 HydrophobicContact CB-CG2 4.15Å
199	I	90	Very high	90.8	Very high	82 Å²	82	57.7 Å²	57.7	42%	0.421	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-49	174.3	-66.9	166.6	0	0	0	110.5	A195 E196 L201 Q202 T279 L283	A195-I199 WeakPolarHBondContact O-CG1 3.41Å; A195-I199 PolarHBondContact O-N 3.43Å; E196-I199 PolarHBondContact O-N 2.88Å; I199-L201 PolarHBondContact O-N 3.39Å; I199-Q202 WeakPolarHBondContact O-CB 3.27Å; I199-Q202 WeakPolarHBondContact O-CG 3.42Å; I199-Q202 PolarHBondContact O-N 3.2Å; I199-Q202 VanDerWaalsContact O-N 3.16Å; I199-T279 HydrophobicContact CD1-CG2 4.12Å; I199-L283 HydrophobicContact CD1-CD1 4.15Å; I199-L283 HydrophobicContact CD1-CD2 4.35Å; I199-L283 HydrophobicContact CG1-CD1 3.99Å; I199-L283 HydrophobicContact CG1-CD2 3.92Å
200	K	89	Confident	90.8	Very high	148 Å²	148	57 Å²	57	64%	0.643	30%	0.303	S	S	*	.	H	α-helix	trans	-60.5	-34.7	179.3	-74.4	171.3	-174.4	167.9	0	112.6	E196 L197 Q202	E196-K200 WeakPolarHBondContact O-CG 3.49Å; E196-K200 PolarHBondContact O-N 3.2Å; L197-K200 PolarHBondContact O-N 2.89Å; K200-Q202 VanDerWaalsContact C-N 3.32Å
201	L	89.3	Confident	90.7	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.052	32%	0.319	C	S	.	.	H	α-helix	trans	-76.4	-16.4	-179.3	-72.6	173.8	0	0	0	113.2	W164 L197 D198 I199 E203 S204 L209 L210 M213	W164-L201 HydrophobicContact CD2-CD2 3.94Å; W164-L201 HydrophobicContact CE3-CD1 4.49Å; W164-L201 HydrophobicContact CE3-CD2 4.15Å; W164-L201 HydrophobicContact CG-CD2 4.42Å; W164-L201 HydrophobicContact CH2-CD2 4.38Å; W164-L201 HydrophobicContact CZ2-CD2 4.18Å; W164-L201 HydrophobicContact CZ3-CD2 4.36Å; L197-L201 HydrophobicContact CD2-CD1 3.59Å; L197-L201 HydrophobicContact CD2-CG 4.44Å; L197-L201 HydrophobicContact CG-CD1 4.3Å; L197-L201 WeakPolarHBondContact O-CB 3.22Å; L197-L201 VanDerWaalsContact O-CG 3.29Å; L197-L201 WeakPolarHBondContact O-CG 3.49Å; L197-L201 PolarHBondContact O-N 3.46Å; D198-L201 PolarHBondContact O-N 3.47Å; I199-L201 PolarHBondContact O-N 3.39Å; L201-E203 PolarHBondContact O-N 3.05Å; L201-S204 WeakPolarHBondContact O-CB 3.4Å; L201-S204 PolarHBondContact O-N 3.39Å; L201-L209 HydrophobicContact CD2-CD2 4.46Å; L201-L210 VanDerWaalsContact C-CD2 3.48Å; L201-L210 HydrophobicContact CB-CD2 3.71Å; L201-L210 WeakPolarHBondContact O-CD2 3.44Å; L201-M213 HydrophobicContact CD1-CG 4.25Å
202	Q	87	Confident	90.7	Very high	91 Å²	91	62.2 Å²	62.2	43%	0.425	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.9	-174.3	-67.7	-54.9	-59.5	0	0	114.8	D198 I199 K200 S204	D198-Q202 WeakPolarHBondContact O-CG 3.46Å; D198-Q202 PolarHBondContact O-N 2.9Å; D198-Q202 PolarHBondContact O-NE2 2.67Å; D198-Q202 PolarHBondContact OD2-NE2 2.97Å; I199-Q202 WeakPolarHBondContact O-CB 3.27Å; I199-Q202 WeakPolarHBondContact O-CG 3.42Å; I199-Q202 PolarHBondContact O-N 3.2Å; I199-Q202 VanDerWaalsContact O-N 3.16Å; K200-Q202 VanDerWaalsContact C-N 3.32Å; Q202-S204 PolarHBondContact O-N 3.24Å
203	E	86.4	Confident	90.8	Very high	192 Å²	192	60.9 Å²	60.9	90%	0.897	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-9.3	177.5	-61.9	-176.8	170.5	0	0	113.5	L201	L201-E203 PolarHBondContact O-N 3.05Å
204	S	87.9	Confident	90.7	Very high	39 Å²	39	60.8 Å²	60.8	27%	0.273	32%	0.319	S	S	.	.			trans	-72.7	142.5	-178.5	-172.2	0	0	0	0	112.2	L201 Q202 C206 L210	L201-S204 WeakPolarHBondContact O-CB 3.4Å; L201-S204 PolarHBondContact O-N 3.39Å; Q202-S204 PolarHBondContact O-N 3.24Å; S204-C206 PolarHBondContact O-N 2.99Å; S204-C206 WeakPolarHBondContact OG-CB 3.1Å; S204-C206 PolarHBondContact OG-N 3.11Å; S204-L210 WeakPolarHBondContact O-CD1 3.42Å
205	S	87.6	Confident	90.7	Very high	101 Å²	101	63.3 Å²	63.3	71%	0.706	34%	0.34	S	S	*	.	S	Bend	trans	-77.6	-4.6	169.6	53.2	0	0	0	0	113.5	T207	S205-T207 PolarHBondContact O-N 3Å
206	C	90.1	Very high	90.8	Very high	39 Å²	39	64 Å²	64	26%	0.264	35%	0.345	S	S	.	.			trans	-80.2	79.5	-177.8	-66.5	0	0	0	0	112.7	Y161 S204 H208 L209 L210	Y161-C206 HydrophobicContact CE2-CB 4.24Å; S204-C206 PolarHBondContact O-N 2.99Å; S204-C206 WeakPolarHBondContact OG-CB 3.1Å; S204-C206 PolarHBondContact OG-N 3.11Å; C206-H208 VanDerWaalsContact C-N 3.32Å; C206-H208 PolarHBondContact O-N 3.26Å; C206-L209 HydrophobicContact CB-CB 3.92Å; C206-L209 HydrophobicContact CB-CD2 4.44Å; C206-L209 PolarHBondContact O-N 3.37Å; C206-L209 VanDerWaalsContact O-N 3.12Å; C206-L210 WeakPolarHBondContact O-CG 3.43Å; C206-L210 PolarHBondContact O-N 3.06Å
207	T	91.1	Very high	90.9	Very high	103 Å²	103	59.7 Å²	59.7	63%	0.632	32%	0.324	S	S	*	.	H	α-helix	trans	-55.6	-38	-176.8	56.3	0	0	0	0	114.8	S205 L210 G211	S205-T207 PolarHBondContact O-N 3Å; T207-L210 PolarHBondContact O-N 3.4Å; T207-G211 PolarHBondContact O-N 2.95Å
208	H	91.9	Very high	91.1	Very high	151 Å²	151	64.5 Å²	64.5	70%	0.699	35%	0.345	S	S	*	.	H	α-helix	trans	-69.2	-38.7	178.1	-64.2	102.5	0	0	0	112.8	C206 G211 F212	C206-H208 VanDerWaalsContact C-N 3.32Å; C206-H208 PolarHBondContact O-N 3.26Å; H208-G211 PolarHBondContact O-N 3.47Å; H208-F212 WeakPolarHBondContact O-CB 3.46Å; H208-F212 PolarHBondContact O-N 3.34Å
209	L	92.1	Very high	91.2	Very high	3 Å²	3	70.1 Å²	70.1	2%	0.016	37%	0.369	C	S	.	.	H	α-helix	trans	-65.7	-42.7	175.3	-178.8	64.6	0	0	0	110.5	Y161 W164 I165 I168 L201 C206 F212 M213	Y161-L209 HydrophobicContact CD2-CB 4.47Å; Y161-L209 HydrophobicContact CD2-CD2 4.3Å; Y161-L209 HydrophobicContact CE2-CB 3.66Å; Y161-L209 HydrophobicContact CE2-CD2 4.29Å; Y161-L209 HydrophobicContact CE2-CG 4.38Å; W164-L209 HydrophobicContact CB-CD1 4.23Å; W164-L209 HydrophobicContact CB-CD2 3.95Å; W164-L209 HydrophobicContact CG-CD2 4.26Å; I165-L209 HydrophobicContact CG1-CD1 3.98Å; I168-L209 HydrophobicContact CD1-CD1 3.86Å; L201-L209 HydrophobicContact CD2-CD2 4.46Å; C206-L209 HydrophobicContact CB-CB 3.92Å; C206-L209 HydrophobicContact CB-CD2 4.44Å; C206-L209 PolarHBondContact O-N 3.37Å; C206-L209 VanDerWaalsContact O-N 3.12Å; L209-F212 PolarHBondContact O-N 3.47Å; L209-M213 VanDerWaalsContact O-CB 3.3Å; L209-M213 WeakPolarHBondContact O-CB 3.41Å; L209-M213 PolarHBondContact O-N 3.11Å
210	L	92.3	Very high	91.4	Very high	28 Å²	28	66.8 Å²	66.8	15%	0.147	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-44.2	175	-64.5	174.3	0	0	0	112.1	L201 S204 C206 T207 M213 R214	L201-L210 VanDerWaalsContact C-CD2 3.48Å; L201-L210 HydrophobicContact CB-CD2 3.71Å; L201-L210 WeakPolarHBondContact O-CD2 3.44Å; S204-L210 WeakPolarHBondContact O-CD1 3.42Å; C206-L210 WeakPolarHBondContact O-CG 3.43Å; C206-L210 PolarHBondContact O-N 3.06Å; T207-L210 PolarHBondContact O-N 3.4Å; L210-M213 PolarHBondContact O-N 2.82Å; L210-R214 VanDerWaalsContact O-CB 3.28Å; L210-R214 WeakPolarHBondContact O-CB 3.46Å; L210-R214 PolarHBondContact O-N 3.42Å
211	G	91.4	Very high	91.7	Very high	44 Å²	44	60.2 Å²	60.2	45%	0.454	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-45.8	175.3	0	0	0	0	0	112.3	T207 H208 A215	T207-G211 PolarHBondContact O-N 2.95Å; H208-G211 PolarHBondContact O-N 3.47Å; G211-A215 VanDerWaalsContact O-CB 3.25Å; G211-A215 WeakPolarHBondContact O-CB 3.47Å; G211-A215 PolarHBondContact O-N 3.13Å
212	F	93.5	Very high	91.9	Very high	86 Å²	86	66.2 Å²	66.2	38%	0.377	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-50.4	175.7	177.7	-112.3	0	0	0	111.3	I168 H208 L209 R214 A215 T216	I168-F212 HydrophobicContact CB-CE1 4.14Å; I168-F212 HydrophobicContact CD1-CD1 4.16Å; I168-F212 HydrophobicContact CD1-CE1 4.39Å; I168-F212 HydrophobicContact CG2-CD1 4.17Å; I168-F212 HydrophobicContact CG2-CE1 3.6Å; I168-F212 HydrophobicContact CG2-CZ 4.37Å; H208-F212 WeakPolarHBondContact O-CB 3.46Å; H208-F212 PolarHBondContact O-N 3.34Å; L209-F212 PolarHBondContact O-N 3.47Å; F212-R214 PolarHBondContact O-N 3.26Å; F212-A215 WeakPolarHBondContact O-CB 2.77Å; F212-A215 PolarHBondContact O-N 3.02Å; F212-A215 VanDerWaalsContact O-N 3.16Å; F212-T216 PolarHBondContact O-N 3.38Å; F212-T216 PolarHBondContact O-OG1 3.3Å
213	M	93.8	Very high	92.3	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-57.8	-49.8	179.7	-176.2	56.2	-172.2	0	0	112	I168 M194 L197 D198 L201 L209 L210 A215 T216 V217	I168-M213 HydrophobicContact CB-SD 4.33Å; I168-M213 HydrophobicContact CD1-CB 4.09Å; I168-M213 HydrophobicContact CD1-CG 4.33Å; I168-M213 HydrophobicContact CD1-SD 3.6Å; I168-M213 HydrophobicContact CG1-SD 3.53Å; I168-M213 VanDerWaalsContact CG1-SD 3.53Å; I168-M213 HydrophobicContact CG2-SD 3.87Å; M194-M213 HydrophobicContact CB-CE 4.27Å; M194-M213 HydrophobicContact CG-CE 3.33Å; M194-M213 HydrophobicContact CG-SD 4.32Å; M194-M213 WeakPolarHBondContact O-CE 3.48Å; L197-M213 HydrophobicContact CB-CE 3.9Å; L197-M213 HydrophobicContact CD2-CE 3.42Å; L197-M213 VanDerWaalsContact CD2-CE 3.42Å; L197-M213 HydrophobicContact CD2-CG 4.41Å; L197-M213 HydrophobicContact CD2-SD 3.67Å; L197-M213 HydrophobicContact CG-CE 4.28Å; D198-M213 HydrophobicContact CB-CE 3.83Å; D198-M213 HydrophobicContact CB-CG 3.73Å; D198-M213 WeakPolarHBondContact OD1-CG 3.42Å; L201-M213 HydrophobicContact CD1-CG 4.25Å; L209-M213 VanDerWaalsContact O-CB 3.3Å; L209-M213 WeakPolarHBondContact O-CB 3.41Å; L209-M213 PolarHBondContact O-N 3.11Å; L210-M213 PolarHBondContact O-N 2.82Å; M213-A215 VanDerWaalsContact C-N 3.3Å; M213-A215 PolarHBondContact O-N 3.23Å; M213-T216 PolarHBondContact O-N 2.86Å; M213-V217 HydrophobicContact CE-CG2 3.8Å; M213-V217 WeakPolarHBondContact O-CG2 3.5Å; M213-V217 PolarHBondContact O-N 3.49Å
214	R	92.3	Very high	92.7	Very high	55 Å²	55	55.9 Å²	55.9	21%	0.208	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-36.2	178.5	-172.7	61.1	63	119.9	5.4	111.8	D198 L210 F212 K218 L283	D198-R214 IonicContact OD1-NE 3.96Å; D198-R214 PolarHBondContact OD1-NE 3.1Å; D198-R214 IonicContact OD1-NH2 2.84Å; D198-R214 IonicContact OD2-CZ 3.3Å; D198-R214 IonicContact OD2-NE 2.67Å; D198-R214 PolarHBondContact OD2-NE 3.32Å; D198-R214 IonicContact OD2-NH2 3.7Å; D198-R214 PolarHBondContact OD2-NH2 3.44Å; L210-R214 VanDerWaalsContact O-CB 3.28Å; L210-R214 WeakPolarHBondContact O-CB 3.46Å; L210-R214 PolarHBondContact O-N 3.42Å; F212-R214 PolarHBondContact O-N 3.26Å; R214-K218 HydrophobicContact CG-CD 4.43Å; R214-K218 WeakPolarHBondContact O-CB 3.41Å; R214-K218 WeakPolarHBondContact O-CG 3.4Å; R214-K218 PolarHBondContact O-N 3.04Å; R214-L283 PolarHBondContact NH1-O 2.99Å
215	A	93.3	Very high	93	Very high	53 Å²	53	56.3 Å²	56.3	44%	0.438	30%	0.299	S	S	.	.	H	α-helix	trans	-67.1	-41	175.1	0	0	0	0	0	112	G211 F212 M213 K218 F219	G211-A215 VanDerWaalsContact O-CB 3.25Å; G211-A215 WeakPolarHBondContact O-CB 3.47Å; G211-A215 PolarHBondContact O-N 3.13Å; F212-A215 WeakPolarHBondContact O-CB 2.77Å; F212-A215 PolarHBondContact O-N 3.02Å; F212-A215 VanDerWaalsContact O-N 3.16Å; M213-A215 VanDerWaalsContact C-N 3.3Å; M213-A215 PolarHBondContact O-N 3.23Å; A215-K218 WeakPolarHBondContact O-CB 3.37Å; A215-K218 PolarHBondContact O-N 3.21Å; A215-F219 WeakPolarHBondContact O-CB 3.3Å; A215-F219 PolarHBondContact O-N 2.84Å
216	T	93.4	Very high	93.3	Very high	16 Å²	16	56 Å²	56	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-66.1	-43.6	177.5	-54.5	0	0	0	0	111.5	I168 M194 F212 M213 K218 F219 W220	I168-T216 HydrophobicContact CG2-CG2 4.08Å; M194-T216 HydrophobicContact CE-CG2 3.95Å; M194-T216 HydrophobicContact SD-CG2 3.83Å; F212-T216 PolarHBondContact O-N 3.38Å; F212-T216 PolarHBondContact O-OG1 3.3Å; M213-T216 PolarHBondContact O-N 2.86Å; T216-K218 PolarHBondContact O-N 2.93Å; T216-F219 PolarHBondContact O-N 3.28Å; T216-W220 PolarHBondContact O-N 2.69Å; T216-W220 VanDerWaalsContact O-N 3.08Å
217	V	94.3	Very high	93.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-47.2	172	173.5	0	0	0	0	110.7	L191 M194 D198 M213 F219 W220 H221 L284	L191-V217 HydrophobicContact CD1-CG1 4.49Å; M194-V217 HydrophobicContact CG-CG2 3.76Å; M194-V217 HydrophobicContact SD-CG2 4.09Å; D198-V217 HydrophobicContact CB-CG2 4.15Å; M213-V217 HydrophobicContact CE-CG2 3.8Å; M213-V217 WeakPolarHBondContact O-CG2 3.5Å; M213-V217 PolarHBondContact O-N 3.49Å; V217-F219 VanDerWaalsContact C-N 3.31Å; V217-F219 PolarHBondContact O-N 3.37Å; V217-W220 PolarHBondContact O-N 3.32Å; V217-H221 WeakPolarHBondContact O-CB 3.09Å; V217-H221 PolarHBondContact O-N 3.37Å; V217-L284 HydrophobicContact CG1-CD1 4.41Å
218	K	93.8	Very high	93.6	Very high	113 Å²	113	52.4 Å²	52.4	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-56.6	-44.7	176.3	-80.1	173.3	180	177.9	0	112.4	R214 A215 T216 K222 L284	R214-K218 HydrophobicContact CG-CD 4.43Å; R214-K218 WeakPolarHBondContact O-CB 3.41Å; R214-K218 WeakPolarHBondContact O-CG 3.4Å; R214-K218 PolarHBondContact O-N 3.04Å; A215-K218 WeakPolarHBondContact O-CB 3.37Å; A215-K218 PolarHBondContact O-N 3.21Å; T216-K218 PolarHBondContact O-N 2.93Å; K218-K222 WeakPolarHBondContact O-CB 3.38Å; K218-K222 PolarHBondContact O-N 2.84Å; K218-L284 HydrophobicContact CB-CD1 4.41Å; K218-L284 HydrophobicContact CB-CD2 4.47Å; K218-L284 HydrophobicContact CD-CD2 4.01Å; K218-L284 VanDerWaalsContact CE-CD2 3.49Å; K218-L284 HydrophobicContact CG-CD1 3.86Å; K218-L284 HydrophobicContact CG-CD2 3.24Å; K218-L284 HydrophobicContact CG-CG 4.11Å
219	F	94.9	Very high	93.7	Very high	118 Å²	118	46.4 Å²	46.4	52%	0.518	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-54	-178.5	175.4	-99.8	0	0	0	111.4	A215 T216 V217 K222 I223	A215-F219 WeakPolarHBondContact O-CB 3.3Å; A215-F219 PolarHBondContact O-N 2.84Å; T216-F219 PolarHBondContact O-N 3.28Å; V217-F219 VanDerWaalsContact C-N 3.31Å; V217-F219 PolarHBondContact O-N 3.37Å; F219-K222 PolarHBondContact O-N 2.89Å; F219-I223 HydrophobicContact CD1-CD1 4.16Å; F219-I223 HydrophobicContact CD2-CD1 4.46Å; F219-I223 HydrophobicContact CE1-CD1 3.6Å; F219-I223 HydrophobicContact CE2-CD1 3.95Å; F219-I223 HydrophobicContact CZ-CD1 3.48Å; F219-I223 VanDerWaalsContact CZ-CD1 3.48Å; F219-I223 PolarHBondContact O-N 3.43Å
220	W	94.9	Very high	93.9	Very high	13 Å²	13	49.5 Å²	49.5	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-70.8	-38.6	-178.5	-71.9	121.5	0	0	0	113.1	S172 I175 Q176 L179 L191 T216 V217 K222 I223 L224	S172-W220 WeakPolarHBondContact O-CZ2 3.38Å; S172-W220 WeakPolarHBondContact OG-CZ2 3.13Å; S172-W220 PolarHBondContact OG-NE1 3.19Å; I175-W220 HydrophobicContact CB-CD2 4.19Å; I175-W220 HydrophobicContact CB-CE3 4.4Å; I175-W220 HydrophobicContact CD1-CB 4.19Å; I175-W220 HydrophobicContact CD1-CD2 4.45Å; I175-W220 HydrophobicContact CD1-CG 3.93Å; I175-W220 HydrophobicContact CG2-CB 4.46Å; I175-W220 HydrophobicContact CG2-CD2 3.61Å; I175-W220 HydrophobicContact CG2-CE3 3.45Å; I175-W220 VanDerWaalsContact CG2-CE3 3.45Å; I175-W220 HydrophobicContact CG2-CG 4.07Å; I175-W220 HydrophobicContact CG2-CH2 4.49Å; I175-W220 HydrophobicContact CG2-CZ3 3.94Å; Q176-W220 HydrophobicContact CB-CH2 3.69Å; Q176-W220 HydrophobicContact CB-CZ2 4.13Å; Q176-W220 HydrophobicContact CG-CH2 4.22Å; L179-W220 HydrophobicContact CD1-CE3 4.18Å; L179-W220 HydrophobicContact CD1-CZ3 3.83Å; L191-W220 HydrophobicContact CD1-CB 3.91Å; T216-W220 PolarHBondContact O-N 2.69Å; T216-W220 VanDerWaalsContact O-N 3.08Å; V217-W220 PolarHBondContact O-N 3.32Å; W220-K222 VanDerWaalsContact C-N 3.3Å; W220-K222 PolarHBondContact O-N 3.16Å; W220-I223 HydrophobicContact CE3-CD1 4.05Å; W220-I223 HydrophobicContact CZ3-CD1 4.04Å; W220-I223 PolarHBondContact O-N 2.97Å; W220-L224 WeakPolarHBondContact O-CB 3.43Å; W220-L224 PolarHBondContact O-N 3.16Å
221	H	94.5	Very high	94	Very high	9 Å²	9	50 Å²	50	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-57	-45.6	174.5	-177.1	75.4	0	0	0	111.3	L191 V217 L224 K225 L277 S280 D281 L284	L191-H221 HydrophobicContact CD2-CB 4.08Å; V217-H221 WeakPolarHBondContact O-CB 3.09Å; V217-H221 PolarHBondContact O-N 3.37Å; H221-L224 PolarHBondContact O-N 3.36Å; H221-K225 WeakPolarHBondContact O-CB 3.39Å; H221-K225 PolarHBondContact O-N 2.84Å; H221-L277 PolarHBondContact CE1-O 2.95Å; H221-S280 PolarHBondContact CE1-OG 3.05Å; H221-S280 WeakPolarHBondContact ND1-CB 3.4Å; H221-S280 PolarHBondContact ND1-OG 2.89Å; H221-D281 PolarHBondContact CE1-N 3.06Å; H221-D281 IonicContact CE1-OD1 2.89Å; H221-D281 PolarHBondContact CE1-OD1 3.42Å; H221-D281 IonicContact NE2-OD1 2.75Å; H221-D281 PolarHBondContact NE2-OD1 2.97Å; H221-L284 HydrophobicContact CB-CD1 3.74Å
222	K	94.3	Very high	94.2	Very high	137 Å²	137	48 Å²	48	60%	0.596	24%	0.238	S	C	*	.	H	α-helix	trans	-59.9	-49.3	178.5	-176.9	177.2	178.2	179.9	0	111.9	K218 F219 W220 L224 K225 D226	K218-K222 WeakPolarHBondContact O-CB 3.38Å; K218-K222 PolarHBondContact O-N 2.84Å; F219-K222 PolarHBondContact O-N 2.89Å; W220-K222 VanDerWaalsContact C-N 3.3Å; W220-K222 PolarHBondContact O-N 3.16Å; K222-L224 PolarHBondContact O-N 2.93Å; K222-K225 PolarHBondContact O-N 3Å; K222-D226 WeakPolarHBondContact O-CB 3.45Å; K222-D226 PolarHBondContact O-N 3.36Å
223	I	94.1	Very high	94.2	Very high	65 Å²	65	47.7 Å²	47.7	33%	0.333	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-48.5	-178.9	-66.7	172	0	0	0	111.1	L179 F219 W220 K227	L179-I223 HydrophobicContact CD1-CG2 4.15Å; F219-I223 HydrophobicContact CD1-CD1 4.16Å; F219-I223 HydrophobicContact CD2-CD1 4.46Å; F219-I223 HydrophobicContact CE1-CD1 3.6Å; F219-I223 HydrophobicContact CE2-CD1 3.95Å; F219-I223 HydrophobicContact CZ-CD1 3.48Å; F219-I223 VanDerWaalsContact CZ-CD1 3.48Å; F219-I223 PolarHBondContact O-N 3.43Å; W220-I223 HydrophobicContact CE3-CD1 4.05Å; W220-I223 HydrophobicContact CZ3-CD1 4.04Å; W220-I223 PolarHBondContact O-N 2.97Å; I223-K227 PolarHBondContact O-N 2.89Å; I223-K227 VanDerWaalsContact O-N 3.13Å
224	L	94.1	Very high	94.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-43.3	-179.3	-79	168	0	0	0	111.9	I175 L179 V184 A187 L191 W220 H221 K222 K227 L228 L277	I175-L224 HydrophobicContact CG2-CD1 4.38Å; L179-L224 HydrophobicContact CD2-CD2 3.75Å; L179-L224 HydrophobicContact CG-CD2 4.47Å; V184-L224 HydrophobicContact CG1-CD2 4.15Å; A187-L224 HydrophobicContact CB-CD1 4.45Å; A187-L224 HydrophobicContact CB-CD2 4.04Å; L191-L224 HydrophobicContact CB-CD1 4.07Å; L191-L224 HydrophobicContact CD2-CD1 3.66Å; L191-L224 HydrophobicContact CG-CD1 4.49Å; W220-L224 WeakPolarHBondContact O-CB 3.43Å; W220-L224 PolarHBondContact O-N 3.16Å; H221-L224 PolarHBondContact O-N 3.36Å; K222-L224 PolarHBondContact O-N 2.93Å; L224-K227 PolarHBondContact O-N 3.47Å; L224-L228 VanDerWaalsContact O-CB 3.3Å; L224-L228 WeakPolarHBondContact O-CB 3.04Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3.06Å; L224-L277 HydrophobicContact CB-CD1 4.14Å; L224-L277 HydrophobicContact CB-CD2 4.31Å; L224-L277 HydrophobicContact CD1-CD2 4.43Å
225	K	94.4	Very high	94.3	Very high	48 Å²	48	51 Å²	51	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-46.2	177	-178.6	171.4	175.1	167	0	111.2	H221 K222 T229 L277 D281 L304	H221-K225 WeakPolarHBondContact O-CB 3.39Å; H221-K225 PolarHBondContact O-N 2.84Å; K222-K225 PolarHBondContact O-N 3Å; K225-T229 WeakPolarHBondContact O-CB 3.46Å; K225-T229 PolarHBondContact O-N 3.41Å; K225-T229 PolarHBondContact O-OG1 3.4Å; K225-L277 HydrophobicContact CB-CD1 4.27Å; K225-D281 IonicContact NZ-OD1 2.6Å; K225-D281 PolarHBondContact NZ-OD1 3.29Å; K225-D281 IonicContact NZ-OD2 2.86Å; K225-L304 HydrophobicContact CD-CD1 4.4Å
226	D	94.3	Very high	94.2	Very high	94 Å²	94	48.7 Å²	48.7	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-45.6	180	-72.3	-15	0	0	0	111.1	K222 S230	K222-D226 WeakPolarHBondContact O-CB 3.45Å; K222-D226 PolarHBondContact O-N 3.36Å; D226-S230 WeakPolarHBondContact O-CB 3.41Å; D226-S230 PolarHBondContact O-N 3.12Å; D226-S230 VanDerWaalsContact O-N 3.08Å
227	K	93.4	Very high	94.1	Very high	66 Å²	66	51 Å²	51	29%	0.287	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-54.8	177	-178.1	173.9	177.7	175.8	0	111.9	N182 I223 L224 T229 S230 D231	N182-K227 PolarHBondContact OD1-NZ 2.95Å; I223-K227 PolarHBondContact O-N 2.89Å; I223-K227 VanDerWaalsContact O-N 3.13Å; L224-K227 PolarHBondContact O-N 3.47Å; K227-T229 VanDerWaalsContact C-N 3.32Å; K227-T229 PolarHBondContact O-N 3.36Å; K227-S230 WeakPolarHBondContact O-CB 3.35Å; K227-S230 PolarHBondContact O-N 3.22Å; K227-D231 PolarHBondContact O-N 3.37Å
228	L	94.6	Very high	93.9	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-35.7	-178	-72.1	173.5	0	0	0	112.6	V184 L224 F232 L270 Q273 L274 L277	V184-L228 HydrophobicContact CG1-CD1 4.36Å; V184-L228 HydrophobicContact CG1-CD2 3.65Å; V184-L228 HydrophobicContact CG1-CG 4.12Å; L224-L228 VanDerWaalsContact O-CB 3.3Å; L224-L228 WeakPolarHBondContact O-CB 3.04Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3.06Å; L228-F232 WeakPolarHBondContact O-CB 3.27Å; L228-F232 PolarHBondContact O-N 2.98Å; L228-L270 HydrophobicContact CD2-CD2 3.8Å; L228-Q273 HydrophobicContact CD1-CB 3.97Å; L228-Q273 HydrophobicContact CD2-CB 4.05Å; L228-L274 HydrophobicContact CB-CD2 3.56Å; L228-L274 HydrophobicContact CB-CG 4.04Å; L228-L274 HydrophobicContact CD1-CD2 4.31Å; L228-L277 HydrophobicContact CD1-CD1 3.69Å; L228-L277 HydrophobicContact CD1-CG 4.35Å
229	T	95.1	Very high	93.7	Very high	25 Å²	25	51.1 Å²	51.1	15%	0.153	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-44.2	175.5	-60	0	0	0	0	110.5	K225 K227 F232 E233 I308	K225-T229 WeakPolarHBondContact O-CB 3.46Å; K225-T229 PolarHBondContact O-N 3.41Å; K225-T229 PolarHBondContact O-OG1 3.4Å; K227-T229 VanDerWaalsContact C-N 3.32Å; K227-T229 PolarHBondContact O-N 3.36Å; T229-F232 PolarHBondContact O-N 2.99Å; T229-E233 HydrophobicContact CG2-CG 4.29Å; T229-E233 WeakPolarHBondContact O-CB 3.45Å; T229-E233 WeakPolarHBondContact O-CG 3.46Å; T229-E233 PolarHBondContact O-N 3.43Å; T229-I308 HydrophobicContact CG2-CD1 4.14Å; T229-I308 HydrophobicContact CG2-CG1 4.19Å; T229-I308 HydrophobicContact CG2-CG2 3.9Å; T229-I308 WeakPolarHBondContact OG1-CD1 3.28Å
230	S	95.4	Very high	93.4	Very high	69 Å²	69	51.5 Å²	51.5	48%	0.483	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-49.6	176.7	-175.1	0	0	0	0	111.7	D226 K227 F232 E233 E234	D226-S230 WeakPolarHBondContact O-CB 3.41Å; D226-S230 PolarHBondContact O-N 3.12Å; D226-S230 VanDerWaalsContact O-N 3.08Å; K227-S230 WeakPolarHBondContact O-CB 3.35Å; K227-S230 PolarHBondContact O-N 3.22Å; S230-F232 VanDerWaalsContact C-N 3.28Å; S230-F232 PolarHBondContact O-N 3.14Å; S230-E233 PolarHBondContact O-N 3.04Å; S230-E234 PolarHBondContact O-N 3.03Å
231	D	93.7	Very high	93.2	Very high	39 Å²	39	51.8 Å²	51.8	21%	0.209	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-37.1	179.7	-64.2	-17.1	0	0	0	111.3	K227 I235 L270	K227-D231 PolarHBondContact O-N 3.37Å; D231-I235 PolarHBondContact O-N 2.94Å; D231-L270 HydrophobicContact CB-CD1 4.07Å; D231-L270 HydrophobicContact CB-CD2 3.99Å
232	F	95.8	Very high	93	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-72.4	-38.7	178.1	-169.7	-117.5	0	0	0	112.7	L228 T229 S230 E234 I235 L236 L267 L270 F271 L274 I308 M309	L228-F232 WeakPolarHBondContact O-CB 3.27Å; L228-F232 PolarHBondContact O-N 2.98Å; T229-F232 PolarHBondContact O-N 2.99Å; S230-F232 VanDerWaalsContact C-N 3.28Å; S230-F232 PolarHBondContact O-N 3.14Å; F232-E234 VanDerWaalsContact C-N 3.32Å; F232-E234 PolarHBondContact O-N 3.36Å; F232-I235 HydrophobicContact CD2-CG2 4.17Å; F232-I235 VanDerWaalsContact O-CG2 3.23Å; F232-I235 WeakPolarHBondContact O-CG2 3.36Å; F232-L236 HydrophobicContact CD1-CD1 3.74Å; F232-L236 HydrophobicContact CD1-CG 4.4Å; F232-L236 HydrophobicContact CE1-CD1 3.59Å; F232-L236 HydrophobicContact CE1-CG 4.28Å; F232-L236 HydrophobicContact CG-CD1 4.39Å; F232-L236 HydrophobicContact CZ-CD1 4.12Å; F232-L236 HydrophobicContact CZ-CD2 4.41Å; F232-L236 HydrophobicContact CZ-CG 4.38Å; F232-L236 WeakPolarHBondContact O-CB 3.48Å; F232-L236 WeakPolarHBondContact O-CG 3.22Å; F232-L236 PolarHBondContact O-N 3.15Å; F232-L267 HydrophobicContact CD2-CD1 4.11Å; F232-L267 HydrophobicContact CE2-CD1 3.47Å; F232-L267 VanDerWaalsContact CE2-CD1 3.47Å; F232-L267 HydrophobicContact CE2-CG 4.45Å; F232-L267 HydrophobicContact CZ-CD1 4.27Å; F232-L270 HydrophobicContact CB-CD1 4.39Å; F232-L270 HydrophobicContact CD2-CB 3.9Å; F232-L270 HydrophobicContact CD2-CD1 4.42Å; F232-F271 HydrophobicContact CE2-CB 4.39Å; F232-F271 HydrophobicContact CE2-CD2 4.33Å; F232-F271 HydrophobicContact CZ-CD2 4.04Å; F232-L274 HydrophobicContact CB-CD1 3.8Å; F232-L274 HydrophobicContact CD1-CD1 3.67Å; F232-L274 HydrophobicContact CD2-CD1 4.03Å; F232-L274 HydrophobicContact CE1-CD1 4.17Å; F232-L274 HydrophobicContact CG-CD1 3.58Å; F232-I308 HydrophobicContact CD1-CB 4.26Å; F232-I308 HydrophobicContact CD1-CG2 3.8Å; F232-I308 HydrophobicContact CE1-CB 4.42Å; F232-I308 HydrophobicContact CE1-CG2 4.32Å; F232-M309 HydrophobicContact CE1-CG 3.68Å; F232-M309 HydrophobicContact CE1-SD 4.48Å; F232-M309 HydrophobicContact CZ-CG 3.94Å; F232-M309 HydrophobicContact CZ-SD 4.18Å
233	E	94.4	Very high	92.8	Very high	80 Å²	80	47.3 Å²	47.3	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-64.5	-36.8	173.5	-76	-174.9	159.6	0	0	111.6	T229 S230 L236 A237 I308	T229-E233 HydrophobicContact CG2-CG 4.29Å; T229-E233 WeakPolarHBondContact O-CB 3.45Å; T229-E233 WeakPolarHBondContact O-CG 3.46Å; T229-E233 PolarHBondContact O-N 3.43Å; S230-E233 PolarHBondContact O-N 3.04Å; E233-L236 PolarHBondContact O-N 2.92Å; E233-A237 WeakPolarHBondContact O-CB 3.4Å; E233-A237 PolarHBondContact O-N 2.88Å; E233-I308 HydrophobicContact CG-CG2 4.15Å
234	E	93.6	Very high	92.1	Very high	118 Å²	118	47.8 Å²	47.8	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-64.5	-47.3	176.9	-170.4	178.1	174.8	0	0	111.9	S230 F232 L236 A237 Q238	S230-E234 PolarHBondContact O-N 3.03Å; F232-E234 VanDerWaalsContact C-N 3.32Å; F232-E234 PolarHBondContact O-N 3.36Å; E234-L236 VanDerWaalsContact C-N 3.35Å; E234-L236 PolarHBondContact O-N 3.44Å; E234-A237 PolarHBondContact O-N 3.31Å; E234-Q238 WeakPolarHBondContact O-CG 3.44Å; E234-Q238 PolarHBondContact O-N 3.03Å
235	I	93.5	Very high	91.2	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-66.8	-37.6	177.8	-164.3	62.7	0	0	0	111.5	D231 F232 A237 Q238 L239 M263 Y266 L267 L270	D231-I235 PolarHBondContact O-N 2.94Å; F232-I235 HydrophobicContact CD2-CG2 4.17Å; F232-I235 VanDerWaalsContact O-CG2 3.23Å; F232-I235 WeakPolarHBondContact O-CG2 3.36Å; I235-A237 VanDerWaalsContact C-N 3.33Å; I235-A237 PolarHBondContact O-N 2.69Å; I235-Q238 PolarHBondContact O-N 3.21Å; I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 3.42Å; I235-M263 HydrophobicContact CD1-CB 3.98Å; I235-M263 HydrophobicContact CD1-CG 4.11Å; I235-Y266 HydrophobicContact CB-CD1 4.35Å; I235-Y266 HydrophobicContact CD1-CD1 4.08Å; I235-Y266 HydrophobicContact CG1-CD1 4.17Å; I235-L267 HydrophobicContact CG1-CB 4.47Å; I235-L267 HydrophobicContact CG2-CD1 3.86Å; I235-L270 HydrophobicContact CG2-CD1 4Å
236	L	92.4	Very high	89.8	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-41.6	174.1	-76.3	177.9	0	0	0	111.3	F232 E233 E234 Q238 L239 H240 W241 L267 M309	F232-L236 HydrophobicContact CD1-CD1 3.74Å; F232-L236 HydrophobicContact CD1-CG 4.4Å; F232-L236 HydrophobicContact CE1-CD1 3.59Å; F232-L236 HydrophobicContact CE1-CG 4.28Å; F232-L236 HydrophobicContact CG-CD1 4.39Å; F232-L236 HydrophobicContact CZ-CD1 4.12Å; F232-L236 HydrophobicContact CZ-CD2 4.41Å; F232-L236 HydrophobicContact CZ-CG 4.38Å; F232-L236 WeakPolarHBondContact O-CB 3.48Å; F232-L236 WeakPolarHBondContact O-CG 3.22Å; F232-L236 PolarHBondContact O-N 3.15Å; E233-L236 PolarHBondContact O-N 2.92Å; E234-L236 VanDerWaalsContact C-N 3.35Å; E234-L236 PolarHBondContact O-N 3.44Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 3.16Å; L236-L239 CarbonylContact O-C 3.57Å; L236-L239 PolarHBondContact O-N 3.29Å; L236-L239 VanDerWaalsContact O-N 3.15Å; L236-H240 PolarHBondContact O-N 2.92Å; L236-W241 HydrophobicContact CB-CB 3.92Å; L236-W241 HydrophobicContact CB-CG 4.26Å; L236-W241 HydrophobicContact CD2-CB 3.97Å; L236-W241 HydrophobicContact CD2-CD2 4.22Å; L236-W241 HydrophobicContact CD2-CG 3.87Å; L236-W241 HydrophobicContact CG-CB 4.48Å; L236-W241 HydrophobicContact CG-CG 4.44Å; L236-W241 VanDerWaalsContact O-CB 3.26Å; L236-W241 WeakPolarHBondContact O-CB 3.3Å; L236-W241 PolarHBondContact O-N 2.86Å; L236-L267 HydrophobicContact CD2-CD1 4.18Å; L236-M309 HydrophobicContact CD1-CG 3.9Å; L236-M309 HydrophobicContact CD2-CE 4.03Å; L236-M309 HydrophobicContact CD2-CG 4.42Å
237	A	91.1	Very high	88	Confident	63 Å²	63	48.8 Å²	48.8	52%	0.521	27%	0.269	S	S	.	.	H	α-helix	trans	-62.9	-39.8	176	0	0	0	0	0	112.3	E233 E234 I235 L239 H240	E233-A237 WeakPolarHBondContact O-CB 3.4Å; E233-A237 PolarHBondContact O-N 2.88Å; E234-A237 PolarHBondContact O-N 3.31Å; I235-A237 VanDerWaalsContact C-N 3.33Å; I235-A237 PolarHBondContact O-N 2.69Å; A237-L239 VanDerWaalsContact C-N 3.27Å; A237-L239 PolarHBondContact O-N 3.45Å; A237-H240 PolarHBondContact O-N 2.85Å
238	Q	89.4	Confident	86.1	Confident	92 Å²	92	54 Å²	54	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-32.7	174	-67.3	176.7	27.7	0	0	112.4	E234 I235 L236 H240	E234-Q238 WeakPolarHBondContact O-CG 3.44Å; E234-Q238 PolarHBondContact O-N 3.03Å; I235-Q238 PolarHBondContact O-N 3.21Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 3.16Å; Q238-H240 PolarHBondContact O-N 2.82Å
239	L	89.3	Confident	84	Confident	24 Å²	24	57.4 Å²	57.4	13%	0.126	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	6.8	173.6	-65.4	173.3	0	0	0	113.3	I235 L236 A237 W241 F243 Y264 L267 F350	I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 3.42Å; L236-L239 CarbonylContact O-C 3.57Å; L236-L239 PolarHBondContact O-N 3.29Å; L236-L239 VanDerWaalsContact O-N 3.15Å; A237-L239 VanDerWaalsContact C-N 3.27Å; A237-L239 PolarHBondContact O-N 3.45Å; L239-W241 PolarHBondContact O-N 3.4Å; L239-F243 WeakPolarHBondContact O-CE1 3.42Å; L239-Y264 HydrophobicContact CD1-CE1 4.43Å; L239-Y264 HydrophobicContact CD2-CE1 4.03Å; L239-L267 HydrophobicContact CD1-CD1 4.2Å; L239-L267 HydrophobicContact CD1-CD2 3.96Å; L239-F350 HydrophobicContact CD1-CE2 4.39Å; L239-F350 HydrophobicContact CD1-CZ 4.12Å
240	H	88.3	Confident	81.8	Confident	127 Å²	127	61.8 Å²	61.8	59%	0.588	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	29.9	-176	-56.3	-58	0	0	0	114.2	L236 A237 Q238 P242	L236-H240 PolarHBondContact O-N 2.92Å; A237-H240 PolarHBondContact O-N 2.85Å; Q238-H240 PolarHBondContact O-N 2.82Å; H240-P242 CarbonylContact O-C 3.49Å
241	W	91.1	Very high	79	Confident	18 Å²	18	63.6 Å²	63.6	7%	0.068	35%	0.346	C	S	.	.			trans	-77.6	140.2	172.4	-178	-83.2	0	0	0	110.9	L236 L239 F243 M309 H347 F350 L351 F372	L236-W241 HydrophobicContact CB-CB 3.92Å; L236-W241 HydrophobicContact CB-CG 4.26Å; L236-W241 HydrophobicContact CD2-CB 3.97Å; L236-W241 HydrophobicContact CD2-CD2 4.22Å; L236-W241 HydrophobicContact CD2-CG 3.87Å; L236-W241 HydrophobicContact CG-CB 4.48Å; L236-W241 HydrophobicContact CG-CG 4.44Å; L236-W241 VanDerWaalsContact O-CB 3.26Å; L236-W241 WeakPolarHBondContact O-CB 3.3Å; L236-W241 PolarHBondContact O-N 2.86Å; L239-W241 PolarHBondContact O-N 3.4Å; W241-F243 HydrophobicContact CE3-CD2 4.22Å; W241-F243 AromaticContact CE3-CE2 3.61Å; W241-F243 HydrophobicContact CE3-CE2 3.61Å; W241-F243 AromaticContact CE3-CZ 3.95Å; W241-F243 HydrophobicContact CE3-CZ 3.95Å; W241-F243 HydrophobicContact CZ3-CD2 4.3Å; W241-F243 AromaticContact CZ3-CE2 3.78Å; W241-F243 HydrophobicContact CZ3-CE2 3.78Å; W241-M309 HydrophobicContact CD2-CE 4Å; W241-M309 HydrophobicContact CE3-CE 3.8Å; W241-M309 HydrophobicContact CH2-CE 3.45Å; W241-M309 VanDerWaalsContact CH2-CE 3.45Å; W241-M309 HydrophobicContact CZ2-CB 3.72Å; W241-M309 HydrophobicContact CZ2-CE 3.66Å; W241-M309 HydrophobicContact CZ2-CG 4.4Å; W241-M309 HydrophobicContact CZ3-CE 3.49Å; W241-M309 VanDerWaalsContact CZ3-CE 3.49Å; W241-M309 PolarHBondContact NE1-O 3.13Å; W241-H347 AromaticContact CE3-CD2 3.8Å; W241-H347 HydrophobicContact CH2-CB 4.05Å; W241-H347 AromaticContact CH2-CD2 3.27Å; W241-H347 WeakPolarHBondContact CH2-CD2 3.37Å; W241-H347 AromaticContact CH2-CG 3.9Å; W241-H347 AromaticContact CZ2-CD2 3.71Å; W241-H347 HydrophobicContact CZ3-CB 4.3Å; W241-H347 AromaticContact CZ3-CD2 3.35Å; W241-H347 WeakPolarHBondContact CZ3-CD2 3.4Å; W241-F350 HydrophobicContact CE3-CD1 4.05Å; W241-F350 HydrophobicContact CE3-CE1 4.09Å; W241-F350 AromaticContact CZ3-CD1 3.63Å; W241-F350 HydrophobicContact CZ3-CD1 3.63Å; W241-F350 HydrophobicContact CZ3-CE1 4.01Å; W241-F350 HydrophobicContact CZ3-CG 4.38Å; W241-L351 HydrophobicContact CH2-CD2 4.3Å; W241-F372 HydrophobicContact CH2-CD2 4.44Å; W241-F372 AromaticContact CH2-CE2 3.89Å; W241-F372 HydrophobicContact CH2-CE2 3.89Å; W241-F372 HydrophobicContact CH2-CZ 4.1Å; W241-F372 HydrophobicContact CZ2-CD2 4.34Å; W241-F372 AromaticContact CZ2-CE2 3.55Å; W241-F372 HydrophobicContact CZ2-CE2 3.55Å; W241-F372 AromaticContact CZ2-CZ 3.96Å; W241-F372 HydrophobicContact CZ2-CZ 3.96Å
242	P	91.7	Very high	76.2	Confident	23 Å²	23	68.6 Å²	68.6	15%	0.149	38%	0.377	C	S	.	.	S	Bend	cis	-79.2	155.7	-5.7	33.2	-36.2	0	0	0	112.9	H240 I244 P312 L313 H347	H240-P242 CarbonylContact O-C 3.49Å; P242-I244 HydrophobicContact CG-CG1 4.43Å; P242-I244 PolarHBondContact O-N 3.04Å; P242-I244 VanDerWaalsContact O-N 3.09Å; P242-P312 HydrophobicContact CG-CB 4.03Å; P242-L313 HydrophobicContact CB-CD1 4.24Å; P242-L313 HydrophobicContact CB-CD2 3.62Å; P242-L313 HydrophobicContact CB-CG 3.84Å; P242-L313 HydrophobicContact CG-CD2 3.69Å; P242-L313 HydrophobicContact CG-CG 4.11Å; P242-H347 WeakPolarHBondContact CB-NE2 3.35Å
243	F	89.5	Confident	73.3	Confident	29 Å²	29	71.9 Å²	71.9	13%	0.127	41%	0.411	C	S	.	.			trans	-77.8	92	176.7	-48.2	-53.6	0	0	0	111.2	L239 W241 A245 N346 H347 F350	L239-F243 WeakPolarHBondContact O-CE1 3.42Å; W241-F243 HydrophobicContact CE3-CD2 4.22Å; W241-F243 AromaticContact CE3-CE2 3.61Å; W241-F243 HydrophobicContact CE3-CE2 3.61Å; W241-F243 AromaticContact CE3-CZ 3.95Å; W241-F243 HydrophobicContact CE3-CZ 3.95Å; W241-F243 HydrophobicContact CZ3-CD2 4.3Å; W241-F243 AromaticContact CZ3-CE2 3.78Å; W241-F243 HydrophobicContact CZ3-CE2 3.78Å; F243-A245 VanDerWaalsContact C-N 3.32Å; F243-N346 HydrophobicContact CB-CB 4.35Å; F243-N346 PolarHBondContact O-ND2 3.33Å; F243-H347 HydrophobicContact CD2-CB 4.48Å; F243-H347 AromaticContact CD2-CD2 3.35Å; F243-H347 WeakPolarHBondContact CD2-CD2 3.1Å; F243-H347 AromaticContact CD2-NE2 3.94Å; F243-H347 PolarHBondContact N-NE2 2.89Å; F243-H347 PolarHBondContact O-CE1 3.4Å; F243-F350 HydrophobicContact CD2-CB 4.45Å; F243-F350 HydrophobicContact CE2-CB 3.48Å; F243-F350 VanDerWaalsContact CE2-CB 3.48Å; F243-F350 HydrophobicContact CE2-CD1 4.2Å; F243-F350 AromaticContact CE2-CD2 3.94Å; F243-F350 HydrophobicContact CE2-CD2 3.94Å; F243-F350 AromaticContact CE2-CG 3.62Å; F243-F350 HydrophobicContact CE2-CG 3.62Å; F243-F350 HydrophobicContact CZ-CB 4.11Å; F243-F350 AromaticContact CZ-CD2 3.67Å; F243-F350 HydrophobicContact CZ-CD2 3.67Å; F243-F350 HydrophobicContact CZ-CE2 4.18Å; F243-F350 AromaticContact CZ-CG 3.86Å; F243-F350 HydrophobicContact CZ-CG 3.86Å
244	I	80.1	Confident	70.7	Confident	75 Å²	75	75.7 Å²	75.7	39%	0.385	43%	0.433	S	S	.	.			trans	-74.6	-23.6	-178.4	-60.6	169.5	0	0	0	112.1	P242	P242-I244 HydrophobicContact CG-CG1 4.43Å; P242-I244 PolarHBondContact O-N 3.04Å; P242-I244 VanDerWaalsContact O-N 3.09Å
245	A	73.9	Confident	68.1	Low	43 Å²	43	75.3 Å²	75.3	36%	0.355	44%	0.443	S	S	.	.	S	Bend	trans	-122	156.4	178.3	0	0	0	0	0	111.3	F243	F243-A245 VanDerWaalsContact C-N 3.32Å
246	P	65.3	Low	65.9	Low	56 Å²	56	85.7 Å²	85.7	36%	0.364	48%	0.482	S	S	.	.			trans	-55.4	146.6	178.2	-24.4	31.5	0	0	0	112.6	Q248 S249	P246-Q248 PolarHBondContact O-N 2.87Å; P246-Q248 VanDerWaalsContact O-N 3.11Å; P246-S249 WeakPolarHBondContact CD-OG 3.49Å; P246-S249 PolarHBondContact O-N 2.9Å; P246-S249 PolarHBondContact O-OG 3.34Å
247	P	57.7	Low	63.9	Low	64 Å²	64	88.6 Å²	88.6	42%	0.416	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-55.5	-33.1	178.9	-22.7	30.8	0	0	0	112.9	S249 Q250	P247-S249 VanDerWaalsContact C-N 3.34Å; P247-S249 PolarHBondContact O-N 3.37Å; P247-Q250 PolarHBondContact O-N 3.06Å
248	Q	52	Low	62.1	Low	176 Å²	176	90.7 Å²	90.7	82%	0.822	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-70.8	-24.8	-178.3	-63.6	178.8	-2.6	0	0	113.9	P246 Q250 T251	P246-Q248 PolarHBondContact O-N 2.87Å; P246-Q248 VanDerWaalsContact O-N 3.11Å; Q248-Q250 VanDerWaalsContact C-N 3.27Å; Q248-T251 WeakPolarHBondContact O-CG2 3.44Å
249	S	50.3	Low	60.8	Low	72 Å²	72	88.3 Å²	88.3	50%	0.503	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-78.2	-10.4	173.9	21.9	0	0	0	0	113.2	P246 P247 T251	P246-S249 WeakPolarHBondContact CD-OG 3.49Å; P246-S249 PolarHBondContact O-N 2.9Å; P246-S249 PolarHBondContact O-OG 3.34Å; P247-S249 VanDerWaalsContact C-N 3.34Å; P247-S249 PolarHBondContact O-N 3.37Å; S249-T251 PolarHBondContact O-N 3.34Å; S249-T251 VanDerWaalsContact O-N 3.13Å
250	Q	48.5	Very low	59.9	Low	117 Å²	117	87.9 Å²	87.9	55%	0.547	51%	0.512	S	S	.	.	S	Bend	trans	-85	61.7	167.5	-62.5	-174	0.7	0	0	109.6	P247 Q248 V252	P247-Q250 PolarHBondContact O-N 3.06Å; Q248-Q250 VanDerWaalsContact C-N 3.27Å; Q250-V252 PolarHBondContact O-N 3.38Å
251	T	36.9	Very low	59.5	Low	108 Å²	108	86.3 Å²	86.3	66%	0.663	51%	0.513	S	S	*	.			trans	-72.3	114.9	174.6	43.5	0	0	0	0	111.8	Q248 S249 G253	Q248-T251 WeakPolarHBondContact O-CG2 3.44Å; S249-T251 PolarHBondContact O-N 3.34Å; S249-T251 VanDerWaalsContact O-N 3.13Å; T251-G253 PolarHBondContact O-N 3.1Å
252	V	36.2	Very low	59.2	Low	144 Å²	144	91.9 Å²	91.9	87%	0.873	54%	0.54	S	S	*	.	S	Bend		72.9	2.1	125.2	-173.6	0	0	0	0	118.6	Q250	Q250-V252 PolarHBondContact O-N 3.38Å
253	G	34.3	Very low	59	Low	69 Å²	69	92.6 Å²	92.6	71%	0.711	54%	0.542	S	S	*	.			trans	-97	-12.8	-172.9	0	0	0	0	0	119.5	T251	T251-G253 PolarHBondContact O-N 3.1Å
254	L	39.4	Very low	59	Low	160 Å²	160	95.1 Å²	95.1	84%	0.838	55%	0.551	S	S	*	*	S	Bend	trans	-130.1	116.2	-174.1	-71.8	162.7	0	0	0	110.2	R256	L254-R256 PolarHBondContact O-N 3.49Å
255	S	39	Very low	59.5	Low	109 Å²	109	94.5 Å²	94.5	76%	0.762	55%	0.553	S	S	*	*			trans	-36.1	118.6	166.8	42.8	0	0	0	0	111.2	P257	S255-P257 WeakPolarHBondContact O-CD 3.46Å
256	R	46.9	Very low	60.3	Low	225 Å²	225	97.3 Å²	97.3	85%	0.849	56%	0.556	S	S	*	*			trans	-46.3	112.9	168.2	-168.5	173	171.1	160.5	-3.2	107.5	L254 A258	L254-R256 PolarHBondContact O-N 3.49Å; R256-A258 PolarHBondContact O-N 3.5Å
257	P	51.1	Low	61.7	Low	67 Å²	67	94.7 Å²	94.7	44%	0.435	54%	0.538	S	S	.	.			trans	-62.1	136.9	-172.8	21	-29.4	0	0	0	108.9	S255 S259 A260 M263	S255-P257 WeakPolarHBondContact O-CD 3.46Å; P257-S259 PolarHBondContact O-N 2.81Å; P257-A260 WeakPolarHBondContact O-CB 3.41Å; P257-A260 PolarHBondContact O-N 3.47Å; P257-M263 HydrophobicContact CG-CE 4.37Å
258	A	53	Low	63.4	Low	106 Å²	106	94.5 Å²	94.5	88%	0.876	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-20.2	178.6	0	0	0	0	0	112.8	R256	R256-A258 PolarHBondContact O-N 3.5Å
259	S	62.3	Low	65.3	Low	43 Å²	43	89.2 Å²	89.2	30%	0.301	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	4.4	177.2	53.6	0	0	0	0	115.5	P257 P261 E262 M263	P257-S259 PolarHBondContact O-N 2.81Å; S259-P261 VanDerWaalsContact C-CD 3.5Å; S259-E262 PolarHBondContact O-N 3.42Å; S259-E262 VanDerWaalsContact O-N 3.15Å; S259-M263 PolarHBondContact O-N 3.43Å; S259-M263 WeakPolarHBondContact OG-CE 3.46Å
260	A	70.3	Confident	67.4	Low	14 Å²	14	86 Å²	86	12%	0.116	49%	0.489	C	S	.	.	H	α-helix	trans	-52	-45.8	178.8	0	0	0	0	0	115	P257 E262 M263 Y264	P257-A260 WeakPolarHBondContact O-CB 3.41Å; P257-A260 PolarHBondContact O-N 3.47Å; A260-E262 VanDerWaalsContact C-N 3.32Å; A260-E262 PolarHBondContact O-N 2.99Å; A260-M263 PolarHBondContact O-N 3.49Å; A260-Y264 WeakPolarHBondContact O-CD2 3.12Å; A260-Y264 PolarHBondContact O-N 3.07Å; A260-Y264 VanDerWaalsContact O-N 3.14Å
261	P	81.1	Confident	69.6	Low	94 Å²	94	80.4 Å²	80.4	61%	0.61	46%	0.463	S	S	*	.	H	α-helix	trans	-65.4	-34.3	178.9	23.5	-31.3	0	0	0	113	S259 Y264 S265	S259-P261 VanDerWaalsContact C-CD 3.5Å; P261-Y264 PolarHBondContact O-N 2.91Å; P261-S265 PolarHBondContact O-N 3.36Å
262	E	84.9	Confident	72.3	Confident	136 Å²	136	76.8 Å²	76.8	64%	0.636	44%	0.442	S	S	*	.	H	α-helix	trans	-66.6	-43.6	176.3	-65	174.3	174.2	0	0	110.8	S259 A260 Y264 S265 Y266	S259-E262 PolarHBondContact O-N 3.42Å; S259-E262 VanDerWaalsContact O-N 3.15Å; A260-E262 VanDerWaalsContact C-N 3.32Å; A260-E262 PolarHBondContact O-N 2.99Å; E262-Y264 PolarHBondContact O-N 2.93Å; E262-S265 PolarHBondContact O-N 3.43Å; E262-S265 PolarHBondContact O-OG 3.42Å; E262-Y266 PolarHBondContact O-N 2.98Å
263	M	87	Confident	75	Confident	38 Å²	38	70.6 Å²	70.6	19%	0.187	40%	0.403	C	S	.	.	H	α-helix	trans	-58.7	-44.6	175.3	-68.7	-170.9	-160.9	0	0	112.5	I235 P257 S259 A260 Y266 L267	I235-M263 HydrophobicContact CD1-CB 3.98Å; I235-M263 HydrophobicContact CD1-CG 4.11Å; P257-M263 HydrophobicContact CG-CE 4.37Å; S259-M263 PolarHBondContact O-N 3.43Å; S259-M263 WeakPolarHBondContact OG-CE 3.46Å; A260-M263 PolarHBondContact O-N 3.49Å; M263-Y266 PolarHBondContact O-N 3.4Å; M263-L267 WeakPolarHBondContact O-CB 3.09Å; M263-L267 PolarHBondContact O-N 3.43Å
264	Y	89.1	Confident	77.8	Confident	81 Å²	81	67.3 Å²	67.3	32%	0.318	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-34.8	177.9	-72.9	-63.6	0	0	0	112.7	L239 A260 P261 E262 Y266 L267 E268 F350 K354	L239-Y264 HydrophobicContact CD1-CE1 4.43Å; L239-Y264 HydrophobicContact CD2-CE1 4.03Å; A260-Y264 WeakPolarHBondContact O-CD2 3.12Å; A260-Y264 PolarHBondContact O-N 3.07Å; A260-Y264 VanDerWaalsContact O-N 3.14Å; P261-Y264 PolarHBondContact O-N 2.91Å; E262-Y264 PolarHBondContact O-N 2.93Å; Y264-Y266 VanDerWaalsContact C-N 3.32Å; Y264-L267 HydrophobicContact CD1-CD2 4.24Å; Y264-L267 WeakPolarHBondContact O-CB 3.47Å; Y264-L267 PolarHBondContact O-N 3.35Å; Y264-E268 WeakPolarHBondContact O-CB 3.41Å; Y264-E268 PolarHBondContact O-N 2.78Å; Y264-F350 HydrophobicContact CE1-CE2 4.06Å; Y264-K354 HydrophobicContact CD1-CD 4.06Å; Y264-K354 HydrophobicContact CD1-CG 4.47Å; Y264-K354 HydrophobicContact CE1-CD 3.8Å; Y264-K354 HydrophobicContact CE1-CG 3.99Å
265	S	90	Very high	80.4	Confident	63 Å²	63	61 Å²	61	44%	0.441	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-36.3	173.9	75.8	0	0	0	0	112.2	P261 E262 E268 T269	P261-S265 PolarHBondContact O-N 3.36Å; E262-S265 PolarHBondContact O-N 3.43Å; E262-S265 PolarHBondContact O-OG 3.42Å; S265-E268 PolarHBondContact O-N 3.48Å; S265-T269 PolarHBondContact O-N 3.3Å; S265-T269 PolarHBondContact O-OG1 3.29Å
266	Y	92.1	Very high	82.9	Confident	102 Å²	102	59.7 Å²	59.7	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-70.4	-42.4	175.7	-172.3	-125.5	0	0	0	111.4	I235 E262 M263 Y264 E268 T269 L270	I235-Y266 HydrophobicContact CB-CD1 4.35Å; I235-Y266 HydrophobicContact CD1-CD1 4.08Å; I235-Y266 HydrophobicContact CG1-CD1 4.17Å; E262-Y266 PolarHBondContact O-N 2.98Å; M263-Y266 PolarHBondContact O-N 3.4Å; Y264-Y266 VanDerWaalsContact C-N 3.32Å; Y266-E268 VanDerWaalsContact C-N 3.34Å; Y266-E268 PolarHBondContact O-N 2.87Å; Y266-T269 WeakPolarHBondContact O-CB 3.45Å; Y266-T269 PolarHBondContact O-N 3.49Å; Y266-L270 HydrophobicContact CD1-CD1 3.94Å; Y266-L270 HydrophobicContact CD2-CG 4.46Å; Y266-L270 HydrophobicContact CE1-CD1 3.52Å; Y266-L270 HydrophobicContact CE1-CG 4.29Å; Y266-L270 HydrophobicContact CE2-CD1 4.23Å; Y266-L270 HydrophobicContact CE2-CD2 4.33Å; Y266-L270 HydrophobicContact CE2-CG 4.11Å; Y266-L270 HydrophobicContact CG-CD1 4.46Å; Y266-L270 WeakPolarHBondContact O-CG 3.37Å; Y266-L270 PolarHBondContact O-N 2.88Å
267	L	93.6	Very high	85.1	Confident	1 Å²	1	49 Å²	49	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-55.2	-48.4	170.7	-179	77.5	0	0	0	111.3	F232 I235 L236 L239 M263 Y264 T269 L270 F271 F350 I355	F232-L267 HydrophobicContact CD2-CD1 4.11Å; F232-L267 HydrophobicContact CE2-CD1 3.47Å; F232-L267 VanDerWaalsContact CE2-CD1 3.47Å; F232-L267 HydrophobicContact CE2-CG 4.45Å; F232-L267 HydrophobicContact CZ-CD1 4.27Å; I235-L267 HydrophobicContact CG1-CB 4.47Å; I235-L267 HydrophobicContact CG2-CD1 3.86Å; L236-L267 HydrophobicContact CD2-CD1 4.18Å; L239-L267 HydrophobicContact CD1-CD1 4.2Å; L239-L267 HydrophobicContact CD1-CD2 3.96Å; M263-L267 WeakPolarHBondContact O-CB 3.09Å; M263-L267 PolarHBondContact O-N 3.43Å; Y264-L267 HydrophobicContact CD1-CD2 4.24Å; Y264-L267 WeakPolarHBondContact O-CB 3.47Å; Y264-L267 PolarHBondContact O-N 3.35Å; L267-T269 VanDerWaalsContact C-N 3.31Å; L267-T269 PolarHBondContact O-N 3.35Å; L267-L270 PolarHBondContact O-N 3.33Å; L267-F271 WeakPolarHBondContact O-CB 3.48Å; L267-F271 PolarHBondContact O-N 3.07Å; L267-F350 HydrophobicContact CD2-CZ 3.99Å; L267-I355 HydrophobicContact CD2-CD1 4.13Å
268	E	93.9	Very high	86.9	Confident	60 Å²	60	46.6 Å²	46.6	28%	0.28	26%	0.259	S	S	.	.	H	α-helix	trans	-58.4	-44.1	177.1	175.4	170.1	172	0	0	111.5	Y264 S265 Y266 F271 C272 I358 K361	Y264-E268 WeakPolarHBondContact O-CB 3.41Å; Y264-E268 PolarHBondContact O-N 2.78Å; S265-E268 PolarHBondContact O-N 3.48Å; Y266-E268 VanDerWaalsContact C-N 3.34Å; Y266-E268 PolarHBondContact O-N 2.87Å; E268-F271 PolarHBondContact O-N 3.47Å; E268-C272 WeakPolarHBondContact O-CB 3.3Å; E268-C272 PolarHBondContact O-N 3.08Å; E268-C272 PolarHBondContact O-SG 3.48Å; E268-I358 HydrophobicContact CB-CD1 4.02Å; E268-I358 HydrophobicContact CB-CG1 4.15Å; E268-I358 HydrophobicContact CG-CD1 4.34Å; E268-I358 HydrophobicContact CG-CG1 3.96Å; E268-I358 HydrophobicContact CG-CG2 4.13Å; E268-K361 VanDerWaalsContact OE1-CD 3.29Å; E268-K361 WeakPolarHBondContact OE1-CD 3.4Å; E268-K361 IonicContact OE1-NZ 3.63Å; E268-K361 PolarHBondContact OE1-NZ 2.88Å; E268-K361 IonicContact OE2-NZ 3.42Å; E268-K361 PolarHBondContact OE2-NZ 3.23Å
269	T	92.3	Very high	88.5	Confident	65 Å²	65	44.1 Å²	44.1	40%	0.399	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-50.1	178.6	-58.7	0	0	0	0	111.7	S265 Y266 L267 C272 Q273	S265-T269 PolarHBondContact O-N 3.3Å; S265-T269 PolarHBondContact O-OG1 3.29Å; Y266-T269 WeakPolarHBondContact O-CB 3.45Å; Y266-T269 PolarHBondContact O-N 3.49Å; L267-T269 VanDerWaalsContact C-N 3.31Å; L267-T269 PolarHBondContact O-N 3.35Å; T269-C272 PolarHBondContact O-N 3.38Å; T269-Q273 VanDerWaalsContact O-CG 3.27Å; T269-Q273 WeakPolarHBondContact O-CG 3.25Å; T269-Q273 PolarHBondContact O-N 2.88Å
270	L	93.4	Very high	89.7	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-41	178.4	-71	175.5	0	0	0	111.8	L228 D231 F232 I235 Y266 L267 Q273 L274	L228-L270 HydrophobicContact CD2-CD2 3.8Å; D231-L270 HydrophobicContact CB-CD1 4.07Å; D231-L270 HydrophobicContact CB-CD2 3.99Å; F232-L270 HydrophobicContact CB-CD1 4.39Å; F232-L270 HydrophobicContact CD2-CB 3.9Å; F232-L270 HydrophobicContact CD2-CD1 4.42Å; I235-L270 HydrophobicContact CG2-CD1 4Å; Y266-L270 HydrophobicContact CD1-CD1 3.94Å; Y266-L270 HydrophobicContact CD2-CG 4.46Å; Y266-L270 HydrophobicContact CE1-CD1 3.52Å; Y266-L270 HydrophobicContact CE1-CG 4.29Å; Y266-L270 HydrophobicContact CE2-CD1 4.23Å; Y266-L270 HydrophobicContact CE2-CD2 4.33Å; Y266-L270 HydrophobicContact CE2-CG 4.11Å; Y266-L270 HydrophobicContact CG-CD1 4.46Å; Y266-L270 WeakPolarHBondContact O-CG 3.37Å; Y266-L270 PolarHBondContact O-N 2.88Å; L267-L270 PolarHBondContact O-N 3.33Å; L270-Q273 PolarHBondContact O-N 3.18Å; L270-L274 WeakPolarHBondContact O-CB 3.21Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 2.9Å
271	F	95.3	Very high	90.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-46.9	177.4	-168.6	-78.3	0	0	0	111.1	F232 L267 E268 Q273 L274 L275 I303 P305 I306 M309 I355 I358 L359	F232-F271 HydrophobicContact CE2-CB 4.39Å; F232-F271 HydrophobicContact CE2-CD2 4.33Å; F232-F271 HydrophobicContact CZ-CD2 4.04Å; L267-F271 WeakPolarHBondContact O-CB 3.48Å; L267-F271 PolarHBondContact O-N 3.07Å; E268-F271 PolarHBondContact O-N 3.47Å; F271-Q273 PolarHBondContact O-N 2.83Å; F271-L274 PolarHBondContact O-N 2.99Å; F271-L275 WeakPolarHBondContact O-CB 3.38Å; F271-L275 PolarHBondContact O-N 2.81Å; F271-I303 HydrophobicContact CZ-CD1 4.18Å; F271-P305 HydrophobicContact CD1-CB 4.44Å; F271-P305 HydrophobicContact CD1-CG 4.37Å; F271-P305 HydrophobicContact CD2-CB 3.59Å; F271-P305 HydrophobicContact CD2-CG 4.36Å; F271-P305 HydrophobicContact CE1-CB 4.26Å; F271-P305 HydrophobicContact CE1-CG 4.19Å; F271-P305 HydrophobicContact CE2-CB 3.38Å; F271-P305 HydrophobicContact CE2-CG 4.19Å; F271-P305 HydrophobicContact CG-CB 4.13Å; F271-P305 HydrophobicContact CG-CG 4.45Å; F271-P305 HydrophobicContact CZ-CB 3.74Å; F271-P305 HydrophobicContact CZ-CG 4.09Å; F271-I306 HydrophobicContact CE2-CG1 4.5Å; F271-M309 HydrophobicContact CE2-SD 4.47Å; F271-I355 HydrophobicContact CD2-CD1 4.17Å; F271-I355 HydrophobicContact CD2-CG2 4.32Å; F271-I355 HydrophobicContact CE1-CG2 4.45Å; F271-I355 HydrophobicContact CE2-CD1 4.23Å; F271-I355 HydrophobicContact CE2-CG2 3.46Å; F271-I355 VanDerWaalsContact CE2-CG2 3.46Å; F271-I355 HydrophobicContact CZ-CG2 3.55Å; F271-I358 HydrophobicContact CB-CD1 4.29Å; F271-I358 HydrophobicContact CB-CG2 4.38Å; F271-I358 HydrophobicContact CD1-CB 4.32Å; F271-I358 HydrophobicContact CD1-CG2 3.63Å; F271-I358 HydrophobicContact CE1-CG2 4.31Å; F271-I358 HydrophobicContact CG-CD1 4.34Å; F271-I358 HydrophobicContact CG-CG2 4.26Å; F271-L359 HydrophobicContact CE1-CD2 3.71Å; F271-L359 HydrophobicContact CE1-CG 4.1Å; F271-L359 HydrophobicContact CZ-CD2 4.14Å; F271-L359 HydrophobicContact CZ-CG 4.33Å
272	C	93.2	Very high	90.7	Very high	33 Å²	33	42 Å²	42	22%	0.223	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-40.3	175.5	-74.6	0	0	0	0	112.4	E268 T269 L275 K276 I358	E268-C272 WeakPolarHBondContact O-CB 3.3Å; E268-C272 PolarHBondContact O-N 3.08Å; E268-C272 PolarHBondContact O-SG 3.48Å; T269-C272 PolarHBondContact O-N 3.38Å; C272-L275 PolarHBondContact O-N 2.96Å; C272-K276 WeakPolarHBondContact O-CG 3.28Å; C272-K276 PolarHBondContact O-N 2.9Å; C272-I358 VanDerWaalsContact SG-CG2 3.58Å
273	Q	92.5	Very high	90.6	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-66.7	-42.8	177.5	-72	170.2	1.4	0	0	112.1	P185 L228 T269 L270 F271 L275 K276 L277	P185-Q273 HydrophobicContact CB-CG 4.23Å; P185-Q273 VanDerWaalsContact CD-NE2 3.28Å; P185-Q273 VanDerWaalsContact CG-NE2 3.29Å; L228-Q273 HydrophobicContact CD1-CB 3.97Å; L228-Q273 HydrophobicContact CD2-CB 4.05Å; T269-Q273 VanDerWaalsContact O-CG 3.27Å; T269-Q273 WeakPolarHBondContact O-CG 3.25Å; T269-Q273 PolarHBondContact O-N 2.88Å; L270-Q273 PolarHBondContact O-N 3.18Å; F271-Q273 PolarHBondContact O-N 2.83Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.48Å; Q273-K276 WeakPolarHBondContact O-CB 3.28Å; Q273-K276 PolarHBondContact O-N 3.49Å; Q273-L277 PolarHBondContact O-N 3.47Å
274	L	94.5	Very high	90.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-36.4	173.8	-75.3	167.9	0	0	0	111.8	L228 F232 L270 F271 K276 L277 L304 P305 I308	L228-L274 HydrophobicContact CB-CD2 3.56Å; L228-L274 HydrophobicContact CB-CG 4.04Å; L228-L274 HydrophobicContact CD1-CD2 4.31Å; F232-L274 HydrophobicContact CB-CD1 3.8Å; F232-L274 HydrophobicContact CD1-CD1 3.67Å; F232-L274 HydrophobicContact CD2-CD1 4.03Å; F232-L274 HydrophobicContact CE1-CD1 4.17Å; F232-L274 HydrophobicContact CG-CD1 3.58Å; L270-L274 WeakPolarHBondContact O-CB 3.21Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 2.9Å; F271-L274 PolarHBondContact O-N 2.99Å; L274-K276 VanDerWaalsContact C-N 3.31Å; L274-K276 PolarHBondContact O-N 3.47Å; L274-L277 WeakPolarHBondContact O-CB 3.44Å; L274-L277 PolarHBondContact O-N 3.21Å; L274-L277 VanDerWaalsContact O-N 3.1Å; L274-L304 HydrophobicContact CD2-CD2 4.42Å; L274-P305 HydrophobicContact CB-CB 4.32Å; L274-P305 HydrophobicContact CB-CG 3.76Å; L274-I308 HydrophobicContact CD1-CD1 3.88Å; L274-I308 HydrophobicContact CD2-CD1 3.74Å; L274-I308 HydrophobicContact CG-CD1 4.42Å
275	L	93.3	Very high	90.2	Very high	27 Å²	27	37.2 Å²	37.2	14%	0.141	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-34.9	175.4	-172.7	62.8	0	0	0	111.9	F271 C272 Q273 L277 Q278 P305 L359 V362	F271-L275 WeakPolarHBondContact O-CB 3.38Å; F271-L275 PolarHBondContact O-N 2.81Å; C272-L275 PolarHBondContact O-N 2.96Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.48Å; L275-L277 PolarHBondContact O-N 2.9Å; L275-Q278 WeakPolarHBondContact O-CB 3.36Å; L275-Q278 PolarHBondContact O-N 3.01Å; L275-P305 HydrophobicContact CB-CG 4.3Å; L275-L359 HydrophobicContact CD2-CD2 4.16Å; L275-V362 HydrophobicContact CD2-CB 4.34Å; L275-V362 HydrophobicContact CD2-CG1 3.92Å; L275-V362 HydrophobicContact CD2-CG2 4.49Å
276	K	91.1	Very high	89.3	Confident	81 Å²	81	42.6 Å²	42.6	35%	0.352	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-31.9	171.6	-71.1	177.6	178.7	-172.9	0	112.3	A188 S189 V192 C272 Q273 L274 Q278	A188-K276 HydrophobicContact CB-CB 4.41Å; A188-K276 HydrophobicContact CB-CD 4.35Å; S189-K276 PolarHBondContact OG-NZ 3.26Å; V192-K276 HydrophobicContact CG2-CB 4.02Å; V192-K276 WeakPolarHBondContact CG2-O 3.25Å; C272-K276 WeakPolarHBondContact O-CG 3.28Å; C272-K276 PolarHBondContact O-N 2.9Å; Q273-K276 WeakPolarHBondContact O-CB 3.28Å; Q273-K276 PolarHBondContact O-N 3.49Å; L274-K276 VanDerWaalsContact C-N 3.31Å; L274-K276 PolarHBondContact O-N 3.47Å; K276-Q278 PolarHBondContact O-N 3.02Å
277	L	92.4	Very high	88.3	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.6	175.9	-61.5	-175.5	0	0	0	113.8	L191 H221 L224 K225 L228 Q273 L274 L275 T279 S280 D281 L304	L191-L277 HydrophobicContact CD2-CD2 3.46Å; L191-L277 VanDerWaalsContact CD2-CD2 3.46Å; L191-L277 HydrophobicContact CG-CD2 4.41Å; H221-L277 PolarHBondContact CE1-O 2.95Å; L224-L277 HydrophobicContact CB-CD1 4.14Å; L224-L277 HydrophobicContact CB-CD2 4.31Å; L224-L277 HydrophobicContact CD1-CD2 4.43Å; K225-L277 HydrophobicContact CB-CD1 4.27Å; L228-L277 HydrophobicContact CD1-CD1 3.69Å; L228-L277 HydrophobicContact CD1-CG 4.35Å; Q273-L277 PolarHBondContact O-N 3.47Å; L274-L277 WeakPolarHBondContact O-CB 3.44Å; L274-L277 PolarHBondContact O-N 3.21Å; L274-L277 VanDerWaalsContact O-N 3.1Å; L275-L277 PolarHBondContact O-N 2.9Å; L277-T279 PolarHBondContact O-N 3.4Å; L277-S280 PolarHBondContact O-N 3.2Å; L277-S280 PolarHBondContact O-OG 3.43Å; L277-D281 WeakPolarHBondContact O-CB 3.35Å; L277-D281 PolarHBondContact O-N 2.93Å; L277-L304 HydrophobicContact CB-CD2 3.91Å
278	Q	90.4	Very high	87	Confident	16 Å²	16	48.8 Å²	48.8	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-58.7	-46.5	-177	-176.8	65.2	23.6	0	0	112.2	L275 K276 S280 D281 E282 L304	L275-Q278 WeakPolarHBondContact O-CB 3.36Å; L275-Q278 PolarHBondContact O-N 3.01Å; K276-Q278 PolarHBondContact O-N 3.02Å; Q278-S280 PolarHBondContact O-N 3.49Å; Q278-D281 WeakPolarHBondContact O-CB 3.47Å; Q278-D281 PolarHBondContact O-N 3.11Å; Q278-E282 HydrophobicContact CG-CG 4.45Å; Q278-E282 WeakPolarHBondContact CG-OE1 3.18Å; Q278-E282 PolarHBondContact NE2-OE1 2.81Å; Q278-E282 WeakPolarHBondContact O-CG 3.23Å; Q278-E282 PolarHBondContact O-N 3.35Å; Q278-L304 VanDerWaalsContact OE1-CB 3.26Å
279	T	85.7	Confident	86	Confident	54 Å²	54	53.5 Å²	53.5	33%	0.331	27%	0.272	S	S	.	.	H	α-helix	trans	-61.1	-45.4	-177.6	-51.7	0	0	0	0	111.7	A195 I199 L277 D281 L283	A195-T279 HydrophobicContact CB-CG2 4.34Å; I199-T279 HydrophobicContact CD1-CG2 4.12Å; L277-T279 PolarHBondContact O-N 3.4Å; T279-D281 VanDerWaalsContact C-N 3.33Å; T279-L283 VanDerWaalsContact O-CG 3.3Å; T279-L283 WeakPolarHBondContact O-CG 3.32Å; T279-L283 PolarHBondContact O-N 3.06Å
280	S	86.9	Confident	85.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-68.5	-32.6	174.9	49.3	0	0	0	0	111.7	H221 L277 Q278 L283 L284	H221-S280 PolarHBondContact CE1-OG 3.05Å; H221-S280 WeakPolarHBondContact ND1-CB 3.4Å; H221-S280 PolarHBondContact ND1-OG 2.89Å; L277-S280 PolarHBondContact O-N 3.2Å; L277-S280 PolarHBondContact O-OG 3.43Å; Q278-S280 PolarHBondContact O-N 3.49Å; S280-L283 PolarHBondContact O-N 3.34Å; S280-L284 WeakPolarHBondContact O-CB 3.08Å; S280-L284 WeakPolarHBondContact O-CD1 3.46Å; S280-L284 WeakPolarHBondContact O-CG 3.38Å; S280-L284 PolarHBondContact O-N 3.34Å
281	D	87.7	Confident	85.1	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-43.2	177.2	-153.9	65.4	0	0	0	112.8	H221 K225 L277 Q278 T279 L283 L284 T285 L304	H221-D281 PolarHBondContact CE1-N 3.06Å; H221-D281 IonicContact CE1-OD1 2.89Å; H221-D281 PolarHBondContact CE1-OD1 3.42Å; H221-D281 IonicContact NE2-OD1 2.75Å; H221-D281 PolarHBondContact NE2-OD1 2.97Å; K225-D281 IonicContact NZ-OD1 2.6Å; K225-D281 PolarHBondContact NZ-OD1 3.29Å; K225-D281 IonicContact NZ-OD2 2.86Å; L277-D281 WeakPolarHBondContact O-CB 3.35Å; L277-D281 PolarHBondContact O-N 2.93Å; Q278-D281 WeakPolarHBondContact O-CB 3.47Å; Q278-D281 PolarHBondContact O-N 3.11Å; T279-D281 VanDerWaalsContact C-N 3.33Å; D281-L283 VanDerWaalsContact C-N 3.34Å; D281-L283 PolarHBondContact O-N 3.22Å; D281-L284 PolarHBondContact O-N 3.08Å; D281-L284 VanDerWaalsContact O-N 3.16Å; D281-T285 VanDerWaalsContact O-CB 3.28Å; D281-T285 WeakPolarHBondContact O-CB 3.33Å; D281-T285 PolarHBondContact O-N 3.4Å; D281-T285 PolarHBondContact O-OG1 3.13Å; D281-L304 HydrophobicContact CB-CD2 4.27Å
282	E	85.6	Confident	84.6	Confident	104 Å²	104	63.9 Å²	63.9	49%	0.486	32%	0.323	S	S	.	.	H	α-helix	trans	-64.7	-35.7	177.2	-72.5	174.3	-177.1	0	0	112.4	Q278 L284	Q278-E282 HydrophobicContact CG-CG 4.45Å; Q278-E282 WeakPolarHBondContact CG-OE1 3.18Å; Q278-E282 PolarHBondContact NE2-OE1 2.81Å; Q278-E282 WeakPolarHBondContact O-CG 3.23Å; Q278-E282 PolarHBondContact O-N 3.35Å; E282-L284 PolarHBondContact O-N 2.83Å
283	L	83.4	Confident	84.3	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.236	34%	0.335	C	S	.	.	H	α-helix	trans	-67.2	-24.2	174.8	-73.2	172	0	0	0	113.2	A195 I199 R214 T279 S280 D281	A195-L283 HydrophobicContact CB-CD1 4Å; I199-L283 HydrophobicContact CD1-CD1 4.15Å; I199-L283 HydrophobicContact CD1-CD2 4.35Å; I199-L283 HydrophobicContact CG1-CD1 3.99Å; I199-L283 HydrophobicContact CG1-CD2 3.92Å; R214-L283 PolarHBondContact NH1-O 2.99Å; T279-L283 VanDerWaalsContact O-CG 3.3Å; T279-L283 WeakPolarHBondContact O-CG 3.32Å; T279-L283 PolarHBondContact O-N 3.06Å; S280-L283 PolarHBondContact O-N 3.34Å; D281-L283 VanDerWaalsContact C-N 3.34Å; D281-L283 PolarHBondContact O-N 3.22Å
284	L	85.1	Confident	84.1	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.236	34%	0.335	C	S	.	.	H	α-helix	trans	-108.8	-25.1	-169.5	-62.9	-177.6	0	0	0	113.8	V217 K218 H221 S280 D281 E282	V217-L284 HydrophobicContact CG1-CD1 4.41Å; K218-L284 HydrophobicContact CB-CD1 4.41Å; K218-L284 HydrophobicContact CB-CD2 4.47Å; K218-L284 HydrophobicContact CD-CD2 4.01Å; K218-L284 VanDerWaalsContact CE-CD2 3.49Å; K218-L284 HydrophobicContact CG-CD1 3.86Å; K218-L284 HydrophobicContact CG-CD2 3.24Å; K218-L284 HydrophobicContact CG-CG 4.11Å; H221-L284 HydrophobicContact CB-CD1 3.74Å; S280-L284 WeakPolarHBondContact O-CB 3.08Å; S280-L284 WeakPolarHBondContact O-CD1 3.46Å; S280-L284 WeakPolarHBondContact O-CG 3.38Å; S280-L284 PolarHBondContact O-N 3.34Å; D281-L284 PolarHBondContact O-N 3.08Å; D281-L284 VanDerWaalsContact O-N 3.16Å; E282-L284 PolarHBondContact O-N 2.83Å
285	T	81.4	Confident	83.6	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.393	37%	0.368	S	S	.	.			trans	-109.5	119.5	-172.6	-46.1	0	0	0	0	109.8	D281	D281-T285 VanDerWaalsContact O-CB 3.28Å; D281-T285 WeakPolarHBondContact O-CB 3.33Å; D281-T285 PolarHBondContact O-N 3.4Å; D281-T285 PolarHBondContact O-OG1 3.13Å
286	E	72.1	Confident	83.4	Confident	176 Å²	176	73.4 Å²	73.4	82%	0.822	37%	0.374	S	S	*	.			trans	-69.8	130.6	167.5	-71.5	-178.4	179.8	0	0	109.6	K288	E286-K288 PolarHBondContact O-N 3.46Å
287	P	70.1	Confident	83.2	Confident	75 Å²	75	71.6 Å²	71.6	49%	0.487	37%	0.37	S	S	.	.			trans	-61	132.1	176.6	23.1	-30.5	0	0	0	109.6	Q289	P287-Q289 PolarHBondContact O-N 2.98Å
288	K	67.7	Low	82.7	Confident	157 Å²	157	76.8 Å²	76.8	68%	0.683	41%	0.413	S	S	*	.			trans	-65.1	109.5	172.5	-72.3	-179	-179.4	174.4	0	108.9	E286	E286-K288 PolarHBondContact O-N 3.46Å
289	Q	72.4	Confident	82.1	Confident	159 Å²	159	78.9 Å²	78.9	74%	0.743	43%	0.43	S	S	*	.			trans	-107.7	140.3	178.3	-68.7	177.6	0.7	0	0	110.1	P287	P287-Q289 PolarHBondContact O-N 2.98Å
290	L	84	Confident	81.9	Confident	22 Å²	22	80.8 Å²	80.8	12%	0.115	44%	0.443	C	S	.	.			trans	-65.6	157.1	165.6	-84.8	156.1	0	0	0	109.3	Y294 L296 M378 L381 E382 A385 I428	L290-Y294 HydrophobicContact CB-CD2 4.19Å; L290-Y294 HydrophobicContact CD2-CD2 4.42Å; L290-L296 HydrophobicContact CB-CD1 3.75Å; L290-L296 HydrophobicContact CD1-CD1 3.65Å; L290-L296 HydrophobicContact CG-CD1 4.29Å; L290-M378 HydrophobicContact CD1-CE 3.89Å; L290-M378 HydrophobicContact CG-CE 4.26Å; L290-L381 HydrophobicContact CD1-CB 3.6Å; L290-L381 HydrophobicContact CD1-CD1 4.32Å; L290-E382 HydrophobicContact CD2-CG 4.39Å; L290-A385 HydrophobicContact CD2-CB 3.92Å; L290-I428 HydrophobicContact CD1-CD1 4.22Å
291	P	82.9	Confident	81.8	Confident	74 Å²	74	82.7 Å²	82.7	48%	0.481	46%	0.456	S	S	.	.			trans	-52.4	142.4	178.5	-26.6	34.3	0	0	0	112.4	K293 Y294	P291-K293 HydrophobicContact CB-CG 4.15Å; P291-K293 PolarHBondContact O-N 3.08Å; P291-Y294 HydrophobicContact CB-CD2 4.34Å; P291-Y294 HydrophobicContact CB-CE2 4.48Å; P291-Y294 HydrophobicContact CG-CD2 4.49Å; P291-Y294 HydrophobicContact CG-CE2 4.34Å; P291-Y294 WeakPolarHBondContact O-CD2 3.34Å; P291-Y294 PolarHBondContact O-N 2.92Å
292	E	83.5	Confident	82	Confident	190 Å²	190	83.5 Å²	83.5	89%	0.888	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.3	-175.1	-67.2	-179.9	172	0	0	114.5	Y294	E292-Y294 PolarHBondContact O-N 3.05Å; E292-Y294 VanDerWaalsContact O-N 3.12Å
293	K	87.4	Confident	82.3	Confident	111 Å²	111	79.2 Å²	79.2	48%	0.483	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.8	174	71.2	179.5	-176.1	166.8	0	113.5	P291 E431	P291-K293 HydrophobicContact CB-CG 4.15Å; P291-K293 PolarHBondContact O-N 3.08Å; K293-E431 HydrophobicContact CD-CG 4.41Å; K293-E431 HydrophobicContact CG-CG 4.46Å
294	Y	88.4	Confident	82.8	Confident	14 Å²	14	77.1 Å²	77.1	6%	0.055	43%	0.431	C	S	.	.	S	Bend	trans	-92.9	106.8	172.2	-58	-68.2	0	0	0	108.5	L290 P291 E292 L296 A385 I428 E431	L290-Y294 HydrophobicContact CB-CD2 4.19Å; L290-Y294 HydrophobicContact CD2-CD2 4.42Å; P291-Y294 HydrophobicContact CB-CD2 4.34Å; P291-Y294 HydrophobicContact CB-CE2 4.48Å; P291-Y294 HydrophobicContact CG-CD2 4.49Å; P291-Y294 HydrophobicContact CG-CE2 4.34Å; P291-Y294 WeakPolarHBondContact O-CD2 3.34Å; P291-Y294 PolarHBondContact O-N 2.92Å; E292-Y294 PolarHBondContact O-N 3.05Å; E292-Y294 VanDerWaalsContact O-N 3.12Å; Y294-L296 PolarHBondContact O-N 3.16Å; Y294-A385 HydrophobicContact CE2-CB 3.75Å; Y294-I428 HydrophobicContact CD1-CB 4.48Å; Y294-I428 HydrophobicContact CD1-CD1 3.72Å; Y294-I428 HydrophobicContact CD1-CG2 4.23Å; Y294-I428 HydrophobicContact CE1-CB 4.39Å; Y294-I428 HydrophobicContact CE1-CD1 4.12Å; Y294-I428 HydrophobicContact CE1-CG2 3.68Å; Y294-I428 HydrophobicContact CG-CD1 3.94Å; Y294-E431 HydrophobicContact CD1-CB 3.95Å; Y294-E431 HydrophobicContact CD1-CG 4.21Å; Y294-E431 HydrophobicContact CE1-CB 3.76Å; Y294-E431 HydrophobicContact CE1-CG 3.88Å
295	S	84.4	Confident	83.3	Confident	99 Å²	99	75 Å²	75	69%	0.692	42%	0.419	S	S	*	.			trans	-72.3	74.5	179.4	-50.8	0	0	0	0	111.5	H427	S295-H427 PolarHBondContact O-CD2 2.82Å; S295-H427 VanDerWaalsContact O-CD2 3.31Å
296	L	88.1	Confident	84	Confident	50 Å²	50	71.9 Å²	71.9	26%	0.262	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-83.7	145.6	-178.8	-62.7	172.6	0	0	0	111.6	L290 Y294 A298 A423 H427	L290-L296 HydrophobicContact CB-CD1 3.75Å; L290-L296 HydrophobicContact CD1-CD1 3.65Å; L290-L296 HydrophobicContact CG-CD1 4.29Å; Y294-L296 PolarHBondContact O-N 3.16Å; L296-A298 PolarHBondContact O-N 2.63Å; L296-A423 HydrophobicContact CD2-CB 3.97Å; L296-H427 HydrophobicContact CD2-CB 3.55Å
297	P	87.2	Confident	85.1	Confident	44 Å²	44	66 Å²	66	29%	0.286	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-60.7	137.4	172.6	-20.3	32.4	0	0	0	110.9	S299 H427	P297-S299 PolarHBondContact O-N 2.9Å; P297-H427 WeakPolarHBondContact CD-NE2 3.1Å
298	A	81.4	Confident	86.3	Confident	109 Å²	109	62.9 Å²	62.9	90%	0.901	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-60	125	172.3	0	0	0	0	0	109.1	L296	L296-A298 PolarHBondContact O-N 2.63Å
299	S	78.5	Confident	87.6	Confident	61 Å²	61	55.4 Å²	55.4	43%	0.427	32%	0.32	S	S	.	.			trans	-145.6	141.4	179.8	72.2	0	0	0	0	110.6	P297 R374	P297-S299 PolarHBondContact O-N 2.9Å; S299-R374 PolarHBondContact OG-NH2 3.33Å
300	P	81.5	Confident	88.8	Confident	94 Å²	94	47.9 Å²	47.9	61%	0.61	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-64.7	156	-178.3	26.8	-33.6	0	0	0	110.5	R374	P300-R374 PolarHBondContact O-NH1 2.95Å; P300-R374 PolarHBondContact O-NH2 2.87Å
301	S	84.9	Confident	89.3	Confident	41 Å²	41	48.7 Å²	48.7	29%	0.287	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-60	151.2	173.8	57.5	0	0	0	0	110.4
302	V	90.9	Very high	89.9	Confident	20 Å²	20	47.2 Å²	47.2	12%	0.121	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-62.1	141.3	175.2	173.2	0	0	0	0	108.9	I306 Q307 L310 E371	V302-I306 HydrophobicContact CG1-CB 3.85Å; V302-I306 HydrophobicContact CG1-CG2 3.64Å; V302-Q307 HydrophobicContact CB-CG 3.97Å; V302-Q307 HydrophobicContact CG1-CG 4.07Å; V302-Q307 VanDerWaalsContact O-CG 3.26Å; V302-Q307 WeakPolarHBondContact O-CG 3.04Å; V302-Q307 PolarHBondContact O-NE2 2.67Å; V302-L310 HydrophobicContact CG1-CD1 4.16Å; V302-E371 WeakPolarHBondContact CA-OE2 3.27Å; V302-E371 HydrophobicContact CG1-CB 4.33Å
303	I	93.3	Very high	90.5	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.067	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-60.7	142.4	179.6	63.3	174.2	0	0	0	112.2	F271 I306 Q307 L359 V366 E371	F271-I303 HydrophobicContact CZ-CD1 4.18Å; I303-I306 HydrophobicContact CD1-CD1 3.65Å; I303-I306 HydrophobicContact CD1-CG1 3.9Å; I303-I306 HydrophobicContact CG1-CB 3.9Å; I303-I306 HydrophobicContact CG1-CD1 3.69Å; I303-I306 HydrophobicContact CG1-CG1 3.7Å; I303-I306 WeakPolarHBondContact O-CA 3.17Å; I303-I306 PolarHBondContact O-N 2.87Å; I303-Q307 PolarHBondContact O-N 2.69Å; I303-L359 HydrophobicContact CD1-CD1 4.33Å; I303-L359 HydrophobicContact CD1-CD2 3.86Å; I303-V366 HydrophobicContact CD1-CG1 4.48Å; I303-V366 HydrophobicContact CG2-CG1 4.45Å; I303-E371 PolarHBondContact N-OE2 3.42Å; I303-E371 VanDerWaalsContact N-OE2 3.08Å
304	L	93.4	Very high	90.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-52.1	-47.2	-171.7	174.3	63.7	0	0	0	114	K225 L274 L277 Q278 D281 I306 Q307 I308	K225-L304 HydrophobicContact CD-CD1 4.4Å; L274-L304 HydrophobicContact CD2-CD2 4.42Å; L277-L304 HydrophobicContact CB-CD2 3.91Å; Q278-L304 VanDerWaalsContact OE1-CB 3.26Å; D281-L304 HydrophobicContact CB-CD2 4.27Å; L304-I306 VanDerWaalsContact C-N 3.26Å; L304-I306 PolarHBondContact O-N 3.36Å; L304-Q307 WeakPolarHBondContact O-CB 3.48Å; L304-Q307 PolarHBondContact O-N 2.76Å; L304-Q307 VanDerWaalsContact O-N 3.16Å; L304-I308 HydrophobicContact CD1-CD1 4.17Å; L304-I308 HydrophobicContact CD1-CG1 4.32Å; L304-I308 HydrophobicContact CG-CD1 4.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.48Å; L304-I308 PolarHBondContact O-N 2.66Å
305	P	95.2	Very high	91.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-42.1	176.6	-21.6	29.6	0	0	0	112.3	F271 L274 L275 I308 M309	F271-P305 HydrophobicContact CD1-CB 4.44Å; F271-P305 HydrophobicContact CD1-CG 4.37Å; F271-P305 HydrophobicContact CD2-CB 3.59Å; F271-P305 HydrophobicContact CD2-CG 4.36Å; F271-P305 HydrophobicContact CE1-CB 4.26Å; F271-P305 HydrophobicContact CE1-CG 4.19Å; F271-P305 HydrophobicContact CE2-CB 3.38Å; F271-P305 HydrophobicContact CE2-CG 4.19Å; F271-P305 HydrophobicContact CG-CB 4.13Å; F271-P305 HydrophobicContact CG-CG 4.45Å; F271-P305 HydrophobicContact CZ-CB 3.74Å; F271-P305 HydrophobicContact CZ-CG 4.09Å; L274-P305 HydrophobicContact CB-CB 4.32Å; L274-P305 HydrophobicContact CB-CG 3.76Å; L275-P305 HydrophobicContact CB-CG 4.3Å; P305-I308 PolarHBondContact O-N 2.82Å; P305-M309 WeakPolarHBondContact O-CG 3.42Å; P305-M309 PolarHBondContact O-N 2.96Å
306	I	96.3	Very high	91.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-73.3	-34.8	179.7	-63.4	-177.5	0	0	0	111.1	F271 V302 I303 L304 I308 M309 L310 A368 E371 F372	F271-I306 HydrophobicContact CE2-CG1 4.5Å; V302-I306 HydrophobicContact CG1-CB 3.85Å; V302-I306 HydrophobicContact CG1-CG2 3.64Å; I303-I306 HydrophobicContact CD1-CD1 3.65Å; I303-I306 HydrophobicContact CD1-CG1 3.9Å; I303-I306 HydrophobicContact CG1-CB 3.9Å; I303-I306 HydrophobicContact CG1-CD1 3.69Å; I303-I306 HydrophobicContact CG1-CG1 3.7Å; I303-I306 WeakPolarHBondContact O-CA 3.17Å; I303-I306 PolarHBondContact O-N 2.87Å; L304-I306 VanDerWaalsContact C-N 3.26Å; L304-I306 PolarHBondContact O-N 3.36Å; I306-I308 VanDerWaalsContact C-N 3.27Å; I306-I308 PolarHBondContact O-N 3.16Å; I306-M309 PolarHBondContact O-N 3.46Å; I306-L310 HydrophobicContact CG2-CD1 4Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.4Å; I306-L310 WeakPolarHBondContact O-CD1 3.42Å; I306-L310 VanDerWaalsContact O-CG 3.29Å; I306-L310 WeakPolarHBondContact O-CG 3.47Å; I306-L310 PolarHBondContact O-N 3.29Å; I306-A368 HydrophobicContact CD1-CB 4.12Å; I306-E371 HydrophobicContact CD1-CB 3.62Å; I306-E371 HydrophobicContact CD1-CG 4.29Å; I306-E371 HydrophobicContact CG2-CB 4.3Å; I306-F372 HydrophobicContact CG2-CB 4.13Å; I306-F372 HydrophobicContact CG2-CD2 4.24Å
307	Q	94.6	Very high	92.1	Very high	52 Å²	52	37.6 Å²	37.6	24%	0.243	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-42.1	171.4	-64.4	-176.4	14	0	0	111.7	V302 I303 L304 L310 T311	V302-Q307 HydrophobicContact CB-CG 3.97Å; V302-Q307 HydrophobicContact CG1-CG 4.07Å; V302-Q307 VanDerWaalsContact O-CG 3.26Å; V302-Q307 WeakPolarHBondContact O-CG 3.04Å; V302-Q307 PolarHBondContact O-NE2 2.67Å; I303-Q307 PolarHBondContact O-N 2.69Å; L304-Q307 WeakPolarHBondContact O-CB 3.48Å; L304-Q307 PolarHBondContact O-N 2.76Å; L304-Q307 VanDerWaalsContact O-N 3.16Å; Q307-L310 PolarHBondContact O-N 3.37Å; Q307-T311 PolarHBondContact O-N 3.23Å; Q307-T311 PolarHBondContact O-OG1 2.78Å; Q307-T311 VanDerWaalsContact O-OG1 3.05Å
308	I	95.4	Very high	92.5	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.046	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-47.7	176.1	-63.3	163	0	0	0	109.8	T229 F232 E233 L274 L304 P305 I306 L310 T311 P312	T229-I308 HydrophobicContact CG2-CD1 4.14Å; T229-I308 HydrophobicContact CG2-CG1 4.19Å; T229-I308 HydrophobicContact CG2-CG2 3.9Å; T229-I308 WeakPolarHBondContact OG1-CD1 3.28Å; F232-I308 HydrophobicContact CD1-CB 4.26Å; F232-I308 HydrophobicContact CD1-CG2 3.8Å; F232-I308 HydrophobicContact CE1-CB 4.42Å; F232-I308 HydrophobicContact CE1-CG2 4.32Å; E233-I308 HydrophobicContact CG-CG2 4.15Å; L274-I308 HydrophobicContact CD1-CD1 3.88Å; L274-I308 HydrophobicContact CD2-CD1 3.74Å; L274-I308 HydrophobicContact CG-CD1 4.42Å; L304-I308 HydrophobicContact CD1-CD1 4.17Å; L304-I308 HydrophobicContact CD1-CG1 4.32Å; L304-I308 HydrophobicContact CG-CD1 4.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.48Å; L304-I308 PolarHBondContact O-N 2.66Å; P305-I308 PolarHBondContact O-N 2.82Å; I306-I308 VanDerWaalsContact C-N 3.27Å; I306-I308 PolarHBondContact O-N 3.16Å; I308-L310 PolarHBondContact O-N 3.29Å; I308-T311 VanDerWaalsContact O-CB 3.26Å; I308-T311 WeakPolarHBondContact O-CB 3.32Å; I308-T311 PolarHBondContact O-N 3.36Å; I308-T311 PolarHBondContact O-OG1 3.36Å; I308-P312 WeakPolarHBondContact O-CD 3.34Å
309	M	96.7	Very high	93.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-32.5	176.4	-67.1	178.1	86.5	0	0	113.2	F232 L236 W241 F271 P305 I306 P312 F350 L351 I355	F232-M309 HydrophobicContact CE1-CG 3.68Å; F232-M309 HydrophobicContact CE1-SD 4.48Å; F232-M309 HydrophobicContact CZ-CG 3.94Å; F232-M309 HydrophobicContact CZ-SD 4.18Å; L236-M309 HydrophobicContact CD1-CG 3.9Å; L236-M309 HydrophobicContact CD2-CE 4.03Å; L236-M309 HydrophobicContact CD2-CG 4.42Å; W241-M309 HydrophobicContact CD2-CE 4Å; W241-M309 HydrophobicContact CE3-CE 3.8Å; W241-M309 HydrophobicContact CH2-CE 3.45Å; W241-M309 VanDerWaalsContact CH2-CE 3.45Å; W241-M309 HydrophobicContact CZ2-CB 3.72Å; W241-M309 HydrophobicContact CZ2-CE 3.66Å; W241-M309 HydrophobicContact CZ2-CG 4.4Å; W241-M309 HydrophobicContact CZ3-CE 3.49Å; W241-M309 VanDerWaalsContact CZ3-CE 3.49Å; W241-M309 PolarHBondContact NE1-O 3.13Å; F271-M309 HydrophobicContact CE2-SD 4.47Å; P305-M309 WeakPolarHBondContact O-CG 3.42Å; P305-M309 PolarHBondContact O-N 2.96Å; I306-M309 PolarHBondContact O-N 3.46Å; M309-P312 WeakPolarHBondContact O-CD 3.21Å; M309-F350 HydrophobicContact CE-CD1 4.46Å; M309-F350 HydrophobicContact CE-CE1 3.95Å; M309-L351 HydrophobicContact CE-CD2 4.46Å; M309-I355 HydrophobicContact CE-CD1 4.19Å; M309-I355 HydrophobicContact CE-CG1 4.14Å; M309-I355 HydrophobicContact SD-CD1 4.45Å
310	L	96.4	Very high	93.8	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-75.2	-24.5	176.9	-74.5	162.1	0	0	0	113.3	V302 I306 Q307 I308 L313 Q314 F372 L376	V302-L310 HydrophobicContact CG1-CD1 4.16Å; I306-L310 HydrophobicContact CG2-CD1 4Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.4Å; I306-L310 WeakPolarHBondContact O-CD1 3.42Å; I306-L310 VanDerWaalsContact O-CG 3.29Å; I306-L310 WeakPolarHBondContact O-CG 3.47Å; I306-L310 PolarHBondContact O-N 3.29Å; Q307-L310 PolarHBondContact O-N 3.37Å; I308-L310 PolarHBondContact O-N 3.29Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 2.88Å; L310-Q314 HydrophobicContact CB-CG 4.44Å; L310-Q314 WeakPolarHBondContact O-CG 3.37Å; L310-Q314 PolarHBondContact O-N 3.04Å; L310-F372 HydrophobicContact CD2-CD2 3.5Å; L310-F372 VanDerWaalsContact CD2-CD2 3.5Å; L310-F372 HydrophobicContact CD2-CE2 3.43Å; L310-F372 VanDerWaalsContact CD2-CE2 3.43Å; L310-F372 HydrophobicContact CD2-CG 4.23Å; L310-F372 HydrophobicContact CD2-CZ 4.18Å; L310-F372 HydrophobicContact CG-CD2 3.84Å; L310-F372 HydrophobicContact CG-CE2 3.97Å; L310-L376 HydrophobicContact CD2-CD2 3.7Å; L310-L376 HydrophobicContact CD2-CG 3.73Å
311	T	95.6	Very high	94.4	Very high	38 Å²	38	36 Å²	36	23%	0.233	17%	0.167	C	C	.	.	H	α-helix	trans	-55.2	-45.3	-171.1	-67.3	0	0	0	0	113.9	Q307 I308 L313 Q314 K315	Q307-T311 PolarHBondContact O-N 3.23Å; Q307-T311 PolarHBondContact O-OG1 2.78Å; Q307-T311 VanDerWaalsContact O-OG1 3.05Å; I308-T311 VanDerWaalsContact O-CB 3.26Å; I308-T311 WeakPolarHBondContact O-CB 3.32Å; I308-T311 PolarHBondContact O-N 3.36Å; I308-T311 PolarHBondContact O-OG1 3.36Å; T311-L313 VanDerWaalsContact C-N 3.33Å; T311-L313 PolarHBondContact O-N 3.43Å; T311-Q314 PolarHBondContact O-N 3.15Å; T311-K315 HydrophobicContact CG2-CD 4.3Å; T311-K315 WeakPolarHBondContact O-CG 3.44Å; T311-K315 PolarHBondContact O-N 3.47Å
312	P	95.3	Very high	94.7	Very high	44 Å²	44	36.7 Å²	36.7	29%	0.286	16%	0.163	S	C	.	.	H	α-helix	trans	-59.4	-40.5	175.3	-25	35.1	0	0	0	113.3	P242 I308 M309 K315 R316	P242-P312 HydrophobicContact CG-CB 4.03Å; I308-P312 WeakPolarHBondContact O-CD 3.34Å; M309-P312 WeakPolarHBondContact O-CD 3.21Å; P312-K315 PolarHBondContact O-N 3.26Å; P312-R316 WeakPolarHBondContact O-CB 3.3Å; P312-R316 PolarHBondContact O-N 3.33Å
313	L	96.7	Very high	94.5	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.4	-40.2	178.4	-65.6	178	0	0	0	111.6	P242 L310 T311 K315 R316 F317 W343 F372 L376	P242-L313 HydrophobicContact CB-CD1 4.24Å; P242-L313 HydrophobicContact CB-CD2 3.62Å; P242-L313 HydrophobicContact CB-CG 3.84Å; P242-L313 HydrophobicContact CG-CD2 3.69Å; P242-L313 HydrophobicContact CG-CG 4.11Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 2.88Å; T311-L313 VanDerWaalsContact C-N 3.33Å; T311-L313 PolarHBondContact O-N 3.43Å; L313-K315 PolarHBondContact O-N 3.07Å; L313-R316 PolarHBondContact O-N 2.92Å; L313-F317 WeakPolarHBondContact O-CB 3.26Å; L313-F317 PolarHBondContact O-N 3.26Å; L313-W343 HydrophobicContact CB-CE3 4.38Å; L313-W343 HydrophobicContact CB-CZ3 4.43Å; L313-W343 HydrophobicContact CD1-CB 4.43Å; L313-W343 HydrophobicContact CD1-CD2 4.46Å; L313-W343 HydrophobicContact CD1-CG 4.38Å; L313-W343 HydrophobicContact CD2-CD2 3.84Å; L313-W343 HydrophobicContact CD2-CE3 4.38Å; L313-W343 HydrophobicContact CD2-CG 4.07Å; L313-W343 HydrophobicContact CD2-CZ2 4.2Å; L313-F372 HydrophobicContact CD1-CE1 4.47Å; L313-F372 HydrophobicContact CD1-CE2 4.06Å; L313-F372 HydrophobicContact CD1-CZ 3.47Å; L313-F372 VanDerWaalsContact CD1-CZ 3.47Å; L313-L376 HydrophobicContact CB-CD2 4.14Å; L313-L376 HydrophobicContact CD1-CD2 4.03Å
314	Q	95.8	Very high	94	Very high	38 Å²	38	45.7 Å²	45.7	18%	0.178	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-42.9	174.2	-64.9	-178.7	7.5	0	0	111.9	L310 T311 R316 F317 R318 L379	L310-Q314 HydrophobicContact CB-CG 4.44Å; L310-Q314 WeakPolarHBondContact O-CG 3.37Å; L310-Q314 PolarHBondContact O-N 3.04Å; T311-Q314 PolarHBondContact O-N 3.15Å; Q314-R316 VanDerWaalsContact C-N 3.33Å; Q314-F317 PolarHBondContact O-N 2.84Å; Q314-R318 WeakPolarHBondContact O-CB 3.39Å; Q314-R318 VanDerWaalsContact O-CG 3.32Å; Q314-R318 WeakPolarHBondContact O-CG 3.48Å; Q314-R318 PolarHBondContact O-N 3.42Å; Q314-L379 HydrophobicContact CB-CD2 4.23Å; Q314-L379 HydrophobicContact CG-CD1 4.11Å; Q314-L379 HydrophobicContact CG-CD2 3.92Å; Q314-L379 HydrophobicContact CG-CG 4.39Å
315	K	94.8	Very high	93.8	Very high	133 Å²	133	51.5 Å²	51.5	58%	0.578	24%	0.244	S	C	*	.	H	α-helix	trans	-59.7	-45.6	174.4	-74	175.4	-173.7	170.9	0	110.5	T311 P312 L313 R318 Y319	T311-K315 HydrophobicContact CG2-CD 4.3Å; T311-K315 WeakPolarHBondContact O-CG 3.44Å; T311-K315 PolarHBondContact O-N 3.47Å; P312-K315 PolarHBondContact O-N 3.26Å; L313-K315 PolarHBondContact O-N 3.07Å; K315-R318 PolarHBondContact O-N 3.27Å; K315-Y319 WeakPolarHBondContact O-CB 3.4Å; K315-Y319 PolarHBondContact O-N 3.02Å
316	R	94.8	Very high	93.3	Very high	89 Å²	89	60.3 Å²	60.3	34%	0.336	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-45.8	177.6	-173.2	174.8	179	99.1	1	112.3	P312 L313 Q314 Y319 H320 W343	P312-R316 WeakPolarHBondContact O-CB 3.3Å; P312-R316 PolarHBondContact O-N 3.33Å; L313-R316 PolarHBondContact O-N 2.92Å; Q314-R316 VanDerWaalsContact C-N 3.33Å; R316-Y319 PolarHBondContact O-N 2.91Å; R316-H320 PolarHBondContact O-CD2 3.21Å; R316-H320 VanDerWaalsContact O-CD2 3.29Å; R316-H320 PolarHBondContact O-N 3.03Å; R316-W343 HydrophobicContact CB-CZ2 4.48Å; R316-W343 HydrophobicContact CG-CH2 4.45Å; R316-W343 HydrophobicContact CG-CZ2 4.12Å
317	F	96.2	Very high	92.9	Very high	1 Å²	1	62.6 Å²	62.6	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-49.1	177	-173.1	-85.8	0	0	0	111.2	L313 Q314 Y319 H320 F321 Y336 V340 W343 L379 K383	L313-F317 WeakPolarHBondContact O-CB 3.26Å; L313-F317 PolarHBondContact O-N 3.26Å; Q314-F317 PolarHBondContact O-N 2.84Å; F317-Y319 VanDerWaalsContact C-N 3.31Å; F317-Y319 PolarHBondContact O-N 3.21Å; F317-H320 PolarHBondContact O-N 2.71Å; F317-F321 HydrophobicContact CD1-CB 4.49Å; F317-F321 HydrophobicContact CD1-CD2 4.44Å; F317-F321 AromaticContact CD2-CD2 3.55Å; F317-F321 HydrophobicContact CD2-CD2 3.55Å; F317-F321 HydrophobicContact CD2-CE2 4.05Å; F317-F321 HydrophobicContact CE1-CB 4.25Å; F317-F321 AromaticContact CE2-CD2 3.75Å; F317-F321 HydrophobicContact CE2-CD2 3.75Å; F317-F321 HydrophobicContact CE2-CE2 4.33Å; F317-F321 HydrophobicContact CE2-CG 4.49Å; F317-F321 AromaticContact CG-CD2 3.93Å; F317-F321 HydrophobicContact CG-CD2 3.93Å; F317-F321 HydrophobicContact CZ-CB 4.32Å; F317-F321 HydrophobicContact CZ-CD2 4.27Å; F317-F321 WeakPolarHBondContact O-CB 3.35Å; F317-F321 PolarHBondContact O-N 2.97Å; F317-Y336 HydrophobicContact CE2-CD2 4.41Å; F317-Y336 HydrophobicContact CE2-CG 4.49Å; F317-Y336 HydrophobicContact CZ-CD2 4.28Å; F317-Y336 HydrophobicContact CZ-CG 4.42Å; F317-V340 HydrophobicContact CD2-CG2 4.15Å; F317-V340 HydrophobicContact CE2-CG2 3.92Å; F317-W343 HydrophobicContact CB-CH2 3.97Å; F317-W343 HydrophobicContact CB-CZ3 4.01Å; F317-W343 HydrophobicContact CD2-CH2 4.26Å; F317-W343 AromaticContact CD2-CZ3 3.92Å; F317-W343 HydrophobicContact CD2-CZ3 3.92Å; F317-W343 HydrophobicContact CG-CZ3 4.46Å; F317-L379 HydrophobicContact CB-CD1 3.86Å; F317-L379 HydrophobicContact CD1-CB 3.98Å; F317-L379 HydrophobicContact CD1-CD1 4.41Å; F317-L379 HydrophobicContact CD1-CD2 4.37Å; F317-L379 HydrophobicContact CD1-CG 4.49Å; F317-L379 HydrophobicContact CD2-CB 4.26Å; F317-L379 HydrophobicContact CD2-CD1 4.24Å; F317-L379 HydrophobicContact CE1-CB 3.97Å; F317-L379 HydrophobicContact CE2-CB 4.24Å; F317-L379 HydrophobicContact CG-CB 4.13Å; F317-L379 HydrophobicContact CG-CD1 3.93Å; F317-L379 HydrophobicContact CG-CG 4.47Å; F317-L379 HydrophobicContact CZ-CB 4.1Å; F317-K383 HydrophobicContact CE1-CB 4.13Å; F317-K383 HydrophobicContact CE1-CG 4.49Å; F317-K383 HydrophobicContact CZ-CB 3.98Å; F317-K383 HydrophobicContact CZ-CG 4.22Å
318	R	94.7	Very high	92.8	Very high	89 Å²	89	62.2 Å²	62.2	34%	0.336	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-40.1	176.7	-70.4	178.5	-173.4	113.6	9.1	111.6	Q314 K315 R322	Q314-R318 WeakPolarHBondContact O-CB 3.39Å; Q314-R318 VanDerWaalsContact O-CG 3.32Å; Q314-R318 WeakPolarHBondContact O-CG 3.48Å; Q314-R318 PolarHBondContact O-N 3.42Å; K315-R318 PolarHBondContact O-N 3.27Å; R318-R322 HydrophobicContact CB-CG 4.36Å; R318-R322 HydrophobicContact CG-CG 4.37Å; R318-R322 WeakPolarHBondContact O-CB 3.27Å; R318-R322 PolarHBondContact O-N 3.33Å; R318-R322 VanDerWaalsContact O-N 3.16Å
319	Y	93.4	Very high	92.7	Very high	122 Å²	122	64.1 Å²	64.1	48%	0.478	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-44.6	177.8	178.3	-93.3	0	0	0	112.7	K315 R316 F317 R325	K315-Y319 WeakPolarHBondContact O-CB 3.4Å; K315-Y319 PolarHBondContact O-N 3.02Å; R316-Y319 PolarHBondContact O-N 2.91Å; F317-Y319 VanDerWaalsContact C-N 3.31Å; F317-Y319 PolarHBondContact O-N 3.21Å; Y319-R325 WeakPolarHBondContact O-CG 3.29Å; Y319-R325 PolarHBondContact OH-NH1 3.34Å; Y319-R325 PolarHBondContact OH-NH2 3.18Å
320	H	93.6	Very high	92.5	Very high	49 Å²	49	67.2 Å²	67.2	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-85.6	-38.9	-175.2	-75.7	-74.3	0	0	0	113.9	R316 F317 T327 N328	R316-H320 PolarHBondContact O-CD2 3.21Å; R316-H320 VanDerWaalsContact O-CD2 3.29Å; R316-H320 PolarHBondContact O-N 3.03Å; F317-H320 PolarHBondContact O-N 2.71Å; H320-T327 WeakPolarHBondContact CA-OG1 3.49Å; H320-T327 CarbonylContact O-C 3.59Å; H320-T327 WeakPolarHBondContact O-CB 3.37Å; H320-T327 PolarHBondContact O-OG1 3.38Å; H320-N328 PolarHBondContact O-N 3.37Å
321	F	95.5	Very high	92.4	Very high	14 Å²	14	69.4 Å²	69.4	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-113.1	9.1	-168	-51.7	-62.7	0	0	0	113.3	F317 N328 W335 Q339 K383	F317-F321 HydrophobicContact CD1-CB 4.49Å; F317-F321 HydrophobicContact CD1-CD2 4.44Å; F317-F321 AromaticContact CD2-CD2 3.55Å; F317-F321 HydrophobicContact CD2-CD2 3.55Å; F317-F321 HydrophobicContact CD2-CE2 4.05Å; F317-F321 HydrophobicContact CE1-CB 4.25Å; F317-F321 AromaticContact CE2-CD2 3.75Å; F317-F321 HydrophobicContact CE2-CD2 3.75Å; F317-F321 HydrophobicContact CE2-CE2 4.33Å; F317-F321 HydrophobicContact CE2-CG 4.49Å; F317-F321 AromaticContact CG-CD2 3.93Å; F317-F321 HydrophobicContact CG-CD2 3.93Å; F317-F321 HydrophobicContact CZ-CB 4.32Å; F317-F321 HydrophobicContact CZ-CD2 4.27Å; F317-F321 WeakPolarHBondContact O-CB 3.35Å; F317-F321 PolarHBondContact O-N 2.97Å; F321-N328 PolarHBondContact O-OD1 2.97Å; F321-W335 HydrophobicContact CE1-CB 4.13Å; F321-Q339 HydrophobicContact CE2-CB 4.21Å; F321-Q339 HydrophobicContact CE2-CG 4Å; F321-Q339 HydrophobicContact CZ-CB 4.11Å; F321-Q339 HydrophobicContact CZ-CG 4.16Å; F321-K383 WeakPolarHBondContact O-CE 2.78Å; F321-K383 PolarHBondContact O-NZ 3.47Å
322	R	89.4	Confident	92.4	Very high	56 Å²	56	71.4 Å²	71.4	21%	0.211	35%	0.348	C	S	.	.	S	Bend	trans	-125.7	155.8	168.9	-53.1	-70.8	-168.7	176.5	8.2	110.7	R318 E382 T386	R318-R322 HydrophobicContact CB-CG 4.36Å; R318-R322 HydrophobicContact CG-CG 4.37Å; R318-R322 WeakPolarHBondContact O-CB 3.27Å; R318-R322 PolarHBondContact O-N 3.33Å; R318-R322 VanDerWaalsContact O-N 3.16Å; R322-E382 VanDerWaalsContact NH2-CB 3.34Å; R322-E382 PolarHBondContact NH2-O 3.42Å; R322-T386 PolarHBondContact NH1-OG1 3.46Å
323	G	86.8	Confident	92.5	Very high	48 Å²	48	69.4 Å²	69.4	50%	0.495	34%	0.335	S	S	.	.	S	Bend	trans	73.1	-150.2	-179.9	0	0	0	0	0	113.3	R325 N328	G323-R325 PolarHBondContact O-N 2.8Å; G323-N328 PolarHBondContact O-ND2 3.43Å
324	N	84.6	Confident	92.5	Very high	175 Å²	175	71.2 Å²	71.2	94%	0.936	34%	0.344	S	S	*	.	S	Bend	trans	-98.3	24.6	-166.2	-61.6	-10.1	0	0	0	114.2
325	R	88.1	Confident	92.5	Very high	122 Å²	122	74.9 Å²	74.9	46%	0.46	36%	0.356	S	S	.	.			trans	-74.6	148.8	177.5	-68.8	-60.5	-178.1	172.9	-10.1	111.3	Y319 G323 T327 N328	Y319-R325 WeakPolarHBondContact O-CG 3.29Å; Y319-R325 PolarHBondContact OH-NH1 3.34Å; Y319-R325 PolarHBondContact OH-NH2 3.18Å; G323-R325 PolarHBondContact O-N 2.8Å; R325-T327 PolarHBondContact O-N 3.42Å; R325-T327 VanDerWaalsContact O-N 3.13Å; R325-N328 WeakPolarHBondContact O-CB 3.34Å; R325-N328 PolarHBondContact O-N 3.05Å
326	Q	85.4	Confident	92.6	Very high	185 Å²	185	68.9 Å²	68.9	86%	0.864	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.7	172.9	-67.9	-179.9	-11	0	0	113.6	V329	Q326-V329 WeakPolarHBondContact O-CG2 3.48Å
327	T	86.6	Confident	92.8	Very high	49 Å²	49	64.8 Å²	64.8	30%	0.301	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.9	174.6	44.6	0	0	0	0	113.2	H320 R325 V329	H320-T327 WeakPolarHBondContact CA-OG1 3.49Å; H320-T327 CarbonylContact O-C 3.59Å; H320-T327 WeakPolarHBondContact O-CB 3.37Å; H320-T327 PolarHBondContact O-OG1 3.38Å; R325-T327 PolarHBondContact O-N 3.42Å; R325-T327 VanDerWaalsContact O-N 3.13Å; T327-V329 PolarHBondContact O-N 3.04Å
328	N	93.3	Very high	92.8	Very high	44 Å²	44	67.5 Å²	67.5	24%	0.235	34%	0.337	C	S	.	.			trans	-93.8	80.5	175.1	-178.9	28.5	0	0	0	109.7	H320 F321 G323 R325 K383	H320-N328 PolarHBondContact O-N 3.37Å; F321-N328 PolarHBondContact O-OD1 2.97Å; G323-N328 PolarHBondContact O-ND2 3.43Å; R325-N328 WeakPolarHBondContact O-CB 3.34Å; R325-N328 PolarHBondContact O-N 3.05Å; N328-K383 PolarHBondContact OD1-NZ 2.93Å
329	V	92.9	Very high	92.9	Very high	48 Å²	48	65.1 Å²	65.1	29%	0.291	33%	0.33	S	S	.	.			trans	-117.3	120.3	-176.3	180	0	0	0	0	109.5	Q326 T327 S331 K332 W335	Q326-V329 WeakPolarHBondContact O-CG2 3.48Å; T327-V329 PolarHBondContact O-N 3.04Å; V329-S331 WeakPolarHBondContact CG1-OG 3.49Å; V329-S331 PolarHBondContact O-N 2.72Å; V329-K332 HydrophobicContact CB-CB 4.16Å; V329-K332 HydrophobicContact CB-CG 4.44Å; V329-K332 HydrophobicContact CG1-CB 4.22Å; V329-K332 HydrophobicContact CG1-CG 4.08Å; V329-K332 PolarHBondContact O-N 2.84Å; V329-W335 HydrophobicContact CB-CZ3 4.27Å; V329-W335 HydrophobicContact CG2-CH2 4.45Å; V329-W335 HydrophobicContact CG2-CZ3 3.88Å
330	L	92.7	Very high	93.1	Very high	66 Å²	66	59.3 Å²	59.3	35%	0.346	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-29.6	-178.3	-68.8	175.9	0	0	0	113.2	K332 D387 C390 L391	L330-K332 PolarHBondContact O-N 3.24Å; L330-D387 HydrophobicContact CD2-CB 3.73Å; L330-D387 VanDerWaalsContact CD2-CG 3.46Å; L330-C390 HydrophobicContact CD1-CB 4.06Å; L330-L391 HydrophobicContact CB-CD2 4.08Å
331	S	94.3	Very high	93.2	Very high	48 Å²	48	57.5 Å²	57.5	34%	0.336	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.2	176.6	62.1	0	0	0	0	114.4	V329 L397	V329-S331 WeakPolarHBondContact CG1-OG 3.49Å; V329-S331 PolarHBondContact O-N 2.72Å; S331-L397 VanDerWaalsContact CB-CD2 3.47Å
332	K	96	Very high	93.2	Very high	79 Å²	79	60.2 Å²	60.2	34%	0.343	31%	0.312	S	S	.	.			trans	-127.6	56.8	-178.1	-64.7	-64.2	-178.8	-168.2	0	113.1	V329 L330 E334 W335	V329-K332 HydrophobicContact CB-CB 4.16Å; V329-K332 HydrophobicContact CB-CG 4.44Å; V329-K332 HydrophobicContact CG1-CB 4.22Å; V329-K332 HydrophobicContact CG1-CG 4.08Å; V329-K332 PolarHBondContact O-N 2.84Å; L330-K332 PolarHBondContact O-N 3.24Å; K332-E334 VanDerWaalsContact C-OE2 3.29Å; K332-E334 VanDerWaalsContact CA-OE2 3.27Å; K332-E334 WeakPolarHBondContact CA-OE2 3.48Å; K332-E334 WeakPolarHBondContact CD-OE1 3.26Å; K332-E334 WeakPolarHBondContact CE-OE1 3.44Å; K332-E334 IonicContact NZ-OE1 3.06Å; K332-E334 PolarHBondContact NZ-OE1 3.49Å; K332-E334 PolarHBondContact O-N 3.33Å; K332-W335 HydrophobicContact CB-CD2 3.75Å; K332-W335 HydrophobicContact CB-CE3 4.06Å; K332-W335 HydrophobicContact CB-CG 4.1Å; K332-W335 HydrophobicContact CB-CZ2 4.24Å; K332-W335 HydrophobicContact CB-CZ3 4.42Å; K332-W335 HydrophobicContact CG-CD2 4.42Å; K332-W335 HydrophobicContact CG-CH2 4.35Å; K332-W335 HydrophobicContact CG-CZ2 3.99Å; K332-W335 PolarHBondContact O-N 3.32Å
333	P	96.7	Very high	93.6	Very high	3 Å²	3	57.7 Å²	57.7	2%	0.019	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.3	178.1	27.3	-33.8	0	0	0	113.2	W335 Y336 L337 L401 E404	P333-W335 PolarHBondContact O-N 3.05Å; P333-Y336 VanDerWaalsContact CA-CE1 3.43Å; P333-Y336 HydrophobicContact CB-CE1 3.74Å; P333-Y336 WeakPolarHBondContact O-CD1 3.45Å; P333-Y336 PolarHBondContact O-N 3.41Å; P333-L337 HydrophobicContact CB-CD1 4.26Å; P333-L337 VanDerWaalsContact O-CG 3.31Å; P333-L337 WeakPolarHBondContact O-CG 3.26Å; P333-L337 PolarHBondContact O-N 3.47Å; P333-L401 HydrophobicContact CB-CD1 3.38Å; P333-L401 HydrophobicContact CG-CB 4.42Å; P333-L401 HydrophobicContact CG-CD1 3.68Å; P333-E404 HydrophobicContact CG-CB 4.11Å; P333-E404 HydrophobicContact CG-CG 4.14Å
334	E	97.1	Very high	94	Very high	38 Å²	38	55.5 Å²	55.5	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-54	-28.3	176.9	63.2	-94.7	-149.6	0	0	112.8	K332 A338 H400 E404	K332-E334 VanDerWaalsContact C-OE2 3.29Å; K332-E334 VanDerWaalsContact CA-OE2 3.27Å; K332-E334 WeakPolarHBondContact CA-OE2 3.48Å; K332-E334 WeakPolarHBondContact CD-OE1 3.26Å; K332-E334 WeakPolarHBondContact CE-OE1 3.44Å; K332-E334 IonicContact NZ-OE1 3.06Å; K332-E334 PolarHBondContact NZ-OE1 3.49Å; K332-E334 PolarHBondContact O-N 3.33Å; E334-A338 WeakPolarHBondContact O-CB 3.41Å; E334-A338 PolarHBondContact O-N 3.5Å; E334-H400 IonicContact OE1-NE2 2.92Å; E334-H400 IonicContact OE2-CD2 3.83Å; E334-H400 IonicContact OE2-CE1 3.79Å; E334-H400 IonicContact OE2-NE2 3.5Å; E334-H400 PolarHBondContact OE2-NE2 3.48Å; E334-E404 HydrophobicContact CB-CG 4.22Å; E334-E404 WeakPolarHBondContact CB-OE2 3.08Å
335	W	96.6	Very high	94.5	Very high	115 Å²	115	48.7 Å²	48.7	44%	0.436	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-47.1	-178.7	-69.6	-2.7	0	0	0	113.1	F321 V329 K332 P333 Q339	F321-W335 HydrophobicContact CE1-CB 4.13Å; V329-W335 HydrophobicContact CB-CZ3 4.27Å; V329-W335 HydrophobicContact CG2-CH2 4.45Å; V329-W335 HydrophobicContact CG2-CZ3 3.88Å; K332-W335 HydrophobicContact CB-CD2 3.75Å; K332-W335 HydrophobicContact CB-CE3 4.06Å; K332-W335 HydrophobicContact CB-CG 4.1Å; K332-W335 HydrophobicContact CB-CZ2 4.24Å; K332-W335 HydrophobicContact CB-CZ3 4.42Å; K332-W335 HydrophobicContact CG-CD2 4.42Å; K332-W335 HydrophobicContact CG-CH2 4.35Å; K332-W335 HydrophobicContact CG-CZ2 3.99Å; K332-W335 PolarHBondContact O-N 3.32Å; P333-W335 PolarHBondContact O-N 3.05Å; W335-Q339 WeakPolarHBondContact O-CB 3.47Å; W335-Q339 PolarHBondContact O-N 3.04Å
336	Y	97.1	Very high	94.8	Very high	6 Å²	6	43.7 Å²	43.7	2%	0.024	23%	0.233	C	C	.	.	H	α-helix	trans	-81	-30.6	-179.7	69.5	-104	0	0	0	111.6	F317 P333 V340 V380 K383 L384	F317-Y336 HydrophobicContact CE2-CD2 4.41Å; F317-Y336 HydrophobicContact CE2-CG 4.49Å; F317-Y336 HydrophobicContact CZ-CD2 4.28Å; F317-Y336 HydrophobicContact CZ-CG 4.42Å; P333-Y336 VanDerWaalsContact CA-CE1 3.43Å; P333-Y336 HydrophobicContact CB-CE1 3.74Å; P333-Y336 WeakPolarHBondContact O-CD1 3.45Å; P333-Y336 PolarHBondContact O-N 3.41Å; Y336-V340 WeakPolarHBondContact O-CG2 3.35Å; Y336-V340 PolarHBondContact O-N 2.79Å; Y336-V340 VanDerWaalsContact O-N 3.12Å; Y336-V380 HydrophobicContact CE2-CG1 4.19Å; Y336-K383 HydrophobicContact CD1-CG 4.14Å; Y336-K383 HydrophobicContact CD2-CG 4.25Å; Y336-K383 HydrophobicContact CE1-CG 3.93Å; Y336-K383 HydrophobicContact CE2-CB 4.49Å; Y336-K383 HydrophobicContact CE2-CG 4.08Å; Y336-K383 HydrophobicContact CG-CG 4.31Å; Y336-L384 WeakPolarHBondContact OH-CD2 3.27Å
337	L	98.1	Very high	95.2	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-54	176.7	-67.2	173.2	0	0	0	111.1	P333 Q339 V340 L341 V380 E404 V405 F408	P333-L337 HydrophobicContact CB-CD1 4.26Å; P333-L337 VanDerWaalsContact O-CG 3.31Å; P333-L337 WeakPolarHBondContact O-CG 3.26Å; P333-L337 PolarHBondContact O-N 3.47Å; L337-Q339 VanDerWaalsContact C-N 3.27Å; L337-Q339 PolarHBondContact O-N 3.12Å; L337-V340 PolarHBondContact O-N 2.99Å; L337-V340 VanDerWaalsContact O-N 3.17Å; L337-L341 PolarHBondContact O-N 3.28Å; L337-L341 VanDerWaalsContact O-N 3.08Å; L337-V380 HydrophobicContact CD2-CG1 3.6Å; L337-E404 HydrophobicContact CD1-CB 3.9Å; L337-V405 HydrophobicContact CD1-CG2 4.32Å; L337-F408 HydrophobicContact CB-CB 4.23Å; L337-F408 HydrophobicContact CB-CD2 3.73Å; L337-F408 HydrophobicContact CB-CE2 4.46Å; L337-F408 HydrophobicContact CB-CG 4.2Å; L337-F408 HydrophobicContact CD1-CB 4.19Å; L337-F408 HydrophobicContact CD2-CB 4.12Å; L337-F408 HydrophobicContact CD2-CD1 4.06Å; L337-F408 HydrophobicContact CD2-CD2 3.77Å; L337-F408 HydrophobicContact CD2-CE1 4.47Å; L337-F408 HydrophobicContact CD2-CE2 4.18Å; L337-F408 HydrophobicContact CD2-CG 3.71Å; L337-F408 HydrophobicContact CG-CB 4.41Å; L337-F408 HydrophobicContact CG-CD2 4.31Å; L337-F408 HydrophobicContact CG-CG 4.39Å
338	A	96.6	Very high	95.6	Very high	57 Å²	57	34 Å²	34	47%	0.471	19%	0.187	S	C	.	.	H	α-helix	trans	-62.8	-35.5	177.5	0	0	0	0	0	112	E334 V340 L341 M342	E334-A338 WeakPolarHBondContact O-CB 3.41Å; E334-A338 PolarHBondContact O-N 3.5Å; A338-V340 VanDerWaalsContact C-N 3.32Å; A338-V340 PolarHBondContact O-N 2.94Å; A338-L341 PolarHBondContact O-N 2.88Å; A338-M342 WeakPolarHBondContact O-CB 3.49Å; A338-M342 PolarHBondContact O-N 3.13Å
339	Q	96.2	Very high	95.6	Very high	40 Å²	40	36.8 Å²	36.8	19%	0.187	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-38.4	176.9	-176.4	62.9	71.4	0	0	112.3	F321 W335 L337 W343	F321-Q339 HydrophobicContact CE2-CB 4.21Å; F321-Q339 HydrophobicContact CE2-CG 4Å; F321-Q339 HydrophobicContact CZ-CB 4.11Å; F321-Q339 HydrophobicContact CZ-CG 4.16Å; W335-Q339 WeakPolarHBondContact O-CB 3.47Å; W335-Q339 PolarHBondContact O-N 3.04Å; L337-Q339 VanDerWaalsContact C-N 3.27Å; L337-Q339 PolarHBondContact O-N 3.12Å; Q339-W343 HydrophobicContact CG-CD2 4.29Å; Q339-W343 HydrophobicContact CG-CH2 3.89Å; Q339-W343 HydrophobicContact CG-CZ2 3.57Å; Q339-W343 HydrophobicContact CG-CZ3 4.37Å; Q339-W343 VanDerWaalsContact O-CG 3.31Å; Q339-W343 PolarHBondContact O-N 2.84Å; Q339-W343 VanDerWaalsContact O-N 3.07Å
340	V	97.3	Very high	95.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-44.3	176.5	165.5	0	0	0	0	111.2	F317 Y336 L337 A338 M342 W343 I344 L376 V380 F408	F317-V340 HydrophobicContact CD2-CG2 4.15Å; F317-V340 HydrophobicContact CE2-CG2 3.92Å; Y336-V340 WeakPolarHBondContact O-CG2 3.35Å; Y336-V340 PolarHBondContact O-N 2.79Å; Y336-V340 VanDerWaalsContact O-N 3.12Å; L337-V340 PolarHBondContact O-N 2.99Å; L337-V340 VanDerWaalsContact O-N 3.17Å; A338-V340 VanDerWaalsContact C-N 3.32Å; A338-V340 PolarHBondContact O-N 2.94Å; V340-M342 VanDerWaalsContact C-N 3.31Å; V340-M342 PolarHBondContact O-N 3.11Å; V340-W343 HydrophobicContact CG2-CE3 4.2Å; V340-W343 HydrophobicContact CG2-CZ3 4.3Å; V340-W343 PolarHBondContact O-N 3.09Å; V340-W343 VanDerWaalsContact O-N 3.13Å; V340-I344 HydrophobicContact CG1-CD1 4.04Å; V340-I344 WeakPolarHBondContact O-CG1 3.32Å; V340-I344 PolarHBondContact O-N 2.8Å; V340-L376 HydrophobicContact CG1-CB 3.99Å; V340-V380 HydrophobicContact CB-CG2 4.05Å; V340-V380 HydrophobicContact CG1-CG2 3.95Å; V340-V380 HydrophobicContact CG2-CG2 3.77Å; V340-F408 HydrophobicContact CB-CE2 4.43Å; V340-F408 HydrophobicContact CG1-CE2 4.23Å; V340-F408 HydrophobicContact CG1-CZ 4.36Å
341	L	96.9	Very high	95.8	Very high	11 Å²	11	32.4 Å²	32.4	6%	0.058	17%	0.173	C	C	.	.	H	α-helix	trans	-57.9	-45	174.2	-69.3	169.1	0	0	0	111.4	L337 A338 W343 I344 G345 F408 E411 L412	L337-L341 PolarHBondContact O-N 3.28Å; L337-L341 VanDerWaalsContact O-N 3.08Å; A338-L341 PolarHBondContact O-N 2.88Å; L341-W343 VanDerWaalsContact C-N 3.32Å; L341-W343 PolarHBondContact O-N 3.02Å; L341-I344 PolarHBondContact O-N 2.89Å; L341-I344 VanDerWaalsContact O-N 3.15Å; L341-G345 PolarHBondContact O-N 3.21Å; L341-F408 HydrophobicContact CD1-CD2 3.57Å; L341-F408 HydrophobicContact CD1-CE2 4.16Å; L341-F408 HydrophobicContact CD1-CG 4.43Å; L341-F408 HydrophobicContact CD2-CD2 3.92Å; L341-F408 HydrophobicContact CD2-CE2 3.78Å; L341-F408 HydrophobicContact CD2-CZ 4.5Å; L341-F408 HydrophobicContact CG-CD2 3.55Å; L341-F408 HydrophobicContact CG-CE2 3.59Å; L341-E411 HydrophobicContact CD1-CB 4.15Å; L341-E411 HydrophobicContact CD1-CG 4.17Å; L341-E411 HydrophobicContact CD2-CB 4.49Å; L341-E411 HydrophobicContact CD2-CG 4.41Å; L341-L412 HydrophobicContact CD2-CB 4.17Å; L341-L412 HydrophobicContact CD2-CD1 4.3Å
342	M	95.5	Very high	95.8	Very high	71 Å²	71	32.8 Å²	32.8	35%	0.35	17%	0.171	S	C	.	.	H	α-helix	trans	-60.2	-41.1	175.8	-174.5	178.2	64.9	0	0	111.9	A338 V340 G345 N346	A338-M342 WeakPolarHBondContact O-CB 3.49Å; A338-M342 PolarHBondContact O-N 3.13Å; V340-M342 VanDerWaalsContact C-N 3.31Å; V340-M342 PolarHBondContact O-N 3.11Å; M342-G345 PolarHBondContact O-N 3.46Å; M342-N346 VanDerWaalsContact O-CB 3.32Å; M342-N346 WeakPolarHBondContact O-CB 3.35Å; M342-N346 PolarHBondContact O-N 2.69Å; M342-N346 PolarHBondContact O-OD1 3.26Å
343	W	96.7	Very high	95.7	Very high	2 Å²	2	34 Å²	34	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-65	-42	174.6	-69.5	-25.2	0	0	0	112.2	L313 R316 F317 Q339 V340 L341 G345 H347 L376	L313-W343 HydrophobicContact CB-CE3 4.38Å; L313-W343 HydrophobicContact CB-CZ3 4.43Å; L313-W343 HydrophobicContact CD1-CB 4.43Å; L313-W343 HydrophobicContact CD1-CD2 4.46Å; L313-W343 HydrophobicContact CD1-CG 4.38Å; L313-W343 HydrophobicContact CD2-CD2 3.84Å; L313-W343 HydrophobicContact CD2-CE3 4.38Å; L313-W343 HydrophobicContact CD2-CG 4.07Å; L313-W343 HydrophobicContact CD2-CZ2 4.2Å; R316-W343 HydrophobicContact CB-CZ2 4.48Å; R316-W343 HydrophobicContact CG-CH2 4.45Å; R316-W343 HydrophobicContact CG-CZ2 4.12Å; F317-W343 HydrophobicContact CB-CH2 3.97Å; F317-W343 HydrophobicContact CB-CZ3 4.01Å; F317-W343 HydrophobicContact CD2-CH2 4.26Å; F317-W343 AromaticContact CD2-CZ3 3.92Å; F317-W343 HydrophobicContact CD2-CZ3 3.92Å; F317-W343 HydrophobicContact CG-CZ3 4.46Å; Q339-W343 HydrophobicContact CG-CD2 4.29Å; Q339-W343 HydrophobicContact CG-CH2 3.89Å; Q339-W343 HydrophobicContact CG-CZ2 3.57Å; Q339-W343 HydrophobicContact CG-CZ3 4.37Å; Q339-W343 VanDerWaalsContact O-CG 3.31Å; Q339-W343 PolarHBondContact O-N 2.84Å; Q339-W343 VanDerWaalsContact O-N 3.07Å; V340-W343 HydrophobicContact CG2-CE3 4.2Å; V340-W343 HydrophobicContact CG2-CZ3 4.3Å; V340-W343 PolarHBondContact O-N 3.09Å; V340-W343 VanDerWaalsContact O-N 3.13Å; L341-W343 VanDerWaalsContact C-N 3.32Å; L341-W343 PolarHBondContact O-N 3.02Å; W343-G345 VanDerWaalsContact C-N 3.34Å; W343-G345 PolarHBondContact O-N 2.89Å; W343-H347 PolarHBondContact O-N 3.31Å; W343-H347 PolarHBondContact O-ND1 3.37Å; W343-L376 HydrophobicContact CB-CD1 3.76Å; W343-L376 HydrophobicContact CE3-CD2 3.99Å
344	I	96	Very high	95.5	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-48.8	175.8	-67.1	169.9	0	0	0	110	V340 L341 T348 L376 L412 H416	V340-I344 HydrophobicContact CG1-CD1 4.04Å; V340-I344 WeakPolarHBondContact O-CG1 3.32Å; V340-I344 PolarHBondContact O-N 2.8Å; L341-I344 PolarHBondContact O-N 2.89Å; L341-I344 VanDerWaalsContact O-N 3.15Å; I344-T348 PolarHBondContact O-N 3.45Å; I344-T348 PolarHBondContact O-OG1 3.19Å; I344-L376 HydrophobicContact CG1-CD1 3.71Å; I344-L412 HydrophobicContact CD1-CD1 3.7Å; I344-H416 HydrophobicContact CG2-CB 4Å
345	G	94.7	Very high	95.4	Very high	33 Å²	33	35.4 Å²	35.4	34%	0.34	18%	0.183	S	C	.	.	H	α-helix	trans	-59.8	-51.1	178.3	0	0	0	0	0	113.4	L341 M342 W343 H347 T348	L341-G345 PolarHBondContact O-N 3.21Å; M342-G345 PolarHBondContact O-N 3.46Å; W343-G345 VanDerWaalsContact C-N 3.34Å; W343-G345 PolarHBondContact O-N 2.89Å; G345-H347 VanDerWaalsContact C-N 3.26Å; G345-H347 PolarHBondContact O-N 3.47Å; G345-T348 PolarHBondContact O-N 3.43Å
346	N	94.1	Very high	95.4	Very high	16 Å²	16	31.2 Å²	31.2	9%	0.086	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-28.6	-174.6	-72.9	-8.5	0	0	0	113.9	F243 M342	F243-N346 HydrophobicContact CB-CB 4.35Å; F243-N346 PolarHBondContact O-ND2 3.33Å; M342-N346 VanDerWaalsContact O-CB 3.32Å; M342-N346 WeakPolarHBondContact O-CB 3.35Å; M342-N346 PolarHBondContact O-N 2.69Å; M342-N346 PolarHBondContact O-OD1 3.26Å
347	H	94.8	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-97	-9.1	-176.8	-59.6	84.7	0	0	0	113.6	W241 P242 F243 W343 G345 Q349 F350 L351 F372	W241-H347 AromaticContact CE3-CD2 3.8Å; W241-H347 HydrophobicContact CH2-CB 4.05Å; W241-H347 AromaticContact CH2-CD2 3.27Å; W241-H347 WeakPolarHBondContact CH2-CD2 3.37Å; W241-H347 AromaticContact CH2-CG 3.9Å; W241-H347 AromaticContact CZ2-CD2 3.71Å; W241-H347 HydrophobicContact CZ3-CB 4.3Å; W241-H347 AromaticContact CZ3-CD2 3.35Å; W241-H347 WeakPolarHBondContact CZ3-CD2 3.4Å; P242-H347 WeakPolarHBondContact CB-NE2 3.35Å; F243-H347 HydrophobicContact CD2-CB 4.48Å; F243-H347 AromaticContact CD2-CD2 3.35Å; F243-H347 WeakPolarHBondContact CD2-CD2 3.1Å; F243-H347 AromaticContact CD2-NE2 3.94Å; F243-H347 PolarHBondContact N-NE2 2.89Å; F243-H347 PolarHBondContact O-CE1 3.4Å; W343-H347 PolarHBondContact O-N 3.31Å; W343-H347 PolarHBondContact O-ND1 3.37Å; G345-H347 VanDerWaalsContact C-N 3.26Å; G345-H347 PolarHBondContact O-N 3.47Å; H347-Q349 PolarHBondContact O-N 2.89Å; H347-F350 PolarHBondContact O-N 2.95Å; H347-L351 HydrophobicContact CB-CD1 4.05Å; H347-L351 HydrophobicContact CB-CG 4.5Å; H347-L351 VanDerWaalsContact O-CG 3.3Å; H347-L351 WeakPolarHBondContact O-CG 3.35Å; H347-L351 PolarHBondContact O-N 3.33Å; H347-F372 HydrophobicContact CB-CD1 4.38Å; H347-F372 HydrophobicContact CB-CE1 3.71Å; H347-F372 HydrophobicContact CB-CZ 4.06Å; H347-F372 AromaticContact CG-CE1 3.84Å; H347-F372 AromaticContact CG-CZ 3.79Å; H347-F372 AromaticContact ND1-CE1 3.91Å; H347-F372 AromaticContact ND1-CZ 3.9Å
348	T	93.4	Very high	95.2	Very high	31 Å²	31	33.4 Å²	33.4	19%	0.19	18%	0.183	C	C	.	.	H	α-helix	trans	-55	-51.1	-175	-70.5	0	0	0	0	112.1	I344 G345 F350 L351 D352 R369	I344-T348 PolarHBondContact O-N 3.45Å; I344-T348 PolarHBondContact O-OG1 3.19Å; G345-T348 PolarHBondContact O-N 3.43Å; T348-F350 PolarHBondContact O-N 3.4Å; T348-L351 PolarHBondContact O-N 3.19Å; T348-D352 WeakPolarHBondContact CG2-OD2 3.47Å; T348-D352 WeakPolarHBondContact O-CB 3.4Å; T348-D352 PolarHBondContact O-N 2.98Å; T348-R369 HydrophobicContact CG2-CG 4.48Å
349	Q	93.2	Very high	95.2	Very high	102 Å²	102	30.7 Å²	30.7	48%	0.477	16%	0.161	S	C	.	.	H	α-helix	trans	-60.3	-43.9	-177.5	-173.6	-179	4.9	0	0	112.6	H347 D352 E353	H347-Q349 PolarHBondContact O-N 2.89Å; Q349-D352 PolarHBondContact O-N 3.03Å; Q349-E353 HydrophobicContact CG-CG 4.22Å; Q349-E353 WeakPolarHBondContact CG-OE1 3.39Å; Q349-E353 PolarHBondContact NE2-OE1 3.26Å; Q349-E353 VanDerWaalsContact O-CB 3.28Å; Q349-E353 WeakPolarHBondContact O-CB 3.42Å; Q349-E353 WeakPolarHBondContact O-CG 3.48Å; Q349-E353 PolarHBondContact O-N 2.82Å
350	F	94.1	Very high	95.1	Very high	21 Å²	21	33.3 Å²	33.3	9%	0.092	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-40.7	179.8	-178.1	-88	0	0	0	111.9	L239 W241 F243 Y264 L267 M309 H347 T348 K354 I355	L239-F350 HydrophobicContact CD1-CE2 4.39Å; L239-F350 HydrophobicContact CD1-CZ 4.12Å; W241-F350 HydrophobicContact CE3-CD1 4.05Å; W241-F350 HydrophobicContact CE3-CE1 4.09Å; W241-F350 AromaticContact CZ3-CD1 3.63Å; W241-F350 HydrophobicContact CZ3-CD1 3.63Å; W241-F350 HydrophobicContact CZ3-CE1 4.01Å; W241-F350 HydrophobicContact CZ3-CG 4.38Å; F243-F350 HydrophobicContact CD2-CB 4.45Å; F243-F350 HydrophobicContact CE2-CB 3.48Å; F243-F350 VanDerWaalsContact CE2-CB 3.48Å; F243-F350 HydrophobicContact CE2-CD1 4.2Å; F243-F350 AromaticContact CE2-CD2 3.94Å; F243-F350 HydrophobicContact CE2-CD2 3.94Å; F243-F350 AromaticContact CE2-CG 3.62Å; F243-F350 HydrophobicContact CE2-CG 3.62Å; F243-F350 HydrophobicContact CZ-CB 4.11Å; F243-F350 AromaticContact CZ-CD2 3.67Å; F243-F350 HydrophobicContact CZ-CD2 3.67Å; F243-F350 HydrophobicContact CZ-CE2 4.18Å; F243-F350 AromaticContact CZ-CG 3.86Å; F243-F350 HydrophobicContact CZ-CG 3.86Å; Y264-F350 HydrophobicContact CE1-CE2 4.06Å; L267-F350 HydrophobicContact CD2-CZ 3.99Å; M309-F350 HydrophobicContact CE-CD1 4.46Å; M309-F350 HydrophobicContact CE-CE1 3.95Å; H347-F350 PolarHBondContact O-N 2.95Å; T348-F350 PolarHBondContact O-N 3.4Å; F350-K354 HydrophobicContact CD1-CB 4.44Å; F350-K354 HydrophobicContact CD2-CB 4.27Å; F350-K354 HydrophobicContact CD2-CG 3.82Å; F350-K354 HydrophobicContact CE1-CB 4.31Å; F350-K354 HydrophobicContact CE2-CB 4.14Å; F350-K354 HydrophobicContact CE2-CG 3.89Å; F350-K354 HydrophobicContact CG-CB 4.43Å; F350-K354 HydrophobicContact CG-CG 4.3Å; F350-K354 HydrophobicContact CZ-CB 4.16Å; F350-K354 HydrophobicContact CZ-CG 4.41Å; F350-K354 WeakPolarHBondContact O-CA 3.49Å; F350-K354 VanDerWaalsContact O-CB 3.25Å; F350-K354 WeakPolarHBondContact O-CB 3.41Å; F350-K354 PolarHBondContact O-N 3.42Å; F350-I355 HydrophobicContact CD1-CG1 4.09Å; F350-I355 HydrophobicContact CE1-CD1 3.88Å; F350-I355 HydrophobicContact CE1-CG1 3.81Å; F350-I355 PolarHBondContact O-N 3.08Å
351	L	96.1	Very high	94.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.205	C	C	.	.	I	π-helix	trans	-62.9	-44.8	177.4	-68.5	166.7	0	0	0	110.7	W241 M309 H347 T348 I355 Q356 A368 F372	W241-L351 HydrophobicContact CH2-CD2 4.3Å; M309-L351 HydrophobicContact CE-CD2 4.46Å; H347-L351 HydrophobicContact CB-CD1 4.05Å; H347-L351 HydrophobicContact CB-CG 4.5Å; H347-L351 VanDerWaalsContact O-CG 3.3Å; H347-L351 WeakPolarHBondContact O-CG 3.35Å; H347-L351 PolarHBondContact O-N 3.33Å; T348-L351 PolarHBondContact O-N 3.19Å; L351-I355 HydrophobicContact CD2-CB 4.32Å; L351-I355 HydrophobicContact CD2-CG1 4.12Å; L351-I355 PolarHBondContact O-N 3.25Å; L351-Q356 PolarHBondContact O-N 3.29Å; L351-A368 HydrophobicContact CB-CB 4.5Å; L351-A368 HydrophobicContact CD2-CB 4.47Å; L351-F372 HydrophobicContact CD1-CB 3.61Å; L351-F372 HydrophobicContact CD1-CD1 3.58Å; L351-F372 HydrophobicContact CD1-CD2 4.36Å; L351-F372 HydrophobicContact CD1-CE1 4.29Å; L351-F372 HydrophobicContact CD1-CG 3.59Å; L351-F372 HydrophobicContact CD2-CB 4.48Å
352	D	94.5	Very high	94.5	Very high	57 Å²	57	43.2 Å²	43.2	31%	0.305	23%	0.225	S	C	.	.	I	π-helix	trans	-71.2	-40.8	-179.1	-68.8	-15	0	0	0	112.2	T348 Q349 R369	T348-D352 WeakPolarHBondContact CG2-OD2 3.47Å; T348-D352 WeakPolarHBondContact O-CB 3.4Å; T348-D352 PolarHBondContact O-N 2.98Å; Q349-D352 PolarHBondContact O-N 3.03Å; D352-R369 IonicContact OD2-NH1 2.67Å; D352-R369 PolarHBondContact OD2-NH1 2.7Å
353	E	93.5	Very high	94.1	Very high	103 Å²	103	42.6 Å²	42.6	48%	0.481	24%	0.238	S	C	.	.	I	π-helix	trans	-89.5	-24	-174.6	-67.6	-178.5	-166.9	0	0	114.8	Q349	Q349-E353 HydrophobicContact CG-CG 4.22Å; Q349-E353 WeakPolarHBondContact CG-OE1 3.39Å; Q349-E353 PolarHBondContact NE2-OE1 3.26Å; Q349-E353 VanDerWaalsContact O-CB 3.28Å; Q349-E353 WeakPolarHBondContact O-CB 3.42Å; Q349-E353 WeakPolarHBondContact O-CG 3.48Å; Q349-E353 PolarHBondContact O-N 2.82Å
354	K	92.8	Very high	93.7	Very high	72 Å²	72	44 Å²	44	31%	0.313	25%	0.247	S	C	.	.	I	π-helix	trans	-118.1	-39.2	-173	-52.9	-60.2	170.4	-155.9	0	113.6	Y264 F350 I358	Y264-K354 HydrophobicContact CD1-CD 4.06Å; Y264-K354 HydrophobicContact CD1-CG 4.47Å; Y264-K354 HydrophobicContact CE1-CD 3.8Å; Y264-K354 HydrophobicContact CE1-CG 3.99Å; F350-K354 HydrophobicContact CD1-CB 4.44Å; F350-K354 HydrophobicContact CD2-CB 4.27Å; F350-K354 HydrophobicContact CD2-CG 3.82Å; F350-K354 HydrophobicContact CE1-CB 4.31Å; F350-K354 HydrophobicContact CE2-CB 4.14Å; F350-K354 HydrophobicContact CE2-CG 3.89Å; F350-K354 HydrophobicContact CG-CB 4.43Å; F350-K354 HydrophobicContact CG-CG 4.3Å; F350-K354 HydrophobicContact CZ-CB 4.16Å; F350-K354 HydrophobicContact CZ-CG 4.41Å; F350-K354 WeakPolarHBondContact O-CA 3.49Å; F350-K354 VanDerWaalsContact O-CB 3.25Å; F350-K354 WeakPolarHBondContact O-CB 3.41Å; F350-K354 PolarHBondContact O-N 3.42Å; K354-I358 VanDerWaalsContact O-CD1 3.27Å; K354-I358 WeakPolarHBondContact O-CD1 3.31Å; K354-I358 WeakPolarHBondContact O-CG1 3.39Å
355	I	95.9	Very high	93.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-93	-45.5	-174.9	-57.4	-56.6	0	0	0	112.1	L267 F271 M309 F350 L351 P357 I358 L359 A368	L267-I355 HydrophobicContact CD2-CD1 4.13Å; F271-I355 HydrophobicContact CD2-CD1 4.17Å; F271-I355 HydrophobicContact CD2-CG2 4.32Å; F271-I355 HydrophobicContact CE1-CG2 4.45Å; F271-I355 HydrophobicContact CE2-CD1 4.23Å; F271-I355 HydrophobicContact CE2-CG2 3.46Å; F271-I355 VanDerWaalsContact CE2-CG2 3.46Å; F271-I355 HydrophobicContact CZ-CG2 3.55Å; M309-I355 HydrophobicContact CE-CD1 4.19Å; M309-I355 HydrophobicContact CE-CG1 4.14Å; M309-I355 HydrophobicContact SD-CD1 4.45Å; F350-I355 HydrophobicContact CD1-CG1 4.09Å; F350-I355 HydrophobicContact CE1-CD1 3.88Å; F350-I355 HydrophobicContact CE1-CG1 3.81Å; F350-I355 PolarHBondContact O-N 3.08Å; L351-I355 HydrophobicContact CD2-CB 4.32Å; L351-I355 HydrophobicContact CD2-CG1 4.12Å; L351-I355 PolarHBondContact O-N 3.25Å; I355-P357 VanDerWaalsContact C-CD 3.5Å; I355-I358 HydrophobicContact CD1-CD1 4.28Å; I355-I358 WeakPolarHBondContact O-CB 3.47Å; I355-I358 PolarHBondContact O-N 3.13Å; I355-L359 PolarHBondContact O-N 3.27Å; I355-A368 HydrophobicContact CB-CB 4.23Å; I355-A368 HydrophobicContact CG2-CB 3.77Å
356	Q	96.6	Very high	93.2	Very high	27 Å²	27	53 Å²	53	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-56.1	-42.8	179.8	-169.6	62.9	53	0	0	112.8	L351 I358 L359 D360 V366	L351-Q356 PolarHBondContact O-N 3.29Å; Q356-I358 PolarHBondContact O-N 2.93Å; Q356-I358 VanDerWaalsContact O-N 3.16Å; Q356-L359 WeakPolarHBondContact O-CB 3.48Å; Q356-L359 PolarHBondContact O-N 3.04Å; Q356-D360 PolarHBondContact NE2-OD1 3.04Å; Q356-D360 PolarHBondContact O-N 2.95Å; Q356-V366 PolarHBondContact NE2-O 3.11Å; Q356-V366 VanDerWaalsContact NE2-O 3.13Å
357	P	96	Very high	93.2	Very high	50 Å²	50	54.9 Å²	54.9	33%	0.325	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-27.4	177.4	-24.8	36.2	0	0	0	113.8	I355 K361	I355-P357 VanDerWaalsContact C-CD 3.5Å; P357-K361 WeakPolarHBondContact O-CB 3.47Å; P357-K361 VanDerWaalsContact O-CG 3.22Å; P357-K361 WeakPolarHBondContact O-CG 3.42Å; P357-K361 PolarHBondContact O-N 3.39Å; P357-K361 VanDerWaalsContact O-N 3.1Å
358	I	95.2	Very high	93.2	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-45.2	175.2	-56.5	166.7	0	0	0	109.4	E268 F271 C272 K354 I355 Q356 D360 K361 V362	E268-I358 HydrophobicContact CB-CD1 4.02Å; E268-I358 HydrophobicContact CB-CG1 4.15Å; E268-I358 HydrophobicContact CG-CD1 4.34Å; E268-I358 HydrophobicContact CG-CG1 3.96Å; E268-I358 HydrophobicContact CG-CG2 4.13Å; F271-I358 HydrophobicContact CB-CD1 4.29Å; F271-I358 HydrophobicContact CB-CG2 4.38Å; F271-I358 HydrophobicContact CD1-CB 4.32Å; F271-I358 HydrophobicContact CD1-CG2 3.63Å; F271-I358 HydrophobicContact CE1-CG2 4.31Å; F271-I358 HydrophobicContact CG-CD1 4.34Å; F271-I358 HydrophobicContact CG-CG2 4.26Å; C272-I358 VanDerWaalsContact SG-CG2 3.58Å; K354-I358 VanDerWaalsContact O-CD1 3.27Å; K354-I358 WeakPolarHBondContact O-CD1 3.31Å; K354-I358 WeakPolarHBondContact O-CG1 3.39Å; I355-I358 HydrophobicContact CD1-CD1 4.28Å; I355-I358 WeakPolarHBondContact O-CB 3.47Å; I355-I358 PolarHBondContact O-N 3.13Å; Q356-I358 PolarHBondContact O-N 2.93Å; Q356-I358 VanDerWaalsContact O-N 3.16Å; I358-D360 VanDerWaalsContact C-N 3.35Å; I358-K361 PolarHBondContact O-N 3.33Å; I358-V362 WeakPolarHBondContact O-CG2 3.42Å; I358-V362 PolarHBondContact O-N 2.81Å
359	L	95.2	Very high	93.3	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-42.2	176.1	-69.5	173.9	0	0	0	111.9	F271 L275 I303 I355 Q356 K361 V362 G363 S364 A368	F271-L359 HydrophobicContact CE1-CD2 3.71Å; F271-L359 HydrophobicContact CE1-CG 4.1Å; F271-L359 HydrophobicContact CZ-CD2 4.14Å; F271-L359 HydrophobicContact CZ-CG 4.33Å; L275-L359 HydrophobicContact CD2-CD2 4.16Å; I303-L359 HydrophobicContact CD1-CD1 4.33Å; I303-L359 HydrophobicContact CD1-CD2 3.86Å; I355-L359 PolarHBondContact O-N 3.27Å; Q356-L359 WeakPolarHBondContact O-CB 3.48Å; Q356-L359 PolarHBondContact O-N 3.04Å; L359-K361 PolarHBondContact O-N 3.26Å; L359-V362 PolarHBondContact O-N 2.82Å; L359-G363 PolarHBondContact O-N 3.04Å; L359-G363 VanDerWaalsContact O-N 3.11Å; L359-S364 PolarHBondContact O-N 3.37Å; L359-A368 HydrophobicContact CD1-CB 3.8Å
360	D	94.3	Very high	93.3	Very high	96 Å²	96	53.5 Å²	53.5	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-41.6	179.3	-60.7	-18	0	0	0	111.2	Q356 I358 V362 G363	Q356-D360 PolarHBondContact NE2-OD1 3.04Å; Q356-D360 PolarHBondContact O-N 2.95Å; I358-D360 VanDerWaalsContact C-N 3.35Å; D360-V362 VanDerWaalsContact C-N 3.29Å; D360-V362 PolarHBondContact O-N 3.12Å; D360-G363 PolarHBondContact O-N 2.68Å
361	K	92.3	Very high	93.3	Very high	139 Å²	139	53.2 Å²	53.2	60%	0.604	29%	0.286	S	S	*	.	H	α-helix	trans	-61.3	-36	175.5	-78.1	170.6	178.2	-179.7	0	112.9	E268 P357 I358 L359	E268-K361 VanDerWaalsContact OE1-CD 3.29Å; E268-K361 WeakPolarHBondContact OE1-CD 3.4Å; E268-K361 IonicContact OE1-NZ 3.63Å; E268-K361 PolarHBondContact OE1-NZ 2.88Å; E268-K361 IonicContact OE2-NZ 3.42Å; E268-K361 PolarHBondContact OE2-NZ 3.23Å; P357-K361 WeakPolarHBondContact O-CB 3.47Å; P357-K361 VanDerWaalsContact O-CG 3.22Å; P357-K361 WeakPolarHBondContact O-CG 3.42Å; P357-K361 PolarHBondContact O-N 3.39Å; P357-K361 VanDerWaalsContact O-N 3.1Å; I358-K361 PolarHBondContact O-N 3.33Å; L359-K361 PolarHBondContact O-N 3.26Å
362	V	89	Confident	93.3	Very high	79 Å²	79	53.2 Å²	53.2	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-81.7	-6.5	178	-177.5	0	0	0	0	111.5	L275 I358 L359 D360	L275-V362 HydrophobicContact CD2-CB 4.34Å; L275-V362 HydrophobicContact CD2-CG1 3.92Å; L275-V362 HydrophobicContact CD2-CG2 4.49Å; I358-V362 WeakPolarHBondContact O-CG2 3.42Å; I358-V362 PolarHBondContact O-N 2.81Å; L359-V362 PolarHBondContact O-N 2.82Å; D360-V362 VanDerWaalsContact C-N 3.29Å; D360-V362 PolarHBondContact O-N 3.12Å
363	G	88.1	Confident	93.4	Very high	59 Å²	59	50.7 Å²	50.7	61%	0.608	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	22.1	-179.6	0	0	0	0	0	113.7	L359 D360	L359-G363 PolarHBondContact O-N 3.04Å; L359-G363 VanDerWaalsContact O-N 3.11Å; D360-G363 PolarHBondContact O-N 2.68Å
364	S	87.5	Confident	93.4	Very high	31 Å²	31	46.7 Å²	46.7	22%	0.217	25%	0.254	C	S	.	.			trans	-75.9	134.7	176.4	-176.4	0	0	0	0	110.8	L359 V366	L359-S364 PolarHBondContact O-N 3.37Å; S364-V366 PolarHBondContact O-N 3.28Å; S364-V366 WeakPolarHBondContact OG-CB 3.35Å; S364-V366 WeakPolarHBondContact OG-CG2 3.47Å; S364-V366 PolarHBondContact OG-N 3.1Å
365	L	89.4	Confident	93.5	Very high	183 Å²	183	43.6 Å²	43.6	96%	0.958	24%	0.242	S	C	*	.			trans	-81.3	2	175.2	-60.7	175.6	0	0	0	112.8
366	V	90.9	Very high	93.5	Very high	41 Å²	41	43.6 Å²	43.6	25%	0.248	24%	0.242	C	C	.	.			trans	-80	136.8	-174.5	178.7	0	0	0	0	110.5	I303 Q356 S364 E371	I303-V366 HydrophobicContact CD1-CG1 4.48Å; I303-V366 HydrophobicContact CG2-CG1 4.45Å; Q356-V366 PolarHBondContact NE2-O 3.11Å; Q356-V366 VanDerWaalsContact NE2-O 3.13Å; S364-V366 PolarHBondContact O-N 3.28Å; S364-V366 WeakPolarHBondContact OG-CB 3.35Å; S364-V366 WeakPolarHBondContact OG-CG2 3.47Å; S364-V366 PolarHBondContact OG-N 3.1Å; V366-E371 HydrophobicContact CG1-CB 4.49Å; V366-E371 HydrophobicContact CG1-CG 3.15Å
367	N	93.8	Very high	93.4	Very high	56 Å²	56	42.4 Å²	42.4	30%	0.299	24%	0.237	S	C	.	.			trans	-94.8	114.9	173.1	-177	-70.5	0	0	0	110.5	R369 L370 E371	N367-R369 VanDerWaalsContact C-N 3.32Å; N367-R369 PolarHBondContact O-N 3.19Å; N367-R369 WeakPolarHBondContact OD1-CB 3.46Å; N367-R369 PolarHBondContact OD1-N 3.22Å; N367-R369 VanDerWaalsContact OD1-N 3.11Å; N367-L370 HydrophobicContact CB-CB 4.08Å; N367-L370 HydrophobicContact CB-CD1 3.96Å; N367-L370 HydrophobicContact CB-CG 4.05Å; N367-L370 PolarHBondContact O-N 3.46Å; N367-L370 WeakPolarHBondContact OD1-CG 3.48Å; N367-L370 PolarHBondContact OD1-N 2.76Å; N367-E371 WeakPolarHBondContact O-CG 3.44Å; N367-E371 PolarHBondContact O-N 3.5Å
368	A	95.5	Very high	93.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-41.8	-175.7	0	0	0	0	0	113	I306 L351 I355 L359 F372	I306-A368 HydrophobicContact CD1-CB 4.12Å; L351-A368 HydrophobicContact CB-CB 4.5Å; L351-A368 HydrophobicContact CD2-CB 4.47Å; I355-A368 HydrophobicContact CB-CB 4.23Å; I355-A368 HydrophobicContact CG2-CB 3.77Å; L359-A368 HydrophobicContact CD1-CB 3.8Å; A368-F372 WeakPolarHBondContact O-CB 3.39Å; A368-F372 PolarHBondContact O-N 2.9Å
369	R	95.3	Very high	93.3	Very high	71 Å²	71	42.5 Å²	42.5	27%	0.268	23%	0.233	S	C	.	.	H	α-helix	trans	-64.2	-43.3	179	-176	-175.6	72.7	-168.4	6.1	111.6	T348 D352 N367 S373	T348-R369 HydrophobicContact CG2-CG 4.48Å; D352-R369 IonicContact OD2-NH1 2.67Å; D352-R369 PolarHBondContact OD2-NH1 2.7Å; N367-R369 VanDerWaalsContact C-N 3.32Å; N367-R369 PolarHBondContact O-N 3.19Å; N367-R369 WeakPolarHBondContact OD1-CB 3.46Å; N367-R369 PolarHBondContact OD1-N 3.22Å; N367-R369 VanDerWaalsContact OD1-N 3.11Å; R369-S373 WeakPolarHBondContact O-CB 3.34Å; R369-S373 PolarHBondContact O-N 3.07Å; R369-S373 PolarHBondContact O-OG 3.43Å
370	L	93.9	Very high	93.4	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.173	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-44.1	178.3	-67.3	-177.8	0	0	0	111.6	N367 F372 S373 R374 P419 F422	N367-L370 HydrophobicContact CB-CB 4.08Å; N367-L370 HydrophobicContact CB-CD1 3.96Å; N367-L370 HydrophobicContact CB-CG 4.05Å; N367-L370 PolarHBondContact O-N 3.46Å; N367-L370 WeakPolarHBondContact OD1-CG 3.48Å; N367-L370 PolarHBondContact OD1-N 2.76Å; L370-F372 VanDerWaalsContact C-N 3.33Å; L370-F372 PolarHBondContact O-N 3.35Å; L370-S373 PolarHBondContact O-N 3.37Å; L370-R374 WeakPolarHBondContact O-CB 3.3Å; L370-R374 VanDerWaalsContact O-CG 3.27Å; L370-R374 WeakPolarHBondContact O-CG 3.49Å; L370-R374 PolarHBondContact O-N 3.39Å; L370-P419 HydrophobicContact CD1-CG 4.14Å; L370-P419 HydrophobicContact CD2-CG 4.35Å; L370-F422 HydrophobicContact CB-CE2 4.44Å; L370-F422 HydrophobicContact CD1-CE2 4.4Å
371	E	94.1	Very high	93.5	Very high	14 Å²	14	37.9 Å²	37.9	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-46.1	175.2	-75.8	-66.3	103.2	0	0	112.5	V302 I303 I306 V366 N367 S373 R374 G375	V302-E371 WeakPolarHBondContact CA-OE2 3.27Å; V302-E371 HydrophobicContact CG1-CB 4.33Å; I303-E371 PolarHBondContact N-OE2 3.42Å; I303-E371 VanDerWaalsContact N-OE2 3.08Å; I306-E371 HydrophobicContact CD1-CB 3.62Å; I306-E371 HydrophobicContact CD1-CG 4.29Å; I306-E371 HydrophobicContact CG2-CB 4.3Å; V366-E371 HydrophobicContact CG1-CB 4.49Å; V366-E371 HydrophobicContact CG1-CG 3.15Å; N367-E371 WeakPolarHBondContact O-CG 3.44Å; N367-E371 PolarHBondContact O-N 3.5Å; E371-S373 VanDerWaalsContact C-N 3.35Å; E371-R374 PolarHBondContact O-N 3.15Å; E371-R374 IonicContact OE1-CZ 3.3Å; E371-R374 IonicContact OE1-NH1 2.93Å; E371-R374 PolarHBondContact OE1-NH1 2.89Å; E371-G375 PolarHBondContact O-N 2.92Å
372	F	96.4	Very high	93.6	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-44.4	176.5	-175.7	-102.5	0	0	0	111.5	W241 I306 L310 L313 H347 L351 A368 L370 G375 L376	W241-F372 HydrophobicContact CH2-CD2 4.44Å; W241-F372 AromaticContact CH2-CE2 3.89Å; W241-F372 HydrophobicContact CH2-CE2 3.89Å; W241-F372 HydrophobicContact CH2-CZ 4.1Å; W241-F372 HydrophobicContact CZ2-CD2 4.34Å; W241-F372 AromaticContact CZ2-CE2 3.55Å; W241-F372 HydrophobicContact CZ2-CE2 3.55Å; W241-F372 AromaticContact CZ2-CZ 3.96Å; W241-F372 HydrophobicContact CZ2-CZ 3.96Å; I306-F372 HydrophobicContact CG2-CB 4.13Å; I306-F372 HydrophobicContact CG2-CD2 4.24Å; L310-F372 HydrophobicContact CD2-CD2 3.5Å; L310-F372 VanDerWaalsContact CD2-CD2 3.5Å; L310-F372 HydrophobicContact CD2-CE2 3.43Å; L310-F372 VanDerWaalsContact CD2-CE2 3.43Å; L310-F372 HydrophobicContact CD2-CG 4.23Å; L310-F372 HydrophobicContact CD2-CZ 4.18Å; L310-F372 HydrophobicContact CG-CD2 3.84Å; L310-F372 HydrophobicContact CG-CE2 3.97Å; L313-F372 HydrophobicContact CD1-CE1 4.47Å; L313-F372 HydrophobicContact CD1-CE2 4.06Å; L313-F372 HydrophobicContact CD1-CZ 3.47Å; L313-F372 VanDerWaalsContact CD1-CZ 3.47Å; H347-F372 HydrophobicContact CB-CD1 4.38Å; H347-F372 HydrophobicContact CB-CE1 3.71Å; H347-F372 HydrophobicContact CB-CZ 4.06Å; H347-F372 AromaticContact CG-CE1 3.84Å; H347-F372 AromaticContact CG-CZ 3.79Å; H347-F372 AromaticContact ND1-CE1 3.91Å; H347-F372 AromaticContact ND1-CZ 3.9Å; L351-F372 HydrophobicContact CD1-CB 3.61Å; L351-F372 HydrophobicContact CD1-CD1 3.58Å; L351-F372 HydrophobicContact CD1-CD2 4.36Å; L351-F372 HydrophobicContact CD1-CE1 4.29Å; L351-F372 HydrophobicContact CD1-CG 3.59Å; L351-F372 HydrophobicContact CD2-CB 4.48Å; A368-F372 WeakPolarHBondContact O-CB 3.39Å; A368-F372 PolarHBondContact O-N 2.9Å; L370-F372 VanDerWaalsContact C-N 3.33Å; L370-F372 PolarHBondContact O-N 3.35Å; F372-G375 PolarHBondContact O-N 3.43Å; F372-L376 HydrophobicContact CD1-CD1 4.03Å; F372-L376 HydrophobicContact CE1-CD1 3.51Å; F372-L376 HydrophobicContact CE1-CG 4.3Å; F372-L376 HydrophobicContact CZ-CD1 3.98Å; F372-L376 HydrophobicContact CZ-CG 4.48Å; F372-L376 PolarHBondContact O-N 3.08Å; F372-L376 VanDerWaalsContact O-N 3.08Å
373	S	96.2	Very high	93.9	Very high	4 Å²	4	30.2 Å²	30.2	3%	0.028	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-42.5	177.3	-56.1	0	0	0	0	111.9	R369 L370 E371 G375 L376 M377	R369-S373 WeakPolarHBondContact O-CB 3.34Å; R369-S373 PolarHBondContact O-N 3.07Å; R369-S373 PolarHBondContact O-OG 3.43Å; L370-S373 PolarHBondContact O-N 3.37Å; E371-S373 VanDerWaalsContact C-N 3.35Å; S373-G375 VanDerWaalsContact C-N 3.32Å; S373-G375 PolarHBondContact O-N 3.07Å; S373-L376 PolarHBondContact O-N 3.13Å; S373-M377 VanDerWaalsContact O-CB 3.31Å; S373-M377 WeakPolarHBondContact O-CB 3.45Å; S373-M377 PolarHBondContact O-N 2.87Å
374	R	93.8	Very high	94.3	Very high	20 Å²	20	27.4 Å²	27.4	8%	0.075	14%	0.141	C	C	.	.	H	α-helix	trans	-58.2	-43.8	174.7	-73.4	173.7	68.5	-144.9	-7.4	111.3	S299 P300 L370 E371 M377 M378 Y418 F422	S299-R374 PolarHBondContact OG-NH2 3.33Å; P300-R374 PolarHBondContact O-NH1 2.95Å; P300-R374 PolarHBondContact O-NH2 2.87Å; L370-R374 WeakPolarHBondContact O-CB 3.3Å; L370-R374 VanDerWaalsContact O-CG 3.27Å; L370-R374 WeakPolarHBondContact O-CG 3.49Å; L370-R374 PolarHBondContact O-N 3.39Å; E371-R374 PolarHBondContact O-N 3.15Å; E371-R374 IonicContact OE1-CZ 3.3Å; E371-R374 IonicContact OE1-NH1 2.93Å; E371-R374 PolarHBondContact OE1-NH1 2.89Å; R374-M377 WeakPolarHBondContact O-CB 3.26Å; R374-M377 PolarHBondContact O-N 2.63Å; R374-M378 WeakPolarHBondContact O-CG 3.29Å; R374-M378 PolarHBondContact O-N 3.45Å; R374-Y418 HydrophobicContact CG-CE2 3.88Å; R374-F422 HydrophobicContact CG-CD2 3.89Å; R374-F422 HydrophobicContact CG-CE2 4.14Å; R374-F422 HydrophobicContact CG-CG 4.47Å
375	G	94.2	Very high	94.7	Very high	7 Å²	7	26.6 Å²	26.6	7%	0.072	14%	0.136	C	C	.	.	H	α-helix	trans	-64.9	-37.7	178	0	0	0	0	0	114	E371 F372 S373	E371-G375 PolarHBondContact O-N 2.92Å; F372-G375 PolarHBondContact O-N 3.43Å; S373-G375 VanDerWaalsContact C-N 3.32Å; S373-G375 PolarHBondContact O-N 3.07Å
376	L	96.1	Very high	94.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-72.1	-37.1	172.7	-68.2	-179.9	0	0	0	112.2	L310 L313 V340 W343 I344 F372 S373 M378 L379	L310-L376 HydrophobicContact CD2-CD2 3.7Å; L310-L376 HydrophobicContact CD2-CG 3.73Å; L313-L376 HydrophobicContact CB-CD2 4.14Å; L313-L376 HydrophobicContact CD1-CD2 4.03Å; V340-L376 HydrophobicContact CG1-CB 3.99Å; W343-L376 HydrophobicContact CB-CD1 3.76Å; W343-L376 HydrophobicContact CE3-CD2 3.99Å; I344-L376 HydrophobicContact CG1-CD1 3.71Å; F372-L376 HydrophobicContact CD1-CD1 4.03Å; F372-L376 HydrophobicContact CE1-CD1 3.51Å; F372-L376 HydrophobicContact CE1-CG 4.3Å; F372-L376 HydrophobicContact CZ-CD1 3.98Å; F372-L376 HydrophobicContact CZ-CG 4.48Å; F372-L376 PolarHBondContact O-N 3.08Å; F372-L376 VanDerWaalsContact O-N 3.08Å; S373-L376 PolarHBondContact O-N 3.13Å; L376-M378 VanDerWaalsContact C-N 3.28Å; L376-M378 PolarHBondContact O-N 2.79Å; L376-L379 HydrophobicContact CD2-CD1 4.09Å; L376-L379 VanDerWaalsContact O-CB 3.29Å; L376-L379 WeakPolarHBondContact O-CB 3.32Å; L376-L379 PolarHBondContact O-N 3.24Å; L376-L379 VanDerWaalsContact O-N 3.08Å
377	M	95.3	Very high	95.1	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-59.9	-40.2	176.9	-170.6	61.9	-159.9	0	0	111.4	S373 R374 L379 V380 L381 F408 L412 C425	S373-M377 VanDerWaalsContact O-CB 3.31Å; S373-M377 WeakPolarHBondContact O-CB 3.45Å; S373-M377 PolarHBondContact O-N 2.87Å; R374-M377 WeakPolarHBondContact O-CB 3.26Å; R374-M377 PolarHBondContact O-N 2.63Å; M377-L379 PolarHBondContact O-N 2.76Å; M377-V380 HydrophobicContact CE-CG1 4.39Å; M377-V380 WeakPolarHBondContact O-CA 3.39Å; M377-V380 WeakPolarHBondContact O-CB 3.41Å; M377-V380 PolarHBondContact O-N 3.06Å; M377-V380 HydrophobicContact SD-CB 4.44Å; M377-L381 HydrophobicContact CE-CD2 3.56Å; M377-L381 HydrophobicContact CE-CG 4.08Å; M377-L381 HydrophobicContact CG-CD1 4.47Å; M377-L381 HydrophobicContact CG-CG 4.36Å; M377-L381 WeakPolarHBondContact O-CG 3.28Å; M377-L381 PolarHBondContact O-N 3.49Å; M377-F408 HydrophobicContact CE-CE1 3.84Å; M377-F408 HydrophobicContact CE-CZ 4.5Å; M377-F408 HydrophobicContact SD-CE1 3.65Å; M377-F408 HydrophobicContact SD-CZ 3.78Å; M377-L412 HydrophobicContact SD-CD2 3.74Å; M377-C425 HydrophobicContact CE-CB 4.25Å; M377-C425 WeakPolarHBondContact CE-SG 3.44Å
378	M	93.6	Very high	95.2	Very high	54 Å²	54	17.7 Å²	17.7	27%	0.266	9%	0.091	S	C	.	.	H	α-helix	trans	-56.6	-33.5	175.2	-74.4	-56.5	-56.8	0	0	113.4	L290 R374 L376 V380 L381 E382	L290-M378 HydrophobicContact CD1-CE 3.89Å; L290-M378 HydrophobicContact CG-CE 4.26Å; R374-M378 WeakPolarHBondContact O-CG 3.29Å; R374-M378 PolarHBondContact O-N 3.45Å; L376-M378 VanDerWaalsContact C-N 3.28Å; L376-M378 PolarHBondContact O-N 2.79Å; M378-V380 VanDerWaalsContact C-N 3.32Å; M378-V380 PolarHBondContact O-N 3.08Å; M378-L381 PolarHBondContact O-N 3.01Å; M378-L381 HydrophobicContact SD-CD1 3.87Å; M378-E382 WeakPolarHBondContact O-CB 3.43Å; M378-E382 VanDerWaalsContact O-CG 3.28Å; M378-E382 WeakPolarHBondContact O-CG 3.21Å; M378-E382 PolarHBondContact O-N 3.46Å
379	L	95.4	Very high	95.2	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.016	11%	0.109	C	C	.	.	H	α-helix	trans	-64	-39.5	175.2	-61.5	174.2	0	0	0	111.8	Q314 F317 L376 M377 K383	Q314-L379 HydrophobicContact CB-CD2 4.23Å; Q314-L379 HydrophobicContact CG-CD1 4.11Å; Q314-L379 HydrophobicContact CG-CD2 3.92Å; Q314-L379 HydrophobicContact CG-CG 4.39Å; F317-L379 HydrophobicContact CB-CD1 3.86Å; F317-L379 HydrophobicContact CD1-CB 3.98Å; F317-L379 HydrophobicContact CD1-CD1 4.41Å; F317-L379 HydrophobicContact CD1-CD2 4.37Å; F317-L379 HydrophobicContact CD1-CG 4.49Å; F317-L379 HydrophobicContact CD2-CB 4.26Å; F317-L379 HydrophobicContact CD2-CD1 4.24Å; F317-L379 HydrophobicContact CE1-CB 3.97Å; F317-L379 HydrophobicContact CE2-CB 4.24Å; F317-L379 HydrophobicContact CG-CB 4.13Å; F317-L379 HydrophobicContact CG-CD1 3.93Å; F317-L379 HydrophobicContact CG-CG 4.47Å; F317-L379 HydrophobicContact CZ-CB 4.1Å; L376-L379 HydrophobicContact CD2-CD1 4.09Å; L376-L379 VanDerWaalsContact O-CB 3.29Å; L376-L379 WeakPolarHBondContact O-CB 3.32Å; L376-L379 PolarHBondContact O-N 3.24Å; L376-L379 VanDerWaalsContact O-N 3.08Å; M377-L379 PolarHBondContact O-N 2.76Å; L379-K383 VanDerWaalsContact O-CB 3.29Å; L379-K383 WeakPolarHBondContact O-CB 3.45Å; L379-K383 PolarHBondContact O-N 3.12Å
380	V	97.1	Very high	95.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.9	-47.2	176.6	177.5	0	0	0	0	110.2	Y336 L337 V340 M377 M378 E382 K383 L384 F408 C425	Y336-V380 HydrophobicContact CE2-CG1 4.19Å; L337-V380 HydrophobicContact CD2-CG1 3.6Å; V340-V380 HydrophobicContact CB-CG2 4.05Å; V340-V380 HydrophobicContact CG1-CG2 3.95Å; V340-V380 HydrophobicContact CG2-CG2 3.77Å; M377-V380 HydrophobicContact CE-CG1 4.39Å; M377-V380 WeakPolarHBondContact O-CA 3.39Å; M377-V380 WeakPolarHBondContact O-CB 3.41Å; M377-V380 PolarHBondContact O-N 3.06Å; M377-V380 HydrophobicContact SD-CB 4.44Å; M378-V380 VanDerWaalsContact C-N 3.32Å; M378-V380 PolarHBondContact O-N 3.08Å; V380-E382 PolarHBondContact O-N 3.46Å; V380-K383 WeakPolarHBondContact O-CA 3.24Å; V380-K383 WeakPolarHBondContact O-CB 3.49Å; V380-K383 PolarHBondContact O-N 3.18Å; V380-L384 HydrophobicContact CG1-CD1 3.87Å; V380-L384 HydrophobicContact CG1-CG 4.33Å; V380-L384 WeakPolarHBondContact O-CG 3.22Å; V380-L384 PolarHBondContact O-N 3.39Å; V380-F408 HydrophobicContact CG1-CE1 4.4Å; V380-F408 HydrophobicContact CG1-CZ 4.47Å; V380-F408 HydrophobicContact CG2-CZ 4.17Å; V380-C425 VanDerWaalsContact CG1-SG 3.6Å
381	L	95.9	Very high	95.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.8	-46.6	179.3	-59.8	-178.2	0	0	0	111.7	L290 M377 M378 K383 L384 A385 A423 S424 I428	L290-L381 HydrophobicContact CD1-CB 3.6Å; L290-L381 HydrophobicContact CD1-CD1 4.32Å; M377-L381 HydrophobicContact CE-CD2 3.56Å; M377-L381 HydrophobicContact CE-CG 4.08Å; M377-L381 HydrophobicContact CG-CD1 4.47Å; M377-L381 HydrophobicContact CG-CG 4.36Å; M377-L381 WeakPolarHBondContact O-CG 3.28Å; M377-L381 PolarHBondContact O-N 3.49Å; M378-L381 PolarHBondContact O-N 3.01Å; M378-L381 HydrophobicContact SD-CD1 3.87Å; L381-K383 PolarHBondContact O-N 2.94Å; L381-L384 PolarHBondContact O-N 2.95Å; L381-A385 VanDerWaalsContact O-CB 3.28Å; L381-A385 WeakPolarHBondContact O-CB 3.43Å; L381-A385 PolarHBondContact O-N 2.74Å; L381-A423 HydrophobicContact CD1-CB 3.83Å; L381-S424 VanDerWaalsContact CD2-C 3.42Å; L381-S424 WeakPolarHBondContact CD2-O 3.48Å; L381-I428 HydrophobicContact CB-CD1 4.27Å; L381-I428 HydrophobicContact CB-CG1 4.37Å; L381-I428 HydrophobicContact CD2-CD1 4.25Å; L381-I428 HydrophobicContact CD2-CG1 3.73Å
382	E	94.6	Very high	95.2	Very high	52 Å²	52	20.5 Å²	20.5	24%	0.243	12%	0.121	C	C	.	.	H	α-helix	trans	-59.2	-36.2	173.4	-72.4	176.4	179.9	0	0	111.7	L290 R322 M378 V380 T386	L290-E382 HydrophobicContact CD2-CG 4.39Å; R322-E382 VanDerWaalsContact NH2-CB 3.34Å; R322-E382 PolarHBondContact NH2-O 3.42Å; M378-E382 WeakPolarHBondContact O-CB 3.43Å; M378-E382 VanDerWaalsContact O-CG 3.28Å; M378-E382 WeakPolarHBondContact O-CG 3.21Å; M378-E382 PolarHBondContact O-N 3.46Å; V380-E382 PolarHBondContact O-N 3.46Å; E382-T386 PolarHBondContact O-N 2.99Å; E382-T386 PolarHBondContact O-OG1 3.19Å
383	K	95.8	Very high	95.1	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-71	-50	-178.3	-177.9	54.8	171.8	149.1	0	111	F317 F321 N328 Y336 L379 V380 L381 A385 T386 D387	F317-K383 HydrophobicContact CE1-CB 4.13Å; F317-K383 HydrophobicContact CE1-CG 4.49Å; F317-K383 HydrophobicContact CZ-CB 3.98Å; F317-K383 HydrophobicContact CZ-CG 4.22Å; F321-K383 WeakPolarHBondContact O-CE 2.78Å; F321-K383 PolarHBondContact O-NZ 3.47Å; N328-K383 PolarHBondContact OD1-NZ 2.93Å; Y336-K383 HydrophobicContact CD1-CG 4.14Å; Y336-K383 HydrophobicContact CD2-CG 4.25Å; Y336-K383 HydrophobicContact CE1-CG 3.93Å; Y336-K383 HydrophobicContact CE2-CB 4.49Å; Y336-K383 HydrophobicContact CE2-CG 4.08Å; Y336-K383 HydrophobicContact CG-CG 4.31Å; L379-K383 VanDerWaalsContact O-CB 3.29Å; L379-K383 WeakPolarHBondContact O-CB 3.45Å; L379-K383 PolarHBondContact O-N 3.12Å; V380-K383 WeakPolarHBondContact O-CA 3.24Å; V380-K383 WeakPolarHBondContact O-CB 3.49Å; V380-K383 PolarHBondContact O-N 3.18Å; L381-K383 PolarHBondContact O-N 2.94Å; K383-A385 VanDerWaalsContact C-N 3.35Å; K383-A385 PolarHBondContact O-N 3.4Å; K383-T386 WeakPolarHBondContact O-CB 3.22Å; K383-T386 PolarHBondContact O-N 2.97Å; K383-D387 WeakPolarHBondContact CD-OD2 3.46Å; K383-D387 WeakPolarHBondContact CE-OD2 3.27Å; K383-D387 IonicContact NZ-OD1 3.74Å; K383-D387 PolarHBondContact NZ-OD1 3.01Å; K383-D387 IonicContact NZ-OD2 2.67Å; K383-D387 PolarHBondContact NZ-OD2 2.99Å; K383-D387 PolarHBondContact O-N 3.02Å
384	L	96.6	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.2	-45	175.3	-72.1	171.7	0	0	0	112.3	Y336 V380 L381 T386 D387 I388 L401 V405 C425 I428	Y336-L384 WeakPolarHBondContact OH-CD2 3.27Å; V380-L384 HydrophobicContact CG1-CD1 3.87Å; V380-L384 HydrophobicContact CG1-CG 4.33Å; V380-L384 WeakPolarHBondContact O-CG 3.22Å; V380-L384 PolarHBondContact O-N 3.39Å; L381-L384 PolarHBondContact O-N 2.95Å; L384-T386 PolarHBondContact O-N 3.14Å; L384-T386 VanDerWaalsContact O-N 3.12Å; L384-D387 PolarHBondContact O-N 3.38Å; L384-D387 VanDerWaalsContact O-N 3.14Å; L384-I388 HydrophobicContact CB-CD1 4.07Å; L384-I388 HydrophobicContact CD2-CD1 4.45Å; L384-I388 WeakPolarHBondContact O-CB 3.39Å; L384-I388 WeakPolarHBondContact O-CG1 3.42Å; L384-I388 PolarHBondContact O-N 3.05Å; L384-L401 HydrophobicContact CD2-CD1 3.77Å; L384-L401 HydrophobicContact CD2-CD2 4.25Å; L384-L401 HydrophobicContact CD2-CG 4.32Å; L384-V405 HydrophobicContact CD1-CG2 4.09Å; L384-V405 HydrophobicContact CD2-CG2 3.75Å; L384-C425 HydrophobicContact CD1-CB 3.77Å; L384-C425 WeakPolarHBondContact CD1-SG 3.44Å; L384-I428 HydrophobicContact CB-CG2 4.04Å
385	A	95.3	Very high	95.1	Very high	15 Å²	15	33.8 Å²	33.8	12%	0.124	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-26	177.5	0	0	0	0	0	113.2	L290 Y294 L381 K383 P389	L290-A385 HydrophobicContact CD2-CB 3.92Å; Y294-A385 HydrophobicContact CE2-CB 3.75Å; L381-A385 VanDerWaalsContact O-CB 3.28Å; L381-A385 WeakPolarHBondContact O-CB 3.43Å; L381-A385 PolarHBondContact O-N 2.74Å; K383-A385 VanDerWaalsContact C-N 3.35Å; K383-A385 PolarHBondContact O-N 3.4Å; A385-P389 WeakPolarHBondContact O-CD 3.39Å
386	T	93.9	Very high	95.1	Very high	76 Å²	76	38.9 Å²	38.9	47%	0.466	21%	0.205	S	C	.	.	H	α-helix	trans	-85.5	-41.1	175.2	-47.4	0	0	0	0	112.3	R322 E382 K383 L384	R322-T386 PolarHBondContact NH1-OG1 3.46Å; E382-T386 PolarHBondContact O-N 2.99Å; E382-T386 PolarHBondContact O-OG1 3.19Å; K383-T386 WeakPolarHBondContact O-CB 3.22Å; K383-T386 PolarHBondContact O-N 2.97Å; L384-T386 PolarHBondContact O-N 3.14Å; L384-T386 VanDerWaalsContact O-N 3.12Å
387	D	95.2	Very high	95.1	Very high	11 Å²	11	41.5 Å²	41.5	6%	0.059	22%	0.218	C	C	.	.	H	α-helix	trans	-82.4	-38.8	-169.4	-70.9	-0.1	0	0	0	112.8	L330 K383 L384 C390 L391	L330-D387 HydrophobicContact CD2-CB 3.73Å; L330-D387 VanDerWaalsContact CD2-CG 3.46Å; K383-D387 WeakPolarHBondContact CD-OD2 3.46Å; K383-D387 WeakPolarHBondContact CE-OD2 3.27Å; K383-D387 IonicContact NZ-OD1 3.74Å; K383-D387 PolarHBondContact NZ-OD1 3.01Å; K383-D387 IonicContact NZ-OD2 2.67Å; K383-D387 PolarHBondContact NZ-OD2 2.99Å; K383-D387 PolarHBondContact O-N 3.02Å; L384-D387 PolarHBondContact O-N 3.38Å; L384-D387 VanDerWaalsContact O-N 3.14Å; D387-C390 WeakPolarHBondContact O-CB 3.12Å; D387-C390 PolarHBondContact O-N 3.39Å; D387-L391 PolarHBondContact O-N 3.31Å
388	I	95.9	Very high	95.2	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-53.7	-48.1	-176.9	-76.5	166	0	0	0	112.5	L384 C390 L391 L392 L401 I428 L429 C434	L384-I388 HydrophobicContact CB-CD1 4.07Å; L384-I388 HydrophobicContact CD2-CD1 4.45Å; L384-I388 WeakPolarHBondContact O-CB 3.39Å; L384-I388 WeakPolarHBondContact O-CG1 3.42Å; L384-I388 PolarHBondContact O-N 3.05Å; I388-C390 PolarHBondContact O-N 3.22Å; I388-C390 VanDerWaalsContact O-N 3.12Å; I388-L391 PolarHBondContact O-N 3.06Å; I388-L392 HydrophobicContact CG2-CD2 3.95Å; I388-L392 WeakPolarHBondContact O-CG 3.44Å; I388-L392 PolarHBondContact O-N 2.82Å; I388-L401 HydrophobicContact CD1-CD2 4.4Å; I388-L401 HydrophobicContact CG1-CD2 3.55Å; I388-I428 HydrophobicContact CD1-CG2 3.62Å; I388-L429 HydrophobicContact CD1-CD2 4.01Å; I388-C434 HydrophobicContact CG2-CB 3.86Å; I388-C434 VanDerWaalsContact CG2-SG 3.54Å
389	P	95.1	Very high	95.3	Very high	58 Å²	58	39.8 Å²	39.8	38%	0.377	21%	0.212	S	C	.	.	H	α-helix	trans	-55.1	-31.8	178.4	-27.9	36	0	0	0	114.2	A385 L391	A385-P389 WeakPolarHBondContact O-CD 3.39Å; P389-L391 VanDerWaalsContact C-N 3.32Å
390	C	94.5	Very high	95.3	Very high	88 Å²	88	42.3 Å²	42.3	60%	0.595	22%	0.223	S	C	*	.	H	α-helix	trans	-77.7	-18.3	178.2	-60.3	0	0	0	0	113.2	L330 D387 I388	L330-C390 HydrophobicContact CD1-CB 4.06Å; D387-C390 WeakPolarHBondContact O-CB 3.12Å; D387-C390 PolarHBondContact O-N 3.39Å; I388-C390 PolarHBondContact O-N 3.22Å; I388-C390 VanDerWaalsContact O-N 3.12Å
391	L	95.3	Very high	95.4	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-100.3	-11.1	-174.4	-67.2	173.6	0	0	0	113	L330 D387 I388 P389 Y393 D394 L397 L401	L330-L391 HydrophobicContact CB-CD2 4.08Å; D387-L391 PolarHBondContact O-N 3.31Å; I388-L391 PolarHBondContact O-N 3.06Å; P389-L391 VanDerWaalsContact C-N 3.32Å; L391-Y393 PolarHBondContact O-N 3.47Å; L391-D394 PolarHBondContact O-N 3.01Å; L391-D394 VanDerWaalsContact O-N 3.12Å; L391-L397 HydrophobicContact CD2-CB 3.8Å; L391-L397 HydrophobicContact CD2-CD1 4.02Å; L391-L401 HydrophobicContact CD1-CB 4.37Å; L391-L401 HydrophobicContact CD1-CD2 3.74Å; L391-L401 HydrophobicContact CD1-CG 4.48Å
392	L	93.8	Very high	95.4	Very high	28 Å²	28	42.4 Å²	42.4	15%	0.147	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-22.5	-176.6	-63.9	-178.3	0	0	0	113.5	I388 F398 R437	I388-L392 HydrophobicContact CG2-CD2 3.95Å; I388-L392 WeakPolarHBondContact O-CG 3.44Å; I388-L392 PolarHBondContact O-N 2.82Å; L392-F398 HydrophobicContact CD2-CD2 4.35Å; L392-F398 HydrophobicContact CD2-CE2 4.04Å; L392-R437 HydrophobicContact CD2-CB 4.07Å; L392-R437 HydrophobicContact CD2-CG 4.11Å; L392-R437 PolarHBondContact O-NE 3.3Å; L392-R437 PolarHBondContact O-NH2 3.06Å
393	Y	93	Very high	95.5	Very high	208 Å²	208	42.9 Å²	42.9	82%	0.816	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-3.6	-177.1	-58.3	-76.5	0	0	0	114.8	L391	L391-Y393 PolarHBondContact O-N 3.47Å
394	D	95.8	Very high	95.6	Very high	68 Å²	68	44.9 Å²	44.9	36%	0.364	24%	0.237	S	C	.	.			trans	-117.6	107.3	178	-172.3	-38.2	0	0	0	110.2	L391 N396 L397 F398	L391-D394 PolarHBondContact O-N 3.01Å; L391-D394 VanDerWaalsContact O-N 3.12Å; D394-N396 VanDerWaalsContact C-N 3.3Å; D394-N396 PolarHBondContact O-N 2.85Å; D394-N396 PolarHBondContact OD1-N 3.15Å; D394-L397 HydrophobicContact CB-CB 4.1Å; D394-L397 HydrophobicContact CB-CD1 4.15Å; D394-L397 HydrophobicContact CB-CG 4.26Å; D394-L397 PolarHBondContact OD1-N 2.95Å; D394-L397 VanDerWaalsContact OD1-N 3.1Å; D394-L397 WeakPolarHBondContact OD2-CD1 3.5Å; D394-F398 WeakPolarHBondContact O-CB 3.45Å; D394-F398 PolarHBondContact O-N 3.23Å
395	D	94.6	Very high	95.7	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-41.3	-176.9	-66.8	-8.3	0	0	0	112.4	C399 R437 V441 K444 F445	D395-C399 WeakPolarHBondContact O-CB 3.41Å; D395-C399 PolarHBondContact O-N 3.42Å; D395-R437 IonicContact OD1-CZ 2.54Å; D395-R437 IonicContact OD1-NH1 3.82Å; D395-R437 PolarHBondContact OD1-NH1 3.31Å; D395-R437 IonicContact OD1-NH2 3.06Å; D395-R437 PolarHBondContact OD1-NH2 3.48Å; D395-V441 HydrophobicContact CB-CG1 4.39Å; D395-K444 IonicContact OD2-NZ 3.88Å; D395-K444 PolarHBondContact OD2-NZ 3.28Å; D395-F445 HydrophobicContact CB-CE2 4.27Å; D395-F445 HydrophobicContact CB-CZ 4.43Å
396	N	94.4	Very high	95.8	Very high	114 Å²	114	45 Å²	45	61%	0.61	24%	0.236	S	C	*	.	H	α-helix	trans	-75.2	-44.5	-173.2	-65	-50.2	0	0	0	111	D394 F398 C399 H400	D394-N396 VanDerWaalsContact C-N 3.3Å; D394-N396 PolarHBondContact O-N 2.85Å; D394-N396 PolarHBondContact OD1-N 3.15Å; N396-F398 VanDerWaalsContact C-N 3.33Å; N396-C399 PolarHBondContact O-N 2.81Å; N396-H400 WeakPolarHBondContact O-CB 3.47Å; N396-H400 PolarHBondContact O-N 3.12Å
397	L	95.8	Very high	95.9	Very high	55 Å²	55	45.8 Å²	45.8	29%	0.288	24%	0.236	S	C	.	.	H	α-helix	trans	-66.5	-38.4	177.5	-66.2	-179.7	0	0	0	111.6	S331 L391 D394 L401	S331-L397 VanDerWaalsContact CB-CD2 3.47Å; L391-L397 HydrophobicContact CD2-CB 3.8Å; L391-L397 HydrophobicContact CD2-CD1 4.02Å; D394-L397 HydrophobicContact CB-CB 4.1Å; D394-L397 HydrophobicContact CB-CD1 4.15Å; D394-L397 HydrophobicContact CB-CG 4.26Å; D394-L397 PolarHBondContact OD1-N 2.95Å; D394-L397 VanDerWaalsContact OD1-N 3.1Å; D394-L397 WeakPolarHBondContact OD2-CD1 3.5Å; L397-L401 WeakPolarHBondContact O-CB 3.44Å; L397-L401 PolarHBondContact O-N 3.31Å
398	F	97.4	Very high	96	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-46.9	176	-176.6	-94.3	0	0	0	111.8	L392 D394 N396 H400 L401 V402 R437 W438	L392-F398 HydrophobicContact CD2-CD2 4.35Å; L392-F398 HydrophobicContact CD2-CE2 4.04Å; D394-F398 WeakPolarHBondContact O-CB 3.45Å; D394-F398 PolarHBondContact O-N 3.23Å; N396-F398 VanDerWaalsContact C-N 3.33Å; F398-H400 PolarHBondContact O-N 3.28Å; F398-L401 WeakPolarHBondContact O-CB 3.4Å; F398-L401 PolarHBondContact O-N 2.91Å; F398-V402 HydrophobicContact CD1-CG2 4.16Å; F398-V402 HydrophobicContact CE1-CG2 3.64Å; F398-V402 HydrophobicContact CE2-CG2 4.49Å; F398-V402 HydrophobicContact CZ-CG2 3.84Å; F398-V402 WeakPolarHBondContact O-CG2 3.45Å; F398-V402 PolarHBondContact O-N 3.1Å; F398-R437 HydrophobicContact CE1-CG 4.47Å; F398-W438 HydrophobicContact CE1-CB 3.81Å; F398-W438 HydrophobicContact CE1-CG 4.25Å; F398-W438 HydrophobicContact CZ-CB 3.97Å
399	C	95.3	Very high	96	Very high	19 Å²	19	45.5 Å²	45.5	13%	0.128	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-48.8	174.4	-88	0	0	0	0	112.3	D395 N396 L401 V402 D403 V441 F445	D395-C399 WeakPolarHBondContact O-CB 3.41Å; D395-C399 PolarHBondContact O-N 3.42Å; N396-C399 PolarHBondContact O-N 2.81Å; C399-L401 VanDerWaalsContact C-N 3.28Å; C399-L401 PolarHBondContact O-N 3.43Å; C399-V402 PolarHBondContact O-N 3.29Å; C399-V402 VanDerWaalsContact O-N 3.1Å; C399-D403 VanDerWaalsContact O-CG 3.26Å; C399-D403 PolarHBondContact O-N 3.45Å; C399-V441 WeakPolarHBondContact SG-CG1 3.47Å; C399-F445 WeakPolarHBondContact SG-CE2 3.46Å
400	H	96.9	Very high	96	Very high	55 Å²	55	48.9 Å²	48.9	26%	0.255	24%	0.24	S	C	.	.	H	α-helix	trans	-57	-43.7	177.8	-176.2	64.4	0	0	0	111.3	E334 N396 F398 V402 D403 E404	E334-H400 IonicContact OE1-NE2 2.92Å; E334-H400 IonicContact OE2-CD2 3.83Å; E334-H400 IonicContact OE2-CE1 3.79Å; E334-H400 IonicContact OE2-NE2 3.5Å; E334-H400 PolarHBondContact OE2-NE2 3.48Å; N396-H400 WeakPolarHBondContact O-CB 3.47Å; N396-H400 PolarHBondContact O-N 3.12Å; F398-H400 PolarHBondContact O-N 3.28Å; H400-V402 PolarHBondContact O-N 2.95Å; H400-D403 PolarHBondContact O-N 2.94Å; H400-E404 IonicContact CE1-OE1 3.79Å; H400-E404 PolarHBondContact CE1-OE1 2.9Å; H400-E404 IonicContact NE2-OE1 2.7Å; H400-E404 WeakPolarHBondContact O-CG 3.47Å; H400-E404 PolarHBondContact O-N 3.28Å
401	L	97.6	Very high	96.1	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-48.6	174.3	178.6	72.7	0	0	0	112.3	P333 L384 I388 L391 L397 F398 C399 D403 E404 V405	P333-L401 HydrophobicContact CB-CD1 3.38Å; P333-L401 HydrophobicContact CG-CB 4.42Å; P333-L401 HydrophobicContact CG-CD1 3.68Å; L384-L401 HydrophobicContact CD2-CD1 3.77Å; L384-L401 HydrophobicContact CD2-CD2 4.25Å; L384-L401 HydrophobicContact CD2-CG 4.32Å; I388-L401 HydrophobicContact CD1-CD2 4.4Å; I388-L401 HydrophobicContact CG1-CD2 3.55Å; L391-L401 HydrophobicContact CD1-CB 4.37Å; L391-L401 HydrophobicContact CD1-CD2 3.74Å; L391-L401 HydrophobicContact CD1-CG 4.48Å; L397-L401 WeakPolarHBondContact O-CB 3.44Å; L397-L401 PolarHBondContact O-N 3.31Å; F398-L401 WeakPolarHBondContact O-CB 3.4Å; F398-L401 PolarHBondContact O-N 2.91Å; C399-L401 VanDerWaalsContact C-N 3.28Å; C399-L401 PolarHBondContact O-N 3.43Å; L401-D403 VanDerWaalsContact C-N 3.32Å; L401-D403 PolarHBondContact O-N 2.92Å; L401-E404 PolarHBondContact O-N 3.12Å; L401-V405 HydrophobicContact CD1-CG2 4.28Å; L401-V405 HydrophobicContact CG-CG2 4.37Å; L401-V405 WeakPolarHBondContact O-CB 3.05Å; L401-V405 VanDerWaalsContact O-CG2 3.24Å; L401-V405 WeakPolarHBondContact O-CG2 2.95Å; L401-V405 PolarHBondContact O-N 3.19Å
402	V	97.3	Very high	96.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-45.7	179.6	171.7	0	0	0	0	110.2	F398 C399 H400 E404 V405 L406 L429 W438	F398-V402 HydrophobicContact CD1-CG2 4.16Å; F398-V402 HydrophobicContact CE1-CG2 3.64Å; F398-V402 HydrophobicContact CE2-CG2 4.49Å; F398-V402 HydrophobicContact CZ-CG2 3.84Å; F398-V402 WeakPolarHBondContact O-CG2 3.45Å; F398-V402 PolarHBondContact O-N 3.1Å; C399-V402 PolarHBondContact O-N 3.29Å; C399-V402 VanDerWaalsContact O-N 3.1Å; H400-V402 PolarHBondContact O-N 2.95Å; V402-E404 PolarHBondContact O-N 3.23Å; V402-V405 PolarHBondContact O-N 3.28Å; V402-L406 HydrophobicContact CG1-CD1 3.96Å; V402-L406 HydrophobicContact CG1-CG 4.16Å; V402-L406 VanDerWaalsContact O-CG 3.25Å; V402-L406 WeakPolarHBondContact O-CG 3.46Å; V402-L406 PolarHBondContact O-N 2.79Å; V402-L429 HydrophobicContact CG2-CD2 4.25Å; V402-W438 HydrophobicContact CG1-CD2 4.29Å; V402-W438 HydrophobicContact CG1-CH2 4.4Å; V402-W438 HydrophobicContact CG1-CZ2 3.68Å
403	D	96.8	Very high	96.1	Very high	63 Å²	63	50.4 Å²	50.4	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-59.8	-48.3	179.9	-66.5	-16.9	0	0	0	111.5	C399 H400 L401 V405 L406 L407 R492	C399-D403 VanDerWaalsContact O-CG 3.26Å; C399-D403 PolarHBondContact O-N 3.45Å; H400-D403 PolarHBondContact O-N 2.94Å; L401-D403 VanDerWaalsContact C-N 3.32Å; L401-D403 PolarHBondContact O-N 2.92Å; D403-V405 VanDerWaalsContact C-N 3.33Å; D403-V405 PolarHBondContact O-N 3.04Å; D403-L406 PolarHBondContact O-N 3.47Å; D403-L407 VanDerWaalsContact O-CG 3.32Å; D403-L407 WeakPolarHBondContact O-CG 3.15Å; D403-L407 PolarHBondContact O-N 3.23Å; D403-R492 IonicContact OD1-CZ 2.71Å; D403-R492 IonicContact OD1-NH1 3.91Å; D403-R492 PolarHBondContact OD1-NH1 3.41Å; D403-R492 IonicContact OD1-NH2 2.61Å; D403-R492 PolarHBondContact OD1-NH2 2.83Å
404	E	98.1	Very high	96.1	Very high	46 Å²	46	44.8 Å²	44.8	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-37.2	177	-67.8	-60	153.4	0	0	112.4	P333 E334 L337 H400 L401 V402 L407 F408	P333-E404 HydrophobicContact CG-CB 4.11Å; P333-E404 HydrophobicContact CG-CG 4.14Å; E334-E404 HydrophobicContact CB-CG 4.22Å; E334-E404 WeakPolarHBondContact CB-OE2 3.08Å; L337-E404 HydrophobicContact CD1-CB 3.9Å; H400-E404 IonicContact CE1-OE1 3.79Å; H400-E404 PolarHBondContact CE1-OE1 2.9Å; H400-E404 IonicContact NE2-OE1 2.7Å; H400-E404 WeakPolarHBondContact O-CG 3.47Å; H400-E404 PolarHBondContact O-N 3.28Å; L401-E404 PolarHBondContact O-N 3.12Å; V402-E404 PolarHBondContact O-N 3.23Å; E404-L407 PolarHBondContact O-N 3.4Å; E404-F408 VanDerWaalsContact O-CB 3.3Å; E404-F408 WeakPolarHBondContact O-CB 3.47Å; E404-F408 PolarHBondContact O-N 3.04Å
405	V	97.9	Very high	96	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-43.1	174.5	166.7	0	0	0	0	111.4	L337 L384 L401 V402 D403 L407 F408 E409 C425 L429	L337-V405 HydrophobicContact CD1-CG2 4.32Å; L384-V405 HydrophobicContact CD1-CG2 4.09Å; L384-V405 HydrophobicContact CD2-CG2 3.75Å; L401-V405 HydrophobicContact CD1-CG2 4.28Å; L401-V405 HydrophobicContact CG-CG2 4.37Å; L401-V405 WeakPolarHBondContact O-CB 3.05Å; L401-V405 VanDerWaalsContact O-CG2 3.24Å; L401-V405 WeakPolarHBondContact O-CG2 2.95Å; L401-V405 PolarHBondContact O-N 3.19Å; V402-V405 PolarHBondContact O-N 3.28Å; D403-V405 VanDerWaalsContact C-N 3.33Å; D403-V405 PolarHBondContact O-N 3.04Å; V405-L407 VanDerWaalsContact C-N 3.33Å; V405-L407 PolarHBondContact O-N 3.42Å; V405-F408 PolarHBondContact O-N 3.32Å; V405-E409 HydrophobicContact CG1-CG 4.36Å; V405-E409 WeakPolarHBondContact O-CB 3.35Å; V405-E409 VanDerWaalsContact O-CG 3.25Å; V405-E409 WeakPolarHBondContact O-CG 3.35Å; V405-E409 PolarHBondContact O-N 3.2Å; V405-C425 HydrophobicContact CG1-CB 3.37Å; V405-L429 HydrophobicContact CB-CD1 4.43Å; V405-L429 HydrophobicContact CG1-CD1 3.73Å; V405-L429 HydrophobicContact CG1-CG 4.45Å
406	L	96.9	Very high	95.9	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.089	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-36.8	177.9	-68.4	179.3	0	0	0	111.9	V402 D403 R410 M426 W438 R492	V402-L406 HydrophobicContact CG1-CD1 3.96Å; V402-L406 HydrophobicContact CG1-CG 4.16Å; V402-L406 VanDerWaalsContact O-CG 3.25Å; V402-L406 WeakPolarHBondContact O-CG 3.46Å; V402-L406 PolarHBondContact O-N 2.79Å; D403-L406 PolarHBondContact O-N 3.47Å; L406-R410 WeakPolarHBondContact O-CB 3.43Å; L406-R410 PolarHBondContact O-N 3.42Å; L406-R410 VanDerWaalsContact O-N 3.09Å; L406-M426 HydrophobicContact CD2-CE 3.34Å; L406-M426 HydrophobicContact CD2-SD 3.91Å; L406-W438 HydrophobicContact CD1-CZ2 4.34Å; L406-W438 HydrophobicContact CD2-CH2 4.3Å; L406-R492 HydrophobicContact CD1-CB 3.95Å; L406-R492 HydrophobicContact CD1-CG 3.68Å
407	L	96.6	Very high	95.8	Very high	92 Å²	92	42.9 Å²	42.9	48%	0.482	23%	0.23	S	C	.	.	H	α-helix	trans	-65.7	-48.5	173.2	-71.4	173	0	0	0	111.3	D403 E404 V405 E409 R410 E411	D403-L407 VanDerWaalsContact O-CG 3.32Å; D403-L407 WeakPolarHBondContact O-CG 3.15Å; D403-L407 PolarHBondContact O-N 3.23Å; E404-L407 PolarHBondContact O-N 3.4Å; V405-L407 VanDerWaalsContact C-N 3.33Å; V405-L407 PolarHBondContact O-N 3.42Å; L407-E409 VanDerWaalsContact C-N 3.34Å; L407-E409 PolarHBondContact O-N 3.44Å; L407-R410 WeakPolarHBondContact O-CB 3.41Å; L407-R410 PolarHBondContact O-N 3.29Å; L407-E411 PolarHBondContact O-N 3.17Å
408	F	97.7	Very high	95.7	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.022	22%	0.218	C	C	.	.	H	α-helix	trans	-56	-47.5	175.9	168.6	-91	0	0	0	111.9	L337 V340 L341 M377 V380 E404 V405 R410 E411 L412	L337-F408 HydrophobicContact CB-CB 4.23Å; L337-F408 HydrophobicContact CB-CD2 3.73Å; L337-F408 HydrophobicContact CB-CE2 4.46Å; L337-F408 HydrophobicContact CB-CG 4.2Å; L337-F408 HydrophobicContact CD1-CB 4.19Å; L337-F408 HydrophobicContact CD2-CB 4.12Å; L337-F408 HydrophobicContact CD2-CD1 4.06Å; L337-F408 HydrophobicContact CD2-CD2 3.77Å; L337-F408 HydrophobicContact CD2-CE1 4.47Å; L337-F408 HydrophobicContact CD2-CE2 4.18Å; L337-F408 HydrophobicContact CD2-CG 3.71Å; L337-F408 HydrophobicContact CG-CB 4.41Å; L337-F408 HydrophobicContact CG-CD2 4.31Å; L337-F408 HydrophobicContact CG-CG 4.39Å; V340-F408 HydrophobicContact CB-CE2 4.43Å; V340-F408 HydrophobicContact CG1-CE2 4.23Å; V340-F408 HydrophobicContact CG1-CZ 4.36Å; L341-F408 HydrophobicContact CD1-CD2 3.57Å; L341-F408 HydrophobicContact CD1-CE2 4.16Å; L341-F408 HydrophobicContact CD1-CG 4.43Å; L341-F408 HydrophobicContact CD2-CD2 3.92Å; L341-F408 HydrophobicContact CD2-CE2 3.78Å; L341-F408 HydrophobicContact CD2-CZ 4.5Å; L341-F408 HydrophobicContact CG-CD2 3.55Å; L341-F408 HydrophobicContact CG-CE2 3.59Å; M377-F408 HydrophobicContact CE-CE1 3.84Å; M377-F408 HydrophobicContact CE-CZ 4.5Å; M377-F408 HydrophobicContact SD-CE1 3.65Å; M377-F408 HydrophobicContact SD-CZ 3.78Å; V380-F408 HydrophobicContact CG1-CE1 4.4Å; V380-F408 HydrophobicContact CG1-CZ 4.47Å; V380-F408 HydrophobicContact CG2-CZ 4.17Å; E404-F408 VanDerWaalsContact O-CB 3.3Å; E404-F408 WeakPolarHBondContact O-CB 3.47Å; E404-F408 PolarHBondContact O-N 3.04Å; V405-F408 PolarHBondContact O-N 3.32Å; F408-R410 VanDerWaalsContact C-N 3.34Å; F408-R410 PolarHBondContact O-N 2.91Å; F408-E411 PolarHBondContact O-N 3.34Å; F408-L412 HydrophobicContact CE1-CD2 3.88Å; F408-L412 HydrophobicContact CZ-CD2 4.16Å; F408-L412 VanDerWaalsContact O-CB 3.26Å; F408-L412 WeakPolarHBondContact O-CB 3.38Å; F408-L412 PolarHBondContact O-N 3.27Å
409	E	95.8	Very high	95.4	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.023	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-41.7	178.7	-76.7	-81.6	145.2	0	0	111.6	V405 L407 L412 H413 S424 C425 M426	V405-E409 HydrophobicContact CG1-CG 4.36Å; V405-E409 WeakPolarHBondContact O-CB 3.35Å; V405-E409 VanDerWaalsContact O-CG 3.25Å; V405-E409 WeakPolarHBondContact O-CG 3.35Å; V405-E409 PolarHBondContact O-N 3.2Å; L407-E409 VanDerWaalsContact C-N 3.34Å; L407-E409 PolarHBondContact O-N 3.44Å; E409-L412 PolarHBondContact O-N 2.84Å; E409-H413 PolarHBondContact O-N 3.4Å; E409-H413 PolarHBondContact O-ND1 3.42Å; E409-H413 IonicContact OE2-CE1 2.84Å; E409-H413 PolarHBondContact OE2-CE1 3.26Å; E409-H413 IonicContact OE2-ND1 2.98Å; E409-S424 WeakPolarHBondContact OE1-CB 3.49Å; E409-C425 HydrophobicContact CG-CB 4.02Å; E409-C425 WeakPolarHBondContact OE1-CB 3.11Å; E409-C425 PolarHBondContact OE1-N 3.05Å; E409-M426 HydrophobicContact CB-CE 3.68Å; E409-M426 HydrophobicContact CG-CE 3.65Å; E409-M426 HydrophobicContact CG-CG 4.45Å
410	R	95.1	Very high	95	Very high	130 Å²	130	44.7 Å²	44.7	49%	0.491	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-46.1	177.3	-172.1	-174.1	-49.7	-146.3	-7.8	111.5	L406 L407 F408 S414 D491	L406-R410 WeakPolarHBondContact O-CB 3.43Å; L406-R410 PolarHBondContact O-N 3.42Å; L406-R410 VanDerWaalsContact O-N 3.09Å; L407-R410 WeakPolarHBondContact O-CB 3.41Å; L407-R410 PolarHBondContact O-N 3.29Å; F408-R410 VanDerWaalsContact C-N 3.34Å; F408-R410 PolarHBondContact O-N 2.91Å; R410-S414 VanDerWaalsContact O-CB 3.27Å; R410-S414 WeakPolarHBondContact O-CB 3.25Å; R410-S414 PolarHBondContact O-N 2.89Å; R410-S414 PolarHBondContact O-OG 3.45Å; R410-D491 IonicContact CZ-OD2 3.32Å; R410-D491 IonicContact NH1-OD2 2.79Å; R410-D491 IonicContact NH2-OD2 3.8Å; R410-D491 PolarHBondContact NH2-OD2 3.03Å
411	E	96.2	Very high	94.5	Very high	88 Å²	88	45.8 Å²	45.8	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-44	178.2	-170.3	171.5	161.3	0	0	111.4	L341 L407 F408 H413 S414 V415 H416	L341-E411 HydrophobicContact CD1-CB 4.15Å; L341-E411 HydrophobicContact CD1-CG 4.17Å; L341-E411 HydrophobicContact CD2-CB 4.49Å; L341-E411 HydrophobicContact CD2-CG 4.41Å; L407-E411 PolarHBondContact O-N 3.17Å; F408-E411 PolarHBondContact O-N 3.34Å; E411-H413 VanDerWaalsContact C-N 3.32Å; E411-H413 PolarHBondContact O-N 3.12Å; E411-S414 PolarHBondContact O-N 3.03Å; E411-V415 HydrophobicContact CG-CB 4.15Å; E411-V415 HydrophobicContact CG-CG2 3.92Å; E411-V415 WeakPolarHBondContact O-CA 3.34Å; E411-V415 VanDerWaalsContact O-CB 3.3Å; E411-V415 WeakPolarHBondContact O-CB 3.47Å; E411-V415 PolarHBondContact O-N 2.62Å; E411-H416 PolarHBondContact O-N 3.09Å
412	L	95.6	Very high	94.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-56.9	-43.3	178.3	-176.5	65	0	0	0	112.4	L341 I344 M377 F408 E409 H416 G417 Y418	L341-L412 HydrophobicContact CD2-CB 4.17Å; L341-L412 HydrophobicContact CD2-CD1 4.3Å; I344-L412 HydrophobicContact CD1-CD1 3.7Å; M377-L412 HydrophobicContact SD-CD2 3.74Å; F408-L412 HydrophobicContact CE1-CD2 3.88Å; F408-L412 HydrophobicContact CZ-CD2 4.16Å; F408-L412 VanDerWaalsContact O-CB 3.26Å; F408-L412 WeakPolarHBondContact O-CB 3.38Å; F408-L412 PolarHBondContact O-N 3.27Å; E409-L412 PolarHBondContact O-N 2.84Å; L412-H416 HydrophobicContact CD1-CB 4.45Å; L412-H416 CarbonylContact O-C 3.45Å; L412-H416 WeakPolarHBondContact O-CB 3.2Å; L412-H416 PolarHBondContact O-N 3.44Å; L412-G417 PolarHBondContact O-N 3.37Å; L412-Y418 HydrophobicContact CD1-CD2 4.47Å; L412-Y418 HydrophobicContact CD1-CG 4.24Å; L412-Y418 HydrophobicContact CD2-CD1 3.88Å; L412-Y418 HydrophobicContact CD2-CE1 4.36Å; L412-Y418 HydrophobicContact CD2-CG 4Å; L412-Y418 HydrophobicContact CG-CD1 4.23Å; L412-Y418 HydrophobicContact CG-CG 3.94Å; L412-Y418 WeakPolarHBondContact O-CB 3.3Å; L412-Y418 PolarHBondContact O-N 3.32Å
413	H	93.6	Very high	93.8	Very high	62 Å²	62	48.5 Å²	48.5	29%	0.287	29%	0.287	S	S	.	.	H	α-helix	trans	-78.3	-47.1	179.1	-69.7	83.8	0	0	0	112.5	E409 E411 G417 Y418	E409-H413 PolarHBondContact O-N 3.4Å; E409-H413 PolarHBondContact O-ND1 3.42Å; E409-H413 IonicContact OE2-CE1 2.84Å; E409-H413 PolarHBondContact OE2-CE1 3.26Å; E409-H413 IonicContact OE2-ND1 2.98Å; E411-H413 VanDerWaalsContact C-N 3.32Å; E411-H413 PolarHBondContact O-N 3.12Å; H413-G417 WeakPolarHBondContact O-CA 3.33Å; H413-G417 PolarHBondContact O-N 2.9Å; H413-Y418 PolarHBondContact CD2-O 3.49Å
414	S	93.5	Very high	93.7	Very high	90 Å²	90	45.9 Å²	45.9	63%	0.629	27%	0.274	S	S	*	.	H	α-helix	trans	-78.9	-37.1	-171.9	62.6	0	0	0	0	114	R410 E411	R410-S414 VanDerWaalsContact O-CB 3.27Å; R410-S414 WeakPolarHBondContact O-CB 3.25Å; R410-S414 PolarHBondContact O-N 2.89Å; R410-S414 PolarHBondContact O-OG 3.45Å; E411-S414 PolarHBondContact O-N 3.03Å
415	V	93.8	Very high	93.5	Very high	99 Å²	99	43.7 Å²	43.7	60%	0.6	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-44.2	-176.3	-178.7	0	0	0	0	111.1	E411	E411-V415 HydrophobicContact CG-CB 4.15Å; E411-V415 HydrophobicContact CG-CG2 3.92Å; E411-V415 WeakPolarHBondContact O-CA 3.34Å; E411-V415 VanDerWaalsContact O-CB 3.3Å; E411-V415 WeakPolarHBondContact O-CB 3.47Å; E411-V415 PolarHBondContact O-N 2.62Å
416	H	92.4	Very high	93.4	Very high	30 Å²	30	43.8 Å²	43.8	14%	0.139	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-4.9	-175.7	-60	-67.9	0	0	0	114.3	I344 E411 L412 Y418	I344-H416 HydrophobicContact CG2-CB 4Å; E411-H416 PolarHBondContact O-N 3.09Å; L412-H416 HydrophobicContact CD1-CB 4.45Å; L412-H416 CarbonylContact O-C 3.45Å; L412-H416 WeakPolarHBondContact O-CB 3.2Å; L412-H416 PolarHBondContact O-N 3.44Å; H416-Y418 VanDerWaalsContact C-N 3.29Å; H416-Y418 PolarHBondContact O-N 2.89Å
417	G	92.1	Very high	93.3	Very high	41 Å²	41	43.8 Å²	43.8	42%	0.423	26%	0.263	S	S	.	.			trans	64.6	30.8	175.1	0	0	0	0	0	113.7	L412 H413 P419	L412-G417 PolarHBondContact O-N 3.37Å; H413-G417 WeakPolarHBondContact O-CA 3.33Å; H413-G417 PolarHBondContact O-N 2.9Å; G417-P419 WeakPolarHBondContact O-CD 3.46Å
418	Y	93.4	Very high	93.2	Very high	9 Å²	9	39.4 Å²	39.4	4%	0.035	24%	0.24	C	C	.	.			trans	-68.8	127.4	176.9	-167.9	-101.8	0	0	0	110.5	R374 L412 H413 H416 F422 A423	R374-Y418 HydrophobicContact CG-CE2 3.88Å; L412-Y418 HydrophobicContact CD1-CD2 4.47Å; L412-Y418 HydrophobicContact CD1-CG 4.24Å; L412-Y418 HydrophobicContact CD2-CD1 3.88Å; L412-Y418 HydrophobicContact CD2-CE1 4.36Å; L412-Y418 HydrophobicContact CD2-CG 4Å; L412-Y418 HydrophobicContact CG-CD1 4.23Å; L412-Y418 HydrophobicContact CG-CG 3.94Å; L412-Y418 WeakPolarHBondContact O-CB 3.3Å; L412-Y418 PolarHBondContact O-N 3.32Å; H413-Y418 PolarHBondContact CD2-O 3.49Å; H416-Y418 VanDerWaalsContact C-N 3.29Å; H416-Y418 PolarHBondContact O-N 2.89Å; Y418-F422 HydrophobicContact CD2-CD2 4.5Å; Y418-F422 HydrophobicContact CE1-CB 3.68Å; Y418-F422 HydrophobicContact CE1-CD2 4.35Å; Y418-F422 AromaticContact CE2-CD2 3.96Å; Y418-F422 HydrophobicContact CE2-CD2 3.96Å; Y418-F422 AromaticContact CZ-CD2 3.9Å; Y418-F422 WeakPolarHBondContact OH-CB 3.29Å; Y418-A423 WeakPolarHBondContact CE1-O 3.34Å; Y418-A423 PolarHBondContact OH-O 3.27Å
419	P	91.4	Very high	93.2	Very high	43 Å²	43	39.2 Å²	39.2	28%	0.279	24%	0.239	S	C	.	.			trans	-70	135.4	-178.5	-22.6	33.7	0	0	0	113.6	L370 G417 A421 F422	L370-P419 HydrophobicContact CD1-CG 4.14Å; L370-P419 HydrophobicContact CD2-CG 4.35Å; G417-P419 WeakPolarHBondContact O-CD 3.46Å; P419-A421 PolarHBondContact O-N 3.47Å; P419-A421 VanDerWaalsContact O-N 3.11Å; P419-F422 HydrophobicContact CB-CD2 4.17Å; P419-F422 HydrophobicContact CB-CE2 4.26Å; P419-F422 HydrophobicContact CG-CD2 4.02Å; P419-F422 HydrophobicContact CG-CE2 3.75Å; P419-F422 HydrophobicContact CG-CZ 4.36Å; P419-F422 PolarHBondContact O-N 2.97Å; P419-F422 VanDerWaalsContact O-N 3.13Å
420	G	85.8	Confident	93.1	Very high	60 Å²	60	39.5 Å²	39.5	62%	0.619	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.6	175.1	0	0	0	0	0	115.1	F422	G420-F422 VanDerWaalsContact C-N 3.27Å
421	A	86.8	Confident	93.1	Very high	78 Å²	78	34.6 Å²	34.6	65%	0.645	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.2	173.4	0	0	0	0	0	113.1	P419	P419-A421 PolarHBondContact O-N 3.47Å; P419-A421 VanDerWaalsContact O-N 3.11Å
422	F	90.1	Very high	93	Very high	52 Å²	52	34.5 Å²	34.5	23%	0.228	22%	0.224	C	C	.	.	S	Bend	trans	-90.8	164.7	179.9	-64.6	-24	0	0	0	112.4	L370 R374 Y418 P419 G420 S424	L370-F422 HydrophobicContact CB-CE2 4.44Å; L370-F422 HydrophobicContact CD1-CE2 4.4Å; R374-F422 HydrophobicContact CG-CD2 3.89Å; R374-F422 HydrophobicContact CG-CE2 4.14Å; R374-F422 HydrophobicContact CG-CG 4.47Å; Y418-F422 HydrophobicContact CD2-CD2 4.5Å; Y418-F422 HydrophobicContact CE1-CB 3.68Å; Y418-F422 HydrophobicContact CE1-CD2 4.35Å; Y418-F422 AromaticContact CE2-CD2 3.96Å; Y418-F422 HydrophobicContact CE2-CD2 3.96Å; Y418-F422 AromaticContact CZ-CD2 3.9Å; Y418-F422 WeakPolarHBondContact OH-CB 3.29Å; P419-F422 HydrophobicContact CB-CD2 4.17Å; P419-F422 HydrophobicContact CB-CE2 4.26Å; P419-F422 HydrophobicContact CG-CD2 4.02Å; P419-F422 HydrophobicContact CG-CE2 3.75Å; P419-F422 HydrophobicContact CG-CZ 4.36Å; P419-F422 PolarHBondContact O-N 2.97Å; P419-F422 VanDerWaalsContact O-N 3.13Å; G420-F422 VanDerWaalsContact C-N 3.27Å; F422-S424 PolarHBondContact O-N 3.16Å
423	A	91.3	Very high	93	Very high	8 Å²	8	38.4 Å²	38.4	7%	0.066	25%	0.248	C	C	.	.			trans	-55.3	132.8	171.7	0	0	0	0	0	110.9	L296 L381 Y418	L296-A423 HydrophobicContact CD2-CB 3.97Å; L381-A423 HydrophobicContact CD1-CB 3.83Å; Y418-A423 WeakPolarHBondContact CE1-O 3.34Å; Y418-A423 PolarHBondContact OH-O 3.27Å
424	S	92.9	Very high	93.1	Very high	8 Å²	8	35.4 Å²	35.4	6%	0.056	23%	0.234	C	C	.	.			trans	-141.5	164	-174.2	75.3	0	0	0	0	111.2	L381 E409 F422 M426 H427	L381-S424 VanDerWaalsContact CD2-C 3.42Å; L381-S424 WeakPolarHBondContact CD2-O 3.48Å; E409-S424 WeakPolarHBondContact OE1-CB 3.49Å; F422-S424 PolarHBondContact O-N 3.16Å; S424-M426 PolarHBondContact O-N 3.48Å; S424-M426 VanDerWaalsContact O-N 3.16Å; S424-M426 PolarHBondContact OG-N 3.16Å; S424-H427 PolarHBondContact N-ND1 3.37Å; S424-H427 VanDerWaalsContact N-ND1 3.12Å; S424-H427 WeakPolarHBondContact O-CB 3.15Å; S424-H427 PolarHBondContact O-N 3.03Å; S424-H427 PolarHBondContact O-ND1 3.4Å; S424-H427 PolarHBondContact OG-CE1 3.03Å; S424-H427 PolarHBondContact OG-ND1 3.32Å
425	C	95.6	Very high	93.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.4	-28.3	177.7	-65.6	0	0	0	0	112.1	M377 V380 L384 V405 E409 H427 I428 L429	M377-C425 HydrophobicContact CE-CB 4.25Å; M377-C425 WeakPolarHBondContact CE-SG 3.44Å; V380-C425 VanDerWaalsContact CG1-SG 3.6Å; L384-C425 HydrophobicContact CD1-CB 3.77Å; L384-C425 WeakPolarHBondContact CD1-SG 3.44Å; V405-C425 HydrophobicContact CG1-CB 3.37Å; E409-C425 HydrophobicContact CG-CB 4.02Å; E409-C425 WeakPolarHBondContact OE1-CB 3.11Å; E409-C425 PolarHBondContact OE1-N 3.05Å; C425-H427 PolarHBondContact O-N 2.91Å; C425-I428 WeakPolarHBondContact O-CB 3.28Å; C425-I428 PolarHBondContact O-N 3.47Å; C425-L429 PolarHBondContact O-N 3.31Å
426	M	94.9	Very high	93.4	Very high	2 Å²	2	30 Å²	30	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-30	177.5	-57.1	-59.1	180	0	0	112.3	L406 E409 S424 I428 L429 S430 N495	L406-M426 HydrophobicContact CD2-CE 3.34Å; L406-M426 HydrophobicContact CD2-SD 3.91Å; E409-M426 HydrophobicContact CB-CE 3.68Å; E409-M426 HydrophobicContact CG-CE 3.65Å; E409-M426 HydrophobicContact CG-CG 4.45Å; S424-M426 PolarHBondContact O-N 3.48Å; S424-M426 VanDerWaalsContact O-N 3.16Å; S424-M426 PolarHBondContact OG-N 3.16Å; M426-I428 VanDerWaalsContact C-N 3.33Å; M426-L429 PolarHBondContact O-N 3.41Å; M426-L429 HydrophobicContact SD-CD1 4.45Å; M426-S430 VanDerWaalsContact O-CB 3.26Å; M426-S430 WeakPolarHBondContact O-CB 3.29Å; M426-S430 PolarHBondContact O-N 2.95Å; M426-S430 PolarHBondContact O-OG 2.86Å; M426-N495 HydrophobicContact CE-CB 4.23Å
427	H	94.6	Very high	93.6	Very high	16 Å²	16	31.4 Å²	31.4	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-32.5	175.3	-61.3	83.4	0	0	0	112.2	S295 L296 P297 S424 C425 P497	S295-H427 PolarHBondContact O-CD2 2.82Å; S295-H427 VanDerWaalsContact O-CD2 3.31Å; L296-H427 HydrophobicContact CD2-CB 3.55Å; P297-H427 WeakPolarHBondContact CD-NE2 3.1Å; S424-H427 PolarHBondContact N-ND1 3.37Å; S424-H427 VanDerWaalsContact N-ND1 3.12Å; S424-H427 WeakPolarHBondContact O-CB 3.15Å; S424-H427 PolarHBondContact O-N 3.03Å; S424-H427 PolarHBondContact O-ND1 3.4Å; S424-H427 PolarHBondContact OG-CE1 3.03Å; S424-H427 PolarHBondContact OG-ND1 3.32Å; C425-H427 PolarHBondContact O-N 2.91Å; H427-P497 WeakPolarHBondContact NE2-CB 2.95Å
428	I	95.8	Very high	93.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-74	-43	176.6	-48.2	-57.2	0	0	0	110.1	L290 Y294 L381 L384 I388 C425 M426 S430 E431	L290-I428 HydrophobicContact CD1-CD1 4.22Å; Y294-I428 HydrophobicContact CD1-CB 4.48Å; Y294-I428 HydrophobicContact CD1-CD1 3.72Å; Y294-I428 HydrophobicContact CD1-CG2 4.23Å; Y294-I428 HydrophobicContact CE1-CB 4.39Å; Y294-I428 HydrophobicContact CE1-CD1 4.12Å; Y294-I428 HydrophobicContact CE1-CG2 3.68Å; Y294-I428 HydrophobicContact CG-CD1 3.94Å; L381-I428 HydrophobicContact CB-CD1 4.27Å; L381-I428 HydrophobicContact CB-CG1 4.37Å; L381-I428 HydrophobicContact CD2-CD1 4.25Å; L381-I428 HydrophobicContact CD2-CG1 3.73Å; L384-I428 HydrophobicContact CB-CG2 4.04Å; I388-I428 HydrophobicContact CD1-CG2 3.62Å; C425-I428 WeakPolarHBondContact O-CB 3.28Å; C425-I428 PolarHBondContact O-N 3.47Å; M426-I428 VanDerWaalsContact C-N 3.33Å; I428-S430 PolarHBondContact O-N 2.99Å; I428-E431 WeakPolarHBondContact O-CB 3.33Å; I428-E431 PolarHBondContact O-N 3.3Å
429	L	95.8	Very high	94.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-21	175.2	-64.5	-179	0	0	0	113.3	I388 V402 V405 C425 M426 E431 F435 W438	I388-L429 HydrophobicContact CD1-CD2 4.01Å; V402-L429 HydrophobicContact CG2-CD2 4.25Å; V405-L429 HydrophobicContact CB-CD1 4.43Å; V405-L429 HydrophobicContact CG1-CD1 3.73Å; V405-L429 HydrophobicContact CG1-CG 4.45Å; C425-L429 PolarHBondContact O-N 3.31Å; M426-L429 PolarHBondContact O-N 3.41Å; M426-L429 HydrophobicContact SD-CD1 4.45Å; L429-E431 VanDerWaalsContact C-N 3.34Å; L429-F435 WeakPolarHBondContact O-CB 3.26Å; L429-W438 HydrophobicContact CB-CE3 4.14Å; L429-W438 HydrophobicContact CB-CZ3 3.93Å; L429-W438 HydrophobicContact CD1-CH2 4.33Å; L429-W438 HydrophobicContact CD1-CZ3 4Å
430	S	95.3	Very high	94.4	Very high	12 Å²	12	31 Å²	31	8%	0.084	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.5	177.3	-62.7	0	0	0	0	114.1	M426 I428 P497 R501	M426-S430 VanDerWaalsContact O-CB 3.26Å; M426-S430 WeakPolarHBondContact O-CB 3.29Å; M426-S430 PolarHBondContact O-N 2.95Å; M426-S430 PolarHBondContact O-OG 2.86Å; I428-S430 PolarHBondContact O-N 2.99Å; S430-P497 VanDerWaalsContact OG-CD 3.27Å; S430-P497 WeakPolarHBondContact OG-CD 3.5Å; S430-P497 WeakPolarHBondContact OG-CG 3.11Å; S430-R501 VanDerWaalsContact O-CZ 3.28Å; S430-R501 PolarHBondContact O-NE 3.2Å; S430-R501 PolarHBondContact O-NH2 3.39Å
431	E	95	Very high	94.9	Very high	26 Å²	26	28.2 Å²	28.2	12%	0.121	16%	0.156	C	C	.	.	S	Bend	trans	-60.8	138.9	170.4	-173.5	-76.5	139.4	0	0	109.5	K293 Y294 I428 L429 T433 C434 F435	K293-E431 HydrophobicContact CD-CG 4.41Å; K293-E431 HydrophobicContact CG-CG 4.46Å; Y294-E431 HydrophobicContact CD1-CB 3.95Å; Y294-E431 HydrophobicContact CD1-CG 4.21Å; Y294-E431 HydrophobicContact CE1-CB 3.76Å; Y294-E431 HydrophobicContact CE1-CG 3.88Å; I428-E431 WeakPolarHBondContact O-CB 3.33Å; I428-E431 PolarHBondContact O-N 3.3Å; L429-E431 VanDerWaalsContact C-N 3.34Å; E431-T433 PolarHBondContact O-N 2.98Å; E431-T433 PolarHBondContact OE1-N 3.07Å; E431-T433 PolarHBondContact OE1-OG1 3.03Å; E431-T433 PolarHBondContact OE2-N 2.86Å; E431-T433 VanDerWaalsContact OE2-N 3.1Å; E431-T433 PolarHBondContact OE2-OG1 3.5Å; E431-C434 PolarHBondContact O-N 3.32Å; E431-C434 PolarHBondContact OE2-N 3.06Å; E431-F435 WeakPolarHBondContact O-CB 3.44Å; E431-F435 PolarHBondContact O-N 2.65Å
432	E	94.3	Very high	95.3	Very high	87 Å²	87	25.4 Å²	25.4	41%	0.407	13%	0.13	S	C	.	.	H	α-helix	trans	-52.4	-51.4	-166.9	-173.4	60	-142.3	0	0	113.6	C434 F435 Q436 R501	E432-C434 PolarHBondContact O-N 3.2Å; E432-F435 PolarHBondContact O-N 2.97Å; E432-Q436 WeakPolarHBondContact O-CG 3.28Å; E432-Q436 PolarHBondContact O-N 2.95Å; E432-Q436 VanDerWaalsContact OE1-CG 3.24Å; E432-Q436 WeakPolarHBondContact OE1-CG 3.38Å; E432-Q436 PolarHBondContact OE1-NE2 3.26Å; E432-R501 IonicContact OE1-NH1 3.42Å; E432-R501 IonicContact OE2-CZ 3.98Å; E432-R501 IonicContact OE2-NH1 2.82Å; E432-R501 PolarHBondContact OE2-NH1 2.8Å; E432-R501 IonicContact OE2-NH2 3.48Å; E432-R501 PolarHBondContact OE2-NH2 2.96Å
433	T	95.2	Very high	95.7	Very high	82 Å²	82	27.3 Å²	27.3	50%	0.503	14%	0.136	S	C	.	.	H	α-helix	trans	-67.5	-40.9	-175.7	67	0	0	0	0	112.2	E431 R437	E431-T433 PolarHBondContact O-N 2.98Å; E431-T433 PolarHBondContact OE1-N 3.07Å; E431-T433 PolarHBondContact OE1-OG1 3.03Å; E431-T433 PolarHBondContact OE2-N 2.86Å; E431-T433 VanDerWaalsContact OE2-N 3.1Å; E431-T433 PolarHBondContact OE2-OG1 3.5Å; T433-R437 WeakPolarHBondContact O-CB 2.98Å; T433-R437 PolarHBondContact O-N 3.15Å
434	C	96	Very high	96	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.8	-42.9	175.2	-176.3	0	0	0	0	111.8	I388 E431 E432 R437 W438	I388-C434 HydrophobicContact CG2-CB 3.86Å; I388-C434 VanDerWaalsContact CG2-SG 3.54Å; E431-C434 PolarHBondContact O-N 3.32Å; E431-C434 PolarHBondContact OE2-N 3.06Å; E432-C434 PolarHBondContact O-N 3.2Å; C434-R437 WeakPolarHBondContact O-CB 3.44Å; C434-R437 PolarHBondContact O-N 3.48Å; C434-W438 PolarHBondContact O-N 3.24Å
435	F	96.9	Very high	96.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-67.8	-46	-176.3	-175.2	-101.1	0	0	0	112.2	L429 E431 E432 R437 W438 L439 L496 R501 Q504 F505	L429-F435 WeakPolarHBondContact O-CB 3.26Å; E431-F435 WeakPolarHBondContact O-CB 3.44Å; E431-F435 PolarHBondContact O-N 2.65Å; E432-F435 PolarHBondContact O-N 2.97Å; F435-R437 PolarHBondContact O-N 3.39Å; F435-W438 HydrophobicContact CD2-CE3 4.4Å; F435-W438 WeakPolarHBondContact O-CB 3.48Å; F435-W438 PolarHBondContact O-N 3.38Å; F435-W438 VanDerWaalsContact O-N 3.12Å; F435-L439 HydrophobicContact CD1-CD1 3.96Å; F435-L439 HydrophobicContact CD1-CG 4.4Å; F435-L439 HydrophobicContact CE1-CD1 3.46Å; F435-L439 VanDerWaalsContact CE1-CD1 3.46Å; F435-L439 HydrophobicContact CE1-CG 3.97Å; F435-L439 HydrophobicContact CZ-CD1 4.09Å; F435-L439 HydrophobicContact CZ-CD2 4.34Å; F435-L439 HydrophobicContact CZ-CG 4.19Å; F435-L439 PolarHBondContact O-N 3.06Å; F435-L496 HydrophobicContact CE2-CD1 3.81Å; F435-L496 HydrophobicContact CE2-CD2 4.48Å; F435-L496 HydrophobicContact CZ-CD1 4.46Å; F435-R501 VanDerWaalsContact CE1-CD 3.48Å; F435-R501 HydrophobicContact CE2-CB 3.95Å; F435-R501 HydrophobicContact CE2-CG 4.35Å; F435-R501 HydrophobicContact CZ-CB 3.93Å; F435-R501 HydrophobicContact CZ-CG 4.39Å; F435-R501 VanDerWaalsContact CZ-O 3.31Å; F435-R501 WeakPolarHBondContact CZ-O 3.48Å; F435-Q504 HydrophobicContact CE1-CB 3.83Å; F435-Q504 HydrophobicContact CE1-CG 4.48Å; F435-Q504 HydrophobicContact CZ-CB 4.13Å; F435-F505 HydrophobicContact CD2-CE2 4.2Å; F435-F505 AromaticContact CE2-CD2 3.49Å; F435-F505 HydrophobicContact CE2-CD2 3.49Å; F435-F505 VanDerWaalsContact CE2-CD2 3.49Å; F435-F505 AromaticContact CE2-CE2 3.35Å; F435-F505 HydrophobicContact CE2-CE2 3.35Å; F435-F505 AromaticContact CZ-CD2 3.51Å; F435-F505 HydrophobicContact CZ-CD2 3.51Å; F435-F505 AromaticContact CZ-CE2 3.76Å; F435-F505 HydrophobicContact CZ-CE2 3.76Å
436	Q	96.6	Very high	96.2	Very high	74 Å²	74	34.5 Å²	34.5	35%	0.346	17%	0.165	S	C	.	.	H	α-helix	trans	-61.1	-37.8	175	-68.4	-54.5	-31.6	0	0	111.7	E432 T440	E432-Q436 WeakPolarHBondContact O-CG 3.28Å; E432-Q436 PolarHBondContact O-N 2.95Å; E432-Q436 VanDerWaalsContact OE1-CG 3.24Å; E432-Q436 WeakPolarHBondContact OE1-CG 3.38Å; E432-Q436 PolarHBondContact OE1-NE2 3.26Å; Q436-T440 WeakPolarHBondContact O-CB 3.33Å; Q436-T440 PolarHBondContact O-N 3.24Å; Q436-T440 PolarHBondContact O-OG1 3.32Å
437	R	96.9	Very high	96.3	Very high	60 Å²	60	36.4 Å²	36.4	23%	0.226	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-43.4	174.9	-175.3	53.3	165.3	164	-3.1	111.4	L392 D395 F398 T433 C434 F435 T440 V441	L392-R437 HydrophobicContact CD2-CB 4.07Å; L392-R437 HydrophobicContact CD2-CG 4.11Å; L392-R437 PolarHBondContact O-NE 3.3Å; L392-R437 PolarHBondContact O-NH2 3.06Å; D395-R437 IonicContact OD1-CZ 2.54Å; D395-R437 IonicContact OD1-NH1 3.82Å; D395-R437 PolarHBondContact OD1-NH1 3.31Å; D395-R437 IonicContact OD1-NH2 3.06Å; D395-R437 PolarHBondContact OD1-NH2 3.48Å; F398-R437 HydrophobicContact CE1-CG 4.47Å; T433-R437 WeakPolarHBondContact O-CB 2.98Å; T433-R437 PolarHBondContact O-N 3.15Å; C434-R437 WeakPolarHBondContact O-CB 3.44Å; C434-R437 PolarHBondContact O-N 3.48Å; F435-R437 PolarHBondContact O-N 3.39Å; R437-T440 PolarHBondContact O-N 2.88Å; R437-V441 HydrophobicContact CG-CG2 4.38Å; R437-V441 WeakPolarHBondContact O-CG2 3.06Å; R437-V441 PolarHBondContact O-N 2.89Å
438	W	97.5	Very high	96.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-51.5	175.6	-173.2	8	0	0	0	111.9	F398 V402 L406 L429 C434 F435 T440 V441 E442 R492 L496 F505	F398-W438 HydrophobicContact CE1-CB 3.81Å; F398-W438 HydrophobicContact CE1-CG 4.25Å; F398-W438 HydrophobicContact CZ-CB 3.97Å; V402-W438 HydrophobicContact CG1-CD2 4.29Å; V402-W438 HydrophobicContact CG1-CH2 4.4Å; V402-W438 HydrophobicContact CG1-CZ2 3.68Å; L406-W438 HydrophobicContact CD1-CZ2 4.34Å; L406-W438 HydrophobicContact CD2-CH2 4.3Å; L429-W438 HydrophobicContact CB-CE3 4.14Å; L429-W438 HydrophobicContact CB-CZ3 3.93Å; L429-W438 HydrophobicContact CD1-CH2 4.33Å; L429-W438 HydrophobicContact CD1-CZ3 4Å; C434-W438 PolarHBondContact O-N 3.24Å; F435-W438 HydrophobicContact CD2-CE3 4.4Å; F435-W438 WeakPolarHBondContact O-CB 3.48Å; F435-W438 PolarHBondContact O-N 3.38Å; F435-W438 VanDerWaalsContact O-N 3.12Å; W438-T440 VanDerWaalsContact C-N 3.27Å; W438-T440 PolarHBondContact O-N 2.97Å; W438-V441 PolarHBondContact O-N 2.91Å; W438-E442 PolarHBondContact NE1-OE2 3.04Å; W438-E442 VanDerWaalsContact O-CB 3.26Å; W438-E442 WeakPolarHBondContact O-CB 3.05Å; W438-E442 PolarHBondContact O-N 2.76Å; W438-R492 HydrophobicContact CZ2-CB 4.14Å; W438-L496 HydrophobicContact CH2-CD2 4.4Å; W438-L496 HydrophobicContact CZ3-CD2 3.87Å; W438-F505 AromaticContact CD2-CE2 3.97Å; W438-F505 HydrophobicContact CD2-CE2 3.97Å; W438-F505 AromaticContact CD2-CZ 3.6Å; W438-F505 HydrophobicContact CD2-CZ 3.6Å; W438-F505 AromaticContact CE2-CZ 3.58Å; W438-F505 AromaticContact CE3-CE2 3.93Å; W438-F505 HydrophobicContact CE3-CE2 3.93Å; W438-F505 HydrophobicContact CE3-CZ 4.06Å; W438-F505 AromaticContact CG-CZ 3.9Å; W438-F505 HydrophobicContact CG-CZ 3.9Å; W438-F505 HydrophobicContact CH2-CE2 4.38Å; W438-F505 HydrophobicContact CH2-CZ 4.46Å; W438-F505 HydrophobicContact CZ2-CE2 4.41Å; W438-F505 HydrophobicContact CZ2-CZ 4.04Å; W438-F505 HydrophobicContact CZ3-CE2 4.15Å; W438-F505 HydrophobicContact CZ3-CZ 4.48Å; W438-F505 AromaticContact NE1-CZ 3.8Å
439	L	97.6	Very high	96.3	Very high	14 Å²	14	45.2 Å²	45.2	7%	0.073	21%	0.214	C	C	.	.	H	α-helix	trans	-54.4	-43.7	175.5	-73.1	174.9	0	0	0	112.6	F435 R443 Q504 F505 L508	F435-L439 HydrophobicContact CD1-CD1 3.96Å; F435-L439 HydrophobicContact CD1-CG 4.4Å; F435-L439 HydrophobicContact CE1-CD1 3.46Å; F435-L439 VanDerWaalsContact CE1-CD1 3.46Å; F435-L439 HydrophobicContact CE1-CG 3.97Å; F435-L439 HydrophobicContact CZ-CD1 4.09Å; F435-L439 HydrophobicContact CZ-CD2 4.34Å; F435-L439 HydrophobicContact CZ-CG 4.19Å; F435-L439 PolarHBondContact O-N 3.06Å; L439-R443 WeakPolarHBondContact O-CB 3.31Å; L439-R443 PolarHBondContact O-N 3.36Å; L439-Q504 HydrophobicContact CD1-CB 4.27Å; L439-F505 HydrophobicContact CD2-CB 4.37Å; L439-F505 HydrophobicContact CD2-CD1 3.54Å; L439-F505 HydrophobicContact CD2-CD2 3.8Å; L439-F505 HydrophobicContact CD2-CE1 3.61Å; L439-F505 HydrophobicContact CD2-CE2 3.89Å; L439-F505 HydrophobicContact CD2-CG 3.63Å; L439-F505 HydrophobicContact CD2-CZ 3.78Å; L439-F505 HydrophobicContact CG-CE2 4.45Å; L439-F505 HydrophobicContact CG-CZ 4.41Å; L439-L508 HydrophobicContact CD2-CB 4.26Å; L439-L508 HydrophobicContact CD2-CD2 3.96Å
440	T	96.9	Very high	96.3	Very high	69 Å²	69	45.2 Å²	45.2	42%	0.423	21%	0.214	S	C	.	.	H	α-helix	trans	-63.5	-47	-179	-60.5	0	0	0	0	111.8	Q436 R437 W438 K444	Q436-T440 WeakPolarHBondContact O-CB 3.33Å; Q436-T440 PolarHBondContact O-N 3.24Å; Q436-T440 PolarHBondContact O-OG1 3.32Å; R437-T440 PolarHBondContact O-N 2.88Å; W438-T440 VanDerWaalsContact C-N 3.27Å; W438-T440 PolarHBondContact O-N 2.97Å; T440-K444 WeakPolarHBondContact O-CB 3.47Å; T440-K444 PolarHBondContact O-N 3.45Å
441	V	96.6	Very high	96.2	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-70	-41.4	-178.7	175.3	0	0	0	0	110.5	D395 C399 R437 W438 R443 K444 F445	D395-V441 HydrophobicContact CB-CG1 4.39Å; C399-V441 WeakPolarHBondContact SG-CG1 3.47Å; R437-V441 HydrophobicContact CG-CG2 4.38Å; R437-V441 WeakPolarHBondContact O-CG2 3.06Å; R437-V441 PolarHBondContact O-N 2.89Å; W438-V441 PolarHBondContact O-N 2.91Å; V441-R443 PolarHBondContact O-N 3.23Å; V441-K444 WeakPolarHBondContact O-CB 3.45Å; V441-K444 PolarHBondContact O-N 3.07Å; V441-F445 HydrophobicContact CG1-CD2 3.54Å; V441-F445 HydrophobicContact CG1-CE2 3.47Å; V441-F445 VanDerWaalsContact CG1-CE2 3.47Å; V441-F445 VanDerWaalsContact O-CD2 3.31Å; V441-F445 WeakPolarHBondContact O-CD2 3.42Å; V441-F445 PolarHBondContact O-N 3.11Å
442	E	96.6	Very high	96.2	Very high	20 Å²	20	50.6 Å²	50.6	9%	0.093	25%	0.25	C	C	.	.	H	α-helix	trans	-59.1	-47.9	175.7	-160	77.2	-152.2	0	0	111.1	W438 K444 F445 A446 I489 R492 F505 L508	W438-E442 PolarHBondContact NE1-OE2 3.04Å; W438-E442 VanDerWaalsContact O-CB 3.26Å; W438-E442 WeakPolarHBondContact O-CB 3.05Å; W438-E442 PolarHBondContact O-N 2.76Å; E442-K444 VanDerWaalsContact C-N 3.35Å; E442-K444 PolarHBondContact O-N 3.49Å; E442-F445 PolarHBondContact O-N 3.26Å; E442-A446 VanDerWaalsContact O-CB 3.26Å; E442-A446 WeakPolarHBondContact O-CB 3.39Å; E442-A446 PolarHBondContact O-N 2.94Å; E442-I489 HydrophobicContact CG-CG1 4.47Å; E442-R492 WeakPolarHBondContact OE1-CD 3.35Å; E442-R492 IonicContact OE1-CZ 3.16Å; E442-R492 IonicContact OE1-NE 3.14Å; E442-R492 PolarHBondContact OE1-NE 2.69Å; E442-R492 IonicContact OE1-NH2 2.63Å; E442-R492 IonicContact OE2-CZ 3.19Å; E442-R492 VanDerWaalsContact OE2-CZ 3.3Å; E442-R492 IonicContact OE2-NE 3.58Å; E442-R492 PolarHBondContact OE2-NE 3.48Å; E442-R492 IonicContact OE2-NH2 2.62Å; E442-R492 PolarHBondContact OE2-NH2 2.93Å; E442-F505 HydrophobicContact CB-CE1 4.4Å; E442-F505 HydrophobicContact CG-CE1 4.18Å; E442-L508 HydrophobicContact CB-CD2 4.05Å; E442-L508 HydrophobicContact CG-CD2 4.23Å
443	R	97.6	Very high	96.3	Very high	92 Å²	92	46.9 Å²	46.9	35%	0.347	23%	0.232	S	C	.	.	H	α-helix	trans	-56.1	-48.4	174.1	-173.7	-178.8	-80.5	130.2	-7.9	111.3	L439 V441 F445 A446 L447 L508 D511	L439-R443 WeakPolarHBondContact O-CB 3.31Å; L439-R443 PolarHBondContact O-N 3.36Å; V441-R443 PolarHBondContact O-N 3.23Å; R443-F445 PolarHBondContact O-N 3.45Å; R443-A446 PolarHBondContact O-N 3.2Å; R443-L447 HydrophobicContact CG-CD1 4.02Å; R443-L447 HydrophobicContact CG-CG 4.41Å; R443-L447 WeakPolarHBondContact O-CB 3.49Å; R443-L447 VanDerWaalsContact O-CG 3.31Å; R443-L447 WeakPolarHBondContact O-CG 3.37Å; R443-L447 PolarHBondContact O-N 3.26Å; R443-L508 HydrophobicContact CB-CD1 3.55Å; R443-L508 HydrophobicContact CG-CD1 3.73Å; R443-D511 IonicContact CZ-OD2 2.62Å; R443-D511 IonicContact NH2-OD2 3.28Å; R443-D511 PolarHBondContact NH2-OD2 2.84Å
444	K	96.7	Very high	96.2	Very high	95 Å²	95	44 Å²	44	41%	0.413	21%	0.214	S	C	.	.	H	α-helix	trans	-58.2	-50.1	-178.4	178.3	-178	173	-178.4	0	111.6	D395 T440 V441 E442 L447 Q448	D395-K444 IonicContact OD2-NZ 3.88Å; D395-K444 PolarHBondContact OD2-NZ 3.28Å; T440-K444 WeakPolarHBondContact O-CB 3.47Å; T440-K444 PolarHBondContact O-N 3.45Å; V441-K444 WeakPolarHBondContact O-CB 3.45Å; V441-K444 PolarHBondContact O-N 3.07Å; E442-K444 VanDerWaalsContact C-N 3.35Å; E442-K444 PolarHBondContact O-N 3.49Å; K444-L447 PolarHBondContact O-N 3.36Å; K444-Q448 WeakPolarHBondContact O-CG 3.32Å; K444-Q448 PolarHBondContact O-N 2.96Å; K444-Q448 VanDerWaalsContact O-N 3.09Å
445	F	95.8	Very high	96	Very high	69 Å²	69	48.9 Å²	48.9	30%	0.303	25%	0.248	S	C	.	.	H	α-helix	trans	-70.6	-36.2	-179.1	-77.5	-67.3	0	0	0	112.5	D395 C399 V441 E442 R443 Q448 K449	D395-F445 HydrophobicContact CB-CE2 4.27Å; D395-F445 HydrophobicContact CB-CZ 4.43Å; C399-F445 WeakPolarHBondContact SG-CE2 3.46Å; V441-F445 HydrophobicContact CG1-CD2 3.54Å; V441-F445 HydrophobicContact CG1-CE2 3.47Å; V441-F445 VanDerWaalsContact CG1-CE2 3.47Å; V441-F445 VanDerWaalsContact O-CD2 3.31Å; V441-F445 WeakPolarHBondContact O-CD2 3.42Å; V441-F445 PolarHBondContact O-N 3.11Å; E442-F445 PolarHBondContact O-N 3.26Å; R443-F445 PolarHBondContact O-N 3.45Å; F445-Q448 PolarHBondContact O-N 3.01Å; F445-K449 WeakPolarHBondContact O-CB 3.39Å; F445-K449 PolarHBondContact O-N 3.23Å
446	A	97.1	Very high	95.8	Very high	3 Å²	3	51.2 Å²	51.2	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-45	173.9	0	0	0	0	0	111.6	E442 R443 K449 M450 L485 I489 L512	E442-A446 VanDerWaalsContact O-CB 3.26Å; E442-A446 WeakPolarHBondContact O-CB 3.39Å; E442-A446 PolarHBondContact O-N 2.94Å; R443-A446 PolarHBondContact O-N 3.2Å; A446-K449 PolarHBondContact O-N 3.27Å; A446-M450 HydrophobicContact CB-CE 4.43Å; A446-M450 WeakPolarHBondContact O-CG 3.16Å; A446-M450 PolarHBondContact O-N 2.68Å; A446-L485 HydrophobicContact CB-CD2 4.16Å; A446-I489 HydrophobicContact CB-CD1 4.15Å; A446-L512 HydrophobicContact CB-CD1 3.76Å; A446-L512 HydrophobicContact CB-CD2 3.78Å; A446-L512 HydrophobicContact CB-CG 4.45Å
447	L	96.9	Very high	95.3	Very high	42 Å²	42	57.1 Å²	57.1	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-43.6	176.6	-71.3	175.3	0	0	0	112.4	R443 K444 K449 M450 D451 L512 D515 R519	R443-L447 HydrophobicContact CG-CD1 4.02Å; R443-L447 HydrophobicContact CG-CG 4.41Å; R443-L447 WeakPolarHBondContact O-CB 3.49Å; R443-L447 VanDerWaalsContact O-CG 3.31Å; R443-L447 WeakPolarHBondContact O-CG 3.37Å; R443-L447 PolarHBondContact O-N 3.26Å; K444-L447 PolarHBondContact O-N 3.36Å; L447-K449 VanDerWaalsContact C-N 3.33Å; L447-K449 PolarHBondContact O-N 3.03Å; L447-M450 HydrophobicContact CD2-CE 4.41Å; L447-M450 WeakPolarHBondContact O-CB 3.49Å; L447-M450 PolarHBondContact O-N 3.47Å; L447-D451 PolarHBondContact O-N 3.31Å; L447-D451 VanDerWaalsContact O-OD2 3.11Å; L447-L512 HydrophobicContact CD2-CD2 4.2Å; L447-L512 HydrophobicContact CG-CD2 4.33Å; L447-D515 HydrophobicContact CD2-CB 4.26Å; L447-R519 PolarHBondContact O-NH1 3.01Å
448	Q	95.9	Very high	95	Very high	95 Å²	95	56.5 Å²	56.5	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-41.6	174.9	-73.5	177	-9.9	0	0	112.1	K444 F445 M450 D451 S452	K444-Q448 WeakPolarHBondContact O-CG 3.32Å; K444-Q448 PolarHBondContact O-N 2.96Å; K444-Q448 VanDerWaalsContact O-N 3.09Å; F445-Q448 PolarHBondContact O-N 3.01Å; Q448-M450 VanDerWaalsContact C-N 3.33Å; Q448-D451 PolarHBondContact O-N 3.21Å; Q448-S452 WeakPolarHBondContact O-CB 3.13Å; Q448-S452 PolarHBondContact O-N 3.3Å
449	K	95.3	Very high	94.8	Very high	106 Å²	106	56.4 Å²	56.4	46%	0.461	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-41.9	176.5	-175.9	61.6	176.6	179.1	0	111	F445 A446 L447 S452 M453 L485	F445-K449 WeakPolarHBondContact O-CB 3.39Å; F445-K449 PolarHBondContact O-N 3.23Å; A446-K449 PolarHBondContact O-N 3.27Å; L447-K449 VanDerWaalsContact C-N 3.33Å; L447-K449 PolarHBondContact O-N 3.03Å; K449-S452 PolarHBondContact O-N 2.61Å; K449-M453 VanDerWaalsContact O-CG 3.22Å; K449-M453 WeakPolarHBondContact O-CG 3.39Å; K449-M453 PolarHBondContact O-N 3.39Å; K449-L485 HydrophobicContact CB-CD2 4.32Å; K449-L485 HydrophobicContact CG-CD1 4.49Å; K449-L485 HydrophobicContact CG-CD2 4.3Å
450	M	95.3	Very high	94.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-40.4	174.5	-75.9	-173	-130.1	0	0	113.7	A446 L447 Q448 M453 L454 F482 L485 L512 F516	A446-M450 HydrophobicContact CB-CE 4.43Å; A446-M450 WeakPolarHBondContact O-CG 3.16Å; A446-M450 PolarHBondContact O-N 2.68Å; L447-M450 HydrophobicContact CD2-CE 4.41Å; L447-M450 WeakPolarHBondContact O-CB 3.49Å; L447-M450 PolarHBondContact O-N 3.47Å; Q448-M450 VanDerWaalsContact C-N 3.33Å; M450-M453 VanDerWaalsContact CA-SD 3.58Å; M450-M453 HydrophobicContact CB-SD 4.42Å; M450-M453 HydrophobicContact CG-SD 4.29Å; M450-M453 WeakPolarHBondContact O-CG 3.12Å; M450-L454 WeakPolarHBondContact O-CG 3.39Å; M450-L454 PolarHBondContact O-N 2.95Å; M450-L454 VanDerWaalsContact O-N 3.14Å; M450-F482 HydrophobicContact CE-CD2 4.32Å; M450-F482 HydrophobicContact CE-CE2 3.66Å; M450-F482 HydrophobicContact CG-CD2 3.98Å; M450-F482 HydrophobicContact CG-CE2 4.2Å; M450-F482 HydrophobicContact SD-CD2 4.05Å; M450-F482 HydrophobicContact SD-CE2 3.7Å; M450-L485 HydrophobicContact CE-CD2 4.34Å; M450-L485 HydrophobicContact CG-CD2 4.15Å; M450-L512 HydrophobicContact CE-CB 3.62Å; M450-L512 HydrophobicContact CE-CD1 4.42Å; M450-L512 HydrophobicContact CE-CD2 3.33Å; M450-L512 HydrophobicContact CE-CG 3.92Å; M450-F516 HydrophobicContact CG-CD2 4.22Å; M450-F516 HydrophobicContact SD-CB 4.07Å; M450-F516 HydrophobicContact SD-CD2 3.97Å; M450-F516 HydrophobicContact SD-CG 4.49Å
451	D	94.1	Very high	94.3	Very high	73 Å²	73	56 Å²	56	39%	0.39	30%	0.295	S	S	.	.	H	α-helix	trans	-67.8	-42.3	176.4	-68.9	-39.1	0	0	0	111.1	L447 Q448 M453 S455 R519	L447-D451 PolarHBondContact O-N 3.31Å; L447-D451 VanDerWaalsContact O-OD2 3.11Å; Q448-D451 PolarHBondContact O-N 3.21Å; D451-M453 PolarHBondContact O-N 3.22Å; D451-S455 WeakPolarHBondContact O-CB 3.31Å; D451-S455 PolarHBondContact O-N 2.92Å; D451-S455 VanDerWaalsContact O-N 3.15Å; D451-S455 PolarHBondContact O-OG 3.25Å; D451-R519 VanDerWaalsContact CG-NH2 3.31Å; D451-R519 IonicContact OD1-CZ 3.64Å; D451-R519 IonicContact OD1-NE 2.62Å; D451-R519 IonicContact OD1-NH1 3.98Å; D451-R519 PolarHBondContact OD1-NH1 3.41Å; D451-R519 VanDerWaalsContact OD1-NH1 3.16Å; D451-R519 IonicContact OD1-NH2 3.65Å; D451-R519 PolarHBondContact OD1-NH2 2.85Å; D451-R519 IonicContact OD2-CZ 2.98Å; D451-R519 IonicContact OD2-NH1 3.33Å; D451-R519 IonicContact OD2-NH2 2.87Å; D451-R519 PolarHBondContact OD2-NH2 3.43Å
452	S	95.4	Very high	93.7	Very high	79 Å²	79	57 Å²	57	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-61.6	-42.9	177	174.6	0	0	0	0	112.4	Q448 K449 S455 S456	Q448-S452 WeakPolarHBondContact O-CB 3.13Å; Q448-S452 PolarHBondContact O-N 3.3Å; K449-S452 PolarHBondContact O-N 2.61Å; S452-S455 PolarHBondContact O-N 3Å; S452-S456 PolarHBondContact O-N 3.43Å
453	M	94.8	Very high	92.5	Very high	9 Å²	9	60.7 Å²	60.7	4%	0.044	32%	0.319	C	S	.	.	H	α-helix	trans	-73.1	-37.4	-178.5	62.9	-169.1	-73.6	0	0	113.2	K449 M450 D451 S455 S456 A459 C478 T481 F482 F516	K449-M453 VanDerWaalsContact O-CG 3.22Å; K449-M453 WeakPolarHBondContact O-CG 3.39Å; K449-M453 PolarHBondContact O-N 3.39Å; M450-M453 VanDerWaalsContact CA-SD 3.58Å; M450-M453 HydrophobicContact CB-SD 4.42Å; M450-M453 HydrophobicContact CG-SD 4.29Å; M450-M453 WeakPolarHBondContact O-CG 3.12Å; D451-M453 PolarHBondContact O-N 3.22Å; M453-S455 PolarHBondContact O-N 3.47Å; M453-S456 VanDerWaalsContact O-CB 3.29Å; M453-S456 WeakPolarHBondContact O-CB 3.11Å; M453-S456 PolarHBondContact O-N 3.21Å; M453-A459 VanDerWaalsContact O-CB 3.28Å; M453-A459 WeakPolarHBondContact O-CB 3.47Å; M453-C478 HydrophobicContact CE-CB 3.99Å; M453-C478 WeakPolarHBondContact CE-O 3.1Å; M453-T481 HydrophobicContact CB-CG2 4.28Å; M453-T481 HydrophobicContact CE-CG2 3.75Å; M453-T481 HydrophobicContact SD-CG2 4.01Å; M453-F482 HydrophobicContact CE-CB 3.72Å; M453-F482 HydrophobicContact SD-CB 4.39Å; M453-F516 HydrophobicContact CE-CE2 4.28Å; M453-F516 HydrophobicContact CE-CZ 4.48Å
454	L	93.3	Very high	91.3	Very high	21 Å²	21	60.2 Å²	60.2	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-70.1	-24.5	175.8	-72	174.1	0	0	0	112.7	M450 S456 W460 C478 F516 R519 L520	M450-L454 WeakPolarHBondContact O-CG 3.39Å; M450-L454 PolarHBondContact O-N 2.95Å; M450-L454 VanDerWaalsContact O-N 3.14Å; L454-S456 VanDerWaalsContact C-N 3.33Å; L454-W460 HydrophobicContact CD2-CH2 3.69Å; L454-W460 HydrophobicContact CD2-CZ2 3.85Å; L454-C478 HydrophobicContact CD2-CB 4.16Å; L454-F516 HydrophobicContact CD1-CD2 4.49Å; L454-F516 HydrophobicContact CD1-CE2 4.13Å; L454-F516 HydrophobicContact CD2-CE2 3.93Å; L454-F516 HydrophobicContact CD2-CZ 4.16Å; L454-F516 HydrophobicContact CG-CE2 4.06Å; L454-R519 HydrophobicContact CD1-CB 3.77Å; L454-R519 HydrophobicContact CD1-CG 4.39Å; L454-L520 HydrophobicContact CD2-CD2 4.45Å
455	S	92.1	Very high	89.9	Confident	102 Å²	102	62.8 Å²	62.8	71%	0.713	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.9	175.7	-55.1	0	0	0	0	113.5	D451 S452 M453	D451-S455 WeakPolarHBondContact O-CB 3.31Å; D451-S455 PolarHBondContact O-N 2.92Å; D451-S455 VanDerWaalsContact O-N 3.15Å; D451-S455 PolarHBondContact O-OG 3.25Å; S452-S455 PolarHBondContact O-N 3Å; M453-S455 PolarHBondContact O-N 3.47Å
456	S	93.8	Very high	88.4	Confident	49 Å²	49	67 Å²	67	34%	0.343	36%	0.355	S	S	.	.	S	Bend	trans	-67.4	140.5	178.4	-179.3	0	0	0	0	111.3	S452 M453 L454 A458 A459	S452-S456 PolarHBondContact O-N 3.43Å; M453-S456 VanDerWaalsContact O-CB 3.29Å; M453-S456 WeakPolarHBondContact O-CB 3.11Å; M453-S456 PolarHBondContact O-N 3.21Å; L454-S456 VanDerWaalsContact C-N 3.33Å; S456-A458 PolarHBondContact O-N 2.72Å; S456-A458 PolarHBondContact OG-N 2.73Å; S456-A459 WeakPolarHBondContact O-CB 2.9Å; S456-A459 PolarHBondContact O-N 2.82Å; S456-A459 VanDerWaalsContact O-N 3.16Å
457	E	86.1	Confident	87	Confident	198 Å²	198	71.1 Å²	71.1	93%	0.925	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.7	175.4	-65.3	-176.2	173.9	0	0	112.2
458	A	89.9	Confident	85	Confident	47 Å²	47	75.3 Å²	75.3	39%	0.388	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-5.3	-179.7	0	0	0	0	0	113.9	S456 W460 V461	S456-A458 PolarHBondContact O-N 2.72Å; S456-A458 PolarHBondContact OG-N 2.73Å; A458-W460 PolarHBondContact O-N 2.9Å; A458-V461 PolarHBondContact O-N 3.36Å
459	A	93.1	Very high	83.1	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-37.8	-169	0	0	0	0	0	114.3	M453 S456 P476 D477 C478	M453-A459 VanDerWaalsContact O-CB 3.28Å; M453-A459 WeakPolarHBondContact O-CB 3.47Å; S456-A459 WeakPolarHBondContact O-CB 2.9Å; S456-A459 PolarHBondContact O-N 2.82Å; S456-A459 VanDerWaalsContact O-N 3.16Å; A459-P476 WeakPolarHBondContact O-CB 3.19Å; A459-D477 PolarHBondContact O-N 2.87Å; A459-C478 HydrophobicContact CB-CB 4.06Å; A459-C478 WeakPolarHBondContact O-CB 3.39Å; A459-C478 PolarHBondContact O-N 3.12Å; A459-C478 PolarHBondContact O-SG 3.19Å
460	W	94	Very high	81.3	Confident	21 Å²	21	76.9 Å²	76.9	8%	0.08	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-2.4	-173.5	-50.5	101.9	0	0	0	113.4	L454 A458 L520 V523 F534 R535 A538 I539	L454-W460 HydrophobicContact CD2-CH2 3.69Å; L454-W460 HydrophobicContact CD2-CZ2 3.85Å; A458-W460 PolarHBondContact O-N 2.9Å; W460-L520 HydrophobicContact CH2-CD2 3.86Å; W460-L520 HydrophobicContact CZ3-CD2 3.93Å; W460-V523 HydrophobicContact CH2-CB 4.41Å; W460-V523 HydrophobicContact CH2-CG1 4.09Å; W460-V523 HydrophobicContact CH2-CG2 4.47Å; W460-V523 HydrophobicContact CZ2-CB 4.43Å; W460-V523 HydrophobicContact CZ2-CG1 3.8Å; W460-V523 HydrophobicContact CZ2-CG2 4.3Å; W460-F534 HydrophobicContact CB-CE1 4.16Å; W460-F534 VanDerWaalsContact O-CZ 3.26Å; W460-F534 WeakPolarHBondContact O-CZ 3.43Å; W460-R535 HydrophobicContact CB-CG 4.44Å; W460-R535 HydrophobicContact CD2-CG 3.97Å; W460-R535 VanDerWaalsContact CE2-NE 3.32Å; W460-R535 HydrophobicContact CG-CG 3.88Å; W460-R535 VanDerWaalsContact NE1-NH2 3.15Å; W460-A538 HydrophobicContact CB-CB 4.05Å; W460-A538 HydrophobicContact CE3-CB 4.39Å; W460-A538 WeakPolarHBondContact O-CB 3.48Å; W460-I539 HydrophobicContact CE3-CG1 3.84Å; W460-I539 HydrophobicContact CH2-CG1 3.9Å; W460-I539 HydrophobicContact CZ3-CB 4.4Å; W460-I539 HydrophobicContact CZ3-CD1 4.36Å; W460-I539 HydrophobicContact CZ3-CG1 3.35Å
461	V	90.7	Very high	79.8	Confident	54 Å²	54	78.1 Å²	78.1	33%	0.327	43%	0.429	S	S	.	.	S	Bend	trans	-86.5	139.5	178.8	-174.7	0	0	0	0	108.4	A458 Q463 K465 D477	A458-V461 PolarHBondContact O-N 3.36Å; V461-Q463 PolarHBondContact O-N 2.89Å; V461-K465 HydrophobicContact CG1-CD 4.28Å; V461-D477 PolarHBondContact O-N 3.26Å
462	S	84.1	Confident	78.9	Confident	21 Å²	21	82.1 Å²	82.1	15%	0.147	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-64.3	131.9	172.7	170.8	0	0	0	0	110.6	Y464 K465 D471 V475	S462-Y464 PolarHBondContact O-N 3.49Å; S462-Y464 PolarHBondContact OG-N 3.27Å; S462-K465 PolarHBondContact O-N 3.27Å; S462-D471 VanDerWaalsContact CB-OD2 3.27Å; S462-D471 WeakPolarHBondContact CB-OD2 3.25Å; S462-D471 PolarHBondContact OG-OD1 3.25Å; S462-D471 PolarHBondContact OG-OD2 3.42Å; S462-V475 VanDerWaalsContact CA-O 3.31Å; S462-V475 WeakPolarHBondContact CA-O 3.47Å
463	Q	70.9	Confident	78.2	Confident	99 Å²	99	81.5 Å²	81.5	46%	0.463	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.6	178.4	-168.7	-178.6	13.4	0	0	112.4	V461 V475	V461-Q463 PolarHBondContact O-N 2.89Å; Q463-V475 PolarHBondContact N-O 3.48Å
464	Y	72.9	Confident	77.9	Confident	81 Å²	81	83.6 Å²	83.6	32%	0.318	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	22.3	-173.7	-56.9	-71.1	0	0	0	112.9	S462 D466 I467 V470	S462-Y464 PolarHBondContact O-N 3.49Å; S462-Y464 PolarHBondContact OG-N 3.27Å; Y464-D466 PolarHBondContact O-N 3.18Å; Y464-I467 HydrophobicContact CD1-CD1 4.38Å; Y464-I467 PolarHBondContact O-N 3.21Å; Y464-V470 HydrophobicContact CD1-CG1 4.39Å; Y464-V470 HydrophobicContact CG-CG1 4.37Å
465	K	66.8	Low	77.8	Confident	149 Å²	149	83.1 Å²	83.1	65%	0.648	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-28.2	-175.5	-171.9	-179.4	177.4	-173.4	0	114.6	V461 S462	V461-K465 HydrophobicContact CG1-CD 4.28Å; S462-K465 PolarHBondContact O-N 3.27Å
466	D	64.9	Low	77.9	Confident	159 Å²	159	78.3 Å²	78.3	85%	0.85	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	2	-178.8	-60.9	-35.9	0	0	0	113.8	Y464	Y464-D466 PolarHBondContact O-N 3.18Å
467	I	67.7	Low	77.9	Confident	89 Å²	89	77.9 Å²	77.9	46%	0.456	40%	0.401	S	S	.	.			trans	-123.9	89.4	-176.4	-47.1	177.9	0	0	0	109.2	Y464 D469 V470	Y464-I467 HydrophobicContact CD1-CD1 4.38Å; Y464-I467 PolarHBondContact O-N 3.21Å; I467-D469 PolarHBondContact O-N 3.48Å; I467-D469 VanDerWaalsContact O-N 3.15Å; I467-V470 HydrophobicContact CB-CB 4.31Å; I467-V470 HydrophobicContact CB-CG2 4.46Å; I467-V470 HydrophobicContact CG2-CB 3.8Å; I467-V470 HydrophobicContact CG2-CG2 3.45Å; I467-V470 VanDerWaalsContact CG2-CG2 3.45Å; I467-V470 PolarHBondContact O-N 3.09Å
468	T	54.1	Low	78.3	Confident	130 Å²	130	68.4 Å²	68.4	80%	0.798	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.5	-170.8	48.9	0	0	0	0	115.1
469	D	56.2	Low	78.6	Confident	145 Å²	145	66.2 Å²	66.2	78%	0.775	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-0.1	-175.1	-60.9	-9.8	0	0	0	112.9	I467	I467-D469 PolarHBondContact O-N 3.48Å; I467-D469 VanDerWaalsContact O-N 3.15Å
470	V	57.4	Low	78.6	Confident	89 Å²	89	68.3 Å²	68.3	54%	0.539	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-28.2	-174.1	178.3	0	0	0	0	112.6	Y464 I467 E472	Y464-V470 HydrophobicContact CD1-CG1 4.39Å; Y464-V470 HydrophobicContact CG-CG1 4.37Å; I467-V470 HydrophobicContact CB-CB 4.31Å; I467-V470 HydrophobicContact CB-CG2 4.46Å; I467-V470 HydrophobicContact CG2-CB 3.8Å; I467-V470 HydrophobicContact CG2-CG2 3.45Å; I467-V470 VanDerWaalsContact CG2-CG2 3.45Å; I467-V470 PolarHBondContact O-N 3.09Å; V470-E472 PolarHBondContact O-N 2.96Å
471	D	63.9	Low	78.7	Confident	25 Å²	25	69 Å²	69	13%	0.134	36%	0.355	C	S	.	.			trans	-95.2	49.9	-172.9	-163.6	23.9	0	0	0	114.5	S462 M473 K474 V475	S462-D471 VanDerWaalsContact CB-OD2 3.27Å; S462-D471 WeakPolarHBondContact CB-OD2 3.25Å; S462-D471 PolarHBondContact OG-OD1 3.25Å; S462-D471 PolarHBondContact OG-OD2 3.42Å; D471-M473 PolarHBondContact O-N 2.94Å; D471-K474 VanDerWaalsContact CG-CA 3.5Å; D471-K474 PolarHBondContact O-N 3.22Å; D471-K474 WeakPolarHBondContact OD1-CA 3.39Å; D471-K474 PolarHBondContact OD1-N 3.05Å; D471-K474 WeakPolarHBondContact OD2-CA 3.39Å; D471-V475 PolarHBondContact OD1-N 3.05Å; D471-V475 VanDerWaalsContact OD1-N 3.15Å
472	E	74.1	Confident	79.1	Confident	158 Å²	158	66.4 Å²	66.4	74%	0.738	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-29.5	178.8	-67.8	-168.8	165.1	0	0	112.6	V470 C667	V470-E472 PolarHBondContact O-N 2.96Å; E472-C667 WeakPolarHBondContact O-CB 3.24Å
473	M	81.2	Confident	79.7	Confident	66 Å²	66	65.6 Å²	65.6	33%	0.325	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-6.8	-176.3	-71.5	-69.8	-170	0	0	114.4	D471 V475 T548 C667	D471-M473 PolarHBondContact O-N 2.94Å; M473-V475 VanDerWaalsContact C-N 3.29Å; M473-V475 HydrophobicContact CB-CG2 3.54Å; M473-V475 PolarHBondContact O-N 3.45Å; M473-T548 HydrophobicContact CE-CG2 4.31Å; M473-C667 VanDerWaalsContact C-CB 3.48Å; M473-C667 VanDerWaalsContact O-CB 3.3Å; M473-C667 WeakPolarHBondContact O-CB 3.39Å
474	K	88.7	Confident	80.9	Confident	52 Å²	52	64.1 Å²	64.1	23%	0.226	33%	0.331	C	S	.	.			trans	49	49.1	-179.1	-62.5	-170.3	-171.1	169.1	0	113.2	D471 P476 N541 E663 Q664 L666 C667	D471-K474 VanDerWaalsContact CG-CA 3.5Å; D471-K474 PolarHBondContact O-N 3.22Å; D471-K474 WeakPolarHBondContact OD1-CA 3.39Å; D471-K474 PolarHBondContact OD1-N 3.05Å; D471-K474 WeakPolarHBondContact OD2-CA 3.39Å; K474-P476 WeakPolarHBondContact O-CD 3.45Å; K474-N541 VanDerWaalsContact CB-ND2 3.35Å; K474-N541 WeakPolarHBondContact CB-ND2 3.4Å; K474-N541 WeakPolarHBondContact O-CB 3.47Å; K474-N541 PolarHBondContact O-ND2 2.89Å; K474-E663 PolarHBondContact NZ-O 3.37Å; K474-Q664 PolarHBondContact NZ-O 2.89Å; K474-L666 WeakPolarHBondContact CD-O 3.48Å; K474-L666 VanDerWaalsContact CE-O 3.27Å; K474-L666 WeakPolarHBondContact CE-O 3.46Å; K474-L666 PolarHBondContact NZ-O 3.4Å; K474-C667 HydrophobicContact CB-CB 4.38Å
475	V	91.2	Very high	82	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.067	32%	0.323	C	S	.	.			trans	-74.7	118.6	-167.7	-175	0	0	0	0	110.5	S462 Q463 D471 M473 A479 E480 Y545	S462-V475 VanDerWaalsContact CA-O 3.31Å; S462-V475 WeakPolarHBondContact CA-O 3.47Å; Q463-V475 PolarHBondContact N-O 3.48Å; D471-V475 PolarHBondContact OD1-N 3.05Å; D471-V475 VanDerWaalsContact OD1-N 3.15Å; M473-V475 VanDerWaalsContact C-N 3.29Å; M473-V475 HydrophobicContact CB-CG2 3.54Å; M473-V475 PolarHBondContact O-N 3.45Å; V475-A479 HydrophobicContact CG1-CB 4.07Å; V475-E480 HydrophobicContact CG1-CB 4.26Å; V475-Y545 HydrophobicContact CB-CG 4.42Å; V475-Y545 HydrophobicContact CG1-CD1 3.47Å; V475-Y545 VanDerWaalsContact CG1-CD1 3.47Å; V475-Y545 HydrophobicContact CG1-CD2 4.15Å; V475-Y545 HydrophobicContact CG1-CE1 3.57Å; V475-Y545 HydrophobicContact CG1-CE2 4.27Å; V475-Y545 HydrophobicContact CG1-CG 3.75Å; V475-Y545 HydrophobicContact CG2-CD1 4.36Å; V475-Y545 HydrophobicContact CG2-CD2 3.51Å; V475-Y545 HydrophobicContact CG2-CE2 3.82Å; V475-Y545 HydrophobicContact CG2-CG 3.81Å
476	P	93.9	Very high	83.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-68.1	147.7	174.5	-18.6	32.9	0	0	0	112.2	A459 K474 C478 A479 E480 A538 A542	A459-P476 WeakPolarHBondContact O-CB 3.19Å; K474-P476 WeakPolarHBondContact O-CD 3.45Å; P476-C478 PolarHBondContact O-N 2.92Å; P476-C478 VanDerWaalsContact O-N 3.13Å; P476-A479 WeakPolarHBondContact O-CB 3.36Å; P476-A479 PolarHBondContact O-N 2.99Å; P476-E480 PolarHBondContact O-N 3.41Å; P476-A538 HydrophobicContact CG-CB 4.13Å; P476-A538 WeakPolarHBondContact CG-O 3.42Å; P476-A542 HydrophobicContact CG-CB 4.06Å
477	D	93.6	Very high	85	Confident	40 Å²	40	51.1 Å²	51.1	21%	0.214	27%	0.274	C	S	.	.	H	α-helix	trans	-51.8	-37.1	178.1	-179	68.3	0	0	0	113.2	A459 V461 A479 E480 T481	A459-D477 PolarHBondContact O-N 2.87Å; V461-D477 PolarHBondContact O-N 3.26Å; D477-A479 VanDerWaalsContact C-N 3.35Å; D477-A479 PolarHBondContact O-N 3.37Å; D477-E480 PolarHBondContact O-N 3.14Å; D477-T481 VanDerWaalsContact O-CB 3.26Å; D477-T481 WeakPolarHBondContact O-CB 3.37Å; D477-T481 PolarHBondContact O-N 3.5Å; D477-T481 PolarHBondContact O-OG1 3.14Å
478	C	95.8	Very high	86.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-31.1	176.7	73.7	0	0	0	0	113	M453 L454 A459 P476 F482	M453-C478 HydrophobicContact CE-CB 3.99Å; M453-C478 WeakPolarHBondContact CE-O 3.1Å; L454-C478 HydrophobicContact CD2-CB 4.16Å; A459-C478 HydrophobicContact CB-CB 4.06Å; A459-C478 WeakPolarHBondContact O-CB 3.39Å; A459-C478 PolarHBondContact O-N 3.12Å; A459-C478 PolarHBondContact O-SG 3.19Å; P476-C478 PolarHBondContact O-N 2.92Å; P476-C478 VanDerWaalsContact O-N 3.13Å; C478-F482 VanDerWaalsContact O-CB 3.23Å; C478-F482 WeakPolarHBondContact O-CB 3.37Å; C478-F482 PolarHBondContact O-N 3.23Å
479	A	95.9	Very high	88.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-73.4	-42.7	177.9	0	0	0	0	0	110.3	V475 P476 D477 F482 M483 A542 Y545 I546	V475-A479 HydrophobicContact CG1-CB 4.07Å; P476-A479 WeakPolarHBondContact O-CB 3.36Å; P476-A479 PolarHBondContact O-N 2.99Å; D477-A479 VanDerWaalsContact C-N 3.35Å; D477-A479 PolarHBondContact O-N 3.37Å; A479-F482 PolarHBondContact O-N 2.94Å; A479-M483 WeakPolarHBondContact O-CG 3.39Å; A479-M483 PolarHBondContact O-N 2.9Å; A479-A542 HydrophobicContact CB-CB 3.69Å; A479-Y545 HydrophobicContact CB-CD1 3.87Å; A479-Y545 HydrophobicContact CB-CE1 4.49Å; A479-I546 HydrophobicContact CB-CD1 4.34Å; A479-I546 HydrophobicContact CB-CG1 4.4Å
480	E	93.3	Very high	90.3	Very high	44 Å²	44	38.1 Å²	38.1	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-47.2	179.3	-175.6	66.3	-175.2	0	0	112.6	V475 P476 D477 F482 M483 T484 Y545	V475-E480 HydrophobicContact CG1-CB 4.26Å; P476-E480 PolarHBondContact O-N 3.41Å; D477-E480 PolarHBondContact O-N 3.14Å; E480-F482 PolarHBondContact O-N 3.03Å; E480-M483 PolarHBondContact O-N 2.88Å; E480-T484 WeakPolarHBondContact O-CB 3.4Å; E480-T484 PolarHBondContact O-N 3.09Å; E480-T484 PolarHBondContact O-OG1 3.27Å; E480-Y545 WeakPolarHBondContact OE2-CE1 3.35Å; E480-Y545 VanDerWaalsContact OE2-CZ 3.24Å; E480-Y545 PolarHBondContact OE2-OH 3.08Å
481	T	95.8	Very high	92.1	Very high	35 Å²	35	36.3 Å²	36.3	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-32.7	177.2	-64.8	0	0	0	0	111	M453 D477 L485	M453-T481 HydrophobicContact CB-CG2 4.28Å; M453-T481 HydrophobicContact CE-CG2 3.75Å; M453-T481 HydrophobicContact SD-CG2 4.01Å; D477-T481 VanDerWaalsContact O-CB 3.26Å; D477-T481 WeakPolarHBondContact O-CB 3.37Å; D477-T481 PolarHBondContact O-N 3.5Å; D477-T481 PolarHBondContact O-OG1 3.14Å; T481-L485 WeakPolarHBondContact O-CB 3.5Å; T481-L485 PolarHBondContact O-N 3.22Å
482	F	97.8	Very high	93.6	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-73	-45.6	179.6	175	-106.8	0	0	0	110.4	M450 M453 C478 A479 E480 T484 L485 L486 L512 V513 F516 I546	M450-F482 HydrophobicContact CE-CD2 4.32Å; M450-F482 HydrophobicContact CE-CE2 3.66Å; M450-F482 HydrophobicContact CG-CD2 3.98Å; M450-F482 HydrophobicContact CG-CE2 4.2Å; M450-F482 HydrophobicContact SD-CD2 4.05Å; M450-F482 HydrophobicContact SD-CE2 3.7Å; M453-F482 HydrophobicContact CE-CB 3.72Å; M453-F482 HydrophobicContact SD-CB 4.39Å; C478-F482 VanDerWaalsContact O-CB 3.23Å; C478-F482 WeakPolarHBondContact O-CB 3.37Å; C478-F482 PolarHBondContact O-N 3.23Å; A479-F482 PolarHBondContact O-N 2.94Å; E480-F482 PolarHBondContact O-N 3.03Å; F482-T484 VanDerWaalsContact C-N 3.28Å; F482-T484 PolarHBondContact O-N 3.33Å; F482-L485 WeakPolarHBondContact O-CB 3.35Å; F482-L485 PolarHBondContact O-N 3.05Å; F482-L485 VanDerWaalsContact O-N 3.14Å; F482-L486 HydrophobicContact CD1-CD1 4.31Å; F482-L486 HydrophobicContact CE1-CD1 3.61Å; F482-L486 HydrophobicContact CE1-CG 4.09Å; F482-L486 HydrophobicContact CE2-CD2 4.16Å; F482-L486 HydrophobicContact CE2-CG 4.3Å; F482-L486 HydrophobicContact CZ-CD1 3.76Å; F482-L486 HydrophobicContact CZ-CD2 3.93Å; F482-L486 HydrophobicContact CZ-CG 3.93Å; F482-L486 WeakPolarHBondContact O-CG 3.49Å; F482-L486 PolarHBondContact O-N 3.49Å; F482-L512 WeakPolarHBondContact CZ-O 3.38Å; F482-V513 HydrophobicContact CE1-CG2 4.34Å; F482-V513 HydrophobicContact CZ-CG2 4.19Å; F482-F516 HydrophobicContact CB-CD1 4.49Å; F482-F516 HydrophobicContact CB-CD2 4.49Å; F482-F516 HydrophobicContact CB-CE1 4.15Å; F482-F516 HydrophobicContact CB-CE2 4.15Å; F482-F516 HydrophobicContact CB-CZ 3.97Å; F482-F516 HydrophobicContact CD1-CB 4.44Å; F482-F516 AromaticContact CD1-CD1 3.66Å; F482-F516 HydrophobicContact CD1-CD1 3.66Å; F482-F516 HydrophobicContact CD1-CE1 4Å; F482-F516 AromaticContact CD1-CG 3.98Å; F482-F516 HydrophobicContact CD1-CG 3.98Å; F482-F516 HydrophobicContact CD2-CB 4.07Å; F482-F516 HydrophobicContact CD2-CD1 4.23Å; F482-F516 AromaticContact CD2-CD2 3.71Å; F482-F516 HydrophobicContact CD2-CD2 3.71Å; F482-F516 HydrophobicContact CD2-CE2 4.18Å; F482-F516 AromaticContact CD2-CG 3.74Å; F482-F516 HydrophobicContact CD2-CG 3.74Å; F482-F516 HydrophobicContact CE1-CB 3.97Å; F482-F516 AromaticContact CE1-CD1 3.88Å; F482-F516 HydrophobicContact CE1-CD1 3.88Å; F482-F516 HydrophobicContact CE1-CG 4.01Å; F482-F516 HydrophobicContact CE2-CB 3.57Å; F482-F516 HydrophobicContact CE2-CD1 4.43Å; F482-F516 HydrophobicContact CE2-CD2 4.08Å; F482-F516 AromaticContact CE2-CG 3.78Å; F482-F516 HydrophobicContact CE2-CG 3.78Å; F482-F516 HydrophobicContact CG-CB 4.49Å; F482-F516 AromaticContact CG-CD1 3.85Å; F482-F516 HydrophobicContact CG-CD1 3.85Å; F482-F516 HydrophobicContact CG-CD2 4Å; F482-F516 HydrophobicContact CG-CE1 4Å; F482-F516 HydrophobicContact CG-CE2 4.15Å; F482-F516 AromaticContact CG-CG 3.85Å; F482-F516 HydrophobicContact CG-CG 3.85Å; F482-F516 HydrophobicContact CG-CZ 4.15Å; F482-F516 HydrophobicContact CZ-CB 3.53Å; F482-F516 HydrophobicContact CZ-CD1 4.28Å; F482-F516 AromaticContact CZ-CG 3.93Å; F482-F516 HydrophobicContact CZ-CG 3.93Å; F482-I546 HydrophobicContact CD1-CD1 4.02Å
483	M	96.8	Very high	94.6	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.02	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-36.6	174.6	-65.4	-45	-66.7	0	0	111.9	A479 E480 L486 L487 Y545 I546 V549 L550 W553	A479-M483 WeakPolarHBondContact O-CG 3.39Å; A479-M483 PolarHBondContact O-N 2.9Å; E480-M483 PolarHBondContact O-N 2.88Å; M483-L486 HydrophobicContact CE-CD1 4.18Å; M483-L486 PolarHBondContact O-N 3.41Å; M483-L486 HydrophobicContact SD-CD1 4.07Å; M483-L487 WeakPolarHBondContact O-CG 3.48Å; M483-L487 PolarHBondContact O-N 2.8Å; M483-Y545 HydrophobicContact CB-CE1 4.48Å; M483-Y545 HydrophobicContact CG-CD1 4.42Å; M483-Y545 HydrophobicContact CG-CE1 3.83Å; M483-I546 HydrophobicContact CG-CG1 4.32Å; M483-I546 HydrophobicContact SD-CB 4.35Å; M483-I546 HydrophobicContact SD-CG1 3.99Å; M483-I546 HydrophobicContact SD-CG2 3.96Å; M483-V549 HydrophobicContact CE-CB 3.93Å; M483-V549 HydrophobicContact CE-CG1 3.46Å; M483-V549 VanDerWaalsContact CE-CG1 3.46Å; M483-L550 HydrophobicContact CE-CD2 4.06Å; M483-L550 HydrophobicContact CE-CG 4.31Å; M483-W553 HydrophobicContact CE-CD2 4.46Å; M483-W553 HydrophobicContact CE-CE3 4.35Å; M483-W553 HydrophobicContact CE-CH2 3.59Å; M483-W553 HydrophobicContact CE-CZ2 3.67Å; M483-W553 HydrophobicContact CE-CZ3 3.95Å
484	T	96.4	Very high	95.2	Very high	67 Å²	67	29.3 Å²	29.3	41%	0.411	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-43.2	172.6	-58.7	0	0	0	0	111.8	E480 F482 L486 L487 V488	E480-T484 WeakPolarHBondContact O-CB 3.4Å; E480-T484 PolarHBondContact O-N 3.09Å; E480-T484 PolarHBondContact O-OG1 3.27Å; F482-T484 VanDerWaalsContact C-N 3.28Å; F482-T484 PolarHBondContact O-N 3.33Å; T484-L486 VanDerWaalsContact C-N 3.32Å; T484-L486 PolarHBondContact O-N 2.62Å; T484-L487 PolarHBondContact O-N 3.41Å; T484-V488 WeakPolarHBondContact O-CG2 3.43Å; T484-V488 PolarHBondContact O-N 3.1Å
485	L	97.4	Very high	95.3	Very high	27 Å²	27	31.4 Å²	31.4	14%	0.141	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-44.5	174.2	174.1	65.4	0	0	0	111.2	A446 K449 M450 T481 F482 L487 V488 I489	A446-L485 HydrophobicContact CB-CD2 4.16Å; K449-L485 HydrophobicContact CB-CD2 4.32Å; K449-L485 HydrophobicContact CG-CD1 4.49Å; K449-L485 HydrophobicContact CG-CD2 4.3Å; M450-L485 HydrophobicContact CE-CD2 4.34Å; M450-L485 HydrophobicContact CG-CD2 4.15Å; T481-L485 WeakPolarHBondContact O-CB 3.5Å; T481-L485 PolarHBondContact O-N 3.22Å; F482-L485 WeakPolarHBondContact O-CB 3.35Å; F482-L485 PolarHBondContact O-N 3.05Å; F482-L485 VanDerWaalsContact O-N 3.14Å; L485-L487 PolarHBondContact O-N 3.21Å; L485-V488 PolarHBondContact O-N 3.23Å; L485-I489 HydrophobicContact CD1-CD1 4.35Å; L485-I489 HydrophobicContact CG-CD1 4.24Å; L485-I489 WeakPolarHBondContact O-CG1 3.19Å; L485-I489 PolarHBondContact O-N 3.43Å
486	L	97.7	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-39.5	176.9	-66.2	-171	0	0	0	112.3	F482 M483 T484 I489 T490 Q509 L512 V513 W553	F482-L486 HydrophobicContact CD1-CD1 4.31Å; F482-L486 HydrophobicContact CE1-CD1 3.61Å; F482-L486 HydrophobicContact CE1-CG 4.09Å; F482-L486 HydrophobicContact CE2-CD2 4.16Å; F482-L486 HydrophobicContact CE2-CG 4.3Å; F482-L486 HydrophobicContact CZ-CD1 3.76Å; F482-L486 HydrophobicContact CZ-CD2 3.93Å; F482-L486 HydrophobicContact CZ-CG 3.93Å; F482-L486 WeakPolarHBondContact O-CG 3.49Å; F482-L486 PolarHBondContact O-N 3.49Å; M483-L486 HydrophobicContact CE-CD1 4.18Å; M483-L486 PolarHBondContact O-N 3.41Å; M483-L486 HydrophobicContact SD-CD1 4.07Å; T484-L486 VanDerWaalsContact C-N 3.32Å; T484-L486 PolarHBondContact O-N 2.62Å; L486-I489 PolarHBondContact O-N 3.39Å; L486-T490 PolarHBondContact O-N 2.98Å; L486-T490 PolarHBondContact O-OG1 3.1Å; L486-Q509 HydrophobicContact CD2-CG 3.96Å; L486-Q509 PolarHBondContact O-NE2 3.34Å; L486-L512 HydrophobicContact CD2-CB 4.18Å; L486-V513 HydrophobicContact CD1-CG2 3.58Å; L486-W553 HydrophobicContact CB-CH2 3.73Å; L486-W553 HydrophobicContact CB-CZ3 3.81Å; L486-W553 HydrophobicContact CD1-CZ3 4.4Å
487	L	96.8	Very high	95.2	Very high	90 Å²	90	33.5 Å²	33.5	47%	0.471	18%	0.181	S	C	.	.	H	α-helix	trans	-61.9	-42.9	174.1	-75.3	173.6	0	0	0	112	M483 T484 L485 I489 T490 D491 W553	M483-L487 WeakPolarHBondContact O-CG 3.48Å; M483-L487 PolarHBondContact O-N 2.8Å; T484-L487 PolarHBondContact O-N 3.41Å; L485-L487 PolarHBondContact O-N 3.21Å; L487-I489 VanDerWaalsContact C-N 3.32Å; L487-I489 PolarHBondContact O-N 2.92Å; L487-T490 PolarHBondContact O-N 3.46Å; L487-D491 PolarHBondContact O-N 3.26Å; L487-W553 HydrophobicContact CB-CH2 4.44Å; L487-W553 HydrophobicContact CD1-CZ2 4.08Å; L487-W553 HydrophobicContact CD2-CH2 3.57Å; L487-W553 HydrophobicContact CD2-CZ2 3.19Å; L487-W553 HydrophobicContact CD2-CZ3 4.44Å; L487-W553 HydrophobicContact CG-CH2 3.56Å; L487-W553 HydrophobicContact CG-CZ2 3.35Å
488	V	95.9	Very high	95	Very high	76 Å²	76	34.6 Å²	34.6	46%	0.461	19%	0.189	S	C	.	.	H	α-helix	trans	-60.3	-44.9	175.6	170.6	0	0	0	0	110	T484 L485 T490 D491 R492	T484-V488 WeakPolarHBondContact O-CG2 3.43Å; T484-V488 PolarHBondContact O-N 3.1Å; L485-V488 PolarHBondContact O-N 3.23Å; V488-T490 PolarHBondContact O-N 3.35Å; V488-D491 PolarHBondContact O-N 3.42Å; V488-R492 WeakPolarHBondContact O-CD 3.39Å; V488-R492 WeakPolarHBondContact O-CG 3.24Å; V488-R492 PolarHBondContact O-N 2.97Å
489	I	96.4	Very high	94.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-46.3	175.7	-67.6	170	0	0	0	110.6	E442 A446 L485 L486 L487 D491 R492 Y493 L512	E442-I489 HydrophobicContact CG-CG1 4.47Å; A446-I489 HydrophobicContact CB-CD1 4.15Å; L485-I489 HydrophobicContact CD1-CD1 4.35Å; L485-I489 HydrophobicContact CG-CD1 4.24Å; L485-I489 WeakPolarHBondContact O-CG1 3.19Å; L485-I489 PolarHBondContact O-N 3.43Å; L486-I489 PolarHBondContact O-N 3.39Å; L487-I489 VanDerWaalsContact C-N 3.32Å; L487-I489 PolarHBondContact O-N 2.92Å; I489-D491 VanDerWaalsContact C-N 3.32Å; I489-D491 PolarHBondContact O-N 2.81Å; I489-R492 WeakPolarHBondContact O-CB 3.24Å; I489-R492 PolarHBondContact O-N 2.84Å; I489-R492 VanDerWaalsContact O-N 3.09Å; I489-Y493 HydrophobicContact CG2-CD1 4.17Å; I489-Y493 HydrophobicContact CG2-CE1 4.27Å; I489-Y493 WeakPolarHBondContact O-CD1 3.27Å; I489-Y493 PolarHBondContact O-N 2.82Å; I489-L512 HydrophobicContact CD1-CD1 3.36Å
490	T	96.5	Very high	94.6	Very high	14 Å²	14	39.7 Å²	39.7	9%	0.086	23%	0.228	C	C	.	.	H	α-helix	trans	-56.4	-43.8	175.5	-63.5	0	0	0	0	112.6	L486 L487 V488 R492 Y493 K494 Q509 F558 F559	L486-T490 PolarHBondContact O-N 2.98Å; L486-T490 PolarHBondContact O-OG1 3.1Å; L487-T490 PolarHBondContact O-N 3.46Å; V488-T490 PolarHBondContact O-N 3.35Å; T490-R492 PolarHBondContact O-N 2.85Å; T490-Y493 VanDerWaalsContact CA-CE1 3.47Å; T490-Y493 PolarHBondContact O-N 3.34Å; T490-K494 WeakPolarHBondContact O-CB 3.5Å; T490-K494 PolarHBondContact O-N 2.93Å; T490-Q509 PolarHBondContact OG1-NE2 3.27Å; T490-Q509 PolarHBondContact OG1-OE1 3.02Å; T490-F558 HydrophobicContact CG2-CD1 4.01Å; T490-F558 HydrophobicContact CG2-CE1 3.74Å; T490-F559 HydrophobicContact CG2-CE2 4.5Å; T490-F559 HydrophobicContact CG2-CZ 3.98Å
491	D	94.8	Very high	94.7	Very high	52 Å²	52	39 Å²	39	28%	0.278	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-31.3	178.3	-166.9	59.3	0	0	0	113	R410 L487 V488 I489 K494	R410-D491 IonicContact CZ-OD2 3.32Å; R410-D491 IonicContact NH1-OD2 2.79Å; R410-D491 IonicContact NH2-OD2 3.8Å; R410-D491 PolarHBondContact NH2-OD2 3.03Å; L487-D491 PolarHBondContact O-N 3.26Å; V488-D491 PolarHBondContact O-N 3.42Å; I489-D491 VanDerWaalsContact C-N 3.32Å; I489-D491 PolarHBondContact O-N 2.81Å; D491-K494 WeakPolarHBondContact OD1-CE 3.24Å; D491-K494 IonicContact OD1-NZ 2.69Å; D491-K494 PolarHBondContact OD1-NZ 3.17Å
492	R	94.7	Very high	94.7	Very high	25 Å²	25	39.4 Å²	39.4	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-74	-35.6	-178.1	-67.1	168.5	73.3	74.7	-6.5	113	D403 L406 W438 E442 V488 I489 T490	D403-R492 IonicContact OD1-CZ 2.71Å; D403-R492 IonicContact OD1-NH1 3.91Å; D403-R492 PolarHBondContact OD1-NH1 3.41Å; D403-R492 IonicContact OD1-NH2 2.61Å; D403-R492 PolarHBondContact OD1-NH2 2.83Å; L406-R492 HydrophobicContact CD1-CB 3.95Å; L406-R492 HydrophobicContact CD1-CG 3.68Å; W438-R492 HydrophobicContact CZ2-CB 4.14Å; E442-R492 WeakPolarHBondContact OE1-CD 3.35Å; E442-R492 IonicContact OE1-CZ 3.16Å; E442-R492 IonicContact OE1-NE 3.14Å; E442-R492 PolarHBondContact OE1-NE 2.69Å; E442-R492 IonicContact OE1-NH2 2.63Å; E442-R492 IonicContact OE2-CZ 3.19Å; E442-R492 VanDerWaalsContact OE2-CZ 3.3Å; E442-R492 IonicContact OE2-NE 3.58Å; E442-R492 PolarHBondContact OE2-NE 3.48Å; E442-R492 IonicContact OE2-NH2 2.62Å; E442-R492 PolarHBondContact OE2-NH2 2.93Å; V488-R492 WeakPolarHBondContact O-CD 3.39Å; V488-R492 WeakPolarHBondContact O-CG 3.24Å; V488-R492 PolarHBondContact O-N 2.97Å; I489-R492 WeakPolarHBondContact O-CB 3.24Å; I489-R492 PolarHBondContact O-N 2.84Å; I489-R492 VanDerWaalsContact O-N 3.09Å; T490-R492 PolarHBondContact O-N 2.85Å
493	Y	95.3	Very high	94.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-105	-13.8	-175.4	80.3	-103.3	0	0	0	114.7	I489 T490 N495 L496 K502 F505 Q509 F558 L562	I489-Y493 HydrophobicContact CG2-CD1 4.17Å; I489-Y493 HydrophobicContact CG2-CE1 4.27Å; I489-Y493 WeakPolarHBondContact O-CD1 3.27Å; I489-Y493 PolarHBondContact O-N 2.82Å; T490-Y493 VanDerWaalsContact CA-CE1 3.47Å; T490-Y493 PolarHBondContact O-N 3.34Å; Y493-N495 PolarHBondContact O-N 2.98Å; Y493-L496 WeakPolarHBondContact O-CB 3.46Å; Y493-L496 VanDerWaalsContact O-CG 3.28Å; Y493-L496 WeakPolarHBondContact O-CG 3.25Å; Y493-L496 PolarHBondContact O-N 2.72Å; Y493-K502 HydrophobicContact CD2-CB 4.06Å; Y493-K502 HydrophobicContact CD2-CG 4.35Å; Y493-K502 HydrophobicContact CE2-CB 4.27Å; Y493-F505 VanDerWaalsContact CB-CG 3.44Å; Y493-F505 HydrophobicContact CD1-CB 3.59Å; Y493-F505 HydrophobicContact CD1-CD1 4.05Å; Y493-F505 AromaticContact CD1-CG 3.95Å; Y493-F505 HydrophobicContact CD1-CG 3.95Å; Y493-F505 HydrophobicContact CD2-CB 3.74Å; Y493-F505 HydrophobicContact CE1-CB 4.14Å; Y493-F505 HydrophobicContact CE2-CB 4.26Å; Y493-F505 HydrophobicContact CG-CB 3.4Å; Y493-F505 HydrophobicContact CG-CD1 4.29Å; Y493-F505 HydrophobicContact CG-CD2 4.29Å; Y493-F505 AromaticContact CG-CG 3.77Å; Y493-F505 HydrophobicContact CG-CG 3.77Å; Y493-Q509 PolarHBondContact OH-OE1 2.99Å; Y493-F558 HydrophobicContact CD2-CZ 4.05Å; Y493-F558 AromaticContact CE2-CE1 3.76Å; Y493-F558 HydrophobicContact CE2-CE1 3.76Å; Y493-F558 AromaticContact CE2-CZ 3.47Å; Y493-F558 HydrophobicContact CE2-CZ 3.47Å; Y493-F558 VanDerWaalsContact CE2-CZ 3.47Å; Y493-F558 AromaticContact CZ-CE1 3.9Å; Y493-L562 HydrophobicContact CE2-CD1 4.01Å
494	K	93.8	Very high	94.5	Very high	76 Å²	76	43.2 Å²	43.2	33%	0.33	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.1	-176.5	69.7	-177.6	-173.2	-170	0	114.5	T490 D491 K502 F558	T490-K494 WeakPolarHBondContact O-CB 3.5Å; T490-K494 PolarHBondContact O-N 2.93Å; D491-K494 WeakPolarHBondContact OD1-CE 3.24Å; D491-K494 IonicContact OD1-NZ 2.69Å; D491-K494 PolarHBondContact OD1-NZ 3.17Å; K494-K502 WeakPolarHBondContact O-CE 3.33Å; K494-K502 PolarHBondContact O-NZ 3.18Å; K494-F558 HydrophobicContact CB-CD2 4.21Å; K494-F558 HydrophobicContact CB-CE1 4.31Å; K494-F558 HydrophobicContact CB-CE2 3.59Å; K494-F558 HydrophobicContact CB-CZ 3.63Å
495	N	91.2	Very high	94.5	Very high	97 Å²	97	40 Å²	40	52%	0.519	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.4	-177.7	-66.2	-26.9	0	0	0	113.8	M426 Y493	M426-N495 HydrophobicContact CE-CB 4.23Å; Y493-N495 PolarHBondContact O-N 2.98Å
496	L	93.3	Very high	94.5	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	22%	0.215	C	C	.	.			trans	-59.6	146.1	173.9	-71.1	169.5	0	0	0	111.1	F435 W438 Y493 R501 K502 F505	F435-L496 HydrophobicContact CE2-CD1 3.81Å; F435-L496 HydrophobicContact CE2-CD2 4.48Å; F435-L496 HydrophobicContact CZ-CD1 4.46Å; W438-L496 HydrophobicContact CH2-CD2 4.4Å; W438-L496 HydrophobicContact CZ3-CD2 3.87Å; Y493-L496 WeakPolarHBondContact O-CB 3.46Å; Y493-L496 VanDerWaalsContact O-CG 3.28Å; Y493-L496 WeakPolarHBondContact O-CG 3.25Å; Y493-L496 PolarHBondContact O-N 2.72Å; L496-R501 HydrophobicContact CB-CB 4.39Å; L496-R501 HydrophobicContact CD1-CB 4.02Å; L496-K502 HydrophobicContact CB-CG 3.92Å; L496-K502 WeakPolarHBondContact O-CE 3.38Å; L496-K502 PolarHBondContact O-NZ 2.54Å; L496-F505 HydrophobicContact CD1-CD2 3.6Å; L496-F505 HydrophobicContact CD1-CE2 4.03Å
497	P	90	Very high	94.4	Very high	52 Å²	52	43.1 Å²	43.1	34%	0.338	24%	0.235	S	C	.	.	S	Bend	trans	-71.6	-35.5	-171.8	26.6	-34.6	0	0	0	113.2	H427 S430	H427-P497 WeakPolarHBondContact NE2-CB 2.95Å; S430-P497 VanDerWaalsContact OG-CD 3.27Å; S430-P497 WeakPolarHBondContact OG-CD 3.5Å; S430-P497 WeakPolarHBondContact OG-CG 3.11Å
498	T	89.6	Confident	94.5	Very high	63 Å²	63	39 Å²	39	39%	0.387	21%	0.213	S	C	.	.	S	Bend	trans	-111.2	142.1	-174.5	61.9	0	0	0	0	111.9	S500 R501 K502	T498-S500 VanDerWaalsContact C-N 3.31Å; T498-S500 PolarHBondContact O-N 3.37Å; T498-R501 PolarHBondContact O-N 2.73Å; T498-R501 WeakPolarHBondContact OG1-CG 3.4Å; T498-K502 PolarHBondContact O-N 3.04Å
499	A	91.7	Very high	94.5	Very high	44 Å²	44	35.4 Å²	35.4	36%	0.364	19%	0.191	S	C	.	.	H	α-helix	trans	-63	-38.3	179.5	0	0	0	0	0	112.2	R501 K502 L503 A565	A499-R501 VanDerWaalsContact C-N 3.27Å; A499-R501 PolarHBondContact O-N 3.15Å; A499-K502 WeakPolarHBondContact O-CB 3.37Å; A499-K502 PolarHBondContact O-N 3.37Å; A499-L503 WeakPolarHBondContact O-CG 3.48Å; A499-L503 PolarHBondContact O-N 2.97Å; A499-A565 HydrophobicContact CB-CB 3.72Å
500	S	91.9	Very high	94.5	Very high	63 Å²	63	36.9 Å²	36.9	44%	0.441	20%	0.198	S	C	.	.	H	α-helix	trans	-53.2	-42.3	174.5	175.5	0	0	0	0	112.7	T498 L503 Q504	T498-S500 VanDerWaalsContact C-N 3.31Å; T498-S500 PolarHBondContact O-N 3.37Å; S500-L503 PolarHBondContact O-N 3.3Å; S500-Q504 WeakPolarHBondContact O-CG 3.46Å; S500-Q504 PolarHBondContact O-N 3.25Å; S500-Q504 VanDerWaalsContact O-N 3.11Å
501	R	94.2	Very high	94.5	Very high	30 Å²	30	39.2 Å²	39.2	11%	0.113	21%	0.21	C	C	.	.	H	α-helix	trans	-69.2	-39.2	177.3	-66.7	-68.3	-171.6	-146.1	-3	112.2	S430 E432 F435 L496 T498 A499 L503 Q504 F505	S430-R501 VanDerWaalsContact O-CZ 3.28Å; S430-R501 PolarHBondContact O-NE 3.2Å; S430-R501 PolarHBondContact O-NH2 3.39Å; E432-R501 IonicContact OE1-NH1 3.42Å; E432-R501 IonicContact OE2-CZ 3.98Å; E432-R501 IonicContact OE2-NH1 2.82Å; E432-R501 PolarHBondContact OE2-NH1 2.8Å; E432-R501 IonicContact OE2-NH2 3.48Å; E432-R501 PolarHBondContact OE2-NH2 2.96Å; F435-R501 VanDerWaalsContact CE1-CD 3.48Å; F435-R501 HydrophobicContact CE2-CB 3.95Å; F435-R501 HydrophobicContact CE2-CG 4.35Å; F435-R501 HydrophobicContact CZ-CB 3.93Å; F435-R501 HydrophobicContact CZ-CG 4.39Å; F435-R501 VanDerWaalsContact CZ-O 3.31Å; F435-R501 WeakPolarHBondContact CZ-O 3.48Å; L496-R501 HydrophobicContact CB-CB 4.39Å; L496-R501 HydrophobicContact CD1-CB 4.02Å; T498-R501 PolarHBondContact O-N 2.73Å; T498-R501 WeakPolarHBondContact OG1-CG 3.4Å; A499-R501 VanDerWaalsContact C-N 3.27Å; A499-R501 PolarHBondContact O-N 3.15Å; R501-L503 VanDerWaalsContact C-N 3.33Å; R501-L503 PolarHBondContact O-N 2.67Å; R501-Q504 PolarHBondContact O-N 3.33Å; R501-F505 PolarHBondContact O-N 2.95Å
502	K	96.1	Very high	94.7	Very high	43 Å²	43	36.7 Å²	36.7	19%	0.187	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-40.1	174.2	-59.9	-176.3	-169.7	-169.8	0	112	Y493 K494 L496 T498 A499 F505 L506 F558 L562	Y493-K502 HydrophobicContact CD2-CB 4.06Å; Y493-K502 HydrophobicContact CD2-CG 4.35Å; Y493-K502 HydrophobicContact CE2-CB 4.27Å; K494-K502 WeakPolarHBondContact O-CE 3.33Å; K494-K502 PolarHBondContact O-NZ 3.18Å; L496-K502 HydrophobicContact CB-CG 3.92Å; L496-K502 WeakPolarHBondContact O-CE 3.38Å; L496-K502 PolarHBondContact O-NZ 2.54Å; T498-K502 PolarHBondContact O-N 3.04Å; A499-K502 WeakPolarHBondContact O-CB 3.37Å; A499-K502 PolarHBondContact O-N 3.37Å; K502-F505 PolarHBondContact O-N 3.13Å; K502-L506 PolarHBondContact O-N 3.4Å; K502-F558 HydrophobicContact CD-CE2 4.21Å; K502-L562 HydrophobicContact CB-CD2 3.48Å; K502-L562 VanDerWaalsContact CB-CD2 3.48Å; K502-L562 HydrophobicContact CD-CD2 4Å; K502-L562 HydrophobicContact CG-CD2 4.38Å
503	L	95.4	Very high	94.9	Very high	24 Å²	24	35.7 Å²	35.7	13%	0.126	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-40.6	177.4	-69.8	172.8	0	0	0	112	A499 S500 R501 F505 L506 E507 L562 A565 A566 V569	A499-L503 WeakPolarHBondContact O-CG 3.48Å; A499-L503 PolarHBondContact O-N 2.97Å; S500-L503 PolarHBondContact O-N 3.3Å; R501-L503 VanDerWaalsContact C-N 3.33Å; R501-L503 PolarHBondContact O-N 2.67Å; L503-F505 VanDerWaalsContact C-N 3.32Å; L503-F505 PolarHBondContact O-N 3.37Å; L503-L506 HydrophobicContact CD2-CD2 4.23Å; L503-L506 WeakPolarHBondContact O-CB 3.43Å; L503-L506 PolarHBondContact O-N 3.05Å; L503-L506 VanDerWaalsContact O-N 3.14Å; L503-E507 PolarHBondContact O-N 3.48Å; L503-L562 HydrophobicContact CD2-CB 4.24Å; L503-L562 HydrophobicContact CD2-CD2 4.47Å; L503-L562 WeakPolarHBondContact CD2-O 3.32Å; L503-A565 HydrophobicContact CD1-CB 4.36Å; L503-A566 HydrophobicContact CD1-CB 4.33Å; L503-A566 HydrophobicContact CD2-CB 3.9Å; L503-V569 HydrophobicContact CD1-CG2 4.18Å
504	Q	95.8	Very high	95	Very high	61 Å²	61	37.7 Å²	37.7	29%	0.285	20%	0.204	S	C	.	.	H	α-helix	trans	-62.8	-37.6	175.3	-70.9	178.1	48.3	0	0	112.7	F435 L439 S500 R501 E507 L508	F435-Q504 HydrophobicContact CE1-CB 3.83Å; F435-Q504 HydrophobicContact CE1-CG 4.48Å; F435-Q504 HydrophobicContact CZ-CB 4.13Å; L439-Q504 HydrophobicContact CD1-CB 4.27Å; S500-Q504 WeakPolarHBondContact O-CG 3.46Å; S500-Q504 PolarHBondContact O-N 3.25Å; S500-Q504 VanDerWaalsContact O-N 3.11Å; R501-Q504 PolarHBondContact O-N 3.33Å; Q504-E507 PolarHBondContact O-N 3.07Å; Q504-L508 PolarHBondContact O-N 2.93Å
505	F	97.3	Very high	95.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.8	-35.3	171.9	-102.1	-71.3	0	0	0	113.1	F435 W438 L439 E442 Y493 L496 R501 K502 L503 E507 L508 Q509	F435-F505 HydrophobicContact CD2-CE2 4.2Å; F435-F505 AromaticContact CE2-CD2 3.49Å; F435-F505 HydrophobicContact CE2-CD2 3.49Å; F435-F505 VanDerWaalsContact CE2-CD2 3.49Å; F435-F505 AromaticContact CE2-CE2 3.35Å; F435-F505 HydrophobicContact CE2-CE2 3.35Å; F435-F505 AromaticContact CZ-CD2 3.51Å; F435-F505 HydrophobicContact CZ-CD2 3.51Å; F435-F505 AromaticContact CZ-CE2 3.76Å; F435-F505 HydrophobicContact CZ-CE2 3.76Å; W438-F505 AromaticContact CD2-CE2 3.97Å; W438-F505 HydrophobicContact CD2-CE2 3.97Å; W438-F505 AromaticContact CD2-CZ 3.6Å; W438-F505 HydrophobicContact CD2-CZ 3.6Å; W438-F505 AromaticContact CE2-CZ 3.58Å; W438-F505 AromaticContact CE3-CE2 3.93Å; W438-F505 HydrophobicContact CE3-CE2 3.93Å; W438-F505 HydrophobicContact CE3-CZ 4.06Å; W438-F505 AromaticContact CG-CZ 3.9Å; W438-F505 HydrophobicContact CG-CZ 3.9Å; W438-F505 HydrophobicContact CH2-CE2 4.38Å; W438-F505 HydrophobicContact CH2-CZ 4.46Å; W438-F505 HydrophobicContact CZ2-CE2 4.41Å; W438-F505 HydrophobicContact CZ2-CZ 4.04Å; W438-F505 HydrophobicContact CZ3-CE2 4.15Å; W438-F505 HydrophobicContact CZ3-CZ 4.48Å; W438-F505 AromaticContact NE1-CZ 3.8Å; L439-F505 HydrophobicContact CD2-CB 4.37Å; L439-F505 HydrophobicContact CD2-CD1 3.54Å; L439-F505 HydrophobicContact CD2-CD2 3.8Å; L439-F505 HydrophobicContact CD2-CE1 3.61Å; L439-F505 HydrophobicContact CD2-CE2 3.89Å; L439-F505 HydrophobicContact CD2-CG 3.63Å; L439-F505 HydrophobicContact CD2-CZ 3.78Å; L439-F505 HydrophobicContact CG-CE2 4.45Å; L439-F505 HydrophobicContact CG-CZ 4.41Å; E442-F505 HydrophobicContact CB-CE1 4.4Å; E442-F505 HydrophobicContact CG-CE1 4.18Å; Y493-F505 VanDerWaalsContact CB-CG 3.44Å; Y493-F505 HydrophobicContact CD1-CB 3.59Å; Y493-F505 HydrophobicContact CD1-CD1 4.05Å; Y493-F505 AromaticContact CD1-CG 3.95Å; Y493-F505 HydrophobicContact CD1-CG 3.95Å; Y493-F505 HydrophobicContact CD2-CB 3.74Å; Y493-F505 HydrophobicContact CE1-CB 4.14Å; Y493-F505 HydrophobicContact CE2-CB 4.26Å; Y493-F505 HydrophobicContact CG-CB 3.4Å; Y493-F505 HydrophobicContact CG-CD1 4.29Å; Y493-F505 HydrophobicContact CG-CD2 4.29Å; Y493-F505 AromaticContact CG-CG 3.77Å; Y493-F505 HydrophobicContact CG-CG 3.77Å; L496-F505 HydrophobicContact CD1-CD2 3.6Å; L496-F505 HydrophobicContact CD1-CE2 4.03Å; R501-F505 PolarHBondContact O-N 2.95Å; K502-F505 PolarHBondContact O-N 3.13Å; L503-F505 VanDerWaalsContact C-N 3.32Å; L503-F505 PolarHBondContact O-N 3.37Å; F505-E507 VanDerWaalsContact C-N 3.31Å; F505-L508 HydrophobicContact CD1-CD2 4.16Å; F505-L508 HydrophobicContact CE1-CD2 4.19Å; F505-L508 WeakPolarHBondContact O-CB 3.5Å; F505-L508 PolarHBondContact O-N 3.49Å; F505-Q509 PolarHBondContact O-N 3.42Å
506	L	96.4	Very high	95.5	Very high	3 Å²	3	32 Å²	32	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-39.9	173.6	178.9	66.4	0	0	0	111	K502 L503 L508 Q509 K510 F559 L562 V591 F592	K502-L506 PolarHBondContact O-N 3.4Å; L503-L506 HydrophobicContact CD2-CD2 4.23Å; L503-L506 WeakPolarHBondContact O-CB 3.43Å; L503-L506 PolarHBondContact O-N 3.05Å; L503-L506 VanDerWaalsContact O-N 3.14Å; L506-L508 VanDerWaalsContact C-N 3.35Å; L506-L508 PolarHBondContact O-N 3.29Å; L506-Q509 WeakPolarHBondContact O-CA 3.29Å; L506-Q509 WeakPolarHBondContact O-CB 3.29Å; L506-Q509 PolarHBondContact O-N 2.82Å; L506-Q509 VanDerWaalsContact O-N 3.09Å; L506-K510 HydrophobicContact CG-CD 4.22Å; L506-K510 WeakPolarHBondContact O-CG 3.42Å; L506-K510 PolarHBondContact O-N 3.48Å; L506-F559 HydrophobicContact CD1-CD1 4.06Å; L506-F559 HydrophobicContact CD1-CE1 3.93Å; L506-L562 HydrophobicContact CB-CD1 4.4Å; L506-L562 HydrophobicContact CD1-CD1 4.42Å; L506-L562 HydrophobicContact CD2-CB 4.12Å; L506-L562 HydrophobicContact CD2-CD1 4.05Å; L506-V591 HydrophobicContact CD2-CB 4.08Å; L506-V591 HydrophobicContact CD2-CG1 4.09Å; L506-V591 HydrophobicContact CD2-CG2 4.46Å; L506-F592 HydrophobicContact CD1-CE1 4.04Å; L506-F592 HydrophobicContact CD1-CZ 3.88Å
507	E	96.3	Very high	95.7	Very high	90 Å²	90	33.5 Å²	33.5	42%	0.421	18%	0.182	S	C	.	.	H	α-helix	trans	-62.6	-41.1	173.4	-68.2	-51.7	138.1	0	0	111.7	L503 Q504 F505 Q509 K510 D511	L503-E507 PolarHBondContact O-N 3.48Å; Q504-E507 PolarHBondContact O-N 3.07Å; F505-E507 VanDerWaalsContact C-N 3.31Å; E507-Q509 VanDerWaalsContact C-N 3.3Å; E507-Q509 PolarHBondContact O-N 3.29Å; E507-K510 VanDerWaalsContact CD-NZ 3.31Å; E507-K510 PolarHBondContact O-N 3.29Å; E507-K510 IonicContact OE1-NZ 2.66Å; E507-K510 PolarHBondContact OE1-NZ 2.98Å; E507-K510 IonicContact OE2-NZ 3.63Å; E507-K510 PolarHBondContact OE2-NZ 3.14Å; E507-D511 VanDerWaalsContact O-CG 3.3Å; E507-D511 PolarHBondContact O-N 2.96Å
508	L	97.1	Very high	96	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-43.4	169.9	171.9	62.5	0	0	0	111.4	L439 E442 R443 Q504 F505 L506 K510 D511 L512	L439-L508 HydrophobicContact CD2-CB 4.26Å; L439-L508 HydrophobicContact CD2-CD2 3.96Å; E442-L508 HydrophobicContact CB-CD2 4.05Å; E442-L508 HydrophobicContact CG-CD2 4.23Å; R443-L508 HydrophobicContact CB-CD1 3.55Å; R443-L508 HydrophobicContact CG-CD1 3.73Å; Q504-L508 PolarHBondContact O-N 2.93Å; F505-L508 HydrophobicContact CD1-CD2 4.16Å; F505-L508 HydrophobicContact CE1-CD2 4.19Å; F505-L508 WeakPolarHBondContact O-CB 3.5Å; F505-L508 PolarHBondContact O-N 3.49Å; L506-L508 VanDerWaalsContact C-N 3.35Å; L506-L508 PolarHBondContact O-N 3.29Å; L508-K510 VanDerWaalsContact C-N 3.32Å; L508-K510 PolarHBondContact O-N 2.97Å; L508-D511 WeakPolarHBondContact O-CB 3.45Å; L508-D511 PolarHBondContact O-N 3.5Å; L508-L512 HydrophobicContact CD1-CD1 4.22Å; L508-L512 HydrophobicContact CD1-CD2 4.41Å; L508-L512 HydrophobicContact CD1-CG 4.12Å; L508-L512 HydrophobicContact CG-CD1 4.18Å; L508-L512 VanDerWaalsContact O-CG 3.23Å; L508-L512 WeakPolarHBondContact O-CG 3.38Å; L508-L512 PolarHBondContact O-N 3.24Å
509	Q	96.6	Very high	96.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-41.5	178.2	-165.4	175.7	18.6	0	0	111.9	L486 T490 Y493 F505 L506 E507 L512 V513	L486-Q509 HydrophobicContact CD2-CG 3.96Å; L486-Q509 PolarHBondContact O-NE2 3.34Å; T490-Q509 PolarHBondContact OG1-NE2 3.27Å; T490-Q509 PolarHBondContact OG1-OE1 3.02Å; Y493-Q509 PolarHBondContact OH-OE1 2.99Å; F505-Q509 PolarHBondContact O-N 3.42Å; L506-Q509 WeakPolarHBondContact O-CA 3.29Å; L506-Q509 WeakPolarHBondContact O-CB 3.29Å; L506-Q509 PolarHBondContact O-N 2.82Å; L506-Q509 VanDerWaalsContact O-N 3.09Å; E507-Q509 VanDerWaalsContact C-N 3.3Å; E507-Q509 PolarHBondContact O-N 3.29Å; Q509-L512 PolarHBondContact O-N 3.39Å; Q509-V513 WeakPolarHBondContact O-CG2 3.46Å; Q509-V513 PolarHBondContact O-N 2.94Å; Q509-V513 VanDerWaalsContact O-N 3.17Å
510	K	96.4	Very high	96.5	Very high	31 Å²	31	31 Å²	31	14%	0.135	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-42.6	175.8	-70.2	165.4	64.3	-161.2	0	111.9	L506 E507 L508 L512 V513 D514 F592 M595	L506-K510 HydrophobicContact CG-CD 4.22Å; L506-K510 WeakPolarHBondContact O-CG 3.42Å; L506-K510 PolarHBondContact O-N 3.48Å; E507-K510 VanDerWaalsContact CD-NZ 3.31Å; E507-K510 PolarHBondContact O-N 3.29Å; E507-K510 IonicContact OE1-NZ 2.66Å; E507-K510 PolarHBondContact OE1-NZ 2.98Å; E507-K510 IonicContact OE2-NZ 3.63Å; E507-K510 PolarHBondContact OE2-NZ 3.14Å; L508-K510 VanDerWaalsContact C-N 3.32Å; L508-K510 PolarHBondContact O-N 2.97Å; K510-L512 VanDerWaalsContact C-N 3.29Å; K510-L512 PolarHBondContact O-N 3.49Å; K510-V513 PolarHBondContact O-N 3.25Å; K510-D514 PolarHBondContact O-N 3.45Å; K510-F592 HydrophobicContact CG-CD1 4.26Å; K510-F592 HydrophobicContact CG-CE1 4.2Å; K510-M595 HydrophobicContact CB-CE 4.19Å; K510-M595 HydrophobicContact CB-SD 4.09Å; K510-M595 HydrophobicContact CD-SD 4.34Å; K510-M595 HydrophobicContact CG-SD 3.93Å
511	D	97.6	Very high	96.7	Very high	63 Å²	63	29.3 Å²	29.3	34%	0.337	14%	0.141	S	C	.	.	H	α-helix	trans	-55.7	-45.5	173.5	-71.6	-16.8	0	0	0	110.8	R443 E507 L508 V513 D514 D515	R443-D511 IonicContact CZ-OD2 2.62Å; R443-D511 IonicContact NH2-OD2 3.28Å; R443-D511 PolarHBondContact NH2-OD2 2.84Å; E507-D511 VanDerWaalsContact O-CG 3.3Å; E507-D511 PolarHBondContact O-N 2.96Å; L508-D511 WeakPolarHBondContact O-CB 3.45Å; L508-D511 PolarHBondContact O-N 3.5Å; D511-V513 VanDerWaalsContact C-N 3.33Å; D511-V513 PolarHBondContact O-N 2.86Å; D511-D514 WeakPolarHBondContact O-CB 3.22Å; D511-D514 PolarHBondContact O-N 3.1Å; D511-D514 VanDerWaalsContact O-N 3.14Å; D511-D515 WeakPolarHBondContact O-CB 3.44Å; D511-D515 PolarHBondContact O-N 3.25Å
512	L	98.1	Very high	96.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-35.1	-179.2	-67.3	173	0	0	0	112.5	A446 L447 M450 F482 L486 I489 L508 Q509 K510 F516	A446-L512 HydrophobicContact CB-CD1 3.76Å; A446-L512 HydrophobicContact CB-CD2 3.78Å; A446-L512 HydrophobicContact CB-CG 4.45Å; L447-L512 HydrophobicContact CD2-CD2 4.2Å; L447-L512 HydrophobicContact CG-CD2 4.33Å; M450-L512 HydrophobicContact CE-CB 3.62Å; M450-L512 HydrophobicContact CE-CD1 4.42Å; M450-L512 HydrophobicContact CE-CD2 3.33Å; M450-L512 HydrophobicContact CE-CG 3.92Å; F482-L512 WeakPolarHBondContact CZ-O 3.38Å; L486-L512 HydrophobicContact CD2-CB 4.18Å; I489-L512 HydrophobicContact CD1-CD1 3.36Å; L508-L512 HydrophobicContact CD1-CD1 4.22Å; L508-L512 HydrophobicContact CD1-CD2 4.41Å; L508-L512 HydrophobicContact CD1-CG 4.12Å; L508-L512 HydrophobicContact CG-CD1 4.18Å; L508-L512 VanDerWaalsContact O-CG 3.23Å; L508-L512 WeakPolarHBondContact O-CG 3.38Å; L508-L512 PolarHBondContact O-N 3.24Å; Q509-L512 PolarHBondContact O-N 3.39Å; K510-L512 VanDerWaalsContact C-N 3.29Å; K510-L512 PolarHBondContact O-N 3.49Å; L512-F516 WeakPolarHBondContact O-CB 3.37Å; L512-F516 PolarHBondContact O-N 2.93Å
513	V	98.1	Very high	96.6	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-43.3	171.7	174.5	0	0	0	0	111	F482 L486 Q509 K510 D511 F516 R517 L550 M595 L599	F482-V513 HydrophobicContact CE1-CG2 4.34Å; F482-V513 HydrophobicContact CZ-CG2 4.19Å; L486-V513 HydrophobicContact CD1-CG2 3.58Å; Q509-V513 WeakPolarHBondContact O-CG2 3.46Å; Q509-V513 PolarHBondContact O-N 2.94Å; Q509-V513 VanDerWaalsContact O-N 3.17Å; K510-V513 PolarHBondContact O-N 3.25Å; D511-V513 VanDerWaalsContact C-N 3.33Å; D511-V513 PolarHBondContact O-N 2.86Å; V513-F516 PolarHBondContact O-N 2.87Å; V513-R517 WeakPolarHBondContact O-CB 3.26Å; V513-R517 PolarHBondContact O-N 3.49Å; V513-L550 HydrophobicContact CG1-CD1 3.79Å; V513-L550 HydrophobicContact CG2-CD1 4.32Å; V513-L550 HydrophobicContact CG2-CD2 4.47Å; V513-M595 HydrophobicContact CB-CG 4.41Å; V513-M595 HydrophobicContact CG1-CB 3.92Å; V513-M595 HydrophobicContact CG1-CG 4.09Å; V513-L599 HydrophobicContact CG1-CD1 4.44Å
514	D	97.4	Very high	96.6	Very high	43 Å²	43	30.9 Å²	30.9	23%	0.23	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-48.1	177.4	-158.2	83.6	0	0	0	111.6	K510 D511 F516 R517 I518	K510-D514 PolarHBondContact O-N 3.45Å; D511-D514 WeakPolarHBondContact O-CB 3.22Å; D511-D514 PolarHBondContact O-N 3.1Å; D511-D514 VanDerWaalsContact O-N 3.14Å; D514-F516 VanDerWaalsContact C-N 3.35Å; D514-F516 PolarHBondContact O-N 2.97Å; D514-R517 WeakPolarHBondContact O-CB 3.26Å; D514-R517 PolarHBondContact O-N 2.93Å; D514-R517 IonicContact OD1-CZ 2.97Å; D514-R517 IonicContact OD1-NH1 3.79Å; D514-R517 PolarHBondContact OD1-NH1 3.28Å; D514-R517 IonicContact OD1-NH2 2.72Å; D514-R517 PolarHBondContact OD1-NH2 3.4Å; D514-R517 IonicContact OD2-CZ 2.82Å; D514-R517 IonicContact OD2-NH2 2.84Å; D514-R517 PolarHBondContact OD2-NH2 3.21Å; D514-I518 WeakPolarHBondContact O-CG1 3.49Å; D514-I518 PolarHBondContact O-N 3.35Å; D514-I518 VanDerWaalsContact OD2-CD1 3.28Å; D514-I518 WeakPolarHBondContact OD2-CD1 3.5Å
515	D	97.6	Very high	96.5	Very high	53 Å²	53	34.2 Å²	34.2	28%	0.283	16%	0.164	S	C	.	.	H	α-helix	trans	-58.6	-45.3	176.8	-80.6	-32.2	0	0	0	111.5	L447 D511 I518 R519	L447-D515 HydrophobicContact CD2-CB 4.26Å; D511-D515 WeakPolarHBondContact O-CB 3.44Å; D511-D515 PolarHBondContact O-N 3.25Å; D515-I518 PolarHBondContact O-N 3.44Å; D515-R519 WeakPolarHBondContact O-CG 3.23Å; D515-R519 PolarHBondContact O-N 3.08Å
516	F	98	Very high	96.2	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-43.5	177.1	-165.7	-106.7	0	0	0	111.6	M450 M453 L454 F482 L512 V513 D514 I518 R519 L520 I546	M450-F516 HydrophobicContact CG-CD2 4.22Å; M450-F516 HydrophobicContact SD-CB 4.07Å; M450-F516 HydrophobicContact SD-CD2 3.97Å; M450-F516 HydrophobicContact SD-CG 4.49Å; M453-F516 HydrophobicContact CE-CE2 4.28Å; M453-F516 HydrophobicContact CE-CZ 4.48Å; L454-F516 HydrophobicContact CD1-CD2 4.49Å; L454-F516 HydrophobicContact CD1-CE2 4.13Å; L454-F516 HydrophobicContact CD2-CE2 3.93Å; L454-F516 HydrophobicContact CD2-CZ 4.16Å; L454-F516 HydrophobicContact CG-CE2 4.06Å; F482-F516 HydrophobicContact CB-CD1 4.49Å; F482-F516 HydrophobicContact CB-CD2 4.49Å; F482-F516 HydrophobicContact CB-CE1 4.15Å; F482-F516 HydrophobicContact CB-CE2 4.15Å; F482-F516 HydrophobicContact CB-CZ 3.97Å; F482-F516 HydrophobicContact CD1-CB 4.44Å; F482-F516 AromaticContact CD1-CD1 3.66Å; F482-F516 HydrophobicContact CD1-CD1 3.66Å; F482-F516 HydrophobicContact CD1-CE1 4Å; F482-F516 AromaticContact CD1-CG 3.98Å; F482-F516 HydrophobicContact CD1-CG 3.98Å; F482-F516 HydrophobicContact CD2-CB 4.07Å; F482-F516 HydrophobicContact CD2-CD1 4.23Å; F482-F516 AromaticContact CD2-CD2 3.71Å; F482-F516 HydrophobicContact CD2-CD2 3.71Å; F482-F516 HydrophobicContact CD2-CE2 4.18Å; F482-F516 AromaticContact CD2-CG 3.74Å; F482-F516 HydrophobicContact CD2-CG 3.74Å; F482-F516 HydrophobicContact CE1-CB 3.97Å; F482-F516 AromaticContact CE1-CD1 3.88Å; F482-F516 HydrophobicContact CE1-CD1 3.88Å; F482-F516 HydrophobicContact CE1-CG 4.01Å; F482-F516 HydrophobicContact CE2-CB 3.57Å; F482-F516 HydrophobicContact CE2-CD1 4.43Å; F482-F516 HydrophobicContact CE2-CD2 4.08Å; F482-F516 AromaticContact CE2-CG 3.78Å; F482-F516 HydrophobicContact CE2-CG 3.78Å; F482-F516 HydrophobicContact CG-CB 4.49Å; F482-F516 AromaticContact CG-CD1 3.85Å; F482-F516 HydrophobicContact CG-CD1 3.85Å; F482-F516 HydrophobicContact CG-CD2 4Å; F482-F516 HydrophobicContact CG-CE1 4Å; F482-F516 HydrophobicContact CG-CE2 4.15Å; F482-F516 AromaticContact CG-CG 3.85Å; F482-F516 HydrophobicContact CG-CG 3.85Å; F482-F516 HydrophobicContact CG-CZ 4.15Å; F482-F516 HydrophobicContact CZ-CB 3.53Å; F482-F516 HydrophobicContact CZ-CD1 4.28Å; F482-F516 AromaticContact CZ-CG 3.93Å; F482-F516 HydrophobicContact CZ-CG 3.93Å; L512-F516 WeakPolarHBondContact O-CB 3.37Å; L512-F516 PolarHBondContact O-N 2.93Å; V513-F516 PolarHBondContact O-N 2.87Å; D514-F516 VanDerWaalsContact C-N 3.35Å; D514-F516 PolarHBondContact O-N 2.97Å; F516-I518 VanDerWaalsContact C-N 3.33Å; F516-I518 PolarHBondContact O-N 2.74Å; F516-R519 PolarHBondContact O-N 2.98Å; F516-L520 HydrophobicContact CD1-CD1 3.85Å; F516-L520 HydrophobicContact CD1-CG 4.03Å; F516-L520 HydrophobicContact CE1-CD1 3.67Å; F516-L520 HydrophobicContact CE1-CD2 3.97Å; F516-L520 HydrophobicContact CE1-CG 3.84Å; F516-L520 HydrophobicContact CZ-CD2 4.1Å; F516-L520 HydrophobicContact CZ-CG 4.37Å; F516-L520 WeakPolarHBondContact O-CG 3.43Å; F516-L520 PolarHBondContact O-N 3.37Å; F516-I546 HydrophobicContact CD1-CD1 3.7Å; F516-I546 HydrophobicContact CE1-CD1 3.48Å; F516-I546 VanDerWaalsContact CE1-CD1 3.48Å
517	R	97.6	Very high	95.8	Very high	33 Å²	33	43 Å²	43	13%	0.125	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-43.5	174.1	-176.8	-158.5	67.3	-123.8	-5.7	111.6	V513 D514 R519 L520 T521 L599 L602	V513-R517 WeakPolarHBondContact O-CB 3.26Å; V513-R517 PolarHBondContact O-N 3.49Å; D514-R517 WeakPolarHBondContact O-CB 3.26Å; D514-R517 PolarHBondContact O-N 2.93Å; D514-R517 IonicContact OD1-CZ 2.97Å; D514-R517 IonicContact OD1-NH1 3.79Å; D514-R517 PolarHBondContact OD1-NH1 3.28Å; D514-R517 IonicContact OD1-NH2 2.72Å; D514-R517 PolarHBondContact OD1-NH2 3.4Å; D514-R517 IonicContact OD2-CZ 2.82Å; D514-R517 IonicContact OD2-NH2 2.84Å; D514-R517 PolarHBondContact OD2-NH2 3.21Å; R517-R519 VanDerWaalsContact C-N 3.34Å; R517-R519 PolarHBondContact O-N 3.17Å; R517-L520 PolarHBondContact O-N 3.07Å; R517-T521 WeakPolarHBondContact O-CB 3.42Å; R517-T521 PolarHBondContact O-N 2.94Å; R517-T521 PolarHBondContact O-OG1 3.06Å; R517-L599 HydrophobicContact CB-CD2 4.13Å; R517-L599 HydrophobicContact CG-CD2 3.87Å; R517-L599 HydrophobicContact CG-CG 4.48Å; R517-L602 HydrophobicContact CG-CD2 4.08Å
518	I	96.8	Very high	95.1	Very high	65 Å²	65	41.5 Å²	41.5	33%	0.333	20%	0.202	S	C	.	.	H	α-helix	trans	-60.6	-45.6	177.6	-71.4	168	0	0	0	110.2	D514 D515 F516 T521 Q522	D514-I518 WeakPolarHBondContact O-CG1 3.49Å; D514-I518 PolarHBondContact O-N 3.35Å; D514-I518 VanDerWaalsContact OD2-CD1 3.28Å; D514-I518 WeakPolarHBondContact OD2-CD1 3.5Å; D515-I518 PolarHBondContact O-N 3.44Å; F516-I518 VanDerWaalsContact C-N 3.33Å; F516-I518 PolarHBondContact O-N 2.74Å; I518-T521 WeakPolarHBondContact O-CB 3.42Å; I518-T521 PolarHBondContact O-N 3.33Å; I518-Q522 WeakPolarHBondContact O-CG 3.43Å; I518-Q522 PolarHBondContact O-N 2.85Å
519	R	96.2	Very high	94.4	Very high	41 Å²	41	53.1 Å²	53.1	16%	0.155	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-45.6	176.8	-70.5	167.3	176.7	-167.2	-14.6	111.9	L447 D451 L454 D515 F516 R517 T521 Q522 V523	L447-R519 PolarHBondContact O-NH1 3.01Å; D451-R519 VanDerWaalsContact CG-NH2 3.31Å; D451-R519 IonicContact OD1-CZ 3.64Å; D451-R519 IonicContact OD1-NE 2.62Å; D451-R519 IonicContact OD1-NH1 3.98Å; D451-R519 PolarHBondContact OD1-NH1 3.41Å; D451-R519 VanDerWaalsContact OD1-NH1 3.16Å; D451-R519 IonicContact OD1-NH2 3.65Å; D451-R519 PolarHBondContact OD1-NH2 2.85Å; D451-R519 IonicContact OD2-CZ 2.98Å; D451-R519 IonicContact OD2-NH1 3.33Å; D451-R519 IonicContact OD2-NH2 2.87Å; D451-R519 PolarHBondContact OD2-NH2 3.43Å; L454-R519 HydrophobicContact CD1-CB 3.77Å; L454-R519 HydrophobicContact CD1-CG 4.39Å; D515-R519 WeakPolarHBondContact O-CG 3.23Å; D515-R519 PolarHBondContact O-N 3.08Å; F516-R519 PolarHBondContact O-N 2.98Å; R517-R519 VanDerWaalsContact C-N 3.34Å; R517-R519 PolarHBondContact O-N 3.17Å; R519-T521 VanDerWaalsContact C-N 3.27Å; R519-T521 PolarHBondContact O-N 3Å; R519-Q522 WeakPolarHBondContact O-CB 3.42Å; R519-Q522 PolarHBondContact O-N 3.24Å; R519-Q522 VanDerWaalsContact O-N 3.11Å; R519-V523 WeakPolarHBondContact O-CG2 3.21Å; R519-V523 PolarHBondContact O-N 2.91Å
520	L	96.4	Very high	94	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.2	-41.8	173.2	-69.9	-177.1	0	0	0	111.7	L454 W460 F516 R517 Q522 V523 M524 I539 A542 V543 I546	L454-L520 HydrophobicContact CD2-CD2 4.45Å; W460-L520 HydrophobicContact CH2-CD2 3.86Å; W460-L520 HydrophobicContact CZ3-CD2 3.93Å; F516-L520 HydrophobicContact CD1-CD1 3.85Å; F516-L520 HydrophobicContact CD1-CG 4.03Å; F516-L520 HydrophobicContact CE1-CD1 3.67Å; F516-L520 HydrophobicContact CE1-CD2 3.97Å; F516-L520 HydrophobicContact CE1-CG 3.84Å; F516-L520 HydrophobicContact CZ-CD2 4.1Å; F516-L520 HydrophobicContact CZ-CG 4.37Å; F516-L520 WeakPolarHBondContact O-CG 3.43Å; F516-L520 PolarHBondContact O-N 3.37Å; R517-L520 PolarHBondContact O-N 3.07Å; L520-Q522 VanDerWaalsContact C-N 3.34Å; L520-Q522 PolarHBondContact O-N 3.27Å; L520-V523 PolarHBondContact O-N 3.41Å; L520-M524 VanDerWaalsContact O-CB 3.24Å; L520-M524 WeakPolarHBondContact O-CB 2.98Å; L520-M524 PolarHBondContact O-N 2.94Å; L520-I539 HydrophobicContact CB-CG2 4.19Å; L520-I539 HydrophobicContact CD2-CG2 4.41Å; L520-A542 HydrophobicContact CD1-CB 4.48Å; L520-V543 HydrophobicContact CD1-CG2 3.92Å; L520-I546 HydrophobicContact CD1-CD1 4.35Å
521	T	96.2	Very high	93.6	Very high	28 Å²	28	54.1 Å²	54.1	17%	0.172	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-39.4	176.8	-56.6	0	0	0	0	111.7	R517 I518 R519 K525 L602	R517-T521 WeakPolarHBondContact O-CB 3.42Å; R517-T521 PolarHBondContact O-N 2.94Å; R517-T521 PolarHBondContact O-OG1 3.06Å; I518-T521 WeakPolarHBondContact O-CB 3.42Å; I518-T521 PolarHBondContact O-N 3.33Å; R519-T521 VanDerWaalsContact C-N 3.27Å; R519-T521 PolarHBondContact O-N 3Å; T521-K525 HydrophobicContact CG2-CD 4.46Å; T521-K525 VanDerWaalsContact O-CG 3.3Å; T521-K525 WeakPolarHBondContact O-CG 3.4Å; T521-K525 PolarHBondContact O-N 3.45Å; T521-L602 HydrophobicContact CG2-CD1 4.39Å; T521-L602 WeakPolarHBondContact OG1-CD2 3.39Å
522	Q	94.6	Very high	93.4	Very high	107 Å²	107	51.6 Å²	51.6	50%	0.5	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-50.6	177	-72.1	169.1	-5.3	0	0	111	I518 R519 L520 M524 K525 E526	I518-Q522 WeakPolarHBondContact O-CG 3.43Å; I518-Q522 PolarHBondContact O-N 2.85Å; R519-Q522 WeakPolarHBondContact O-CB 3.42Å; R519-Q522 PolarHBondContact O-N 3.24Å; R519-Q522 VanDerWaalsContact O-N 3.11Å; L520-Q522 VanDerWaalsContact C-N 3.34Å; L520-Q522 PolarHBondContact O-N 3.27Å; Q522-M524 VanDerWaalsContact C-N 3.29Å; Q522-M524 PolarHBondContact O-N 3.37Å; Q522-K525 WeakPolarHBondContact O-CB 3.39Å; Q522-K525 PolarHBondContact O-N 2.6Å; Q522-E526 PolarHBondContact O-N 2.75Å
523	V	93.5	Very high	93.1	Very high	18 Å²	18	52.6 Å²	52.6	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-40.9	177.1	-177	0	0	0	0	110.7	W460 R519 L520 K525 E526 E527 I539	W460-V523 HydrophobicContact CH2-CB 4.41Å; W460-V523 HydrophobicContact CH2-CG1 4.09Å; W460-V523 HydrophobicContact CH2-CG2 4.47Å; W460-V523 HydrophobicContact CZ2-CB 4.43Å; W460-V523 HydrophobicContact CZ2-CG1 3.8Å; W460-V523 HydrophobicContact CZ2-CG2 4.3Å; R519-V523 WeakPolarHBondContact O-CG2 3.21Å; R519-V523 PolarHBondContact O-N 2.91Å; L520-V523 PolarHBondContact O-N 3.41Å; V523-K525 VanDerWaalsContact C-N 3.27Å; V523-K525 PolarHBondContact O-N 3.12Å; V523-E526 WeakPolarHBondContact O-CB 3.26Å; V523-E526 PolarHBondContact O-N 3.04Å; V523-E527 PolarHBondContact O-N 3.23Å; V523-I539 HydrophobicContact CB-CD1 4.19Å; V523-I539 HydrophobicContact CG1-CD1 3.81Å
524	M	94.5	Very high	92.9	Very high	5 Å²	5	57.5 Å²	57.5	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-37	175.2	-178.8	-115.7	45.9	0	0	112.1	L520 Q522 E526 E527 T528 Y536 I539 M606	L520-M524 VanDerWaalsContact O-CB 3.24Å; L520-M524 WeakPolarHBondContact O-CB 2.98Å; L520-M524 PolarHBondContact O-N 2.94Å; Q522-M524 VanDerWaalsContact C-N 3.29Å; Q522-M524 PolarHBondContact O-N 3.37Å; M524-E526 VanDerWaalsContact C-N 3.31Å; M524-E526 PolarHBondContact O-N 2.76Å; M524-E527 CarbonylContact O-C 3.58Å; M524-E527 PolarHBondContact O-N 2.81Å; M524-T528 PolarHBondContact O-N 3.28Å; M524-T528 PolarHBondContact O-OG1 3Å; M524-Y536 HydrophobicContact CG-CD2 3.93Å; M524-Y536 HydrophobicContact CG-CE2 3.46Å; M524-Y536 VanDerWaalsContact CG-CE2 3.46Å; M524-Y536 HydrophobicContact SD-CE2 3.89Å; M524-I539 HydrophobicContact CB-CD1 4.04Å; M524-I539 HydrophobicContact CB-CG2 4.21Å; M524-M606 HydrophobicContact CG-CE 3.68Å; M524-M606 HydrophobicContact CG-CG 4.07Å; M524-M606 HydrophobicContact CG-SD 3.79Å; M524-M606 HydrophobicContact SD-CE 4.44Å; M524-M606 HydrophobicContact SD-CG 3.55Å; M524-M606 VanDerWaalsContact SD-CG 3.55Å; M524-M606 HydrophobicContact SD-SD 3.98Å
525	K	93.4	Very high	92.7	Very high	131 Å²	131	59 Å²	59	57%	0.57	28%	0.28	S	S	*	.	H	α-helix	trans	-65.5	-37.2	179.8	-80.3	174.9	-177.3	172.9	0	111.2	T521 Q522 V523 E527 T528	T521-K525 HydrophobicContact CG2-CD 4.46Å; T521-K525 VanDerWaalsContact O-CG 3.3Å; T521-K525 WeakPolarHBondContact O-CG 3.4Å; T521-K525 PolarHBondContact O-N 3.45Å; Q522-K525 WeakPolarHBondContact O-CB 3.39Å; Q522-K525 PolarHBondContact O-N 2.6Å; V523-K525 VanDerWaalsContact C-N 3.27Å; V523-K525 PolarHBondContact O-N 3.12Å; K525-E527 VanDerWaalsContact C-N 3.28Å; K525-E527 PolarHBondContact O-N 3.13Å; K525-T528 WeakPolarHBondContact CA-OG1 3.31Å; K525-T528 WeakPolarHBondContact O-CB 3.48Å; K525-T528 PolarHBondContact O-N 3.39Å; K525-T528 PolarHBondContact O-OG1 3.21Å
526	E	90.8	Very high	92.6	Very high	140 Å²	140	56.5 Å²	56.5	65%	0.654	27%	0.267	S	S	*	.	H	α-helix	trans	-61.4	-38	174.4	-63.4	171.5	-178.8	0	0	111.7	Q522 V523 M524 T528	Q522-E526 PolarHBondContact O-N 2.75Å; V523-E526 WeakPolarHBondContact O-CB 3.26Å; V523-E526 PolarHBondContact O-N 3.04Å; M524-E526 VanDerWaalsContact C-N 3.31Å; M524-E526 PolarHBondContact O-N 2.76Å; E526-T528 VanDerWaalsContact C-N 3.31Å; E526-T528 PolarHBondContact O-N 2.9Å
527	E	88.3	Confident	92.5	Very high	49 Å²	49	56.5 Å²	56.5	23%	0.229	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-84.1	4	179.8	-61.7	-63.9	162	0	0	114	V523 M524 K525 R529 A530 R535 Y536	V523-E527 PolarHBondContact O-N 3.23Å; M524-E527 CarbonylContact O-C 3.58Å; M524-E527 PolarHBondContact O-N 2.81Å; K525-E527 VanDerWaalsContact C-N 3.28Å; K525-E527 PolarHBondContact O-N 3.13Å; E527-R529 PolarHBondContact O-N 3.39Å; E527-A530 CarbonylContact O-C 3.21Å; E527-A530 WeakPolarHBondContact O-CA 3.39Å; E527-A530 PolarHBondContact O-N 3.43Å; E527-R535 HydrophobicContact CG-CB 4.24Å; E527-R535 HydrophobicContact CG-CG 4.35Å; E527-R535 WeakPolarHBondContact OE1-CD 3.46Å; E527-R535 IonicContact OE1-NH1 3.94Å; E527-Y536 HydrophobicContact CB-CD2 4.15Å
528	T	81.1	Confident	92.4	Very high	58 Å²	58	55.1 Å²	55.1	36%	0.356	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-58.5	-28.5	-173.8	-55.7	0	0	0	0	113.3	M524 K525 E526 A530	M524-T528 PolarHBondContact O-N 3.28Å; M524-T528 PolarHBondContact O-OG1 3Å; K525-T528 WeakPolarHBondContact CA-OG1 3.31Å; K525-T528 WeakPolarHBondContact O-CB 3.48Å; K525-T528 PolarHBondContact O-N 3.39Å; K525-T528 PolarHBondContact O-OG1 3.21Å; E526-T528 VanDerWaalsContact C-N 3.31Å; E526-T528 PolarHBondContact O-N 2.9Å; T528-A530 VanDerWaalsContact C-N 3.26Å; T528-A530 PolarHBondContact O-N 3.23Å
529	R	83.1	Confident	92.4	Very high	246 Å²	246	52 Å²	52	93%	0.928	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-71.7	-21.6	177.3	-67.6	-175.7	178.5	177.7	0.7	113	E527	E527-R529 PolarHBondContact O-N 3.39Å
530	A	87.8	Confident	92.4	Very high	46 Å²	46	50 Å²	50	38%	0.38	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-123.2	61.6	178.9	0	0	0	0	0	109.3	E527 T528 L532 G533	E527-A530 CarbonylContact O-C 3.21Å; E527-A530 WeakPolarHBondContact O-CA 3.39Å; E527-A530 PolarHBondContact O-N 3.43Å; T528-A530 VanDerWaalsContact C-N 3.26Å; T528-A530 PolarHBondContact O-N 3.23Å; A530-L532 PolarHBondContact O-N 3.37Å; A530-L532 VanDerWaalsContact O-N 3.08Å; A530-G533 WeakPolarHBondContact O-CA 3.45Å; A530-G533 PolarHBondContact O-N 3.17Å
531	S	89.5	Confident	92.4	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.042	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	-177.2	56.7	0	0	0	0	114.3	Y536 Q610 H613	S531-Y536 WeakPolarHBondContact O-CD1 3.48Å; S531-Q610 WeakPolarHBondContact O-CG 3.34Å; S531-Q610 PolarHBondContact O-NE2 3.43Å; S531-H613 WeakPolarHBondContact OG-CB 3.44Å
532	L	92.5	Very high	92.4	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.052	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	4.3	171.9	-49.7	-175.5	0	0	0	113.3	A530 Q610 H613 V614 H658 Q661 L662 Q665	A530-L532 PolarHBondContact O-N 3.37Å; A530-L532 VanDerWaalsContact O-N 3.08Å; L532-Q610 HydrophobicContact CD2-CB 4.37Å; L532-Q610 HydrophobicContact CD2-CG 4.41Å; L532-H613 VanDerWaalsContact CD1-CD2 3.46Å; L532-H613 WeakPolarHBondContact CD1-CD2 3.23Å; L532-H613 VanDerWaalsContact CG-CD2 3.49Å; L532-H613 WeakPolarHBondContact CG-CD2 3.44Å; L532-V614 HydrophobicContact CD1-CG2 3.92Å; L532-V614 HydrophobicContact CD2-CG2 3.69Å; L532-V614 HydrophobicContact CG-CG2 4.43Å; L532-H658 WeakPolarHBondContact CD1-ND1 3.45Å; L532-Q661 PolarHBondContact O-NE2 3.35Å; L532-L662 HydrophobicContact CD2-CD1 4.11Å; L532-L662 HydrophobicContact CD2-CD2 4.1Å; L532-L662 HydrophobicContact CD2-CG 4.45Å; L532-Q665 PolarHBondContact O-OE1 3.44Å
533	G	92.5	Very high	92.6	Very high	21 Å²	21	43.8 Å²	43.8	22%	0.216	21%	0.208	C	C	.	.	S	Bend	trans	-68.5	150	179.8	0	0	0	0	0	111.3	A530 R535 Y536 C537	A530-G533 WeakPolarHBondContact O-CA 3.45Å; A530-G533 PolarHBondContact O-N 3.17Å; G533-R535 VanDerWaalsContact C-N 3.25Å; G533-R535 PolarHBondContact O-N 2.94Å; G533-Y536 WeakPolarHBondContact O-CB 3.37Å; G533-Y536 PolarHBondContact O-N 3.4Å; G533-C537 PolarHBondContact O-N 3.02Å; G533-C537 VanDerWaalsContact O-N 3.16Å
534	F	93	Very high	92.7	Very high	107 Å²	107	43.4 Å²	43.4	47%	0.469	21%	0.205	S	C	.	.	H	α-helix	trans	-48.8	-46.3	-179.9	170	-100.6	0	0	0	112.8	W460 Y536 C537 A538	W460-F534 HydrophobicContact CB-CE1 4.16Å; W460-F534 VanDerWaalsContact O-CZ 3.26Å; W460-F534 WeakPolarHBondContact O-CZ 3.43Å; F534-Y536 PolarHBondContact O-N 3.31Å; F534-C537 PolarHBondContact O-N 3.23Å; F534-A538 WeakPolarHBondContact O-CB 3.47Å; F534-A538 PolarHBondContact O-N 3.35Å
535	R	93.1	Very high	92.8	Very high	74 Å²	74	45 Å²	45	28%	0.279	21%	0.211	S	C	.	.	H	α-helix	trans	-67.4	-36.3	-177.7	-163.1	177	-170.9	-172.4	-0.3	112.6	W460 E527 G533 A538 I539	W460-R535 HydrophobicContact CB-CG 4.44Å; W460-R535 HydrophobicContact CD2-CG 3.97Å; W460-R535 VanDerWaalsContact CE2-NE 3.32Å; W460-R535 HydrophobicContact CG-CG 3.88Å; W460-R535 VanDerWaalsContact NE1-NH2 3.15Å; E527-R535 HydrophobicContact CG-CB 4.24Å; E527-R535 HydrophobicContact CG-CG 4.35Å; E527-R535 WeakPolarHBondContact OE1-CD 3.46Å; E527-R535 IonicContact OE1-NH1 3.94Å; G533-R535 VanDerWaalsContact C-N 3.25Å; G533-R535 PolarHBondContact O-N 2.94Å; R535-A538 PolarHBondContact O-N 3.34Å; R535-I539 HydrophobicContact CG-CD1 4.37Å; R535-I539 WeakPolarHBondContact O-CD1 3.28Å; R535-I539 VanDerWaalsContact O-CG1 3.23Å; R535-I539 WeakPolarHBondContact O-CG1 3.44Å; R535-I539 PolarHBondContact O-N 3.12Å
536	Y	96	Very high	93	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-45.7	175.5	-166.4	-81.1	0	0	0	111.2	M524 E527 S531 G533 F534 I539 L540 M606 Q610	M524-Y536 HydrophobicContact CG-CD2 3.93Å; M524-Y536 HydrophobicContact CG-CE2 3.46Å; M524-Y536 VanDerWaalsContact CG-CE2 3.46Å; M524-Y536 HydrophobicContact SD-CE2 3.89Å; E527-Y536 HydrophobicContact CB-CD2 4.15Å; S531-Y536 WeakPolarHBondContact O-CD1 3.48Å; G533-Y536 WeakPolarHBondContact O-CB 3.37Å; G533-Y536 PolarHBondContact O-N 3.4Å; F534-Y536 PolarHBondContact O-N 3.31Å; Y536-I539 PolarHBondContact O-N 3.03Å; Y536-L540 PolarHBondContact O-N 2.97Å; Y536-M606 HydrophobicContact CD1-CE 3.87Å; Y536-M606 HydrophobicContact CE1-CB 4.03Å; Y536-M606 HydrophobicContact CE1-CE 3.59Å; Y536-M606 HydrophobicContact CE1-CG 4.33Å; Y536-M606 HydrophobicContact CE2-CE 4.31Å; Y536-M606 HydrophobicContact CG-CE 4.36Å; Y536-M606 WeakPolarHBondContact O-CE 3.34Å; Y536-M606 VanDerWaalsContact OH-CA 3.26Å; Y536-M606 WeakPolarHBondContact OH-CA 3.35Å; Y536-M606 WeakPolarHBondContact OH-CG 3.49Å; Y536-M606 PolarHBondContact OH-O 3.46Å; Y536-Q610 HydrophobicContact CD1-CG 4.11Å; Y536-Q610 HydrophobicContact CE1-CG 3.72Å
537	C	95.6	Very high	93.3	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-40.9	175.4	-64.6	0	0	0	0	112.1	G533 F534 L540 N541 Q610 Q665 L666	G533-C537 PolarHBondContact O-N 3.02Å; G533-C537 VanDerWaalsContact O-N 3.16Å; F534-C537 PolarHBondContact O-N 3.23Å; C537-L540 WeakPolarHBondContact O-CB 3.4Å; C537-L540 PolarHBondContact O-N 2.9Å; C537-N541 PolarHBondContact O-N 2.97Å; C537-Q610 PolarHBondContact SG-NE2 3.27Å; C537-Q665 HydrophobicContact CB-CB 3.69Å; C537-Q665 PolarHBondContact SG-OE1 3.05Å; C537-L666 HydrophobicContact CB-CD2 3.83Å
538	A	95.4	Very high	93.6	Very high	4 Å²	4	32 Å²	32	3%	0.033	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-44.1	175.6	0	0	0	0	0	111.7	W460 P476 F534 R535 L540 N541 A542	W460-A538 HydrophobicContact CB-CB 4.05Å; W460-A538 HydrophobicContact CE3-CB 4.39Å; W460-A538 WeakPolarHBondContact O-CB 3.48Å; P476-A538 HydrophobicContact CG-CB 4.13Å; P476-A538 WeakPolarHBondContact CG-O 3.42Å; F534-A538 WeakPolarHBondContact O-CB 3.47Å; F534-A538 PolarHBondContact O-N 3.35Å; R535-A538 PolarHBondContact O-N 3.34Å; A538-L540 VanDerWaalsContact C-N 3.28Å; A538-L540 PolarHBondContact O-N 3.24Å; A538-N541 PolarHBondContact O-N 2.82Å; A538-A542 PolarHBondContact O-N 3.23Å
539	I	96.4	Very high	94.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-41.4	174.4	-64	158.2	0	0	0	110.5	W460 L520 V523 M524 R535 Y536 N541 A542 V543 M606	W460-I539 HydrophobicContact CE3-CG1 3.84Å; W460-I539 HydrophobicContact CH2-CG1 3.9Å; W460-I539 HydrophobicContact CZ3-CB 4.4Å; W460-I539 HydrophobicContact CZ3-CD1 4.36Å; W460-I539 HydrophobicContact CZ3-CG1 3.35Å; L520-I539 HydrophobicContact CB-CG2 4.19Å; L520-I539 HydrophobicContact CD2-CG2 4.41Å; V523-I539 HydrophobicContact CB-CD1 4.19Å; V523-I539 HydrophobicContact CG1-CD1 3.81Å; M524-I539 HydrophobicContact CB-CD1 4.04Å; M524-I539 HydrophobicContact CB-CG2 4.21Å; R535-I539 HydrophobicContact CG-CD1 4.37Å; R535-I539 WeakPolarHBondContact O-CD1 3.28Å; R535-I539 VanDerWaalsContact O-CG1 3.23Å; R535-I539 WeakPolarHBondContact O-CG1 3.44Å; R535-I539 PolarHBondContact O-N 3.12Å; Y536-I539 PolarHBondContact O-N 3.03Å; I539-N541 PolarHBondContact O-N 3.46Å; I539-A542 WeakPolarHBondContact O-CB 3.43Å; I539-A542 PolarHBondContact O-N 2.87Å; I539-V543 HydrophobicContact CG2-CG2 4.35Å; I539-V543 WeakPolarHBondContact O-CG2 3.26Å; I539-V543 PolarHBondContact O-N 2.87Å; I539-M606 HydrophobicContact CB-CE 4.15Å; I539-M606 HydrophobicContact CG2-CE 3.99Å; I539-M606 HydrophobicContact CG2-SD 4.25Å
540	L	97	Very high	94.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.8	-43	178.1	-167.3	50.6	0	0	0	112.1	Y536 C537 A538 V543 N544 K603 M606 L607 L666 L670	Y536-L540 PolarHBondContact O-N 2.97Å; C537-L540 WeakPolarHBondContact O-CB 3.4Å; C537-L540 PolarHBondContact O-N 2.9Å; A538-L540 VanDerWaalsContact C-N 3.28Å; A538-L540 PolarHBondContact O-N 3.24Å; L540-V543 PolarHBondContact O-N 2.93Å; L540-N544 PolarHBondContact O-N 3.47Å; L540-K603 HydrophobicContact CD1-CB 4.3Å; L540-K603 HydrophobicContact CD1-CG 3.81Å; L540-M606 HydrophobicContact CB-CE 3.75Å; L540-M606 HydrophobicContact CD1-CB 3.75Å; L540-M606 HydrophobicContact CD1-CE 4.13Å; L540-M606 HydrophobicContact CD1-SD 4.12Å; L540-M606 HydrophobicContact CG-CE 4.42Å; L540-L607 HydrophobicContact CD1-CG 4.48Å; L540-L607 HydrophobicContact CD2-CD2 3.74Å; L540-L607 HydrophobicContact CD2-CG 3.94Å; L540-L666 HydrophobicContact CB-CD2 4.29Å; L540-L666 HydrophobicContact CD2-CD2 3.86Å; L540-L666 HydrophobicContact CG-CD2 4.39Å; L540-L670 HydrophobicContact CB-CD1 4.38Å; L540-L670 HydrophobicContact CD1-CD2 4.3Å; L540-L670 HydrophobicContact CD2-CD1 4.46Å; L540-L670 HydrophobicContact CD2-CD2 4.41Å; L540-L670 HydrophobicContact CG-CD1 3.79Å; L540-L670 HydrophobicContact CG-CD2 4.03Å
541	N	96.4	Very high	95.3	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.021	10%	0.099	C	C	.	.	H	α-helix	trans	-61.5	-43.1	174	-64.7	-20.4	0	0	0	111.2	K474 C537 A538 I539 V543 N544 Y545 Q665 L666 C667 L670	K474-N541 VanDerWaalsContact CB-ND2 3.35Å; K474-N541 WeakPolarHBondContact CB-ND2 3.4Å; K474-N541 WeakPolarHBondContact O-CB 3.47Å; K474-N541 PolarHBondContact O-ND2 2.89Å; C537-N541 PolarHBondContact O-N 2.97Å; A538-N541 PolarHBondContact O-N 2.82Å; I539-N541 PolarHBondContact O-N 3.46Å; N541-V543 PolarHBondContact O-N 2.94Å; N541-N544 PolarHBondContact O-N 2.74Å; N541-Y545 VanDerWaalsContact O-CB 3.29Å; N541-Y545 WeakPolarHBondContact O-CB 3.34Å; N541-Y545 PolarHBondContact O-N 3.22Å; N541-Q665 PolarHBondContact ND2-O 3.28Å; N541-L666 WeakPolarHBondContact OD1-CA 3.4Å; N541-C667 PolarHBondContact OD1-N 3.01Å; N541-L670 VanDerWaalsContact OD1-CD1 3.3Å; N541-L670 WeakPolarHBondContact OD1-CD1 3.37Å
542	A	96.8	Very high	95.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.2	-47	175.9	0	0	0	0	0	112.2	P476 A479 L520 A538 I539 N544 Y545 I546	P476-A542 HydrophobicContact CG-CB 4.06Å; A479-A542 HydrophobicContact CB-CB 3.69Å; L520-A542 HydrophobicContact CD1-CB 4.48Å; A538-A542 PolarHBondContact O-N 3.23Å; I539-A542 WeakPolarHBondContact O-CB 3.43Å; I539-A542 PolarHBondContact O-N 2.87Å; A542-N544 PolarHBondContact O-N 2.83Å; A542-Y545 PolarHBondContact O-N 3.22Å; A542-I546 VanDerWaalsContact O-CG1 3.28Å; A542-I546 WeakPolarHBondContact O-CG1 3.26Å; A542-I546 PolarHBondContact O-N 3.01Å
543	V	97.8	Very high	95.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.8	-45.6	178.2	171.9	0	0	0	0	110.9	L520 I539 L540 N541 S547 L599 L602 K603	L520-V543 HydrophobicContact CD1-CG2 3.92Å; I539-V543 HydrophobicContact CG2-CG2 4.35Å; I539-V543 WeakPolarHBondContact O-CG2 3.26Å; I539-V543 PolarHBondContact O-N 2.87Å; L540-V543 PolarHBondContact O-N 2.93Å; N541-V543 PolarHBondContact O-N 2.94Å; V543-S547 VanDerWaalsContact O-CB 3.31Å; V543-S547 WeakPolarHBondContact O-CB 3.49Å; V543-S547 PolarHBondContact O-N 3.48Å; V543-L599 HydrophobicContact CG1-CB 4.13Å; V543-L599 HydrophobicContact CG1-CD2 4.02Å; V543-L599 WeakPolarHBondContact CG1-O 3.46Å; V543-L602 HydrophobicContact CG1-CD2 4.46Å; V543-L602 HydrophobicContact CG2-CD2 3.74Å; V543-L602 HydrophobicContact CG2-CG 4.33Å; V543-K603 HydrophobicContact CG1-CB 3.99Å
544	N	96.8	Very high	95.5	Very high	9 Å²	9	22.6 Å²	22.6	5%	0.048	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-43	177.9	-176.5	81.9	0	0	0	112.1	L540 N541 A542 T548 K603 L670	L540-N544 PolarHBondContact O-N 3.47Å; N541-N544 PolarHBondContact O-N 2.74Å; A542-N544 PolarHBondContact O-N 2.83Å; N544-T548 WeakPolarHBondContact O-CB 3.25Å; N544-T548 PolarHBondContact O-N 2.79Å; N544-T548 PolarHBondContact O-OG1 3.49Å; N544-K603 HydrophobicContact CB-CD 4.14Å; N544-L670 HydrophobicContact CB-CD1 3.77Å; N544-L670 HydrophobicContact CB-CD2 4.07Å; N544-L670 HydrophobicContact CB-CG 4Å
545	Y	95.9	Very high	95.4	Very high	38 Å²	38	23.3 Å²	23.3	15%	0.149	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-53.2	178.6	174.9	-113	0	0	0	111.5	V475 A479 E480 M483 N541 A542 S547 T548 V549	V475-Y545 HydrophobicContact CB-CG 4.42Å; V475-Y545 HydrophobicContact CG1-CD1 3.47Å; V475-Y545 VanDerWaalsContact CG1-CD1 3.47Å; V475-Y545 HydrophobicContact CG1-CD2 4.15Å; V475-Y545 HydrophobicContact CG1-CE1 3.57Å; V475-Y545 HydrophobicContact CG1-CE2 4.27Å; V475-Y545 HydrophobicContact CG1-CG 3.75Å; V475-Y545 HydrophobicContact CG2-CD1 4.36Å; V475-Y545 HydrophobicContact CG2-CD2 3.51Å; V475-Y545 HydrophobicContact CG2-CE2 3.82Å; V475-Y545 HydrophobicContact CG2-CG 3.81Å; A479-Y545 HydrophobicContact CB-CD1 3.87Å; A479-Y545 HydrophobicContact CB-CE1 4.49Å; E480-Y545 WeakPolarHBondContact OE2-CE1 3.35Å; E480-Y545 VanDerWaalsContact OE2-CZ 3.24Å; E480-Y545 PolarHBondContact OE2-OH 3.08Å; M483-Y545 HydrophobicContact CB-CE1 4.48Å; M483-Y545 HydrophobicContact CG-CD1 4.42Å; M483-Y545 HydrophobicContact CG-CE1 3.83Å; N541-Y545 VanDerWaalsContact O-CB 3.29Å; N541-Y545 WeakPolarHBondContact O-CB 3.34Å; N541-Y545 PolarHBondContact O-N 3.22Å; A542-Y545 PolarHBondContact O-N 3.22Å; Y545-S547 VanDerWaalsContact C-N 3.32Å; Y545-S547 PolarHBondContact O-N 2.99Å; Y545-T548 WeakPolarHBondContact O-CB 3.49Å; Y545-T548 PolarHBondContact O-N 2.86Å; Y545-T548 VanDerWaalsContact O-N 3.08Å; Y545-V549 HydrophobicContact CD1-CG2 4.48Å; Y545-V549 HydrophobicContact CD2-CG2 3.88Å; Y545-V549 HydrophobicContact CE1-CG2 4.12Å; Y545-V549 HydrophobicContact CE2-CG2 3.4Å; Y545-V549 VanDerWaalsContact CE2-CG2 3.4Å; Y545-V549 HydrophobicContact CG-CG2 4.4Å; Y545-V549 WeakPolarHBondContact O-CG2 3.45Å; Y545-V549 PolarHBondContact O-N 3.2Å
546	I	97.1	Very high	95.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-43.4	-179.3	-65.7	166.8	0	0	0	110.8	A479 F482 M483 F516 L520 A542 T548 V549 L550 L599	A479-I546 HydrophobicContact CB-CD1 4.34Å; A479-I546 HydrophobicContact CB-CG1 4.4Å; F482-I546 HydrophobicContact CD1-CD1 4.02Å; M483-I546 HydrophobicContact CG-CG1 4.32Å; M483-I546 HydrophobicContact SD-CB 4.35Å; M483-I546 HydrophobicContact SD-CG1 3.99Å; M483-I546 HydrophobicContact SD-CG2 3.96Å; F516-I546 HydrophobicContact CD1-CD1 3.7Å; F516-I546 HydrophobicContact CE1-CD1 3.48Å; F516-I546 VanDerWaalsContact CE1-CD1 3.48Å; L520-I546 HydrophobicContact CD1-CD1 4.35Å; A542-I546 VanDerWaalsContact O-CG1 3.28Å; A542-I546 WeakPolarHBondContact O-CG1 3.26Å; A542-I546 PolarHBondContact O-N 3.01Å; I546-T548 VanDerWaalsContact C-N 3.3Å; I546-T548 PolarHBondContact O-N 3.31Å; I546-V549 PolarHBondContact O-N 2.94Å; I546-L550 HydrophobicContact CG2-CD1 3.79Å; I546-L550 HydrophobicContact CG2-CG 4.21Å; I546-L550 WeakPolarHBondContact O-CB 3.28Å; I546-L550 VanDerWaalsContact O-CG 3.26Å; I546-L550 WeakPolarHBondContact O-CG 3.48Å; I546-L550 PolarHBondContact O-N 3.44Å; I546-L599 HydrophobicContact CB-CD1 4.44Å; I546-L599 HydrophobicContact CG2-CD1 3.76Å
547	S	96.9	Very high	95.2	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.028	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-45.1	175.1	-174.7	0	0	0	0	111.5	V543 Y545 A551 E600	V543-S547 VanDerWaalsContact O-CB 3.31Å; V543-S547 WeakPolarHBondContact O-CB 3.49Å; V543-S547 PolarHBondContact O-N 3.48Å; Y545-S547 VanDerWaalsContact C-N 3.32Å; Y545-S547 PolarHBondContact O-N 2.99Å; S547-A551 WeakPolarHBondContact O-CB 3.42Å; S547-A551 PolarHBondContact O-N 2.93Å; S547-E600 PolarHBondContact OG-OE1 3.42Å
548	T	95.1	Very high	95.2	Very high	44 Å²	44	30.3 Å²	30.3	27%	0.27	17%	0.169	S	C	.	.	H	α-helix	trans	-66.5	-47.7	-179.9	-52.3	0	0	0	0	111.5	M473 N544 Y545 I546 L550 A551 D552	M473-T548 HydrophobicContact CE-CG2 4.31Å; N544-T548 WeakPolarHBondContact O-CB 3.25Å; N544-T548 PolarHBondContact O-N 2.79Å; N544-T548 PolarHBondContact O-OG1 3.49Å; Y545-T548 WeakPolarHBondContact O-CB 3.49Å; Y545-T548 PolarHBondContact O-N 2.86Å; Y545-T548 VanDerWaalsContact O-N 3.08Å; I546-T548 VanDerWaalsContact C-N 3.3Å; I546-T548 PolarHBondContact O-N 3.31Å; T548-L550 PolarHBondContact O-N 2.97Å; T548-A551 WeakPolarHBondContact O-CB 3.27Å; T548-A551 PolarHBondContact O-N 2.98Å; T548-D552 PolarHBondContact O-N 3.28Å
549	V	95.7	Very high	95.1	Very high	20 Å²	20	30.5 Å²	30.5	12%	0.121	17%	0.169	C	C	.	.	H	α-helix	trans	-66.1	-38	-179.5	178.8	0	0	0	0	111.7	M483 Y545 I546 A551 D552 W553	M483-V549 HydrophobicContact CE-CB 3.93Å; M483-V549 HydrophobicContact CE-CG1 3.46Å; M483-V549 VanDerWaalsContact CE-CG1 3.46Å; Y545-V549 HydrophobicContact CD1-CG2 4.48Å; Y545-V549 HydrophobicContact CD2-CG2 3.88Å; Y545-V549 HydrophobicContact CE1-CG2 4.12Å; Y545-V549 HydrophobicContact CE2-CG2 3.4Å; Y545-V549 VanDerWaalsContact CE2-CG2 3.4Å; Y545-V549 HydrophobicContact CG-CG2 4.4Å; Y545-V549 WeakPolarHBondContact O-CG2 3.45Å; Y545-V549 PolarHBondContact O-N 3.2Å; I546-V549 PolarHBondContact O-N 2.94Å; V549-A551 VanDerWaalsContact C-N 3.33Å; V549-D552 PolarHBondContact O-N 3.38Å; V549-W553 HydrophobicContact CG1-CD2 4.38Å; V549-W553 HydrophobicContact CG1-CG 4.45Å; V549-W553 HydrophobicContact CG1-CZ2 4.03Å; V549-W553 WeakPolarHBondContact O-CB 3.47Å; V549-W553 PolarHBondContact O-N 3.01Å
550	L	96.4	Very high	94.9	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-36.5	175.3	-72	176	0	0	0	112.1	M483 V513 I546 T548 W553 A554 F592 I596 L599	M483-L550 HydrophobicContact CE-CD2 4.06Å; M483-L550 HydrophobicContact CE-CG 4.31Å; V513-L550 HydrophobicContact CG1-CD1 3.79Å; V513-L550 HydrophobicContact CG2-CD1 4.32Å; V513-L550 HydrophobicContact CG2-CD2 4.47Å; I546-L550 HydrophobicContact CG2-CD1 3.79Å; I546-L550 HydrophobicContact CG2-CG 4.21Å; I546-L550 WeakPolarHBondContact O-CB 3.28Å; I546-L550 VanDerWaalsContact O-CG 3.26Å; I546-L550 WeakPolarHBondContact O-CG 3.48Å; I546-L550 PolarHBondContact O-N 3.44Å; T548-L550 PolarHBondContact O-N 2.97Å; L550-W553 HydrophobicContact CD2-CE3 4.27Å; L550-W553 PolarHBondContact O-N 3.38Å; L550-A554 PolarHBondContact O-N 3.46Å; L550-F592 HydrophobicContact CB-CB 4.45Å; L550-F592 HydrophobicContact CD2-CD1 4.21Å; L550-F592 HydrophobicContact CD2-CD2 4.46Å; L550-F592 HydrophobicContact CD2-CE1 4.38Å; L550-F592 HydrophobicContact CD2-CG 4.26Å; L550-I596 HydrophobicContact CB-CD1 4.11Å; L550-I596 HydrophobicContact CB-CG1 3.89Å; L550-L599 HydrophobicContact CD1-CD1 3.97Å
551	A	94.8	Very high	94.6	Very high	40 Å²	40	39.3 Å²	39.3	33%	0.331	21%	0.213	S	C	.	.	H	α-helix	trans	-63.4	-43.5	172.6	0	0	0	0	0	111	S547 T548 V549 W553 A554 I596	S547-A551 WeakPolarHBondContact O-CB 3.42Å; S547-A551 PolarHBondContact O-N 2.93Å; T548-A551 WeakPolarHBondContact O-CB 3.27Å; T548-A551 PolarHBondContact O-N 2.98Å; V549-A551 VanDerWaalsContact C-N 3.33Å; A551-W553 VanDerWaalsContact C-N 3.3Å; A551-W553 PolarHBondContact O-N 3.36Å; A551-A554 VanDerWaalsContact O-CB 3.29Å; A551-A554 WeakPolarHBondContact O-CB 3.2Å; A551-A554 PolarHBondContact O-N 2.87Å; A551-I596 HydrophobicContact CB-CD1 4.1Å
552	D	94.4	Very high	94.4	Very high	101 Å²	101	39.4 Å²	39.4	54%	0.54	21%	0.213	S	C	.	.	H	α-helix	trans	-64.9	-35.5	175.1	-66	-21.1	0	0	0	112	T548 V549 D555	T548-D552 PolarHBondContact O-N 3.28Å; V549-D552 PolarHBondContact O-N 3.38Å; D552-D555 PolarHBondContact O-N 2.95Å
553	W	94.9	Very high	94.1	Very high	21 Å²	21	40.2 Å²	40.2	8%	0.08	22%	0.217	C	C	.	.	H	α-helix	trans	-69.9	-33.1	177.7	-76.3	16.9	0	0	0	113.3	M483 L486 L487 V549 L550 A551 D555 N556 F559 F592	M483-W553 HydrophobicContact CE-CD2 4.46Å; M483-W553 HydrophobicContact CE-CE3 4.35Å; M483-W553 HydrophobicContact CE-CH2 3.59Å; M483-W553 HydrophobicContact CE-CZ2 3.67Å; M483-W553 HydrophobicContact CE-CZ3 3.95Å; L486-W553 HydrophobicContact CB-CH2 3.73Å; L486-W553 HydrophobicContact CB-CZ3 3.81Å; L486-W553 HydrophobicContact CD1-CZ3 4.4Å; L487-W553 HydrophobicContact CB-CH2 4.44Å; L487-W553 HydrophobicContact CD1-CZ2 4.08Å; L487-W553 HydrophobicContact CD2-CH2 3.57Å; L487-W553 HydrophobicContact CD2-CZ2 3.19Å; L487-W553 HydrophobicContact CD2-CZ3 4.44Å; L487-W553 HydrophobicContact CG-CH2 3.56Å; L487-W553 HydrophobicContact CG-CZ2 3.35Å; V549-W553 HydrophobicContact CG1-CD2 4.38Å; V549-W553 HydrophobicContact CG1-CG 4.45Å; V549-W553 HydrophobicContact CG1-CZ2 4.03Å; V549-W553 WeakPolarHBondContact O-CB 3.47Å; V549-W553 PolarHBondContact O-N 3.01Å; L550-W553 HydrophobicContact CD2-CE3 4.27Å; L550-W553 PolarHBondContact O-N 3.38Å; A551-W553 VanDerWaalsContact C-N 3.3Å; A551-W553 PolarHBondContact O-N 3.36Å; W553-D555 PolarHBondContact O-N 3.35Å; W553-N556 WeakPolarHBondContact O-CB 3.4Å; W553-N556 PolarHBondContact O-N 2.98Å; W553-F559 HydrophobicContact CB-CD2 4.24Å; W553-F559 HydrophobicContact CB-CE2 4.11Å; W553-F559 HydrophobicContact CD2-CE2 4.39Å; W553-F559 HydrophobicContact CE3-CE2 4.13Å; W553-F559 HydrophobicContact CE3-CZ 4.11Å; W553-F559 HydrophobicContact CG-CE2 4.41Å; W553-F559 WeakPolarHBondContact O-CD2 3.38Å; W553-F592 HydrophobicContact CB-CE2 4.31Å
554	A	90.9	Very high	93.6	Very high	7 Å²	7	43.1 Å²	43.1	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-52.8	-36.6	174.8	0	0	0	0	0	112.2	L550 A551 N556 L560 S590	L550-A554 PolarHBondContact O-N 3.46Å; A551-A554 VanDerWaalsContact O-CB 3.29Å; A551-A554 WeakPolarHBondContact O-CB 3.2Å; A551-A554 PolarHBondContact O-N 2.87Å; A554-N556 VanDerWaalsContact C-N 3.31Å; A554-N556 PolarHBondContact O-N 3.2Å; A554-L560 WeakPolarHBondContact O-CD2 3.27Å; A554-S590 WeakPolarHBondContact CB-OG 3.21Å
555	D	90.1	Very high	93.2	Very high	122 Å²	122	43 Å²	43	65%	0.652	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5	-177.8	-67.1	-26.8	0	0	0	113.6	D552 W553	D552-D555 PolarHBondContact O-N 2.95Å; W553-D555 PolarHBondContact O-N 3.35Å
556	N	93.6	Very high	92.7	Very high	78 Å²	78	42.4 Å²	42.4	42%	0.417	23%	0.234	S	C	.	.	S	Bend	trans	-71.5	138.7	175.9	-74.9	-37.4	0	0	0	111.2	W553 A554 F558 F559 L560	W553-N556 WeakPolarHBondContact O-CB 3.4Å; W553-N556 PolarHBondContact O-N 2.98Å; A554-N556 VanDerWaalsContact C-N 3.31Å; A554-N556 PolarHBondContact O-N 3.2Å; N556-F558 PolarHBondContact O-N 3.04Å; N556-F559 HydrophobicContact CB-CD2 4.12Å; N556-F559 PolarHBondContact O-N 3.22Å; N556-L560 PolarHBondContact O-N 3.02Å
557	V	92.3	Very high	92.1	Very high	104 Å²	104	43.1 Å²	43.1	63%	0.63	24%	0.238	S	C	*	.	H	α-helix	trans	-48.7	-40	-178.9	178.5	0	0	0	0	112.9	Q561	V557-Q561 HydrophobicContact CG1-CG 4.48Å; V557-Q561 WeakPolarHBondContact O-CB 3.27Å; V557-Q561 VanDerWaalsContact O-CG 3.24Å; V557-Q561 WeakPolarHBondContact O-CG 3.36Å; V557-Q561 PolarHBondContact O-N 3.41Å
558	F	93.9	Very high	91.3	Very high	39 Å²	39	46.2 Å²	46.2	17%	0.171	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-45.8	179.2	176	-109.4	0	0	0	112.7	T490 Y493 K494 K502 N556 Q561 L562	T490-F558 HydrophobicContact CG2-CD1 4.01Å; T490-F558 HydrophobicContact CG2-CE1 3.74Å; Y493-F558 HydrophobicContact CD2-CZ 4.05Å; Y493-F558 AromaticContact CE2-CE1 3.76Å; Y493-F558 HydrophobicContact CE2-CE1 3.76Å; Y493-F558 AromaticContact CE2-CZ 3.47Å; Y493-F558 HydrophobicContact CE2-CZ 3.47Å; Y493-F558 VanDerWaalsContact CE2-CZ 3.47Å; Y493-F558 AromaticContact CZ-CE1 3.9Å; K494-F558 HydrophobicContact CB-CD2 4.21Å; K494-F558 HydrophobicContact CB-CE1 4.31Å; K494-F558 HydrophobicContact CB-CE2 3.59Å; K494-F558 HydrophobicContact CB-CZ 3.63Å; K502-F558 HydrophobicContact CD-CE2 4.21Å; N556-F558 PolarHBondContact O-N 3.04Å; F558-Q561 WeakPolarHBondContact O-CB 3.28Å; F558-Q561 PolarHBondContact O-N 2.89Å; F558-L562 HydrophobicContact CD1-CD1 4.26Å; F558-L562 HydrophobicContact CE1-CD1 3.64Å; F558-L562 HydrophobicContact CE1-CG 4.48Å; F558-L562 HydrophobicContact CE2-CD1 4.4Å; F558-L562 HydrophobicContact CZ-CD1 3.73Å; F558-L562 HydrophobicContact CZ-CG 4.32Å; F558-L562 WeakPolarHBondContact O-CG 3.43Å; F558-L562 PolarHBondContact O-N 3.07Å; F558-L562 VanDerWaalsContact O-N 3.14Å
559	F	94.7	Very high	90.4	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.035	26%	0.26	C	S	.	.	H	α-helix	trans	-75.7	-32.7	-179	-68.5	-72.6	0	0	0	112.1	T490 L506 W553 N556 Q561 L562 Q563 V591 F592	T490-F559 HydrophobicContact CG2-CE2 4.5Å; T490-F559 HydrophobicContact CG2-CZ 3.98Å; L506-F559 HydrophobicContact CD1-CD1 4.06Å; L506-F559 HydrophobicContact CD1-CE1 3.93Å; W553-F559 HydrophobicContact CB-CD2 4.24Å; W553-F559 HydrophobicContact CB-CE2 4.11Å; W553-F559 HydrophobicContact CD2-CE2 4.39Å; W553-F559 HydrophobicContact CE3-CE2 4.13Å; W553-F559 HydrophobicContact CE3-CZ 4.11Å; W553-F559 HydrophobicContact CG-CE2 4.41Å; W553-F559 WeakPolarHBondContact O-CD2 3.38Å; N556-F559 HydrophobicContact CB-CD2 4.12Å; N556-F559 PolarHBondContact O-N 3.22Å; F559-Q561 VanDerWaalsContact C-N 3.32Å; F559-Q561 PolarHBondContact O-N 3.08Å; F559-L562 HydrophobicContact CD1-CD1 4.17Å; F559-L562 PolarHBondContact O-N 2.88Å; F559-L562 VanDerWaalsContact O-N 3.15Å; F559-Q563 PolarHBondContact O-N 2.49Å; F559-V591 HydrophobicContact CB-CG2 4.15Å; F559-V591 HydrophobicContact CD1-CG2 4.26Å; F559-F592 AromaticContact CD1-CE2 3.59Å; F559-F592 HydrophobicContact CD1-CE2 3.59Å; F559-F592 AromaticContact CD1-CZ 3.79Å; F559-F592 HydrophobicContact CD1-CZ 3.79Å; F559-F592 HydrophobicContact CD2-CE2 4.27Å; F559-F592 AromaticContact CE1-CE2 3.66Å; F559-F592 HydrophobicContact CE1-CE2 3.66Å; F559-F592 AromaticContact CE1-CZ 3.47Å; F559-F592 HydrophobicContact CE1-CZ 3.47Å; F559-F592 VanDerWaalsContact CE1-CZ 3.47Å; F559-F592 HydrophobicContact CE2-CE2 4.31Å; F559-F592 AromaticContact CG-CE2 3.91Å; F559-F592 HydrophobicContact CG-CE2 3.91Å; F559-F592 HydrophobicContact CZ-CE2 4.02Å; F559-F592 AromaticContact CZ-CZ 3.97Å; F559-F592 HydrophobicContact CZ-CZ 3.97Å
560	L	91.6	Very high	89	Confident	74 Å²	74	54.5 Å²	54.5	39%	0.387	29%	0.288	S	S	.	.	H	α-helix	trans	-60.9	-40.4	169.5	-66.1	175.5	0	0	0	112	A554 N556 L562 Q563 Q564	A554-L560 WeakPolarHBondContact O-CD2 3.27Å; N556-L560 PolarHBondContact O-N 3.02Å; L560-L562 VanDerWaalsContact C-N 3.32Å; L560-L562 PolarHBondContact O-N 3.26Å; L560-Q563 WeakPolarHBondContact O-CB 3.47Å; L560-Q563 PolarHBondContact O-N 3.34Å; L560-Q564 PolarHBondContact O-N 3.45Å
561	Q	91.2	Very high	87.6	Confident	112 Å²	112	55.3 Å²	55.3	52%	0.523	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-36.7	173.6	-75.3	173.1	-1.4	0	0	112.2	V557 F558 F559 A565	V557-Q561 HydrophobicContact CG1-CG 4.48Å; V557-Q561 WeakPolarHBondContact O-CB 3.27Å; V557-Q561 VanDerWaalsContact O-CG 3.24Å; V557-Q561 WeakPolarHBondContact O-CG 3.36Å; V557-Q561 PolarHBondContact O-N 3.41Å; F558-Q561 WeakPolarHBondContact O-CB 3.28Å; F558-Q561 PolarHBondContact O-N 2.89Å; F559-Q561 VanDerWaalsContact C-N 3.32Å; F559-Q561 PolarHBondContact O-N 3.08Å; Q561-A565 WeakPolarHBondContact O-CB 3.37Å; Q561-A565 PolarHBondContact O-N 2.97Å
562	L	92.4	Very high	85.8	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-37.9	174.5	-65.5	179.4	0	0	0	112.1	Y493 K502 L503 L506 F558 F559 L560 A565 A566	Y493-L562 HydrophobicContact CE2-CD1 4.01Å; K502-L562 HydrophobicContact CB-CD2 3.48Å; K502-L562 VanDerWaalsContact CB-CD2 3.48Å; K502-L562 HydrophobicContact CD-CD2 4Å; K502-L562 HydrophobicContact CG-CD2 4.38Å; L503-L562 HydrophobicContact CD2-CB 4.24Å; L503-L562 HydrophobicContact CD2-CD2 4.47Å; L503-L562 WeakPolarHBondContact CD2-O 3.32Å; L506-L562 HydrophobicContact CB-CD1 4.4Å; L506-L562 HydrophobicContact CD1-CD1 4.42Å; L506-L562 HydrophobicContact CD2-CB 4.12Å; L506-L562 HydrophobicContact CD2-CD1 4.05Å; F558-L562 HydrophobicContact CD1-CD1 4.26Å; F558-L562 HydrophobicContact CE1-CD1 3.64Å; F558-L562 HydrophobicContact CE1-CG 4.48Å; F558-L562 HydrophobicContact CE2-CD1 4.4Å; F558-L562 HydrophobicContact CZ-CD1 3.73Å; F558-L562 HydrophobicContact CZ-CG 4.32Å; F558-L562 WeakPolarHBondContact O-CG 3.43Å; F558-L562 PolarHBondContact O-N 3.07Å; F558-L562 VanDerWaalsContact O-N 3.14Å; F559-L562 HydrophobicContact CD1-CD1 4.17Å; F559-L562 PolarHBondContact O-N 2.88Å; F559-L562 VanDerWaalsContact O-N 3.15Å; L560-L562 VanDerWaalsContact C-N 3.32Å; L560-L562 PolarHBondContact O-N 3.26Å; L562-A565 PolarHBondContact O-N 3.15Å; L562-A566 WeakPolarHBondContact O-CB 3.35Å; L562-A566 PolarHBondContact O-N 3.24Å
563	Q	89.6	Confident	83.8	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-48.9	173.7	-166.3	-170.9	8.6	0	0	110.9	F559 L560 A565 A566 L567 A585 E588 S589 V591	F559-Q563 PolarHBondContact O-N 2.49Å; L560-Q563 WeakPolarHBondContact O-CB 3.47Å; L560-Q563 PolarHBondContact O-N 3.34Å; Q563-A565 VanDerWaalsContact C-N 3.34Å; Q563-A565 PolarHBondContact O-N 3.07Å; Q563-A566 PolarHBondContact O-N 3.3Å; Q563-L567 PolarHBondContact O-N 2.98Å; Q563-L567 VanDerWaalsContact O-N 3.1Å; Q563-A585 PolarHBondContact NE2-O 2.97Å; Q563-E588 PolarHBondContact NE2-O 3.48Å; Q563-S589 PolarHBondContact NE2-O 3.29Å; Q563-V591 HydrophobicContact CB-CG1 3.72Å; Q563-V591 HydrophobicContact CG-CG1 4.1Å
564	Q	87.1	Confident	82	Confident	61 Å²	61	68.1 Å²	68.1	29%	0.285	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-46.3	174.8	-176.4	-173.6	-20.2	0	0	111.1	L560 A566 L567 E568	L560-Q564 PolarHBondContact O-N 3.45Å; Q564-A566 VanDerWaalsContact C-N 3.33Å; Q564-A566 PolarHBondContact O-N 2.87Å; Q564-L567 WeakPolarHBondContact O-CB 3.08Å; Q564-L567 PolarHBondContact O-N 2.96Å; Q564-E568 PolarHBondContact NE2-OE1 3.04Å; Q564-E568 WeakPolarHBondContact O-CG 3.39Å; Q564-E568 PolarHBondContact O-N 3.27Å
565	A	88.3	Confident	80.5	Confident	8 Å²	8	75.3 Å²	75.3	7%	0.066	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-36.8	179.6	0	0	0	0	0	113.1	A499 L503 Q561 L562 Q563 L567 E568 V569	A499-A565 HydrophobicContact CB-CB 3.72Å; L503-A565 HydrophobicContact CD1-CB 4.36Å; Q561-A565 WeakPolarHBondContact O-CB 3.37Å; Q561-A565 PolarHBondContact O-N 2.97Å; L562-A565 PolarHBondContact O-N 3.15Å; Q563-A565 VanDerWaalsContact C-N 3.34Å; Q563-A565 PolarHBondContact O-N 3.07Å; A565-L567 VanDerWaalsContact C-N 3.32Å; A565-E568 PolarHBondContact O-N 3.33Å; A565-V569 WeakPolarHBondContact O-CG2 3.31Å; A565-V569 PolarHBondContact O-N 3.13Å; A565-V569 VanDerWaalsContact O-N 3.12Å
566	A	86.5	Confident	79.3	Confident	24 Å²	24	73.2 Å²	73.2	20%	0.198	39%	0.386	C	S	.	.	H	α-helix	trans	-60.7	-46.5	174.2	0	0	0	0	0	110	L503 L562 Q563 Q564 E568 V569 F570	L503-A566 HydrophobicContact CD1-CB 4.33Å; L503-A566 HydrophobicContact CD2-CB 3.9Å; L562-A566 WeakPolarHBondContact O-CB 3.35Å; L562-A566 PolarHBondContact O-N 3.24Å; Q563-A566 PolarHBondContact O-N 3.3Å; Q564-A566 VanDerWaalsContact C-N 3.33Å; Q564-A566 PolarHBondContact O-N 2.87Å; A566-E568 VanDerWaalsContact C-N 3.32Å; A566-E568 PolarHBondContact O-N 2.87Å; A566-V569 PolarHBondContact O-N 2.97Å; A566-F570 WeakPolarHBondContact O-CD2 3.46Å; A566-F570 PolarHBondContact O-N 2.91Å
567	L	82.9	Confident	78.2	Confident	17 Å²	17	72.2 Å²	72.2	9%	0.089	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-37.4	175.5	-79.2	169.4	0	0	0	113.2	Q563 Q564 A565 V569 F570 A571 L581 A585 E588	Q563-L567 PolarHBondContact O-N 2.98Å; Q563-L567 VanDerWaalsContact O-N 3.1Å; Q564-L567 WeakPolarHBondContact O-CB 3.08Å; Q564-L567 PolarHBondContact O-N 2.96Å; A565-L567 VanDerWaalsContact C-N 3.32Å; L567-V569 VanDerWaalsContact C-N 3.32Å; L567-V569 PolarHBondContact O-N 2.94Å; L567-F570 PolarHBondContact O-N 3.24Å; L567-A571 WeakPolarHBondContact O-CB 3.26Å; L567-A571 PolarHBondContact O-N 3.23Å; L567-L581 HydrophobicContact CB-CD1 4.16Å; L567-L581 HydrophobicContact CB-CD2 4.16Å; L567-L581 HydrophobicContact CB-CG 4.03Å; L567-A585 HydrophobicContact CD1-CB 3.56Å; L567-E588 WeakPolarHBondContact CD1-OE2 3.5Å; L567-E588 VanDerWaalsContact CD2-CD 3.47Å; L567-E588 WeakPolarHBondContact CD2-OE1 3.36Å; L567-E588 WeakPolarHBondContact CD2-OE2 2.71Å; L567-E588 WeakPolarHBondContact CG-OE2 3.23Å
568	E	80.3	Confident	77	Confident	68 Å²	68	74.9 Å²	74.9	32%	0.318	39%	0.388	S	S	.	.	H	α-helix	trans	-60.5	-44.8	176.3	-73.5	178.3	-177.9	0	0	110.3	Q564 A565 A566 F570 A571 E572 L581	Q564-E568 PolarHBondContact NE2-OE1 3.04Å; Q564-E568 WeakPolarHBondContact O-CG 3.39Å; Q564-E568 PolarHBondContact O-N 3.27Å; A565-E568 PolarHBondContact O-N 3.33Å; A566-E568 VanDerWaalsContact C-N 3.32Å; A566-E568 PolarHBondContact O-N 2.87Å; E568-F570 PolarHBondContact O-N 3.25Å; E568-A571 CarbonylContact O-C 3.59Å; E568-A571 PolarHBondContact O-N 2.66Å; E568-E572 PolarHBondContact O-N 3.13Å; E568-E572 VanDerWaalsContact O-N 3.1Å; E568-L581 HydrophobicContact CB-CD2 3.97Å; E568-L581 HydrophobicContact CG-CD2 3.07Å
569	V	76.4	Confident	75.8	Confident	76 Å²	76	79.2 Å²	79.2	46%	0.461	41%	0.412	S	S	.	.	H	α-helix	trans	-64.5	-39.4	177.2	175.3	0	0	0	0	111.7	L503 A565 A566 L567	L503-V569 HydrophobicContact CD1-CG2 4.18Å; A565-V569 WeakPolarHBondContact O-CG2 3.31Å; A565-V569 PolarHBondContact O-N 3.13Å; A565-V569 VanDerWaalsContact O-N 3.12Å; A566-V569 PolarHBondContact O-N 2.97Å; L567-V569 VanDerWaalsContact C-N 3.32Å; L567-V569 PolarHBondContact O-N 2.94Å
570	F	67.8	Low	74.4	Confident	162 Å²	162	83.1 Å²	83.1	71%	0.711	43%	0.431	S	S	*	.	H	α-helix	trans	-70.6	-32.5	174.6	-74.8	-69.6	0	0	0	112.8	A566 L567 E568	A566-F570 WeakPolarHBondContact O-CD2 3.46Å; A566-F570 PolarHBondContact O-N 2.91Å; L567-F570 PolarHBondContact O-N 3.24Å; E568-F570 PolarHBondContact O-N 3.25Å
571	A	65.9	Low	73.2	Confident	17 Å²	17	80 Å²	80	14%	0.14	42%	0.415	C	S	.	.	H	α-helix	trans	-86.4	-1.6	-176.3	0	0	0	0	0	114.1	L567 E568 N573 N574 L581	L567-A571 WeakPolarHBondContact O-CB 3.26Å; L567-A571 PolarHBondContact O-N 3.23Å; E568-A571 CarbonylContact O-C 3.59Å; E568-A571 PolarHBondContact O-N 2.66Å; A571-N573 PolarHBondContact O-N 3.06Å; A571-N574 CarbonylContact O-C 3.37Å; A571-N574 PolarHBondContact O-N 2.92Å; A571-L581 HydrophobicContact CB-CD1 3.77Å
572	E	56.4	Low	71.9	Confident	169 Å²	169	76 Å²	76	79%	0.79	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-12.1	169.9	-77.1	-176.7	170.2	0	0	113	E568	E568-E572 PolarHBondContact O-N 3.13Å; E568-E572 VanDerWaalsContact O-N 3.1Å
573	N	53.8	Low	70.5	Confident	148 Å²	148	81 Å²	81	79%	0.791	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-10.7	169.6	-69.4	-38.1	0	0	0	115.5	A571	A571-N573 PolarHBondContact O-N 3.06Å
574	N	55.8	Low	69.3	Low	115 Å²	115	83.2 Å²	83.2	62%	0.615	44%	0.438	S	S	*	.	S	Bend	trans	-135.6	132.8	-175.4	-80.6	-29.5	0	0	0	111.9	A571 L576	A571-N574 CarbonylContact O-C 3.37Å; A571-N574 PolarHBondContact O-N 2.92Å; N574-L576 HydrophobicContact CB-CD1 4.38Å; N574-L576 PolarHBondContact O-N 3.24Å
575	T	60.3	Low	68	Low	157 Å²	157	80.6 Å²	80.6	96%	0.963	43%	0.428	S	S	*	.			trans	-72.8	59.4	-179.1	45.1	0	0	0	0	113.7
576	L	63.8	Low	66.7	Low	78 Å²	78	84.8 Å²	84.8	41%	0.408	46%	0.456	S	S	.	.			trans	-92.3	140.5	177.1	-73.6	164	0	0	0	111.7	N574 Q580 L581 L584	N574-L576 HydrophobicContact CB-CD1 4.38Å; N574-L576 PolarHBondContact O-N 3.24Å; L576-Q580 HydrophobicContact CD2-CB 4.37Å; L576-L581 HydrophobicContact CB-CD1 4.5Å; L576-L581 HydrophobicContact CD1-CD1 4.41Å; L576-L584 HydrophobicContact CD1-CD1 3.81Å
577	S	71.6	Confident	65.5	Low	57 Å²	57	91.3 Å²	91.3	40%	0.399	48%	0.484	S	S	.	.			trans	-76.4	152.6	175.4	69.2	0	0	0	0	111.9	L579 Q580 L581	S577-L579 PolarHBondContact O-N 3.24Å; S577-L579 VanDerWaalsContact O-N 3.12Å; S577-Q580 WeakPolarHBondContact O-CB 3.38Å; S577-Q580 PolarHBondContact O-N 2.98Å; S577-Q580 VanDerWaalsContact OG-CD 3.25Å; S577-Q580 VanDerWaalsContact OG-CG 3.29Å; S577-Q580 WeakPolarHBondContact OG-CG 3.19Å; S577-Q580 PolarHBondContact OG-N 3.35Å; S577-Q580 PolarHBondContact OG-OE1 3.5Å; S577-L581 PolarHBondContact O-N 3.1Å
578	K	67	Low	64.7	Low	161 Å²	161	95 Å²	95	70%	0.7	50%	0.502	S	S	*	.	H	α-helix	trans	-53.6	-34.2	178.4	-70.2	-173.2	175.1	-173.2	0	113.9	L581 G582	K578-L581 PolarHBondContact O-N 2.85Å; K578-G582 PolarHBondContact O-N 3.29Å
579	L	67.6	Low	64.4	Low	129 Å²	129	95.3 Å²	95.3	68%	0.675	51%	0.511	S	S	*	.	H	α-helix	trans	-70.8	-42.8	178.2	-165.5	106.7	0	0	0	111.7	S577 L581 G582 Q583	S577-L579 PolarHBondContact O-N 3.24Å; S577-L579 VanDerWaalsContact O-N 3.12Å; L579-L581 VanDerWaalsContact C-N 3.27Å; L579-L581 PolarHBondContact O-N 2.97Å; L579-G582 PolarHBondContact O-N 3.48Å; L579-Q583 WeakPolarHBondContact O-CG 3.21Å; L579-Q583 PolarHBondContact O-N 3.02Å
580	Q	66.7	Low	64.9	Low	90 Å²	90	92.8 Å²	92.8	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-34.9	175.2	-71.5	166.1	-43.1	0	0	111.2	L576 S577 Q583 L584	L576-Q580 HydrophobicContact CD2-CB 4.37Å; S577-Q580 WeakPolarHBondContact O-CB 3.38Å; S577-Q580 PolarHBondContact O-N 2.98Å; S577-Q580 VanDerWaalsContact OG-CD 3.25Å; S577-Q580 VanDerWaalsContact OG-CG 3.29Å; S577-Q580 WeakPolarHBondContact OG-CG 3.19Å; S577-Q580 PolarHBondContact OG-N 3.35Å; S577-Q580 PolarHBondContact OG-OE1 3.5Å; Q580-Q583 WeakPolarHBondContact O-CB 3.15Å; Q580-Q583 PolarHBondContact O-N 3.38Å; Q580-L584 WeakPolarHBondContact O-CG 3.39Å; Q580-L584 PolarHBondContact O-N 2.98Å
581	L	65.3	Low	66	Low	9 Å²	9	86.2 Å²	86.2	5%	0.047	47%	0.47	C	S	.	.	H	α-helix	trans	-71.6	-37.5	177.6	-154.6	79.1	0	0	0	112.7	L567 E568 A571 L576 S577 K578 L579 Q583 L584 A585	L567-L581 HydrophobicContact CB-CD1 4.16Å; L567-L581 HydrophobicContact CB-CD2 4.16Å; L567-L581 HydrophobicContact CB-CG 4.03Å; E568-L581 HydrophobicContact CB-CD2 3.97Å; E568-L581 HydrophobicContact CG-CD2 3.07Å; A571-L581 HydrophobicContact CB-CD1 3.77Å; L576-L581 HydrophobicContact CB-CD1 4.5Å; L576-L581 HydrophobicContact CD1-CD1 4.41Å; S577-L581 PolarHBondContact O-N 3.1Å; K578-L581 PolarHBondContact O-N 2.85Å; L579-L581 VanDerWaalsContact C-N 3.27Å; L579-L581 PolarHBondContact O-N 2.97Å; L581-Q583 VanDerWaalsContact C-N 3.3Å; L581-Q583 PolarHBondContact O-N 3.38Å; L581-L584 HydrophobicContact CD1-CD1 4.36Å; L581-L584 PolarHBondContact O-N 3.27Å; L581-A585 WeakPolarHBondContact O-CB 3.46Å; L581-A585 PolarHBondContact O-N 3.33Å
582	G	64.4	Low	67.4	Low	27 Å²	27	85.4 Å²	85.4	28%	0.278	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-35.5	169.5	0	0	0	0	0	112.8	K578 L579 S586	K578-G582 PolarHBondContact O-N 3.29Å; L579-G582 PolarHBondContact O-N 3.48Å; G582-S586 PolarHBondContact O-N 3.3Å
583	Q	63.8	Low	69.1	Low	110 Å²	110	79.8 Å²	79.8	51%	0.514	44%	0.438	S	S	.	.	H	α-helix	trans	-67.1	-42.3	172.1	-72.5	174.2	-18.8	0	0	111.8	L579 Q580 L581 S586 M587	L579-Q583 WeakPolarHBondContact O-CG 3.21Å; L579-Q583 PolarHBondContact O-N 3.02Å; Q580-Q583 WeakPolarHBondContact O-CB 3.15Å; Q580-Q583 PolarHBondContact O-N 3.38Å; L581-Q583 VanDerWaalsContact C-N 3.3Å; L581-Q583 PolarHBondContact O-N 3.38Å; Q583-S586 PolarHBondContact O-N 2.91Å; Q583-S586 PolarHBondContact O-OG 3.22Å; Q583-M587 WeakPolarHBondContact O-CG 3.49Å; Q583-M587 PolarHBondContact O-N 3.34Å; Q583-M587 VanDerWaalsContact O-N 3.12Å
584	L	63.2	Low	70.9	Confident	64 Å²	64	77.6 Å²	77.6	34%	0.335	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-43	173.7	-73.5	166	0	0	0	111.7	L576 Q580 L581 S586 M587 E588	L576-L584 HydrophobicContact CD1-CD1 3.81Å; Q580-L584 WeakPolarHBondContact O-CG 3.39Å; Q580-L584 PolarHBondContact O-N 2.98Å; L581-L584 HydrophobicContact CD1-CD1 4.36Å; L581-L584 PolarHBondContact O-N 3.27Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 3.5Å; L584-M587 CarbonylContact O-C 3.6Å; L584-M587 WeakPolarHBondContact O-CA 3.46Å; L584-M587 PolarHBondContact O-N 3.01Å; L584-E588 WeakPolarHBondContact O-CB 3.3Å; L584-E588 WeakPolarHBondContact O-CG 3.3Å; L584-E588 PolarHBondContact O-N 2.89Å
585	A	60.8	Low	72.8	Confident	7 Å²	7	73.1 Å²	73.1	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-57.4	-40.7	173.9	0	0	0	0	0	111.9	Q563 L567 L581 M587 E588	Q563-A585 PolarHBondContact NE2-O 2.97Å; L567-A585 HydrophobicContact CD1-CB 3.56Å; L581-A585 WeakPolarHBondContact O-CB 3.46Å; L581-A585 PolarHBondContact O-N 3.33Å; A585-M587 PolarHBondContact O-N 3.38Å; A585-E588 PolarHBondContact O-N 3.5Å
586	S	61.3	Low	74.6	Confident	96 Å²	96	66.5 Å²	66.5	67%	0.671	36%	0.361	S	S	*	.	H	α-helix	trans	-71.1	-17.8	175.7	74.2	0	0	0	0	114.5	G582 Q583 L584	G582-S586 PolarHBondContact O-N 3.3Å; Q583-S586 PolarHBondContact O-N 2.91Å; Q583-S586 PolarHBondContact O-OG 3.22Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 3.5Å
587	M	60.3	Low	76.1	Confident	160 Å²	160	66.4 Å²	66.4	79%	0.788	36%	0.361	S	S	*	.	H	α-helix	trans	-97.1	-19.4	177.1	-69.8	-174.3	71.2	0	0	112.8	Q583 L584 A585	Q583-M587 WeakPolarHBondContact O-CG 3.49Å; Q583-M587 PolarHBondContact O-N 3.34Å; Q583-M587 VanDerWaalsContact O-N 3.12Å; L584-M587 CarbonylContact O-C 3.6Å; L584-M587 WeakPolarHBondContact O-CA 3.46Å; L584-M587 PolarHBondContact O-N 3.01Å; A585-M587 PolarHBondContact O-N 3.38Å
588	E	66	Low	77.4	Confident	96 Å²	96	66.3 Å²	66.3	45%	0.449	36%	0.356	S	S	.	.	S	Bend	trans	-87.4	160.2	177.8	-80.1	-170.6	-178.4	0	0	112.5	Q563 L567 L584 A585	Q563-E588 PolarHBondContact NE2-O 3.48Å; L567-E588 WeakPolarHBondContact CD1-OE2 3.5Å; L567-E588 VanDerWaalsContact CD2-CD 3.47Å; L567-E588 WeakPolarHBondContact CD2-OE1 3.36Å; L567-E588 WeakPolarHBondContact CD2-OE2 2.71Å; L567-E588 WeakPolarHBondContact CG-OE2 3.23Å; L584-E588 WeakPolarHBondContact O-CB 3.3Å; L584-E588 WeakPolarHBondContact O-CG 3.3Å; L584-E588 PolarHBondContact O-N 2.89Å; A585-E588 PolarHBondContact O-N 3.5Å
589	S	74.8	Confident	78.8	Confident	74 Å²	74	58.8 Å²	58.8	52%	0.517	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-59.3	142.6	173.9	50	0	0	0	0	111.8	Q563 D593	Q563-S589 PolarHBondContact NE2-O 3.29Å; S589-D593 VanDerWaalsContact C-OD2 3.31Å; S589-D593 WeakPolarHBondContact CA-OD2 3.38Å; S589-D593 WeakPolarHBondContact CB-OD2 3.47Å
590	S	86.3	Confident	80.2	Confident	23 Å²	23	55.5 Å²	55.5	16%	0.161	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-56.8	155.8	173.2	153.2	0	0	0	0	112.1	A554 F592 D593	A554-S590 WeakPolarHBondContact CB-OG 3.21Å; S590-F592 PolarHBondContact O-N 2.92Å; S590-F592 PolarHBondContact OG-N 3.38Å; S590-F592 VanDerWaalsContact OG-N 3.15Å; S590-D593 WeakPolarHBondContact CB-OD1 3.43Å; S590-D593 VanDerWaalsContact N-CG 3.3Å; S590-D593 PolarHBondContact N-OD2 2.95Å; S590-D593 WeakPolarHBondContact O-CB 3.31Å; S590-D593 PolarHBondContact O-N 2.93Å
591	V	90.7	Very high	81.7	Confident	24 Å²	24	58.6 Å²	58.6	15%	0.145	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.8	175.3	-62.8	0	0	0	0	114.4	L506 F559 Q563	L506-V591 HydrophobicContact CD2-CB 4.08Å; L506-V591 HydrophobicContact CD2-CG1 4.09Å; L506-V591 HydrophobicContact CD2-CG2 4.46Å; F559-V591 HydrophobicContact CB-CG2 4.15Å; F559-V591 HydrophobicContact CD1-CG2 4.26Å; Q563-V591 HydrophobicContact CB-CG1 3.72Å; Q563-V591 HydrophobicContact CG-CG1 4.1Å
592	F	95.4	Very high	83.2	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-1.2	179	-64	-59.9	0	0	0	114.3	L506 K510 L550 W553 F559 S590 D594 M595 I596	L506-F592 HydrophobicContact CD1-CE1 4.04Å; L506-F592 HydrophobicContact CD1-CZ 3.88Å; K510-F592 HydrophobicContact CG-CD1 4.26Å; K510-F592 HydrophobicContact CG-CE1 4.2Å; L550-F592 HydrophobicContact CB-CB 4.45Å; L550-F592 HydrophobicContact CD2-CD1 4.21Å; L550-F592 HydrophobicContact CD2-CD2 4.46Å; L550-F592 HydrophobicContact CD2-CE1 4.38Å; L550-F592 HydrophobicContact CD2-CG 4.26Å; W553-F592 HydrophobicContact CB-CE2 4.31Å; F559-F592 AromaticContact CD1-CE2 3.59Å; F559-F592 HydrophobicContact CD1-CE2 3.59Å; F559-F592 AromaticContact CD1-CZ 3.79Å; F559-F592 HydrophobicContact CD1-CZ 3.79Å; F559-F592 HydrophobicContact CD2-CE2 4.27Å; F559-F592 AromaticContact CE1-CE2 3.66Å; F559-F592 HydrophobicContact CE1-CE2 3.66Å; F559-F592 AromaticContact CE1-CZ 3.47Å; F559-F592 HydrophobicContact CE1-CZ 3.47Å; F559-F592 VanDerWaalsContact CE1-CZ 3.47Å; F559-F592 HydrophobicContact CE2-CE2 4.31Å; F559-F592 AromaticContact CG-CE2 3.91Å; F559-F592 HydrophobicContact CG-CE2 3.91Å; F559-F592 HydrophobicContact CZ-CE2 4.02Å; F559-F592 AromaticContact CZ-CZ 3.97Å; F559-F592 HydrophobicContact CZ-CZ 3.97Å; S590-F592 PolarHBondContact O-N 2.92Å; S590-F592 PolarHBondContact OG-N 3.38Å; S590-F592 VanDerWaalsContact OG-N 3.15Å; F592-D594 VanDerWaalsContact C-N 3.32Å; F592-D594 PolarHBondContact O-N 3.48Å; F592-M595 WeakPolarHBondContact O-CB 3.49Å; F592-M595 PolarHBondContact O-N 3.41Å; F592-I596 HydrophobicContact CB-CD1 3.99Å; F592-I596 HydrophobicContact CB-CG1 4.35Å; F592-I596 WeakPolarHBondContact O-CG1 3.28Å; F592-I596 PolarHBondContact O-N 3.48Å
593	D	92.6	Very high	84.8	Confident	50 Å²	50	58.8 Å²	58.8	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-59.4	-39.3	-171.5	-86.4	-8.5	0	0	0	113.4	S589 S590 M595 I596 N597	S589-D593 VanDerWaalsContact C-OD2 3.31Å; S589-D593 WeakPolarHBondContact CA-OD2 3.38Å; S589-D593 WeakPolarHBondContact CB-OD2 3.47Å; S590-D593 WeakPolarHBondContact CB-OD1 3.43Å; S590-D593 VanDerWaalsContact N-CG 3.3Å; S590-D593 PolarHBondContact N-OD2 2.95Å; S590-D593 WeakPolarHBondContact O-CB 3.31Å; S590-D593 PolarHBondContact O-N 2.93Å; D593-M595 VanDerWaalsContact C-N 3.32Å; D593-M595 PolarHBondContact O-N 3.06Å; D593-I596 PolarHBondContact O-N 3.4Å; D593-N597 VanDerWaalsContact O-CB 3.24Å; D593-N597 WeakPolarHBondContact O-CB 3.36Å; D593-N597 PolarHBondContact O-N 3.2Å; D593-N597 PolarHBondContact O-ND2 3.17Å
594	D	92.2	Very high	86.4	Confident	103 Å²	103	58.5 Å²	58.5	55%	0.551	30%	0.304	S	S	*	.	H	α-helix	trans	-60.9	-42.2	176.2	-74.9	-27.6	0	0	0	111.9	F592 N597 L598	F592-D594 VanDerWaalsContact C-N 3.32Å; F592-D594 PolarHBondContact O-N 3.48Å; D594-N597 PolarHBondContact O-N 2.98Å; D594-L598 WeakPolarHBondContact O-CD1 3.33Å; D594-L598 VanDerWaalsContact O-CG 3.26Å; D594-L598 WeakPolarHBondContact O-CG 3.35Å; D594-L598 PolarHBondContact O-N 3.36Å; D594-L598 VanDerWaalsContact O-N 3.08Å
595	M	95.8	Very high	88	Confident	21 Å²	21	59.7 Å²	59.7	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-69.1	-44.1	178.8	-67.7	73.6	-133.2	0	0	111.1	K510 V513 F592 D593 N597 L598 L599	K510-M595 HydrophobicContact CB-CE 4.19Å; K510-M595 HydrophobicContact CB-SD 4.09Å; K510-M595 HydrophobicContact CD-SD 4.34Å; K510-M595 HydrophobicContact CG-SD 3.93Å; V513-M595 HydrophobicContact CB-CG 4.41Å; V513-M595 HydrophobicContact CG1-CB 3.92Å; V513-M595 HydrophobicContact CG1-CG 4.09Å; F592-M595 WeakPolarHBondContact O-CB 3.49Å; F592-M595 PolarHBondContact O-N 3.41Å; D593-M595 VanDerWaalsContact C-N 3.32Å; D593-M595 PolarHBondContact O-N 3.06Å; M595-N597 VanDerWaalsContact C-N 3.35Å; M595-L598 PolarHBondContact O-N 3.3Å; M595-L599 WeakPolarHBondContact O-CG 3.43Å; M595-L599 PolarHBondContact O-N 2.94Å
596	I	96.8	Very high	89.7	Confident	18 Å²	18	59.3 Å²	59.3	9%	0.092	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-48.6	174.5	-68.7	165.9	0	0	0	109.5	L550 A551 F592 D593 L598 L599 E600	L550-I596 HydrophobicContact CB-CD1 4.11Å; L550-I596 HydrophobicContact CB-CG1 3.89Å; A551-I596 HydrophobicContact CB-CD1 4.1Å; F592-I596 HydrophobicContact CB-CD1 3.99Å; F592-I596 HydrophobicContact CB-CG1 4.35Å; F592-I596 WeakPolarHBondContact O-CG1 3.28Å; F592-I596 PolarHBondContact O-N 3.48Å; D593-I596 PolarHBondContact O-N 3.4Å; I596-L598 VanDerWaalsContact C-N 3.29Å; I596-L598 PolarHBondContact O-N 3.01Å; I596-L599 PolarHBondContact O-N 3.12Å; I596-L599 VanDerWaalsContact O-N 3.13Å; I596-E600 HydrophobicContact CG2-CG 4.18Å; I596-E600 WeakPolarHBondContact O-CB 3.26Å; I596-E600 VanDerWaalsContact O-CG 3.31Å; I596-E600 WeakPolarHBondContact O-CG 3.34Å; I596-E600 PolarHBondContact O-N 3.47Å
597	N	96.2	Very high	91.5	Very high	75 Å²	75	54.9 Å²	54.9	40%	0.401	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-38.4	177.8	-78.3	-43.3	0	0	0	112.6	D593 D594 M595 R601	D593-N597 VanDerWaalsContact O-CB 3.24Å; D593-N597 WeakPolarHBondContact O-CB 3.36Å; D593-N597 PolarHBondContact O-N 3.2Å; D593-N597 PolarHBondContact O-ND2 3.17Å; D594-N597 PolarHBondContact O-N 2.98Å; M595-N597 VanDerWaalsContact C-N 3.35Å; N597-R601 VanDerWaalsContact O-CG 3.26Å; N597-R601 WeakPolarHBondContact O-CG 3.48Å; N597-R601 PolarHBondContact O-N 3.5Å
598	L	97.3	Very high	93.2	Very high	56 Å²	56	49 Å²	49	29%	0.293	25%	0.249	S	C	.	.	H	α-helix	trans	-70.5	-38.2	177	-69.7	165.4	0	0	0	112.3	D594 M595 I596 L602	D594-L598 WeakPolarHBondContact O-CD1 3.33Å; D594-L598 VanDerWaalsContact O-CG 3.26Å; D594-L598 WeakPolarHBondContact O-CG 3.35Å; D594-L598 PolarHBondContact O-N 3.36Å; D594-L598 VanDerWaalsContact O-N 3.08Å; M595-L598 PolarHBondContact O-N 3.3Å; I596-L598 VanDerWaalsContact C-N 3.29Å; I596-L598 PolarHBondContact O-N 3.01Å; L598-L602 PolarHBondContact O-N 3.13Å; L598-L602 VanDerWaalsContact O-N 3.14Å
599	L	97.8	Very high	94.6	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-66.4	-42.7	173.1	-72.7	162.5	0	0	0	111.5	V513 R517 V543 I546 L550 M595 I596 R601 L602 K603	V513-L599 HydrophobicContact CG1-CD1 4.44Å; R517-L599 HydrophobicContact CB-CD2 4.13Å; R517-L599 HydrophobicContact CG-CD2 3.87Å; R517-L599 HydrophobicContact CG-CG 4.48Å; V543-L599 HydrophobicContact CG1-CB 4.13Å; V543-L599 HydrophobicContact CG1-CD2 4.02Å; V543-L599 WeakPolarHBondContact CG1-O 3.46Å; I546-L599 HydrophobicContact CB-CD1 4.44Å; I546-L599 HydrophobicContact CG2-CD1 3.76Å; L550-L599 HydrophobicContact CD1-CD1 3.97Å; M595-L599 WeakPolarHBondContact O-CG 3.43Å; M595-L599 PolarHBondContact O-N 2.94Å; I596-L599 PolarHBondContact O-N 3.12Å; I596-L599 VanDerWaalsContact O-N 3.13Å; L599-R601 PolarHBondContact O-N 3.37Å; L599-L602 WeakPolarHBondContact O-CB 3.28Å; L599-L602 PolarHBondContact O-N 3.19Å; L599-K603 WeakPolarHBondContact O-CB 3.47Å; L599-K603 PolarHBondContact O-N 3.46Å
600	E	97.4	Very high	95.7	Very high	61 Å²	61	45.9 Å²	45.9	29%	0.285	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-40.4	177.1	-75.6	-61.6	127.1	0	0	112.5	S547 I596 K603 H604	S547-E600 PolarHBondContact OG-OE1 3.42Å; I596-E600 HydrophobicContact CG2-CG 4.18Å; I596-E600 WeakPolarHBondContact O-CB 3.26Å; I596-E600 VanDerWaalsContact O-CG 3.31Å; I596-E600 WeakPolarHBondContact O-CG 3.34Å; I596-E600 PolarHBondContact O-N 3.47Å; E600-K603 WeakPolarHBondContact O-CB 3.26Å; E600-K603 PolarHBondContact O-N 3.35Å; E600-K603 WeakPolarHBondContact OE1-CE 3.31Å; E600-K603 IonicContact OE1-NZ 2.69Å; E600-K603 PolarHBondContact OE1-NZ 2.92Å; E600-K603 WeakPolarHBondContact OE2-CE 3.48Å; E600-K603 IonicContact OE2-NZ 3.15Å; E600-K603 PolarHBondContact OE2-NZ 3.19Å; E600-H604 WeakPolarHBondContact O-CB 3.33Å; E600-H604 PolarHBondContact O-N 3.38Å
601	R	97.2	Very high	96.2	Very high	154 Å²	154	44.8 Å²	44.8	58%	0.581	21%	0.214	S	C	*	.	H	α-helix	trans	-61.4	-46.8	171.9	-73.8	172.5	-163.3	152.7	7.2	111.5	N597 L599 K603 H604 D605	N597-R601 VanDerWaalsContact O-CG 3.26Å; N597-R601 WeakPolarHBondContact O-CG 3.48Å; N597-R601 PolarHBondContact O-N 3.5Å; L599-R601 PolarHBondContact O-N 3.37Å; R601-K603 VanDerWaalsContact C-N 3.32Å; R601-K603 PolarHBondContact O-N 2.91Å; R601-H604 PolarHBondContact O-N 3.34Å; R601-D605 WeakPolarHBondContact O-CB 3.31Å; R601-D605 PolarHBondContact O-N 3.16Å
602	L	97.4	Very high	96.5	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-59.7	-44	176.5	177.4	61.1	0	0	0	111.3	R517 T521 V543 L598 L599 H604 D605 M606	R517-L602 HydrophobicContact CG-CD2 4.08Å; T521-L602 HydrophobicContact CG2-CD1 4.39Å; T521-L602 WeakPolarHBondContact OG1-CD2 3.39Å; V543-L602 HydrophobicContact CG1-CD2 4.46Å; V543-L602 HydrophobicContact CG2-CD2 3.74Å; V543-L602 HydrophobicContact CG2-CG 4.33Å; L598-L602 PolarHBondContact O-N 3.13Å; L598-L602 VanDerWaalsContact O-N 3.14Å; L599-L602 WeakPolarHBondContact O-CB 3.28Å; L599-L602 PolarHBondContact O-N 3.19Å; L602-H604 PolarHBondContact O-N 3.15Å; L602-D605 PolarHBondContact O-N 2.86Å; L602-M606 HydrophobicContact CD1-CG 4.15Å; L602-M606 HydrophobicContact CD1-SD 4.07Å; L602-M606 HydrophobicContact CG-SD 4.06Å; L602-M606 WeakPolarHBondContact O-CB 3.42Å; L602-M606 VanDerWaalsContact O-CG 3.24Å; L602-M606 WeakPolarHBondContact O-CG 3.11Å; L602-M606 PolarHBondContact O-N 3.11Å
603	K	97.7	Very high	96.5	Very high	22 Å²	22	49 Å²	49	10%	0.096	24%	0.235	C	C	.	.	H	α-helix	trans	-57	-49.2	175.3	-173.5	-177.5	75.1	-175.1	0	111.5	L540 V543 N544 L599 E600 R601 M606 L607 L670	L540-K603 HydrophobicContact CD1-CB 4.3Å; L540-K603 HydrophobicContact CD1-CG 3.81Å; V543-K603 HydrophobicContact CG1-CB 3.99Å; N544-K603 HydrophobicContact CB-CD 4.14Å; L599-K603 WeakPolarHBondContact O-CB 3.47Å; L599-K603 PolarHBondContact O-N 3.46Å; E600-K603 WeakPolarHBondContact O-CB 3.26Å; E600-K603 PolarHBondContact O-N 3.35Å; E600-K603 WeakPolarHBondContact OE1-CE 3.31Å; E600-K603 IonicContact OE1-NZ 2.69Å; E600-K603 PolarHBondContact OE1-NZ 2.92Å; E600-K603 WeakPolarHBondContact OE2-CE 3.48Å; E600-K603 IonicContact OE2-NZ 3.15Å; E600-K603 PolarHBondContact OE2-NZ 3.19Å; R601-K603 VanDerWaalsContact C-N 3.32Å; R601-K603 PolarHBondContact O-N 2.91Å; K603-M606 PolarHBondContact O-N 3.01Å; K603-L607 HydrophobicContact CG-CD1 4.13Å; K603-L607 WeakPolarHBondContact O-CB 3.48Å; K603-L607 WeakPolarHBondContact O-CG 3.23Å; K603-L607 PolarHBondContact O-N 3.49Å; K603-L670 HydrophobicContact CD-CD2 3.75Å; K603-L670 HydrophobicContact CG-CD2 3.8Å
604	H	97.8	Very high	96.8	Very high	105 Å²	105	46.7 Å²	46.7	49%	0.486	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-44.1	179.9	-176	70.4	0	0	0	112.5	E600 R601 L602 M606 L607 T608	E600-H604 WeakPolarHBondContact O-CB 3.33Å; E600-H604 PolarHBondContact O-N 3.38Å; R601-H604 PolarHBondContact O-N 3.34Å; L602-H604 PolarHBondContact O-N 3.15Å; H604-M606 VanDerWaalsContact C-N 3.32Å; H604-M606 PolarHBondContact O-N 3.1Å; H604-L607 PolarHBondContact O-N 3.31Å; H604-T608 WeakPolarHBondContact O-CB 3.34Å; H604-T608 PolarHBondContact O-N 2.92Å; H604-T608 PolarHBondContact O-OG1 2.95Å
605	D	96.5	Very high	97	Very high	88 Å²	88	43.5 Å²	43.5	47%	0.471	20%	0.204	S	C	.	.	H	α-helix	trans	-60.9	-42.5	176.8	-77.4	-9.3	0	0	0	111.5	R601 L602 R609	R601-D605 WeakPolarHBondContact O-CB 3.31Å; R601-D605 PolarHBondContact O-N 3.16Å; L602-D605 PolarHBondContact O-N 2.86Å; D605-R609 WeakPolarHBondContact O-CG 3.21Å; D605-R609 PolarHBondContact O-N 2.94Å; D605-R609 VanDerWaalsContact O-N 3.15Å
606	M	97.3	Very high	97.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.2	-47.3	178.2	-74.2	-178.5	64.4	0	0	112.4	M524 Y536 I539 L540 L602 K603 H604 T608 R609 Q610	M524-M606 HydrophobicContact CG-CE 3.68Å; M524-M606 HydrophobicContact CG-CG 4.07Å; M524-M606 HydrophobicContact CG-SD 3.79Å; M524-M606 HydrophobicContact SD-CE 4.44Å; M524-M606 HydrophobicContact SD-CG 3.55Å; M524-M606 VanDerWaalsContact SD-CG 3.55Å; M524-M606 HydrophobicContact SD-SD 3.98Å; Y536-M606 HydrophobicContact CD1-CE 3.87Å; Y536-M606 HydrophobicContact CE1-CB 4.03Å; Y536-M606 HydrophobicContact CE1-CE 3.59Å; Y536-M606 HydrophobicContact CE1-CG 4.33Å; Y536-M606 HydrophobicContact CE2-CE 4.31Å; Y536-M606 HydrophobicContact CG-CE 4.36Å; Y536-M606 WeakPolarHBondContact O-CE 3.34Å; Y536-M606 VanDerWaalsContact OH-CA 3.26Å; Y536-M606 WeakPolarHBondContact OH-CA 3.35Å; Y536-M606 WeakPolarHBondContact OH-CG 3.49Å; Y536-M606 PolarHBondContact OH-O 3.46Å; I539-M606 HydrophobicContact CB-CE 4.15Å; I539-M606 HydrophobicContact CG2-CE 3.99Å; I539-M606 HydrophobicContact CG2-SD 4.25Å; L540-M606 HydrophobicContact CB-CE 3.75Å; L540-M606 HydrophobicContact CD1-CB 3.75Å; L540-M606 HydrophobicContact CD1-CE 4.13Å; L540-M606 HydrophobicContact CD1-SD 4.12Å; L540-M606 HydrophobicContact CG-CE 4.42Å; L602-M606 HydrophobicContact CD1-CG 4.15Å; L602-M606 HydrophobicContact CD1-SD 4.07Å; L602-M606 HydrophobicContact CG-SD 4.06Å; L602-M606 WeakPolarHBondContact O-CB 3.42Å; L602-M606 VanDerWaalsContact O-CG 3.24Å; L602-M606 WeakPolarHBondContact O-CG 3.11Å; L602-M606 PolarHBondContact O-N 3.11Å; K603-M606 PolarHBondContact O-N 3.01Å; H604-M606 VanDerWaalsContact C-N 3.32Å; H604-M606 PolarHBondContact O-N 3.1Å; M606-T608 VanDerWaalsContact C-N 3.32Å; M606-T608 PolarHBondContact O-N 3.37Å; M606-R609 PolarHBondContact O-N 3.33Å; M606-Q610 PolarHBondContact O-N 3.06Å; M606-Q610 VanDerWaalsContact O-N 3.07Å
607	L	97.4	Very high	97.1	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-45.1	175.8	-79.3	168.5	0	0	0	111.4	L540 K603 H604 R609 Q610 V611 L670 I673 F674 M677	L540-L607 HydrophobicContact CD1-CG 4.48Å; L540-L607 HydrophobicContact CD2-CD2 3.74Å; L540-L607 HydrophobicContact CD2-CG 3.94Å; K603-L607 HydrophobicContact CG-CD1 4.13Å; K603-L607 WeakPolarHBondContact O-CB 3.48Å; K603-L607 WeakPolarHBondContact O-CG 3.23Å; K603-L607 PolarHBondContact O-N 3.49Å; H604-L607 PolarHBondContact O-N 3.31Å; L607-R609 VanDerWaalsContact C-N 3.29Å; L607-R609 PolarHBondContact O-N 3.41Å; L607-Q610 PolarHBondContact O-N 3.49Å; L607-Q610 VanDerWaalsContact O-N 3.15Å; L607-V611 WeakPolarHBondContact O-CG2 3.42Å; L607-V611 PolarHBondContact O-N 3.26Å; L607-L670 HydrophobicContact CD1-CD2 4.06Å; L607-L670 HydrophobicContact CD2-CD2 4.42Å; L607-L670 HydrophobicContact CG-CD2 4.47Å; L607-I673 HydrophobicContact CD1-CB 4.33Å; L607-I673 HydrophobicContact CD1-CG2 3.83Å; L607-F674 HydrophobicContact CD2-CB 3.97Å; L607-M677 HydrophobicContact CB-SD 4.48Å
608	T	97	Very high	97.1	Very high	36 Å²	36	49.3 Å²	49.3	22%	0.221	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-41.5	178.9	-59.5	0	0	0	0	111.3	H604 M606 V611 D612	H604-T608 WeakPolarHBondContact O-CB 3.34Å; H604-T608 PolarHBondContact O-N 2.92Å; H604-T608 PolarHBondContact O-OG1 2.95Å; M606-T608 VanDerWaalsContact C-N 3.32Å; M606-T608 PolarHBondContact O-N 3.37Å; T608-V611 PolarHBondContact O-N 3.35Å; T608-D612 WeakPolarHBondContact O-CB 3.47Å; T608-D612 VanDerWaalsContact O-CG 3.29Å; T608-D612 PolarHBondContact O-N 2.84Å
609	R	95.9	Very high	97.1	Very high	105 Å²	105	50.8 Å²	50.8	40%	0.396	23%	0.225	S	C	.	.	H	α-helix	trans	-65.9	-38.8	176	-70.5	172.5	-172.2	-149.5	3.5	113.1	D605 M606 L607 H613	D605-R609 WeakPolarHBondContact O-CG 3.21Å; D605-R609 PolarHBondContact O-N 2.94Å; D605-R609 VanDerWaalsContact O-N 3.15Å; M606-R609 PolarHBondContact O-N 3.33Å; L607-R609 VanDerWaalsContact C-N 3.29Å; L607-R609 PolarHBondContact O-N 3.41Å; R609-H613 WeakPolarHBondContact O-CB 3.47Å; R609-H613 PolarHBondContact O-N 3.49Å
610	Q	96.5	Very high	97	Very high	0 Å²	0	54 Å²	54	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-46.7	174.1	-71.6	-169.4	-37.2	0	0	111	S531 L532 Y536 C537 M606 L607 D612 H613 V614 F674	S531-Q610 WeakPolarHBondContact O-CG 3.34Å; S531-Q610 PolarHBondContact O-NE2 3.43Å; L532-Q610 HydrophobicContact CD2-CB 4.37Å; L532-Q610 HydrophobicContact CD2-CG 4.41Å; Y536-Q610 HydrophobicContact CD1-CG 4.11Å; Y536-Q610 HydrophobicContact CE1-CG 3.72Å; C537-Q610 PolarHBondContact SG-NE2 3.27Å; M606-Q610 PolarHBondContact O-N 3.06Å; M606-Q610 VanDerWaalsContact O-N 3.07Å; L607-Q610 PolarHBondContact O-N 3.49Å; L607-Q610 VanDerWaalsContact O-N 3.15Å; Q610-D612 PolarHBondContact O-N 3.22Å; Q610-H613 PolarHBondContact O-N 3.21Å; Q610-V614 WeakPolarHBondContact O-CG2 3.2Å; Q610-V614 PolarHBondContact O-N 2.84Å; Q610-F674 HydrophobicContact CB-CD2 4.06Å; Q610-F674 HydrophobicContact CB-CE2 3.93Å
611	V	97.9	Very high	96.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-46.9	177.6	171.9	0	0	0	0	110.6	L607 T608 H613 V614 F615 F674 M677 L678 K681	L607-V611 WeakPolarHBondContact O-CG2 3.42Å; L607-V611 PolarHBondContact O-N 3.26Å; T608-V611 PolarHBondContact O-N 3.35Å; V611-H613 VanDerWaalsContact C-N 3.32Å; V611-H613 PolarHBondContact O-N 2.94Å; V611-V614 PolarHBondContact O-N 3.43Å; V611-F615 WeakPolarHBondContact O-CB 3.46Å; V611-F615 PolarHBondContact O-N 2.87Å; V611-F674 HydrophobicContact CB-CE2 4.38Å; V611-F674 HydrophobicContact CG2-CD2 3.54Å; V611-F674 HydrophobicContact CG2-CE2 3.71Å; V611-F674 HydrophobicContact CG2-CG 4.43Å; V611-M677 HydrophobicContact CG1-CB 4.32Å; V611-M677 HydrophobicContact CG2-CB 3.81Å; V611-M677 HydrophobicContact CG2-CE 4.48Å; V611-L678 HydrophobicContact CG1-CB 4.37Å; V611-L678 HydrophobicContact CG1-CD1 4.4Å; V611-K681 HydrophobicContact CG1-CD 4.01Å
612	D	96.8	Very high	96.8	Very high	58 Å²	58	44.8 Å²	44.8	31%	0.31	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-37.7	179.2	-78.2	-21.8	0	0	0	113.3	T608 Q610 R616 K681	T608-D612 WeakPolarHBondContact O-CB 3.47Å; T608-D612 VanDerWaalsContact O-CG 3.29Å; T608-D612 PolarHBondContact O-N 2.84Å; Q610-D612 PolarHBondContact O-N 3.22Å; D612-R616 WeakPolarHBondContact O-CB 3.43Å; D612-R616 PolarHBondContact O-N 3.44Å; D612-R616 VanDerWaalsContact O-N 3.08Å; D612-K681 IonicContact OD1-NZ 2.95Å; D612-K681 PolarHBondContact OD1-NZ 3.43Å
613	H	95.9	Very high	96.7	Very high	56 Å²	56	49.5 Å²	49.5	26%	0.259	23%	0.229	S	C	.	.	H	α-helix	trans	-67.1	-53.2	176.9	-179.8	86.5	0	0	0	111	S531 L532 R609 Q610 V611 F615 R616 E617	S531-H613 WeakPolarHBondContact OG-CB 3.44Å; L532-H613 VanDerWaalsContact CD1-CD2 3.46Å; L532-H613 WeakPolarHBondContact CD1-CD2 3.23Å; L532-H613 VanDerWaalsContact CG-CD2 3.49Å; L532-H613 WeakPolarHBondContact CG-CD2 3.44Å; R609-H613 WeakPolarHBondContact O-CB 3.47Å; R609-H613 PolarHBondContact O-N 3.49Å; Q610-H613 PolarHBondContact O-N 3.21Å; V611-H613 VanDerWaalsContact C-N 3.32Å; V611-H613 PolarHBondContact O-N 2.94Å; H613-F615 VanDerWaalsContact C-N 3.34Å; H613-F615 PolarHBondContact O-N 3.14Å; H613-R616 WeakPolarHBondContact O-CB 3.48Å; H613-R616 PolarHBondContact O-N 3.41Å; H613-R616 VanDerWaalsContact O-N 3.17Å; H613-E617 PolarHBondContact O-N 2.99Å; H613-E617 VanDerWaalsContact O-N 3.16Å
614	V	97.4	Very high	96.4	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-44.7	178.4	175.3	0	0	0	0	110.9	L532 Q610 V611 R616 E617 V618 H658 L662 F674 L678	L532-V614 HydrophobicContact CD1-CG2 3.92Å; L532-V614 HydrophobicContact CD2-CG2 3.69Å; L532-V614 HydrophobicContact CG-CG2 4.43Å; Q610-V614 WeakPolarHBondContact O-CG2 3.2Å; Q610-V614 PolarHBondContact O-N 2.84Å; V611-V614 PolarHBondContact O-N 3.43Å; V614-R616 VanDerWaalsContact C-N 3.26Å; V614-R616 PolarHBondContact O-N 3Å; V614-E617 PolarHBondContact O-N 2.65Å; V614-V618 HydrophobicContact CG1-CG2 4.02Å; V614-V618 WeakPolarHBondContact O-CB 3.34Å; V614-V618 WeakPolarHBondContact O-CG2 3.48Å; V614-V618 PolarHBondContact O-N 3.02Å; V614-H658 HydrophobicContact CG1-CB 3.89Å; V614-H658 HydrophobicContact CG2-CB 4.08Å; V614-L662 HydrophobicContact CG2-CD1 4.21Å; V614-F674 HydrophobicContact CB-CZ 4.21Å; V614-F674 HydrophobicContact CG1-CZ 4.43Å; V614-F674 HydrophobicContact CG2-CE2 4.32Å; V614-F674 HydrophobicContact CG2-CZ 3.9Å; V614-L678 HydrophobicContact CB-CD1 4.43Å; V614-L678 HydrophobicContact CG1-CD1 4.13Å; V614-L678 HydrophobicContact CG1-CD2 3.78Å
615	F	97.9	Very high	96.3	Very high	36 Å²	36	48.8 Å²	48.8	16%	0.158	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-37.6	178.3	176.6	-106.7	0	0	0	112.3	V611 H613 K619 L678 K681 L682 Y685	V611-F615 WeakPolarHBondContact O-CB 3.46Å; V611-F615 PolarHBondContact O-N 2.87Å; H613-F615 VanDerWaalsContact C-N 3.34Å; H613-F615 PolarHBondContact O-N 3.14Å; F615-K619 HydrophobicContact CE1-CD 4.3Å; F615-K619 HydrophobicContact CZ-CD 4.48Å; F615-K619 WeakPolarHBondContact O-CB 3.46Å; F615-K619 PolarHBondContact O-N 3.17Å; F615-L678 HydrophobicContact CB-CD1 3.97Å; F615-K681 HydrophobicContact CD1-CD 4.46Å; F615-K681 HydrophobicContact CD2-CB 3.82Å; F615-K681 HydrophobicContact CE2-CB 3.93Å; F615-K681 HydrophobicContact CG-CB 4.26Å; F615-K681 HydrophobicContact CG-CD 4.4Å; F615-K681 HydrophobicContact CZ-CB 4.46Å; F615-L682 HydrophobicContact CD2-CD2 3.83Å; F615-L682 HydrophobicContact CD2-CG 4.35Å; F615-L682 HydrophobicContact CE2-CD2 4.07Å; F615-Y685 HydrophobicContact CE2-CD1 4.39Å; F615-Y685 AromaticContact CE2-CG 3.99Å; F615-Y685 HydrophobicContact CE2-CG 3.99Å; F615-Y685 HydrophobicContact CZ-CD2 4.21Å; F615-Y685 AromaticContact CZ-CG 3.93Å; F615-Y685 HydrophobicContact CZ-CG 3.93Å
616	R	97	Very high	96.1	Very high	152 Å²	152	48 Å²	48	57%	0.574	22%	0.222	S	C	*	.	H	α-helix	trans	-65.2	-48.5	176.7	-172.8	-174.4	-53.3	-177.9	3.3	112.1	D612 H613 V614 V618 K619 D620	D612-R616 WeakPolarHBondContact O-CB 3.43Å; D612-R616 PolarHBondContact O-N 3.44Å; D612-R616 VanDerWaalsContact O-N 3.08Å; H613-R616 WeakPolarHBondContact O-CB 3.48Å; H613-R616 PolarHBondContact O-N 3.41Å; H613-R616 VanDerWaalsContact O-N 3.17Å; V614-R616 VanDerWaalsContact C-N 3.26Å; V614-R616 PolarHBondContact O-N 3Å; R616-V618 VanDerWaalsContact C-N 3.34Å; R616-V618 PolarHBondContact O-N 2.81Å; R616-K619 PolarHBondContact O-N 2.81Å; R616-D620 WeakPolarHBondContact O-CB 3.46Å; R616-D620 PolarHBondContact O-N 2.96Å
617	E	96.7	Very high	95.9	Very high	83 Å²	83	56.3 Å²	56.3	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-45.1	177.5	-67.8	-64.2	133.6	0	0	111.1	H613 V614 K619 D620 A621 T654	H613-E617 PolarHBondContact O-N 2.99Å; H613-E617 VanDerWaalsContact O-N 3.16Å; V614-E617 PolarHBondContact O-N 2.65Å; E617-K619 PolarHBondContact O-N 3.19Å; E617-D620 PolarHBondContact O-N 3.31Å; E617-A621 WeakPolarHBondContact O-CB 3.44Å; E617-A621 PolarHBondContact O-N 3.21Å; E617-T654 HydrophobicContact CB-CG2 4.19Å
618	V	96.6	Very high	95.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-42.9	177.1	174.7	0	0	0	0	111.1	V614 R616 D620 A621 A622 L651 T654 L655 L682	V614-V618 HydrophobicContact CG1-CG2 4.02Å; V614-V618 WeakPolarHBondContact O-CB 3.34Å; V614-V618 WeakPolarHBondContact O-CG2 3.48Å; V614-V618 PolarHBondContact O-N 3.02Å; R616-V618 VanDerWaalsContact C-N 3.34Å; R616-V618 PolarHBondContact O-N 2.81Å; V618-D620 VanDerWaalsContact C-N 3.34Å; V618-D620 PolarHBondContact O-N 3.05Å; V618-A621 PolarHBondContact O-N 3.16Å; V618-A622 WeakPolarHBondContact O-CB 3.45Å; V618-A622 PolarHBondContact O-N 2.7Å; V618-L651 HydrophobicContact CB-CD1 4.47Å; V618-L651 HydrophobicContact CG1-CD1 3.2Å; V618-L651 HydrophobicContact CG1-CG 4.49Å; V618-T654 HydrophobicContact CG2-CG2 4.02Å; V618-L655 HydrophobicContact CG2-CB 4.17Å; V618-L655 HydrophobicContact CG2-CD1 4.27Å; V618-L682 HydrophobicContact CB-CD2 4.48Å; V618-L682 HydrophobicContact CG1-CD2 3.64Å
619	K	96.3	Very high	95.4	Very high	87 Å²	87	65.4 Å²	65.4	38%	0.378	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-39.5	174.8	176.5	173.7	-173.9	177.4	0	112.2	F615 R616 E617 A622 Y685	F615-K619 HydrophobicContact CE1-CD 4.3Å; F615-K619 HydrophobicContact CZ-CD 4.48Å; F615-K619 WeakPolarHBondContact O-CB 3.46Å; F615-K619 PolarHBondContact O-N 3.17Å; R616-K619 PolarHBondContact O-N 2.81Å; E617-K619 PolarHBondContact O-N 3.19Å; K619-A622 WeakPolarHBondContact O-CB 3.3Å; K619-A622 PolarHBondContact O-N 2.99Å; K619-Y685 HydrophobicContact CD-CD2 4.27Å; K619-Y685 HydrophobicContact CD-CE2 3.9Å; K619-Y685 HydrophobicContact CG-CD2 4.41Å; K619-Y685 HydrophobicContact CG-CE1 4.41Å; K619-Y685 HydrophobicContact CG-CE2 3.73Å
620	D	96.3	Very high	95.3	Very high	70 Å²	70	60.5 Å²	60.5	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-68.2	-39.8	176.9	-79.5	-31.8	0	0	0	111.7	R616 E617 V618 A622 K623	R616-D620 WeakPolarHBondContact O-CB 3.46Å; R616-D620 PolarHBondContact O-N 2.96Å; E617-D620 PolarHBondContact O-N 3.31Å; V618-D620 VanDerWaalsContact C-N 3.34Å; V618-D620 PolarHBondContact O-N 3.05Å; D620-A622 VanDerWaalsContact C-N 3.27Å; D620-A622 PolarHBondContact O-N 2.93Å; D620-K623 WeakPolarHBondContact O-CB 3.44Å; D620-K623 WeakPolarHBondContact O-CD 3.36Å; D620-K623 VanDerWaalsContact O-CG 3.3Å; D620-K623 WeakPolarHBondContact O-CG 3.39Å; D620-K623 PolarHBondContact O-N 2.71Å; D620-K623 WeakPolarHBondContact OD1-CE 3.18Å; D620-K623 IonicContact OD1-NZ 2.8Å; D620-K623 PolarHBondContact OD1-NZ 2.61Å
621	A	96	Very high	94.9	Very high	21 Å²	21	64.9 Å²	64.9	17%	0.174	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-27.7	172.4	0	0	0	0	0	113	E617 V618 K623 P650	E617-A621 WeakPolarHBondContact O-CB 3.44Å; E617-A621 PolarHBondContact O-N 3.21Å; V618-A621 PolarHBondContact O-N 3.16Å; A621-K623 VanDerWaalsContact C-N 3.27Å; A621-K623 PolarHBondContact O-N 2.92Å; A621-P650 HydrophobicContact CB-CB 4.32Å
622	A	95.1	Very high	94.4	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-7.7	179	0	0	0	0	0	114.8	V618 K619 D620 L624 Y625 K626 L651 Y685	V618-A622 WeakPolarHBondContact O-CB 3.45Å; V618-A622 PolarHBondContact O-N 2.7Å; K619-A622 WeakPolarHBondContact O-CB 3.3Å; K619-A622 PolarHBondContact O-N 2.99Å; D620-A622 VanDerWaalsContact C-N 3.27Å; D620-A622 PolarHBondContact O-N 2.93Å; A622-L624 PolarHBondContact O-N 3.14Å; A622-L624 VanDerWaalsContact O-N 3.17Å; A622-Y625 PolarHBondContact O-N 2.92Å; A622-Y625 VanDerWaalsContact O-N 3.1Å; A622-K626 PolarHBondContact O-N 3.49Å; A622-L651 HydrophobicContact CB-CB 4.44Å; A622-L651 HydrophobicContact CB-CD1 3.81Å; A622-L651 HydrophobicContact CB-CD2 4.49Å; A622-L651 HydrophobicContact CB-CG 4.47Å; A622-Y685 HydrophobicContact CB-CE1 3.9Å
623	K	94.2	Very high	93.9	Very high	118 Å²	118	67.6 Å²	67.6	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-57	-34.1	-174.6	-76.6	173.3	-175.9	156.4	0	113.9	D620 A621	D620-K623 WeakPolarHBondContact O-CB 3.44Å; D620-K623 WeakPolarHBondContact O-CD 3.36Å; D620-K623 VanDerWaalsContact O-CG 3.3Å; D620-K623 WeakPolarHBondContact O-CG 3.39Å; D620-K623 PolarHBondContact O-N 2.71Å; D620-K623 WeakPolarHBondContact OD1-CE 3.18Å; D620-K623 IonicContact OD1-NZ 2.8Å; D620-K623 PolarHBondContact OD1-NZ 2.61Å; A621-K623 VanDerWaalsContact C-N 3.27Å; A621-K623 PolarHBondContact O-N 2.92Å
624	L	92.6	Very high	93.4	Very high	110 Å²	110	67.4 Å²	67.4	58%	0.576	32%	0.319	S	S	*	.	H	α-helix	trans	-72.5	-46.5	176.9	-67.8	177.6	0	0	0	111	A622 K626 K627 E628	A622-L624 PolarHBondContact O-N 3.14Å; A622-L624 VanDerWaalsContact O-N 3.17Å; L624-K626 VanDerWaalsContact C-N 3.29Å; L624-K626 PolarHBondContact O-N 3.2Å; L624-K627 CarbonylContact O-C 3.57Å; L624-K627 PolarHBondContact O-N 3.32Å; L624-E628 PolarHBondContact O-N 3.15Å
625	Y	95.2	Very high	92.4	Very high	2 Å²	2	68.3 Å²	68.3	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-37.5	177.5	-170.1	-127.3	0	0	0	112.6	A622 K627 E628 W630 S647 A648 L651 I690 D707 M708	A622-Y625 PolarHBondContact O-N 2.92Å; A622-Y625 VanDerWaalsContact O-N 3.1Å; Y625-K627 PolarHBondContact O-N 3.49Å; Y625-E628 WeakPolarHBondContact O-CB 3.48Å; Y625-E628 PolarHBondContact O-N 2.91Å; Y625-E628 VanDerWaalsContact O-N 3.11Å; Y625-W630 HydrophobicContact CD2-CH2 4.47Å; Y625-W630 HydrophobicContact CD2-CZ2 4.16Å; Y625-W630 HydrophobicContact CE1-CZ2 4.32Å; Y625-W630 AromaticContact CE2-CH2 3.5Å; Y625-W630 HydrophobicContact CE2-CH2 3.5Å; Y625-W630 VanDerWaalsContact CE2-CH2 3.5Å; Y625-W630 AromaticContact CE2-CZ2 3.54Å; Y625-W630 HydrophobicContact CE2-CZ2 3.54Å; Y625-W630 AromaticContact CZ-CH2 3.58Å; Y625-W630 AromaticContact CZ-CZ2 3.63Å; Y625-W630 WeakPolarHBondContact OH-CH2 3.28Å; Y625-S647 WeakPolarHBondContact CB-O 3.33Å; Y625-S647 WeakPolarHBondContact CD2-OG 3.26Å; Y625-S647 PolarHBondContact N-O 2.97Å; Y625-A648 HydrophobicContact CD2-CB 3.53Å; Y625-A648 HydrophobicContact CE2-CB 3.64Å; Y625-A648 HydrophobicContact CG-CB 4.02Å; Y625-L651 HydrophobicContact CD1-CD2 3.96Å; Y625-L651 HydrophobicContact CE1-CD2 4.43Å; Y625-I690 HydrophobicContact CD1-CD1 3.65Å; Y625-I690 HydrophobicContact CE1-CD1 4.04Å; Y625-I690 HydrophobicContact CE1-CG2 4.33Å; Y625-D707 PolarHBondContact OH-OD2 3.42Å; Y625-M708 HydrophobicContact CE1-CE 3.94Å; Y625-M708 WeakPolarHBondContact OH-CE 3.47Å
626	K	93.3	Very high	91.2	Very high	72 Å²	72	71.7 Å²	71.7	31%	0.313	34%	0.341	S	S	.	.	H	α-helix	trans	-58.6	-30.2	173.4	178.9	170.3	177.1	174.7	0	113.2	A622 L624 E689 I690 N694	A622-K626 PolarHBondContact O-N 3.49Å; L624-K626 VanDerWaalsContact C-N 3.29Å; L624-K626 PolarHBondContact O-N 3.2Å; K626-E689 WeakPolarHBondContact CD-O 3.16Å; K626-E689 WeakPolarHBondContact CE-O 3.39Å; K626-E689 WeakPolarHBondContact CG-O 3.37Å; K626-E689 IonicContact NZ-OE2 2.67Å; K626-E689 PolarHBondContact NZ-OE2 3.02Å; K626-I690 HydrophobicContact CB-CG1 4.28Å; K626-N694 PolarHBondContact O-ND2 2.54Å
627	K	91.6	Very high	89.9	Confident	173 Å²	173	69.8 Å²	69.8	75%	0.752	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	11.6	-179.4	-62.7	-177.9	-174.3	-178.2	0	113.1	L624 Y625	L624-K627 CarbonylContact O-C 3.57Å; L624-K627 PolarHBondContact O-N 3.32Å; Y625-K627 PolarHBondContact O-N 3.49Å
628	E	92.5	Very high	88.6	Confident	40 Å²	40	72.6 Å²	72.6	19%	0.187	36%	0.364	C	S	.	.			trans	-59.3	144.1	178	-172.5	58.4	-95	0	0	110.8	L624 Y625 W630 S647	L624-E628 PolarHBondContact O-N 3.15Å; Y625-E628 WeakPolarHBondContact O-CB 3.48Å; Y625-E628 PolarHBondContact O-N 2.91Å; Y625-E628 VanDerWaalsContact O-N 3.11Å; E628-W630 HydrophobicContact CB-CD2 4.37Å; E628-W630 HydrophobicContact CB-CZ2 4.02Å; E628-W630 HydrophobicContact CG-CD2 4.33Å; E628-W630 HydrophobicContact CG-CZ2 4.22Å; E628-W630 PolarHBondContact O-N 3.43Å; E628-S647 WeakPolarHBondContact OE2-CB 3.5Å; E628-S647 PolarHBondContact OE2-OG 3.48Å
629	R	91.4	Very high	87.4	Confident	189 Å²	189	75.3 Å²	75.3	71%	0.713	38%	0.377	S	S	*	.			trans	-87	65.2	-174.4	-61.1	-175.3	176.9	-175.7	-0.4	111.3	L631 S632	R629-L631 PolarHBondContact O-N 2.9Å; R629-S632 WeakPolarHBondContact CB-OG 3.31Å; R629-S632 PolarHBondContact O-N 3.07Å; R629-S632 PolarHBondContact O-OG 3.32Å; R629-S632 VanDerWaalsContact O-OG 3.09Å
630	W	93.3	Very high	86	Confident	3 Å²	3	76.3 Å²	76.3	1%	0.011	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-27.8	-174.9	-63	106	0	0	0	115.4	Y625 E628 L633 I690 N694 H695 F696 N697 G700 Q703 L704	Y625-W630 HydrophobicContact CD2-CH2 4.47Å; Y625-W630 HydrophobicContact CD2-CZ2 4.16Å; Y625-W630 HydrophobicContact CE1-CZ2 4.32Å; Y625-W630 AromaticContact CE2-CH2 3.5Å; Y625-W630 HydrophobicContact CE2-CH2 3.5Å; Y625-W630 VanDerWaalsContact CE2-CH2 3.5Å; Y625-W630 AromaticContact CE2-CZ2 3.54Å; Y625-W630 HydrophobicContact CE2-CZ2 3.54Å; Y625-W630 AromaticContact CZ-CH2 3.58Å; Y625-W630 AromaticContact CZ-CZ2 3.63Å; Y625-W630 WeakPolarHBondContact OH-CH2 3.28Å; E628-W630 HydrophobicContact CB-CD2 4.37Å; E628-W630 HydrophobicContact CB-CZ2 4.02Å; E628-W630 HydrophobicContact CG-CD2 4.33Å; E628-W630 HydrophobicContact CG-CZ2 4.22Å; E628-W630 PolarHBondContact O-N 3.43Å; W630-L633 HydrophobicContact CE3-CD1 3.86Å; W630-L633 HydrophobicContact CZ3-CD1 4.23Å; W630-I690 HydrophobicContact CZ2-CG2 4.22Å; W630-N694 HydrophobicContact CG-CB 4.36Å; W630-H695 WeakPolarHBondContact CB-O 3.31Å; W630-F696 HydrophobicContact CB-CD1 3.88Å; W630-F696 HydrophobicContact CB-CE1 3.94Å; W630-F696 HydrophobicContact CD2-CD1 4.07Å; W630-F696 AromaticContact CD2-CE1 3.43Å; W630-F696 HydrophobicContact CD2-CE1 3.43Å; W630-F696 VanDerWaalsContact CD2-CE1 3.43Å; W630-F696 HydrophobicContact CD2-CZ 4.22Å; W630-F696 AromaticContact CE3-CD1 3.94Å; W630-F696 HydrophobicContact CE3-CD1 3.94Å; W630-F696 AromaticContact CE3-CE1 3.54Å; W630-F696 HydrophobicContact CE3-CE1 3.54Å; W630-F696 HydrophobicContact CG-CD1 4.07Å; W630-F696 AromaticContact CG-CE1 3.62Å; W630-F696 HydrophobicContact CG-CE1 3.62Å; W630-F696 HydrophobicContact CG-CZ 4.17Å; W630-F696 HydrophobicContact CZ3-CE1 4.26Å; W630-N697 PolarHBondContact O-OD1 2.72Å; W630-N697 VanDerWaalsContact O-OD1 3.1Å; W630-G700 WeakPolarHBondContact O-CA 3.46Å; W630-Q703 HydrophobicContact CZ3-CB 4.35Å; W630-Q703 HydrophobicContact CZ3-CG 4.41Å; W630-L704 HydrophobicContact CE3-CB 4.44Å; W630-L704 HydrophobicContact CH2-CB 4.13Å; W630-L704 HydrophobicContact CH2-CD1 3.96Å; W630-L704 HydrophobicContact CZ2-CD1 4.39Å; W630-L704 HydrophobicContact CZ3-CB 3.75Å; W630-L704 HydrophobicContact CZ3-CD1 4.42Å
631	L	89.1	Confident	85.3	Confident	92 Å²	92	78.9 Å²	78.9	48%	0.482	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-19.4	178.4	-73	178.2	0	0	0	115.1	R629 H695 N697 T785	R629-L631 PolarHBondContact O-N 2.9Å; L631-H695 HydrophobicContact CD1-CB 4.13Å; L631-H695 HydrophobicContact CD2-CB 3.68Å; L631-H695 WeakPolarHBondContact CD2-O 3.44Å; L631-H695 HydrophobicContact CG-CB 4.08Å; L631-H695 WeakPolarHBondContact CG-O 3.42Å; L631-N697 PolarHBondContact O-ND2 2.86Å; L631-T785 HydrophobicContact CD2-CG2 3.37Å
632	S	86.8	Confident	84.8	Confident	82 Å²	82	79.6 Å²	79.6	57%	0.573	42%	0.42	S	S	*	.	S	Bend	trans	-110	10.7	-174.9	61.2	0	0	0	0	112.9	R629	R629-S632 WeakPolarHBondContact CB-OG 3.31Å; R629-S632 PolarHBondContact O-N 3.07Å; R629-S632 PolarHBondContact O-OG 3.32Å; R629-S632 VanDerWaalsContact O-OG 3.09Å
633	L	87.2	Confident	84.5	Confident	32 Å²	32	83.5 Å²	83.5	17%	0.168	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-75.4	138.6	177.8	-71	173.6	0	0	0	110.1	W630 N697 Q703	W630-L633 HydrophobicContact CE3-CD1 3.86Å; W630-L633 HydrophobicContact CZ3-CD1 4.23Å; L633-N697 PolarHBondContact O-ND2 3.35Å; L633-Q703 HydrophobicContact CD1-CB 3.96Å; L633-Q703 HydrophobicContact CD1-CG 4.08Å
634	P	84.6	Confident	84.4	Confident	53 Å²	53	80 Å²	80	34%	0.344	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64	150.1	179.6	-7.6	19.3	0	0	0	111.1	E638 Q639 G699	P634-E638 HydrophobicContact CB-CB 4.12Å; P634-Q639 HydrophobicContact CB-CG 4.01Å; P634-Q639 HydrophobicContact CG-CG 4.21Å; P634-G699 WeakPolarHBondContact O-CA 3.29Å
635	S	77.9	Confident	84.5	Confident	19 Å²	19	75.2 Å²	75.2	13%	0.133	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-65.9	158.3	174.4	67.8	0	0	0	0	111.3	S637 E638 Q639	S635-S637 PolarHBondContact O-N 2.96Å; S635-S637 VanDerWaalsContact O-N 3.11Å; S635-S637 PolarHBondContact OG-OG 3.5Å; S635-E638 PolarHBondContact N-OE2 3Å; S635-E638 PolarHBondContact O-N 3.42Å; S635-E638 VanDerWaalsContact OG-CD 3.26Å; S635-E638 WeakPolarHBondContact OG-CG 3.3Å; S635-E638 PolarHBondContact OG-OE2 3.37Å; S635-Q639 PolarHBondContact O-N 2.71Å
636	Q	72	Confident	84.3	Confident	107 Å²	107	80 Å²	80	50%	0.5	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-56.4	-28.9	175.4	-82.7	-174.6	-9.2	0	0	112.9	E638 Q639 M642 A702	Q636-E638 VanDerWaalsContact C-N 3.26Å; Q636-E638 PolarHBondContact O-N 3.45Å; Q636-Q639 PolarHBondContact O-N 3.15Å; Q636-M642 HydrophobicContact CG-SD 3.86Å; Q636-M642 PolarHBondContact NE2-SD 3.49Å; Q636-M642 VanDerWaalsContact NE2-SD 3.44Å; Q636-A702 HydrophobicContact CG-CB 3.75Å
637	S	68.6	Low	84.3	Confident	113 Å²	113	77.2 Å²	77.2	79%	0.79	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-70.7	-21.4	177.7	71.6	0	0	0	0	113.9	S635	S635-S637 PolarHBondContact O-N 2.96Å; S635-S637 VanDerWaalsContact O-N 3.11Å; S635-S637 PolarHBondContact OG-OG 3.5Å
638	E	69.6	Low	84.5	Confident	142 Å²	142	69.1 Å²	69.1	66%	0.664	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-97	-5.7	-178.6	-66.3	164	152.2	0	0	112.4	P634 S635 Q636	P634-E638 HydrophobicContact CB-CB 4.12Å; S635-E638 PolarHBondContact N-OE2 3Å; S635-E638 PolarHBondContact O-N 3.42Å; S635-E638 VanDerWaalsContact OG-CD 3.26Å; S635-E638 WeakPolarHBondContact OG-CG 3.3Å; S635-E638 PolarHBondContact OG-OE2 3.37Å; Q636-E638 VanDerWaalsContact C-N 3.26Å; Q636-E638 PolarHBondContact O-N 3.45Å
639	Q	71.9	Confident	84.6	Confident	56 Å²	56	69.2 Å²	69.2	26%	0.262	40%	0.403	S	S	.	.			trans	-113.8	125.6	178.8	-70	-179.4	-9.8	0	0	111.3	P634 S635 Q636	P634-Q639 HydrophobicContact CB-CG 4.01Å; P634-Q639 HydrophobicContact CG-CG 4.21Å; S635-Q639 PolarHBondContact O-N 2.71Å; Q636-Q639 PolarHBondContact O-N 3.15Å
640	A	66.8	Low	84.8	Confident	109 Å²	109	62.5 Å²	62.5	90%	0.901	38%	0.384	S	S	*	.	S	Bend	trans	-71.3	-33.9	178.9	0	0	0	0	0	113.4
641	V	80.8	Confident	84.9	Confident	124 Å²	124	62.5 Å²	62.5	75%	0.752	38%	0.384	S	S	*	.	S	Bend	trans	-147.9	129.2	178	-179.8	0	0	0	0	108.6
642	M	86.3	Confident	85.2	Confident	35 Å²	35	59 Å²	59	17%	0.172	37%	0.366	C	S	.	.			trans	-78.4	140.5	172.3	-63.4	-170.2	77.3	0	0	110.8	Q636 A702 Q703 F706	Q636-M642 HydrophobicContact CG-SD 3.86Å; Q636-M642 PolarHBondContact NE2-SD 3.49Å; Q636-M642 VanDerWaalsContact NE2-SD 3.44Å; M642-A702 HydrophobicContact CE-CB 4.32Å; M642-Q703 HydrophobicContact CE-CB 4.26Å; M642-F706 HydrophobicContact CB-CD1 4.42Å; M642-F706 HydrophobicContact CB-CD2 3.63Å; M642-F706 HydrophobicContact CB-CE1 4.5Å; M642-F706 HydrophobicContact CB-CE2 3.7Å; M642-F706 HydrophobicContact CB-CG 4.01Å; M642-F706 HydrophobicContact CB-CZ 4.15Å; M642-F706 HydrophobicContact CE-CB 3.67Å; M642-F706 HydrophobicContact CE-CD2 4.49Å; M642-F706 HydrophobicContact CE-CG 4.17Å; M642-F706 HydrophobicContact CG-CD2 4.48Å; M642-F706 VanDerWaalsContact O-CZ 3.29Å; M642-F706 WeakPolarHBondContact O-CZ 3.32Å; M642-F706 HydrophobicContact SD-CB 4.23Å; M642-F706 HydrophobicContact SD-CD2 4.13Å; M642-F706 HydrophobicContact SD-CG 4.4Å
643	S	89.9	Confident	85.7	Confident	82 Å²	82	58.9 Å²	58.9	57%	0.573	36%	0.358	S	S	*	.			trans	-131	163.2	176.1	62.1	0	0	0	0	110.6	S645 Q703	S643-S645 PolarHBondContact O-N 3.34Å; S643-Q703 PolarHBondContact O-NE2 3.36Å
644	L	92.1	Very high	86.1	Confident	44 Å²	44	59 Å²	59	23%	0.23	36%	0.361	C	S	.	.			trans	-57.4	134.6	175.3	174.4	63.5	0	0	0	110.6	S646 A648 L652 D707 N711	L644-S646 PolarHBondContact O-N 3.14Å; L644-A648 HydrophobicContact CD1-CB 3.92Å; L644-L652 HydrophobicContact CD1-CD1 3.56Å; L644-L652 HydrophobicContact CD2-CD1 3.82Å; L644-L652 HydrophobicContact CG-CD1 4.35Å; L644-D707 HydrophobicContact CD1-CB 4.43Å; L644-N711 HydrophobicContact CD1-CB 3.97Å
645	S	93.1	Very high	86.7	Confident	11 Å²	11	56.6 Å²	56.6	8%	0.077	34%	0.344	C	S	.	.			trans	-56.4	124.5	173.1	-64.5	0	0	0	0	110.7	S643 S647 A648 C649 Q703 D707	S643-S645 PolarHBondContact O-N 3.34Å; S645-S647 PolarHBondContact O-N 2.72Å; S645-S647 VanDerWaalsContact O-N 3.11Å; S645-A648 WeakPolarHBondContact O-CA 3.33Å; S645-A648 VanDerWaalsContact O-CB 3.31Å; S645-A648 WeakPolarHBondContact O-CB 3.29Å; S645-A648 PolarHBondContact O-N 2.78Å; S645-C649 PolarHBondContact O-N 3.03Å; S645-Q703 WeakPolarHBondContact OG-CG 3.4Å; S645-Q703 PolarHBondContact OG-NE2 3.46Å; S645-D707 WeakPolarHBondContact CB-OD2 3.34Å; S645-D707 PolarHBondContact N-OD1 2.8Å; S645-D707 PolarHBondContact OG-OD1 2.96Å; S645-D707 PolarHBondContact OG-OD2 3.46Å
646	S	91.8	Very high	87.6	Confident	103 Å²	103	61.2 Å²	61.2	72%	0.72	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.8	-178.1	54.2	0	0	0	0	113	L644 A648 C649	L644-S646 PolarHBondContact O-N 3.14Å; S646-A648 VanDerWaalsContact C-N 3.32Å; S646-C649 PolarHBondContact O-N 3.47Å
647	S	93.9	Very high	88.7	Confident	13 Å²	13	59.7 Å²	59.7	9%	0.091	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-21.5	175.5	63.2	0	0	0	0	113.6	Y625 E628 S645	Y625-S647 WeakPolarHBondContact CB-O 3.33Å; Y625-S647 WeakPolarHBondContact CD2-OG 3.26Å; Y625-S647 PolarHBondContact N-O 2.97Å; E628-S647 WeakPolarHBondContact OE2-CB 3.5Å; E628-S647 PolarHBondContact OE2-OG 3.48Å; S645-S647 PolarHBondContact O-N 2.72Å; S645-S647 VanDerWaalsContact O-N 3.11Å
648	A	94.1	Very high	90.1	Very high	3 Å²	3	55.8 Å²	55.8	3%	0.025	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-19	175.4	0	0	0	0	0	113	Y625 L644 S645 S646 L651 L652	Y625-A648 HydrophobicContact CD2-CB 3.53Å; Y625-A648 HydrophobicContact CE2-CB 3.64Å; Y625-A648 HydrophobicContact CG-CB 4.02Å; L644-A648 HydrophobicContact CD1-CB 3.92Å; S645-A648 WeakPolarHBondContact O-CA 3.33Å; S645-A648 VanDerWaalsContact O-CB 3.31Å; S645-A648 WeakPolarHBondContact O-CB 3.29Å; S645-A648 PolarHBondContact O-N 2.78Å; S646-A648 VanDerWaalsContact C-N 3.32Å; A648-L651 WeakPolarHBondContact O-CB 3.44Å; A648-L651 PolarHBondContact O-N 3.35Å; A648-L652 PolarHBondContact O-N 2.93Å; A648-L652 VanDerWaalsContact O-N 3.08Å
649	C	94.7	Very high	91.3	Very high	42 Å²	42	49.1 Å²	49.1	28%	0.284	29%	0.292	S	S	.	.	H	α-helix	trans	-55	-47.8	-178	-65.8	0	0	0	0	113.4	S645 S646 L651 L652 L653	S645-C649 PolarHBondContact O-N 3.03Å; S646-C649 PolarHBondContact O-N 3.47Å; C649-L651 PolarHBondContact O-N 3.42Å; C649-L652 PolarHBondContact O-N 3.26Å; C649-L653 WeakPolarHBondContact O-CB 3.39Å; C649-L653 VanDerWaalsContact O-CG 3.24Å; C649-L653 WeakPolarHBondContact O-CG 3.37Å; C649-L653 PolarHBondContact O-N 3.44Å
650	P	96	Very high	92.4	Very high	47 Å²	47	50.2 Å²	50.2	31%	0.305	30%	0.3	S	S	.	.	H	α-helix	trans	-59	-44.8	178.2	-24.3	35.6	0	0	0	112.7	A621 L652 L653 T654	A621-P650 HydrophobicContact CB-CB 4.32Å; P650-L652 PolarHBondContact O-N 3.42Å; P650-L653 PolarHBondContact O-N 3.33Å; P650-T654 WeakPolarHBondContact O-CB 3.3Å; P650-T654 PolarHBondContact O-N 3.46Å; P650-T654 PolarHBondContact O-OG1 2.97Å
651	L	95.9	Very high	93.7	Very high	4 Å²	4	48 Å²	48	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-55	-51.6	176.7	164.3	74.5	0	0	0	111.6	V618 A622 Y625 A648 C649 L655	V618-L651 HydrophobicContact CB-CD1 4.47Å; V618-L651 HydrophobicContact CG1-CD1 3.2Å; V618-L651 HydrophobicContact CG1-CG 4.49Å; A622-L651 HydrophobicContact CB-CB 4.44Å; A622-L651 HydrophobicContact CB-CD1 3.81Å; A622-L651 HydrophobicContact CB-CD2 4.49Å; A622-L651 HydrophobicContact CB-CG 4.47Å; Y625-L651 HydrophobicContact CD1-CD2 3.96Å; Y625-L651 HydrophobicContact CE1-CD2 4.43Å; A648-L651 WeakPolarHBondContact O-CB 3.44Å; A648-L651 PolarHBondContact O-N 3.35Å; C649-L651 PolarHBondContact O-N 3.42Å; L651-L655 WeakPolarHBondContact O-CB 3.41Å; L651-L655 PolarHBondContact O-N 2.87Å; L651-L655 VanDerWaalsContact O-N 3.08Å
652	L	95.8	Very high	94.4	Very high	18 Å²	18	42 Å²	42	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-72.2	-36.1	-175.6	-65.1	-177	0	0	0	112.8	L644 A648 C649 P650 R656 N711 L712 L715	L644-L652 HydrophobicContact CD1-CD1 3.56Å; L644-L652 HydrophobicContact CD2-CD1 3.82Å; L644-L652 HydrophobicContact CG-CD1 4.35Å; A648-L652 PolarHBondContact O-N 2.93Å; A648-L652 VanDerWaalsContact O-N 3.08Å; C649-L652 PolarHBondContact O-N 3.26Å; P650-L652 PolarHBondContact O-N 3.42Å; L652-R656 WeakPolarHBondContact O-CB 3.41Å; L652-R656 PolarHBondContact O-N 3.37Å; L652-N711 HydrophobicContact CD1-CB 3.64Å; L652-L712 HydrophobicContact CD2-CB 4.04Å; L652-L712 HydrophobicContact CD2-CD1 3.58Å; L652-L712 HydrophobicContact CD2-CG 4.42Å; L652-L715 HydrophobicContact CB-CD1 4.42Å; L652-L715 HydrophobicContact CD2-CD1 3.96Å
653	L	95.9	Very high	94.7	Very high	80 Å²	80	44 Å²	44	42%	0.419	24%	0.243	S	C	.	.	H	α-helix	trans	-65.2	-49.2	175.7	-71.3	172.3	0	0	0	111	C649 P650 L655 R656 D657	C649-L653 WeakPolarHBondContact O-CB 3.39Å; C649-L653 VanDerWaalsContact O-CG 3.24Å; C649-L653 WeakPolarHBondContact O-CG 3.37Å; C649-L653 PolarHBondContact O-N 3.44Å; P650-L653 PolarHBondContact O-N 3.33Å; L653-L655 VanDerWaalsContact C-N 3.3Å; L653-L655 PolarHBondContact O-N 3.26Å; L653-R656 PolarHBondContact O-N 2.82Å; L653-D657 WeakPolarHBondContact O-CB 3.46Å; L653-D657 PolarHBondContact O-N 2.88Å
654	T	97.1	Very high	94.8	Very high	35 Å²	35	46.3 Å²	46.3	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-43.5	176.7	-62.3	0	0	0	0	111.5	E617 V618 P650 H658	E617-T654 HydrophobicContact CB-CG2 4.19Å; V618-T654 HydrophobicContact CG2-CG2 4.02Å; P650-T654 WeakPolarHBondContact O-CB 3.3Å; P650-T654 PolarHBondContact O-N 3.46Å; P650-T654 PolarHBondContact O-OG1 2.97Å; T654-H658 PolarHBondContact O-CD2 3.36Å; T654-H658 PolarHBondContact O-N 3.36Å
655	L	96.8	Very high	94.8	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-48.2	177.6	179.3	59.1	0	0	0	112.3	V618 L651 L653 D657 H658 L659 L678 L682 L712 L715 F716	V618-L655 HydrophobicContact CG2-CB 4.17Å; V618-L655 HydrophobicContact CG2-CD1 4.27Å; L651-L655 WeakPolarHBondContact O-CB 3.41Å; L651-L655 PolarHBondContact O-N 2.87Å; L651-L655 VanDerWaalsContact O-N 3.08Å; L653-L655 VanDerWaalsContact C-N 3.3Å; L653-L655 PolarHBondContact O-N 3.26Å; L655-D657 VanDerWaalsContact C-N 3.35Å; L655-D657 PolarHBondContact O-N 2.89Å; L655-H658 PolarHBondContact O-N 2.93Å; L655-L659 HydrophobicContact CD1-CD1 3.96Å; L655-L659 HydrophobicContact CD1-CG 4.16Å; L655-L659 HydrophobicContact CG-CD1 3.9Å; L655-L659 WeakPolarHBondContact O-CB 3.4Å; L655-L659 VanDerWaalsContact O-CG 3.29Å; L655-L659 WeakPolarHBondContact O-CG 3.49Å; L655-L659 PolarHBondContact O-N 3.26Å; L655-L678 HydrophobicContact CD1-CD2 3.71Å; L655-L682 HydrophobicContact CD1-CD1 3.92Å; L655-L682 HydrophobicContact CD2-CD1 3.95Å; L655-L712 HydrophobicContact CD2-CD1 3.7Å; L655-L715 HydrophobicContact CD2-CD1 4.05Å; L655-L715 HydrophobicContact CG-CD1 4.38Å; L655-F716 HydrophobicContact CD1-CZ 4.42Å; L655-F716 HydrophobicContact CD2-CE2 4.07Å; L655-F716 HydrophobicContact CD2-CZ 4.04Å
656	R	95.9	Very high	94.9	Very high	116 Å²	116	45.8 Å²	45.8	44%	0.438	24%	0.24	S	C	.	.	H	α-helix	trans	-58	-47.2	178.3	179.4	-159.3	66.7	-167	-2.9	111.4	L652 L653 H658 L659 L660 L715	L652-R656 WeakPolarHBondContact O-CB 3.41Å; L652-R656 PolarHBondContact O-N 3.37Å; L653-R656 PolarHBondContact O-N 2.82Å; R656-H658 PolarHBondContact O-N 3.17Å; R656-L659 PolarHBondContact O-N 3.39Å; R656-L660 WeakPolarHBondContact O-CB 3.37Å; R656-L660 PolarHBondContact O-N 3.24Å; R656-L715 HydrophobicContact CB-CD2 4.26Å; R656-L715 HydrophobicContact CG-CD2 4.44Å
657	D	96.3	Very high	95	Very high	75 Å²	75	40.9 Å²	40.9	40%	0.401	21%	0.206	S	C	.	.	H	α-helix	trans	-66.1	-40.5	-173.8	-66.7	-11.9	0	0	0	111.2	L653 L655 Q661	L653-D657 WeakPolarHBondContact O-CB 3.46Å; L653-D657 PolarHBondContact O-N 2.88Å; L655-D657 VanDerWaalsContact C-N 3.35Å; L655-D657 PolarHBondContact O-N 2.89Å; D657-Q661 WeakPolarHBondContact O-CB 3.29Å; D657-Q661 PolarHBondContact O-N 2.95Å
658	H	96.5	Very high	94.8	Very high	31 Å²	31	47.1 Å²	47.1	14%	0.144	23%	0.232	C	C	.	.	H	α-helix	trans	-70.5	-37.3	174.6	-70.2	-46.8	0	0	0	113.6	L532 V614 T654 L655 R656 Q661 L662	L532-H658 WeakPolarHBondContact CD1-ND1 3.45Å; V614-H658 HydrophobicContact CG1-CB 3.89Å; V614-H658 HydrophobicContact CG2-CB 4.08Å; T654-H658 PolarHBondContact O-CD2 3.36Å; T654-H658 PolarHBondContact O-N 3.36Å; L655-H658 PolarHBondContact O-N 2.93Å; R656-H658 PolarHBondContact O-N 3.17Å; H658-Q661 PolarHBondContact ND1-OE1 2.89Å; H658-Q661 PolarHBondContact O-N 3.37Å; H658-L662 WeakPolarHBondContact O-CB 3.41Å; H658-L662 WeakPolarHBondContact O-CG 3.44Å; H658-L662 PolarHBondContact O-N 3.47Å
659	L	95.8	Very high	94.8	Very high	2 Å²	2	49 Å²	49	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-60.6	-47.5	173.9	-75.9	169.3	0	0	0	110.8	L655 R656 Q661 L662 E663 F671 F674 W675 L678 F716 Y719	L655-L659 HydrophobicContact CD1-CD1 3.96Å; L655-L659 HydrophobicContact CD1-CG 4.16Å; L655-L659 HydrophobicContact CG-CD1 3.9Å; L655-L659 WeakPolarHBondContact O-CB 3.4Å; L655-L659 VanDerWaalsContact O-CG 3.29Å; L655-L659 WeakPolarHBondContact O-CG 3.49Å; L655-L659 PolarHBondContact O-N 3.26Å; R656-L659 PolarHBondContact O-N 3.39Å; L659-Q661 PolarHBondContact O-N 2.97Å; L659-L662 PolarHBondContact O-N 3.14Å; L659-E663 VanDerWaalsContact O-CB 3.26Å; L659-E663 WeakPolarHBondContact O-CB 3.2Å; L659-E663 PolarHBondContact O-N 3.29Å; L659-F671 HydrophobicContact CD2-CE2 4.28Å; L659-F671 HydrophobicContact CD2-CZ 4.19Å; L659-F671 WeakPolarHBondContact O-CE2 3.43Å; L659-F674 HydrophobicContact CD2-CE1 4.24Å; L659-W675 HydrophobicContact CD2-CB 4Å; L659-L678 HydrophobicContact CD2-CD2 4.42Å; L659-F716 HydrophobicContact CD1-CD1 4.4Å; L659-F716 HydrophobicContact CD1-CE1 3.78Å; L659-F716 HydrophobicContact CD1-CZ 3.85Å; L659-F716 HydrophobicContact CD2-CE1 4.1Å; L659-Y719 HydrophobicContact CD1-CE2 4.46Å
660	L	94.3	Very high	94.9	Very high	80 Å²	80	47 Å²	47	42%	0.419	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-43.2	178.1	-177.1	66.4	0	0	0	111.9	R656 L662 Q664	R656-L660 WeakPolarHBondContact O-CB 3.37Å; R656-L660 PolarHBondContact O-N 3.24Å; L660-L662 PolarHBondContact O-N 2.93Å; L660-Q664 WeakPolarHBondContact O-CG 3.08Å; L660-Q664 PolarHBondContact O-N 3.33Å; L660-Q664 VanDerWaalsContact O-N 3.15Å
661	Q	94.9	Very high	94.9	Very high	61 Å²	61	45.1 Å²	45.1	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-57.8	-47.8	177	177.7	-177	2.5	0	0	111.5	L532 D657 H658 L659 Q664 Q665	L532-Q661 PolarHBondContact O-NE2 3.35Å; D657-Q661 WeakPolarHBondContact O-CB 3.29Å; D657-Q661 PolarHBondContact O-N 2.95Å; H658-Q661 PolarHBondContact ND1-OE1 2.89Å; H658-Q661 PolarHBondContact O-N 3.37Å; L659-Q661 PolarHBondContact O-N 2.97Å; Q661-Q664 PolarHBondContact O-N 3.02Å; Q661-Q665 WeakPolarHBondContact O-CG 3.22Å; Q661-Q665 PolarHBondContact O-N 3.17Å
662	L	95.4	Very high	94.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-76.3	-34.3	-177.2	-70.9	173.8	0	0	0	112.6	L532 V614 H658 L659 L660 Q664 Q665 L666 F671 F674	L532-L662 HydrophobicContact CD2-CD1 4.11Å; L532-L662 HydrophobicContact CD2-CD2 4.1Å; L532-L662 HydrophobicContact CD2-CG 4.45Å; V614-L662 HydrophobicContact CG2-CD1 4.21Å; H658-L662 WeakPolarHBondContact O-CB 3.41Å; H658-L662 WeakPolarHBondContact O-CG 3.44Å; H658-L662 PolarHBondContact O-N 3.47Å; L659-L662 PolarHBondContact O-N 3.14Å; L660-L662 PolarHBondContact O-N 2.93Å; L662-Q664 PolarHBondContact O-N 3.41Å; L662-Q665 PolarHBondContact O-N 2.9Å; L662-Q665 VanDerWaalsContact O-N 3.14Å; L662-L666 HydrophobicContact CB-CD1 4.24Å; L662-L666 HydrophobicContact CD2-CD1 4.22Å; L662-L666 HydrophobicContact CD2-CG 4.46Å; L662-L666 WeakPolarHBondContact O-CB 3.43Å; L662-L666 PolarHBondContact O-N 3.34Å; L662-F671 HydrophobicContact CB-CD2 4.22Å; L662-F671 HydrophobicContact CB-CE2 4.3Å; L662-F674 HydrophobicContact CD1-CD1 3.89Å; L662-F674 HydrophobicContact CD1-CD2 4.05Å; L662-F674 HydrophobicContact CD1-CE1 3.33Å; L662-F674 HydrophobicContact CD1-CE2 3.5Å; L662-F674 VanDerWaalsContact CD1-CE2 3.5Å; L662-F674 HydrophobicContact CD1-CG 4.24Å; L662-F674 HydrophobicContact CD1-CZ 3.13Å
663	E	93.1	Very high	94.9	Very high	75 Å²	75	51.3 Å²	51.3	35%	0.35	25%	0.247	S	C	.	.	H	α-helix	trans	-57.3	-39.3	172.2	-178.9	-179.2	-169.3	0	0	111.4	K474 L659 F671 Y719	K474-E663 PolarHBondContact NZ-O 3.37Å; L659-E663 VanDerWaalsContact O-CB 3.26Å; L659-E663 WeakPolarHBondContact O-CB 3.2Å; L659-E663 PolarHBondContact O-N 3.29Å; E663-F671 HydrophobicContact CB-CD1 4.48Å; E663-F671 HydrophobicContact CB-CD2 4.14Å; E663-F671 HydrophobicContact CB-CE1 4.17Å; E663-F671 HydrophobicContact CB-CE2 3.79Å; E663-F671 HydrophobicContact CB-CG 4.47Å; E663-F671 HydrophobicContact CB-CZ 3.8Å; E663-F671 HydrophobicContact CG-CD1 4.49Å; E663-F671 HydrophobicContact CG-CE1 4.27Å; E663-F671 HydrophobicContact CG-CZ 4.37Å; E663-Y719 HydrophobicContact CG-CE1 4.39Å; E663-Y719 WeakPolarHBondContact OE1-CE1 3.19Å; E663-Y719 WeakPolarHBondContact OE2-CE1 3.47Å; E663-Y719 PolarHBondContact OE2-OH 3.32Å
664	Q	91	Very high	95	Very high	131 Å²	131	47.5 Å²	47.5	61%	0.612	23%	0.227	S	C	*	.	H	α-helix	trans	-72.1	-28.2	178	-71.4	175.8	9.6	0	0	113.2	K474 L660 Q661 L662	K474-Q664 PolarHBondContact NZ-O 2.89Å; L660-Q664 WeakPolarHBondContact O-CG 3.08Å; L660-Q664 PolarHBondContact O-N 3.33Å; L660-Q664 VanDerWaalsContact O-N 3.15Å; Q661-Q664 PolarHBondContact O-N 3.02Å; L662-Q664 PolarHBondContact O-N 3.41Å
665	Q	92.9	Very high	95	Very high	42 Å²	42	46 Å²	46	20%	0.196	22%	0.217	C	C	.	.	H	α-helix	trans	-102.1	-32.8	-172.7	-64.8	-179.4	13.4	0	0	114.4	L532 C537 N541 Q661 L662	L532-Q665 PolarHBondContact O-OE1 3.44Å; C537-Q665 HydrophobicContact CB-CB 3.69Å; C537-Q665 PolarHBondContact SG-OE1 3.05Å; N541-Q665 PolarHBondContact ND2-O 3.28Å; Q661-Q665 WeakPolarHBondContact O-CG 3.22Å; Q661-Q665 PolarHBondContact O-N 3.17Å; L662-Q665 PolarHBondContact O-N 2.9Å; L662-Q665 VanDerWaalsContact O-N 3.14Å
666	L	94.4	Very high	95	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	23%	0.227	C	C	.	.	S	Bend	trans	-90.8	149.2	180	-63.6	177.9	0	0	0	111.3	K474 C537 L540 N541 L662 L670 F671 F674	K474-L666 WeakPolarHBondContact CD-O 3.48Å; K474-L666 VanDerWaalsContact CE-O 3.27Å; K474-L666 WeakPolarHBondContact CE-O 3.46Å; K474-L666 PolarHBondContact NZ-O 3.4Å; C537-L666 HydrophobicContact CB-CD2 3.83Å; L540-L666 HydrophobicContact CB-CD2 4.29Å; L540-L666 HydrophobicContact CD2-CD2 3.86Å; L540-L666 HydrophobicContact CG-CD2 4.39Å; N541-L666 WeakPolarHBondContact OD1-CA 3.4Å; L662-L666 HydrophobicContact CB-CD1 4.24Å; L662-L666 HydrophobicContact CD2-CD1 4.22Å; L662-L666 HydrophobicContact CD2-CG 4.46Å; L662-L666 WeakPolarHBondContact O-CB 3.43Å; L662-L666 PolarHBondContact O-N 3.34Å; L666-L670 HydrophobicContact CB-CB 4.24Å; L666-L670 HydrophobicContact CD2-CD1 4.48Å; L666-F671 HydrophobicContact CB-CB 4.16Å; L666-F674 HydrophobicContact CD1-CB 4.44Å
667	C	93.3	Very high	95.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.			trans	-66	161.1	168.2	75.4	0	0	0	0	111.3	E472 M473 K474 N541 S669 L670 F671	E472-C667 WeakPolarHBondContact O-CB 3.24Å; M473-C667 VanDerWaalsContact C-CB 3.48Å; M473-C667 VanDerWaalsContact O-CB 3.3Å; M473-C667 WeakPolarHBondContact O-CB 3.39Å; K474-C667 HydrophobicContact CB-CB 4.38Å; N541-C667 PolarHBondContact OD1-N 3.01Å; C667-S669 VanDerWaalsContact C-N 3.33Å; C667-S669 PolarHBondContact O-N 3.39Å; C667-S669 PolarHBondContact SG-OG 2.94Å; C667-L670 PolarHBondContact O-N 2.91Å; C667-L670 VanDerWaalsContact SG-CD1 3.55Å; C667-L670 VanDerWaalsContact SG-CG 3.54Å; C667-F671 WeakPolarHBondContact O-CB 3.42Å; C667-F671 PolarHBondContact O-N 3.09Å
668	F	91.7	Very high	95.2	Very high	145 Å²	145	41 Å²	41	64%	0.636	20%	0.196	S	C	*	.	H	α-helix	trans	-58.5	-42.4	-171.8	175.5	-102.1	0	0	0	113.1	F671 K672	F668-F671 PolarHBondContact O-N 3.49Å; F668-K672 HydrophobicContact CE1-CD 4.44Å; F668-K672 VanDerWaalsContact O-CB 3.29Å; F668-K672 WeakPolarHBondContact O-CB 3.42Å; F668-K672 PolarHBondContact O-N 3.06Å
669	S	93.1	Very high	95.2	Very high	43 Å²	43	39.5 Å²	39.5	30%	0.301	19%	0.19	S	C	.	.	H	α-helix	trans	-63.4	-45	-179.8	57.6	0	0	0	0	111.9	C667 K672 I673	C667-S669 VanDerWaalsContact C-N 3.33Å; C667-S669 PolarHBondContact O-N 3.39Å; C667-S669 PolarHBondContact SG-OG 2.94Å; S669-K672 PolarHBondContact O-N 3.33Å; S669-I673 WeakPolarHBondContact O-CG1 3.39Å; S669-I673 PolarHBondContact O-N 3.16Å
670	L	96.5	Very high	95.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-47.2	176.8	-75.6	173.5	0	0	0	112	L540 N541 N544 K603 L607 L666 C667 K672 I673 F674	L540-L670 HydrophobicContact CB-CD1 4.38Å; L540-L670 HydrophobicContact CD1-CD2 4.3Å; L540-L670 HydrophobicContact CD2-CD1 4.46Å; L540-L670 HydrophobicContact CD2-CD2 4.41Å; L540-L670 HydrophobicContact CG-CD1 3.79Å; L540-L670 HydrophobicContact CG-CD2 4.03Å; N541-L670 VanDerWaalsContact OD1-CD1 3.3Å; N541-L670 WeakPolarHBondContact OD1-CD1 3.37Å; N544-L670 HydrophobicContact CB-CD1 3.77Å; N544-L670 HydrophobicContact CB-CD2 4.07Å; N544-L670 HydrophobicContact CB-CG 4Å; K603-L670 HydrophobicContact CD-CD2 3.75Å; K603-L670 HydrophobicContact CG-CD2 3.8Å; L607-L670 HydrophobicContact CD1-CD2 4.06Å; L607-L670 HydrophobicContact CD2-CD2 4.42Å; L607-L670 HydrophobicContact CG-CD2 4.47Å; L666-L670 HydrophobicContact CB-CB 4.24Å; L666-L670 HydrophobicContact CD2-CD1 4.48Å; C667-L670 PolarHBondContact O-N 2.91Å; C667-L670 VanDerWaalsContact SG-CD1 3.55Å; C667-L670 VanDerWaalsContact SG-CG 3.54Å; L670-K672 PolarHBondContact O-N 3.47Å; L670-I673 PolarHBondContact O-N 2.63Å; L670-F674 WeakPolarHBondContact O-CB 3.37Å; L670-F674 PolarHBondContact O-N 3.28Å
671	F	96.4	Very high	95.4	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-40.1	177.9	178.5	-107.6	0	0	0	111.3	L659 L662 E663 L666 C667 F668 I673 F674 W675 Y719	L659-F671 HydrophobicContact CD2-CE2 4.28Å; L659-F671 HydrophobicContact CD2-CZ 4.19Å; L659-F671 WeakPolarHBondContact O-CE2 3.43Å; L662-F671 HydrophobicContact CB-CD2 4.22Å; L662-F671 HydrophobicContact CB-CE2 4.3Å; E663-F671 HydrophobicContact CB-CD1 4.48Å; E663-F671 HydrophobicContact CB-CD2 4.14Å; E663-F671 HydrophobicContact CB-CE1 4.17Å; E663-F671 HydrophobicContact CB-CE2 3.79Å; E663-F671 HydrophobicContact CB-CG 4.47Å; E663-F671 HydrophobicContact CB-CZ 3.8Å; E663-F671 HydrophobicContact CG-CD1 4.49Å; E663-F671 HydrophobicContact CG-CE1 4.27Å; E663-F671 HydrophobicContact CG-CZ 4.37Å; L666-F671 HydrophobicContact CB-CB 4.16Å; C667-F671 WeakPolarHBondContact O-CB 3.42Å; C667-F671 PolarHBondContact O-N 3.09Å; F668-F671 PolarHBondContact O-N 3.49Å; F671-I673 PolarHBondContact O-N 2.62Å; F671-F674 HydrophobicContact CD2-CD1 4.32Å; F671-F674 HydrophobicContact CE2-CD1 4.36Å; F671-F674 WeakPolarHBondContact O-CB 3.23Å; F671-F674 PolarHBondContact O-N 3.19Å; F671-W675 AromaticContact CD1-CD1 3.86Å; F671-W675 AromaticContact CE1-CD1 3.68Å; F671-W675 PolarHBondContact O-N 3.32Å; F671-Y719 AromaticContact CE1-CD1 3.57Å; F671-Y719 HydrophobicContact CE1-CD1 3.57Å; F671-Y719 HydrophobicContact CE1-CD2 4.09Å; F671-Y719 AromaticContact CE1-CE1 3.49Å; F671-Y719 HydrophobicContact CE1-CE1 3.49Å; F671-Y719 VanDerWaalsContact CE1-CE1 3.49Å; F671-Y719 HydrophobicContact CE1-CE2 4.02Å; F671-Y719 AromaticContact CE1-CG 3.86Å; F671-Y719 HydrophobicContact CE1-CG 3.86Å; F671-Y719 AromaticContact CE1-CZ 3.71Å; F671-Y719 HydrophobicContact CZ-CD1 4.27Å; F671-Y719 HydrophobicContact CZ-CD2 4.21Å; F671-Y719 AromaticContact CZ-CE1 3.84Å; F671-Y719 HydrophobicContact CZ-CE1 3.84Å; F671-Y719 AromaticContact CZ-CE2 3.77Å; F671-Y719 HydrophobicContact CZ-CE2 3.77Å; F671-Y719 HydrophobicContact CZ-CG 4.44Å; F671-Y719 AromaticContact CZ-CZ 3.55Å
672	K	95.1	Very high	95.5	Very high	93 Å²	93	42.3 Å²	42.3	40%	0.404	20%	0.2	S	C	.	.	H	α-helix	trans	-59	-47.8	176.3	-176.1	-178.1	175	-173.1	0	112.6	F668 S669 L670 Q676	F668-K672 HydrophobicContact CE1-CD 4.44Å; F668-K672 VanDerWaalsContact O-CB 3.29Å; F668-K672 WeakPolarHBondContact O-CB 3.42Å; F668-K672 PolarHBondContact O-N 3.06Å; S669-K672 PolarHBondContact O-N 3.33Å; L670-K672 PolarHBondContact O-N 3.47Å; K672-Q676 WeakPolarHBondContact O-CB 3.39Å; K672-Q676 VanDerWaalsContact O-CG 3.23Å; K672-Q676 WeakPolarHBondContact O-CG 3.35Å; K672-Q676 PolarHBondContact O-N 3.32Å
673	I	96.7	Very high	95.6	Very high	60 Å²	60	42.7 Å²	42.7	31%	0.308	20%	0.201	S	C	.	.	H	α-helix	trans	-63.7	-45.7	177.6	-63.3	164.9	0	0	0	109.9	L607 S669 L670 F671 W675 Q676 M677	L607-I673 HydrophobicContact CD1-CB 4.33Å; L607-I673 HydrophobicContact CD1-CG2 3.83Å; S669-I673 WeakPolarHBondContact O-CG1 3.39Å; S669-I673 PolarHBondContact O-N 3.16Å; L670-I673 PolarHBondContact O-N 2.63Å; F671-I673 PolarHBondContact O-N 2.62Å; I673-W675 PolarHBondContact O-N 3Å; I673-Q676 PolarHBondContact O-N 2.92Å; I673-M677 HydrophobicContact CG2-CG 4.41Å; I673-M677 HydrophobicContact CG2-SD 3.85Å; I673-M677 WeakPolarHBondContact O-CG 3.49Å; I673-M677 PolarHBondContact O-N 3.21Å
674	F	97.9	Very high	95.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-54.7	-55.6	179.2	166.5	-93.5	0	0	0	112.4	L607 Q610 V611 V614 L659 L662 L666 L670 F671 Q676 M677 L678	L607-F674 HydrophobicContact CD2-CB 3.97Å; Q610-F674 HydrophobicContact CB-CD2 4.06Å; Q610-F674 HydrophobicContact CB-CE2 3.93Å; V611-F674 HydrophobicContact CB-CE2 4.38Å; V611-F674 HydrophobicContact CG2-CD2 3.54Å; V611-F674 HydrophobicContact CG2-CE2 3.71Å; V611-F674 HydrophobicContact CG2-CG 4.43Å; V614-F674 HydrophobicContact CB-CZ 4.21Å; V614-F674 HydrophobicContact CG1-CZ 4.43Å; V614-F674 HydrophobicContact CG2-CE2 4.32Å; V614-F674 HydrophobicContact CG2-CZ 3.9Å; L659-F674 HydrophobicContact CD2-CE1 4.24Å; L662-F674 HydrophobicContact CD1-CD1 3.89Å; L662-F674 HydrophobicContact CD1-CD2 4.05Å; L662-F674 HydrophobicContact CD1-CE1 3.33Å; L662-F674 HydrophobicContact CD1-CE2 3.5Å; L662-F674 VanDerWaalsContact CD1-CE2 3.5Å; L662-F674 HydrophobicContact CD1-CG 4.24Å; L662-F674 HydrophobicContact CD1-CZ 3.13Å; L666-F674 HydrophobicContact CD1-CB 4.44Å; L670-F674 WeakPolarHBondContact O-CB 3.37Å; L670-F674 PolarHBondContact O-N 3.28Å; F671-F674 HydrophobicContact CD2-CD1 4.32Å; F671-F674 HydrophobicContact CE2-CD1 4.36Å; F671-F674 WeakPolarHBondContact O-CB 3.23Å; F671-F674 PolarHBondContact O-N 3.19Å; F674-Q676 VanDerWaalsContact C-N 3.3Å; F674-Q676 PolarHBondContact O-N 3.16Å; F674-M677 PolarHBondContact O-N 2.98Å; F674-L678 HydrophobicContact CE1-CD2 4.03Å; F674-L678 HydrophobicContact CZ-CD2 3.93Å; F674-L678 PolarHBondContact O-N 3.44Å
675	W	96.9	Very high	96	Very high	4 Å²	4	36 Å²	36	2%	0.015	17%	0.174	C	C	.	.	H	α-helix	trans	-69.5	-31.5	-173.9	74.7	-110.5	0	0	0	111.6	L659 F671 I673 L678 V679 F716 C720 Y726	L659-W675 HydrophobicContact CD2-CB 4Å; F671-W675 AromaticContact CD1-CD1 3.86Å; F671-W675 AromaticContact CE1-CD1 3.68Å; F671-W675 PolarHBondContact O-N 3.32Å; I673-W675 PolarHBondContact O-N 3Å; W675-L678 PolarHBondContact O-N 3.06Å; W675-V679 HydrophobicContact CE3-CG2 3.93Å; W675-V679 HydrophobicContact CZ3-CG2 4.36Å; W675-V679 VanDerWaalsContact O-CG2 3.28Å; W675-V679 WeakPolarHBondContact O-CG2 3.36Å; W675-V679 PolarHBondContact O-N 2.8Å; W675-F716 HydrophobicContact CB-CE1 4.39Å; W675-F716 HydrophobicContact CD2-CD1 4.4Å; W675-F716 AromaticContact CE3-CD1 3.9Å; W675-F716 HydrophobicContact CE3-CD1 3.9Å; W675-F716 HydrophobicContact CE3-CE1 4.34Å; W675-C720 HydrophobicContact CH2-CB 4.06Å; W675-C720 HydrophobicContact CZ2-CB 4.28Å; W675-Y726 HydrophobicContact CH2-CD1 4.16Å; W675-Y726 HydrophobicContact CH2-CD2 4.05Å; W675-Y726 AromaticContact CH2-CE1 3.83Å; W675-Y726 HydrophobicContact CH2-CE1 3.83Å; W675-Y726 AromaticContact CH2-CE2 3.71Å; W675-Y726 HydrophobicContact CH2-CE2 3.71Å; W675-Y726 HydrophobicContact CH2-CG 4.26Å; W675-Y726 AromaticContact CH2-CZ 3.59Å; W675-Y726 AromaticContact CZ3-CD1 3.95Å; W675-Y726 HydrophobicContact CZ3-CD1 3.95Å; W675-Y726 HydrophobicContact CZ3-CD2 4.1Å; W675-Y726 HydrophobicContact CZ3-CE1 4.09Å; W675-Y726 HydrophobicContact CZ3-CE2 4.23Å; W675-Y726 AromaticContact CZ3-CG 3.96Å; W675-Y726 HydrophobicContact CZ3-CG 3.96Å
676	Q	97.1	Very high	96.2	Very high	47 Å²	47	34.1 Å²	34.1	22%	0.22	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-47.3	175.3	-73.9	178.2	-13.1	0	0	111.3	K672 I673 F674 L678 V679 E680 Y726	K672-Q676 WeakPolarHBondContact O-CB 3.39Å; K672-Q676 VanDerWaalsContact O-CG 3.23Å; K672-Q676 WeakPolarHBondContact O-CG 3.35Å; K672-Q676 PolarHBondContact O-N 3.32Å; I673-Q676 PolarHBondContact O-N 2.92Å; F674-Q676 VanDerWaalsContact C-N 3.3Å; F674-Q676 PolarHBondContact O-N 3.16Å; Q676-L678 VanDerWaalsContact C-N 3.3Å; Q676-L678 PolarHBondContact O-N 2.95Å; Q676-V679 PolarHBondContact O-N 3.34Å; Q676-E680 WeakPolarHBondContact O-CG 3.44Å; Q676-E680 PolarHBondContact O-N 3.34Å; Q676-E680 VanDerWaalsContact O-N 3.1Å; Q676-Y726 HydrophobicContact CG-CD1 4.43Å; Q676-Y726 HydrophobicContact CG-CE1 3.98Å; Q676-Y726 PolarHBondContact NE2-OH 3.49Å
677	M	97.9	Very high	96.3	Very high	38 Å²	38	34.5 Å²	34.5	19%	0.187	17%	0.166	C	C	.	.	H	α-helix	trans	-60.9	-39	174.5	-69.4	175.8	68.8	0	0	112.2	L607 V611 I673 F674 K681	L607-M677 HydrophobicContact CB-SD 4.48Å; V611-M677 HydrophobicContact CG1-CB 4.32Å; V611-M677 HydrophobicContact CG2-CB 3.81Å; V611-M677 HydrophobicContact CG2-CE 4.48Å; I673-M677 HydrophobicContact CG2-CG 4.41Å; I673-M677 HydrophobicContact CG2-SD 3.85Å; I673-M677 WeakPolarHBondContact O-CG 3.49Å; I673-M677 PolarHBondContact O-N 3.21Å; F674-M677 PolarHBondContact O-N 2.98Å; M677-K681 PolarHBondContact O-N 3.37Å
678	L	97.9	Very high	96.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-45.3	177.2	-179.9	62.7	0	0	0	111.7	V611 V614 F615 L655 L659 F674 W675 Q676 E680 K681 L682	V611-L678 HydrophobicContact CG1-CB 4.37Å; V611-L678 HydrophobicContact CG1-CD1 4.4Å; V614-L678 HydrophobicContact CB-CD1 4.43Å; V614-L678 HydrophobicContact CG1-CD1 4.13Å; V614-L678 HydrophobicContact CG1-CD2 3.78Å; F615-L678 HydrophobicContact CB-CD1 3.97Å; L655-L678 HydrophobicContact CD1-CD2 3.71Å; L659-L678 HydrophobicContact CD2-CD2 4.42Å; F674-L678 HydrophobicContact CE1-CD2 4.03Å; F674-L678 HydrophobicContact CZ-CD2 3.93Å; F674-L678 PolarHBondContact O-N 3.44Å; W675-L678 PolarHBondContact O-N 3.06Å; Q676-L678 VanDerWaalsContact C-N 3.3Å; Q676-L678 PolarHBondContact O-N 2.95Å; L678-E680 VanDerWaalsContact C-N 3.34Å; L678-E680 PolarHBondContact O-N 2.91Å; L678-K681 PolarHBondContact O-N 2.92Å; L678-L682 HydrophobicContact CD1-CD1 4.27Å; L678-L682 HydrophobicContact CD1-CG 4.29Å; L678-L682 HydrophobicContact CD2-CD1 4.46Å; L678-L682 HydrophobicContact CG-CD1 3.91Å; L678-L682 HydrophobicContact CG-CG 4.35Å; L678-L682 WeakPolarHBondContact O-CG 3.24Å; L678-L682 PolarHBondContact O-N 3.07Å
679	V	96.8	Very high	96.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-41.9	179.4	168.5	0	0	0	0	111.4	W675 Q676 K681 L682 D683 F716 Y726 F727	W675-V679 HydrophobicContact CE3-CG2 3.93Å; W675-V679 HydrophobicContact CZ3-CG2 4.36Å; W675-V679 VanDerWaalsContact O-CG2 3.28Å; W675-V679 WeakPolarHBondContact O-CG2 3.36Å; W675-V679 PolarHBondContact O-N 2.8Å; Q676-V679 PolarHBondContact O-N 3.34Å; V679-K681 VanDerWaalsContact C-N 3.28Å; V679-K681 PolarHBondContact O-N 3.15Å; V679-L682 PolarHBondContact O-N 3.23Å; V679-L682 VanDerWaalsContact O-N 3.16Å; V679-D683 WeakPolarHBondContact O-CB 3.34Å; V679-D683 PolarHBondContact O-N 3.44Å; V679-F716 HydrophobicContact CG2-CD1 3.8Å; V679-F716 HydrophobicContact CG2-CE1 3.3Å; V679-F716 HydrophobicContact CG2-CE2 4.12Å; V679-F716 HydrophobicContact CG2-CG 4.38Å; V679-F716 HydrophobicContact CG2-CZ 3.48Å; V679-F716 VanDerWaalsContact CG2-CZ 3.48Å; V679-Y726 VanDerWaalsContact CG1-CB 3.48Å; V679-F727 HydrophobicContact CB-CE1 4.38Å; V679-F727 HydrophobicContact CB-CE2 4.45Å; V679-F727 HydrophobicContact CB-CZ 4.12Å; V679-F727 HydrophobicContact CG1-CD1 3.82Å; V679-F727 HydrophobicContact CG1-CD2 3.81Å; V679-F727 HydrophobicContact CG1-CE1 3.64Å; V679-F727 HydrophobicContact CG1-CE2 3.6Å; V679-F727 HydrophobicContact CG1-CG 3.93Å; V679-F727 HydrophobicContact CG1-CZ 3.53Å; V679-F727 HydrophobicContact CG2-CE1 4.36Å; V679-F727 HydrophobicContact CG2-CE2 3.97Å; V679-F727 HydrophobicContact CG2-CZ 3.66Å
680	E	96.4	Very high	96.6	Very high	126 Å²	126	33.9 Å²	33.9	59%	0.589	16%	0.16	S	C	*	.	H	α-helix	trans	-57.5	-41.6	176.1	-72.8	178.7	178.6	0	0	112.1	Q676 L678 V684	Q676-E680 WeakPolarHBondContact O-CG 3.44Å; Q676-E680 PolarHBondContact O-N 3.34Å; Q676-E680 VanDerWaalsContact O-N 3.1Å; L678-E680 VanDerWaalsContact C-N 3.34Å; L678-E680 PolarHBondContact O-N 2.91Å; E680-V684 WeakPolarHBondContact O-CG2 3.45Å; E680-V684 PolarHBondContact O-N 3.33Å
681	K	97.2	Very high	96.6	Very high	75 Å²	75	33.9 Å²	33.9	33%	0.326	16%	0.16	S	C	.	.	H	α-helix	trans	-69.3	-40.1	175.4	-69.7	-163.7	178.6	-168.1	0	112.9	V611 D612 F615 M677 L678 V679 Y685	V611-K681 HydrophobicContact CG1-CD 4.01Å; D612-K681 IonicContact OD1-NZ 2.95Å; D612-K681 PolarHBondContact OD1-NZ 3.43Å; F615-K681 HydrophobicContact CD1-CD 4.46Å; F615-K681 HydrophobicContact CD2-CB 3.82Å; F615-K681 HydrophobicContact CE2-CB 3.93Å; F615-K681 HydrophobicContact CG-CB 4.26Å; F615-K681 HydrophobicContact CG-CD 4.4Å; F615-K681 HydrophobicContact CZ-CB 4.46Å; M677-K681 PolarHBondContact O-N 3.37Å; L678-K681 PolarHBondContact O-N 2.92Å; V679-K681 VanDerWaalsContact C-N 3.28Å; V679-K681 PolarHBondContact O-N 3.15Å; K681-Y685 VanDerWaalsContact O-CB 3.27Å; K681-Y685 WeakPolarHBondContact O-CB 3.49Å; K681-Y685 PolarHBondContact O-N 3.38Å
682	L	97.2	Very high	96.5	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-40.8	178.5	-70.4	173.9	0	0	0	112.2	F615 V618 L655 L678 V679 Y685 I686 F727	F615-L682 HydrophobicContact CD2-CD2 3.83Å; F615-L682 HydrophobicContact CD2-CG 4.35Å; F615-L682 HydrophobicContact CE2-CD2 4.07Å; V618-L682 HydrophobicContact CB-CD2 4.48Å; V618-L682 HydrophobicContact CG1-CD2 3.64Å; L655-L682 HydrophobicContact CD1-CD1 3.92Å; L655-L682 HydrophobicContact CD2-CD1 3.95Å; L678-L682 HydrophobicContact CD1-CD1 4.27Å; L678-L682 HydrophobicContact CD1-CG 4.29Å; L678-L682 HydrophobicContact CD2-CD1 4.46Å; L678-L682 HydrophobicContact CG-CD1 3.91Å; L678-L682 HydrophobicContact CG-CG 4.35Å; L678-L682 WeakPolarHBondContact O-CG 3.24Å; L678-L682 PolarHBondContact O-N 3.07Å; V679-L682 PolarHBondContact O-N 3.23Å; V679-L682 VanDerWaalsContact O-N 3.16Å; L682-Y685 PolarHBondContact O-N 3.44Å; L682-I686 WeakPolarHBondContact O-CB 3.35Å; L682-I686 WeakPolarHBondContact O-CG1 3.32Å; L682-I686 PolarHBondContact O-N 2.96Å; L682-F727 HydrophobicContact CB-CE1 4.08Å
683	D	97.3	Very high	96.4	Very high	7 Å²	7	34.1 Å²	34.1	4%	0.037	17%	0.174	C	C	.	.	H	α-helix	trans	-56.6	-51.6	176.4	-173.5	44.6	0	0	0	110.7	V679 Y687 F727 K728 H729 I730	V679-D683 WeakPolarHBondContact O-CB 3.34Å; V679-D683 PolarHBondContact O-N 3.44Å; D683-Y687 WeakPolarHBondContact O-CB 3.43Å; D683-Y687 PolarHBondContact O-N 3.32Å; D683-Y687 VanDerWaalsContact O-N 3.1Å; D683-F727 HydrophobicContact CB-CD1 4.03Å; D683-F727 VanDerWaalsContact CG-C 3.49Å; D683-F727 VanDerWaalsContact OD1-CA 3.23Å; D683-F727 WeakPolarHBondContact OD1-CA 3.37Å; D683-K728 PolarHBondContact OD1-N 3.15Å; D683-K728 PolarHBondContact OD2-N 3.48Å; D683-K728 VanDerWaalsContact OD2-N 3.15Å; D683-H729 PolarHBondContact OD1-N 3.4Å; D683-H729 VanDerWaalsContact OD1-N 3.11Å; D683-H729 IonicContact OD2-CE1 2.68Å; D683-H729 IonicContact OD2-CG 2.73Å; D683-H729 PolarHBondContact OD2-N 2.74Å; D683-H729 IonicContact OD2-ND1 3.87Å; D683-H729 PolarHBondContact OD2-ND1 2.93Å; D683-I730 WeakPolarHBondContact OD1-CG1 3.48Å; D683-I730 PolarHBondContact OD1-N 2.89Å
684	V	96.2	Very high	96.2	Very high	54 Å²	54	32.9 Å²	32.9	33%	0.327	17%	0.168	S	C	.	.	H	α-helix	trans	-64.6	-43.5	177.9	176	0	0	0	0	111.6	E680 Y687 Q688	E680-V684 WeakPolarHBondContact O-CG2 3.45Å; E680-V684 PolarHBondContact O-N 3.33Å; V684-Y687 PolarHBondContact O-N 2.8Å; V684-Q688 HydrophobicContact CG1-CG 4.26Å; V684-Q688 WeakPolarHBondContact O-CB 3.4Å; V684-Q688 WeakPolarHBondContact O-CG 3.26Å; V684-Q688 PolarHBondContact O-N 3.2Å
685	Y	97	Very high	96	Very high	13 Å²	13	37.5 Å²	37.5	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-52.4	-178.7	169.9	-109.6	0	0	0	112.9	F615 K619 A622 K681 L682 Y687 Q688 E689 I690	F615-Y685 HydrophobicContact CE2-CD1 4.39Å; F615-Y685 AromaticContact CE2-CG 3.99Å; F615-Y685 HydrophobicContact CE2-CG 3.99Å; F615-Y685 HydrophobicContact CZ-CD2 4.21Å; F615-Y685 AromaticContact CZ-CG 3.93Å; F615-Y685 HydrophobicContact CZ-CG 3.93Å; K619-Y685 HydrophobicContact CD-CD2 4.27Å; K619-Y685 HydrophobicContact CD-CE2 3.9Å; K619-Y685 HydrophobicContact CG-CD2 4.41Å; K619-Y685 HydrophobicContact CG-CE1 4.41Å; K619-Y685 HydrophobicContact CG-CE2 3.73Å; A622-Y685 HydrophobicContact CB-CE1 3.9Å; K681-Y685 VanDerWaalsContact O-CB 3.27Å; K681-Y685 WeakPolarHBondContact O-CB 3.49Å; K681-Y685 PolarHBondContact O-N 3.38Å; L682-Y685 PolarHBondContact O-N 3.44Å; Y685-Y687 VanDerWaalsContact C-N 3.27Å; Y685-Y687 PolarHBondContact O-N 3.5Å; Y685-Q688 PolarHBondContact O-N 2.87Å; Y685-E689 HydrophobicContact CD2-CB 3.81Å; Y685-E689 HydrophobicContact CD2-CG 3.66Å; Y685-E689 HydrophobicContact CE2-CB 3.52Å; Y685-E689 HydrophobicContact CE2-CG 3.64Å; Y685-E689 VanDerWaalsContact O-CB 3.29Å; Y685-E689 WeakPolarHBondContact O-CB 3.33Å; Y685-E689 PolarHBondContact O-N 3.41Å; Y685-I690 HydrophobicContact CE1-CD1 4.32Å
686	I	96.4	Very high	95.9	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-40.8	-179	-64.9	173.4	0	0	0	109.3	L682 I690 I691 M708 L712 I730	L682-I686 WeakPolarHBondContact O-CB 3.35Å; L682-I686 WeakPolarHBondContact O-CG1 3.32Å; L682-I686 PolarHBondContact O-N 2.96Å; I686-I690 HydrophobicContact CB-CD1 4.39Å; I686-I690 HydrophobicContact CG1-CD1 4.16Å; I686-I690 HydrophobicContact CG2-CB 4.39Å; I686-I690 HydrophobicContact CG2-CD1 4.22Å; I686-I690 WeakPolarHBondContact O-CA 3.41Å; I686-I690 VanDerWaalsContact O-CB 3.3Å; I686-I690 WeakPolarHBondContact O-CB 3.27Å; I686-I690 PolarHBondContact O-N 3.48Å; I686-I690 VanDerWaalsContact O-N 3.15Å; I686-I691 HydrophobicContact CG2-CD1 4.42Å; I686-I691 HydrophobicContact CG2-CG1 4.49Å; I686-I691 PolarHBondContact O-N 3.42Å; I686-M708 HydrophobicContact CG2-CE 3.85Å; I686-L712 HydrophobicContact CD1-CD2 3.71Å; I686-I730 HydrophobicContact CB-CD1 3.6Å; I686-I730 HydrophobicContact CB-CG1 4.01Å; I686-I730 HydrophobicContact CD1-CD1 3.74Å; I686-I730 HydrophobicContact CG1-CD1 4.2Å; I686-I730 HydrophobicContact CG2-CD1 3.74Å; I686-I730 HydrophobicContact CG2-CG1 3.95Å
687	Y	96.9	Very high	95.7	Very high	9 Å²	9	36.7 Å²	36.7	4%	0.035	19%	0.187	C	C	.	.	I	π-helix	trans	-58.2	-53.7	175.1	177.7	-112.5	0	0	0	112.3	D683 V684 Y685 I691 L692 H729 A733 L772 D776 L780	D683-Y687 WeakPolarHBondContact O-CB 3.43Å; D683-Y687 PolarHBondContact O-N 3.32Å; D683-Y687 VanDerWaalsContact O-N 3.1Å; V684-Y687 PolarHBondContact O-N 2.8Å; Y685-Y687 VanDerWaalsContact C-N 3.27Å; Y685-Y687 PolarHBondContact O-N 3.5Å; Y687-I691 WeakPolarHBondContact O-CB 3.32Å; Y687-I691 PolarHBondContact O-N 2.9Å; Y687-L692 HydrophobicContact CD1-CD1 4.25Å; Y687-L692 HydrophobicContact CE1-CD1 3.66Å; Y687-L692 HydrophobicContact CE1-CG 4.23Å; Y687-L692 HydrophobicContact CE2-CD1 4.44Å; Y687-L692 HydrophobicContact CE2-CD2 4.12Å; Y687-L692 HydrophobicContact CE2-CG 4.17Å; Y687-L692 WeakPolarHBondContact O-CG 3.19Å; Y687-L692 PolarHBondContact O-N 3.21Å; Y687-H729 HydrophobicContact CD1-CB 4.04Å; Y687-H729 HydrophobicContact CD2-CB 3.99Å; Y687-H729 HydrophobicContact CG-CB 3.67Å; Y687-A733 HydrophobicContact CD2-CB 4Å; Y687-A733 HydrophobicContact CE2-CB 4.04Å; Y687-L772 HydrophobicContact CE1-CD2 4.32Å; Y687-L772 HydrophobicContact CE2-CD2 3.89Å; Y687-D776 VanDerWaalsContact OH-CB 3.32Å; Y687-D776 WeakPolarHBondContact OH-CB 3.38Å; Y687-D776 PolarHBondContact OH-OD1 2.99Å; Y687-L780 HydrophobicContact CE2-CD1 4.18Å; Y687-L780 HydrophobicContact CE2-CD2 4.18Å; Y687-L780 HydrophobicContact CE2-CG 4.48Å
688	Q	95.5	Very high	95.3	Very high	106 Å²	106	40.7 Å²	40.7	50%	0.495	21%	0.205	S	C	.	.	I	π-helix	trans	-76.3	-44.2	-174.1	-68.4	178.4	-13.7	0	0	113.6	V684 Y685	V684-Q688 HydrophobicContact CG1-CG 4.26Å; V684-Q688 WeakPolarHBondContact O-CB 3.4Å; V684-Q688 WeakPolarHBondContact O-CG 3.26Å; V684-Q688 PolarHBondContact O-N 3.2Å; Y685-Q688 PolarHBondContact O-N 2.87Å
689	E	95.6	Very high	94.9	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	21%	0.207	S	C	.	.	I	π-helix	trans	-96.5	-14.8	-167	-66.8	-74.7	165	0	0	113.6	K626 Y685 A693	K626-E689 WeakPolarHBondContact CD-O 3.16Å; K626-E689 WeakPolarHBondContact CE-O 3.39Å; K626-E689 WeakPolarHBondContact CG-O 3.37Å; K626-E689 IonicContact NZ-OE2 2.67Å; K626-E689 PolarHBondContact NZ-OE2 3.02Å; Y685-E689 HydrophobicContact CD2-CB 3.81Å; Y685-E689 HydrophobicContact CD2-CG 3.66Å; Y685-E689 HydrophobicContact CE2-CB 3.52Å; Y685-E689 HydrophobicContact CE2-CG 3.64Å; Y685-E689 VanDerWaalsContact O-CB 3.29Å; Y685-E689 WeakPolarHBondContact O-CB 3.33Å; Y685-E689 PolarHBondContact O-N 3.41Å; E689-A693 WeakPolarHBondContact O-CB 3.34Å
690	I	94.5	Very high	94.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-116.5	-54.8	179	-56.2	175.2	0	0	0	109.8	Y625 K626 W630 Y685 I686 N694	Y625-I690 HydrophobicContact CD1-CD1 3.65Å; Y625-I690 HydrophobicContact CE1-CD1 4.04Å; Y625-I690 HydrophobicContact CE1-CG2 4.33Å; K626-I690 HydrophobicContact CB-CG1 4.28Å; W630-I690 HydrophobicContact CZ2-CG2 4.22Å; Y685-I690 HydrophobicContact CE1-CD1 4.32Å; I686-I690 HydrophobicContact CB-CD1 4.39Å; I686-I690 HydrophobicContact CG1-CD1 4.16Å; I686-I690 HydrophobicContact CG2-CB 4.39Å; I686-I690 HydrophobicContact CG2-CD1 4.22Å; I686-I690 WeakPolarHBondContact O-CA 3.41Å; I686-I690 VanDerWaalsContact O-CB 3.3Å; I686-I690 WeakPolarHBondContact O-CB 3.27Å; I686-I690 PolarHBondContact O-N 3.48Å; I686-I690 VanDerWaalsContact O-N 3.15Å; I690-N694 WeakPolarHBondContact O-CB 3.37Å; I690-N694 PolarHBondContact O-ND2 3.1Å
691	I	95.9	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	I	π-helix	trans	-71.5	-59.4	-175.8	-60.6	175.9	0	0	0	110.4	I686 Y687 A693 N694 F696 L704 I730 A733 L737 L780	I686-I691 HydrophobicContact CG2-CD1 4.42Å; I686-I691 HydrophobicContact CG2-CG1 4.49Å; I686-I691 PolarHBondContact O-N 3.42Å; Y687-I691 WeakPolarHBondContact O-CB 3.32Å; Y687-I691 PolarHBondContact O-N 2.9Å; I691-A693 PolarHBondContact O-N 2.95Å; I691-N694 PolarHBondContact O-N 3.33Å; I691-F696 HydrophobicContact CG2-CE2 4.33Å; I691-F696 WeakPolarHBondContact O-CE2 3.47Å; I691-L704 HydrophobicContact CD1-CD2 3.99Å; I691-L704 HydrophobicContact CG1-CD1 4.46Å; I691-L704 HydrophobicContact CG1-CD2 3.88Å; I691-I730 HydrophobicContact CD1-CG2 4.38Å; I691-A733 HydrophobicContact CD1-CB 3.92Å; I691-A733 HydrophobicContact CG2-CB 4.14Å; I691-L737 HydrophobicContact CG2-CD1 3.93Å; I691-L780 HydrophobicContact CG2-CD2 3.61Å
692	L	94.8	Very high	94.4	Very high	48 Å²	48	31.7 Å²	31.7	25%	0.251	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19	-177.3	-64.8	-175.8	0	0	0	114.1	Y687 I779 L780 L783	Y687-L692 HydrophobicContact CD1-CD1 4.25Å; Y687-L692 HydrophobicContact CE1-CD1 3.66Å; Y687-L692 HydrophobicContact CE1-CG 4.23Å; Y687-L692 HydrophobicContact CE2-CD1 4.44Å; Y687-L692 HydrophobicContact CE2-CD2 4.12Å; Y687-L692 HydrophobicContact CE2-CG 4.17Å; Y687-L692 WeakPolarHBondContact O-CG 3.19Å; Y687-L692 PolarHBondContact O-N 3.21Å; L692-I779 HydrophobicContact CD2-CG2 3.9Å; L692-L780 HydrophobicContact CD2-CD2 3.84Å; L692-L780 HydrophobicContact CD2-CG 4.21Å; L692-L783 HydrophobicContact CD2-CD1 3.98Å
693	A	92.8	Very high	94.3	Very high	57 Å²	57	32.1 Å²	32.1	47%	0.471	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.6	-179.9	0	0	0	0	0	114.1	E689 I691	E689-A693 WeakPolarHBondContact O-CB 3.34Å; I691-A693 PolarHBondContact O-N 2.95Å
694	N	92.7	Very high	94.2	Very high	33 Å²	33	31.8 Å²	31.8	18%	0.176	17%	0.166	C	C	.	.	S	Bend	trans	-129.7	158.3	-173.6	-71.7	-72.9	0	0	0	111.9	K626 W630 I690 I691 F696	K626-N694 PolarHBondContact O-ND2 2.54Å; W630-N694 HydrophobicContact CG-CB 4.36Å; I690-N694 WeakPolarHBondContact O-CB 3.37Å; I690-N694 PolarHBondContact O-ND2 3.1Å; I691-N694 PolarHBondContact O-N 3.33Å; N694-F696 HydrophobicContact CB-CE2 4.05Å; N694-F696 HydrophobicContact CB-CZ 4.13Å; N694-F696 WeakPolarHBondContact O-CE2 3.44Å
695	H	93.2	Very high	94.1	Very high	97 Å²	97	32.6 Å²	32.6	45%	0.449	17%	0.167	S	C	.	.			trans	-104.4	149.7	170.1	-65.5	72.5	0	0	0	109.5	W630 L631 L783 T785	W630-H695 WeakPolarHBondContact CB-O 3.31Å; L631-H695 HydrophobicContact CD1-CB 4.13Å; L631-H695 HydrophobicContact CD2-CB 3.68Å; L631-H695 WeakPolarHBondContact CD2-O 3.44Å; L631-H695 HydrophobicContact CG-CB 4.08Å; L631-H695 WeakPolarHBondContact CG-O 3.42Å; H695-L783 CarbonylContact C-O 3.55Å; H695-L783 VanDerWaalsContact CA-O 3.26Å; H695-L783 WeakPolarHBondContact CA-O 3.17Å; H695-L783 WeakPolarHBondContact CB-O 3.49Å; H695-T785 HydrophobicContact CB-CG2 4.21Å
696	F	94.6	Very high	94	Very high	1 Å²	1	34.2 Å²	34.2	0%	0.004	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-124.2	131.1	-172.1	-63.5	-95.9	0	0	0	110.8	W630 I691 N694 A701 L704 L737 L783 T785	W630-F696 HydrophobicContact CB-CD1 3.88Å; W630-F696 HydrophobicContact CB-CE1 3.94Å; W630-F696 HydrophobicContact CD2-CD1 4.07Å; W630-F696 AromaticContact CD2-CE1 3.43Å; W630-F696 HydrophobicContact CD2-CE1 3.43Å; W630-F696 VanDerWaalsContact CD2-CE1 3.43Å; W630-F696 HydrophobicContact CD2-CZ 4.22Å; W630-F696 AromaticContact CE3-CD1 3.94Å; W630-F696 HydrophobicContact CE3-CD1 3.94Å; W630-F696 AromaticContact CE3-CE1 3.54Å; W630-F696 HydrophobicContact CE3-CE1 3.54Å; W630-F696 HydrophobicContact CG-CD1 4.07Å; W630-F696 AromaticContact CG-CE1 3.62Å; W630-F696 HydrophobicContact CG-CE1 3.62Å; W630-F696 HydrophobicContact CG-CZ 4.17Å; W630-F696 HydrophobicContact CZ3-CE1 4.26Å; I691-F696 HydrophobicContact CG2-CE2 4.33Å; I691-F696 WeakPolarHBondContact O-CE2 3.47Å; N694-F696 HydrophobicContact CB-CE2 4.05Å; N694-F696 HydrophobicContact CB-CZ 4.13Å; N694-F696 WeakPolarHBondContact O-CE2 3.44Å; F696-A701 HydrophobicContact CB-CB 4.29Å; F696-L704 HydrophobicContact CE1-CB 4.31Å; F696-L704 HydrophobicContact CE1-CD2 3.87Å; F696-L704 HydrophobicContact CZ-CD2 4.1Å; F696-L737 HydrophobicContact CB-CD2 4.48Å; F696-L737 HydrophobicContact CD2-CD1 4Å; F696-L737 HydrophobicContact CD2-CD2 4.1Å; F696-L737 HydrophobicContact CE2-CD1 4.14Å; F696-L737 HydrophobicContact CG-CD1 4.26Å; F696-L737 HydrophobicContact CG-CD2 4.47Å; F696-L737 HydrophobicContact CZ-CD1 4.5Å; F696-L783 PolarHBondContact N-O 2.8Å; F696-T785 PolarHBondContact O-N 3.15Å; F696-T785 PolarHBondContact O-OG1 3.23Å; F696-T785 VanDerWaalsContact O-OG1 3.12Å
697	N	91.9	Very high	94	Very high	34 Å²	34	34.3 Å²	34.3	18%	0.182	18%	0.175	C	C	.	.			trans	-85.3	177.7	159.3	75.1	-3.3	0	0	0	109.2	W630 L631 L633 G699 G700 A701 T785	W630-N697 PolarHBondContact O-OD1 2.72Å; W630-N697 VanDerWaalsContact O-OD1 3.1Å; L631-N697 PolarHBondContact O-ND2 2.86Å; L633-N697 PolarHBondContact O-ND2 3.35Å; N697-G699 VanDerWaalsContact C-N 3.33Å; N697-G699 PolarHBondContact O-N 3.1Å; N697-G699 PolarHBondContact OD1-N 3.01Å; N697-G700 PolarHBondContact O-N 3.38Å; N697-G700 PolarHBondContact OD1-N 3.27Å; N697-A701 PolarHBondContact O-N 3.27Å; N697-T785 WeakPolarHBondContact CA-OG1 3.3Å
698	E	90.1	Very high	93.9	Very high	122 Å²	122	34 Å²	34	57%	0.57	17%	0.174	S	C	*	.	H	α-helix	trans	-58.6	-42.8	179.9	-175.8	177.3	-178	0	0	112.5	A702	E698-A702 WeakPolarHBondContact O-CB 3.26Å; E698-A702 PolarHBondContact O-N 3.09Å
699	G	90.4	Very high	93.9	Very high	4 Å²	4	31.9 Å²	31.9	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-42.7	177.3	0	0	0	0	0	113.8	P634 N697 A702 Q703	P634-G699 WeakPolarHBondContact O-CA 3.29Å; N697-G699 VanDerWaalsContact C-N 3.33Å; N697-G699 PolarHBondContact O-N 3.1Å; N697-G699 PolarHBondContact OD1-N 3.01Å; G699-A702 PolarHBondContact O-N 3.11Å; G699-Q703 WeakPolarHBondContact O-CB 3.29Å; G699-Q703 PolarHBondContact O-N 3.12Å
700	G	92.9	Very high	93.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.6	-38.9	179.2	0	0	0	0	0	113.1	W630 N697 A702 Q703 L704	W630-G700 WeakPolarHBondContact O-CA 3.46Å; N697-G700 PolarHBondContact O-N 3.38Å; N697-G700 PolarHBondContact OD1-N 3.27Å; G700-A702 VanDerWaalsContact C-N 3.32Å; G700-Q703 PolarHBondContact O-N 2.99Å; G700-L704 WeakPolarHBondContact O-CB 3.18Å; G700-L704 PolarHBondContact O-N 2.9Å
701	A	93.7	Very high	93.8	Very high	3 Å²	3	39 Å²	39	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-62.6	-41.5	172.9	0	0	0	0	0	111.4	F696 N697 Q705 L737 N738	F696-A701 HydrophobicContact CB-CB 4.29Å; N697-A701 PolarHBondContact O-N 3.27Å; A701-Q705 PolarHBondContact O-N 3.5Å; A701-L737 HydrophobicContact CB-CB 4Å; A701-N738 PolarHBondContact O-ND2 3.42Å; A701-N738 PolarHBondContact O-OD1 2.83Å
702	A	92.9	Very high	93.8	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.033	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-42.6	175.2	0	0	0	0	0	112.2	Q636 M642 E698 G699 G700 Q705 F706 N738	Q636-A702 HydrophobicContact CG-CB 3.75Å; M642-A702 HydrophobicContact CE-CB 4.32Å; E698-A702 WeakPolarHBondContact O-CB 3.26Å; E698-A702 PolarHBondContact O-N 3.09Å; G699-A702 PolarHBondContact O-N 3.11Å; G700-A702 VanDerWaalsContact C-N 3.32Å; A702-Q705 PolarHBondContact O-N 2.97Å; A702-F706 PolarHBondContact O-N 2.98Å; A702-N738 WeakPolarHBondContact CA-OD1 3.37Å; A702-N738 PolarHBondContact N-OD1 3.45Å
703	Q	94.6	Very high	93.8	Very high	11 Å²	11	37.3 Å²	37.3	5%	0.051	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-43.3	177.3	-174.7	62.7	51.9	0	0	111.5	W630 L633 M642 S643 S645 G699 G700 Q705 F706 D707	W630-Q703 HydrophobicContact CZ3-CB 4.35Å; W630-Q703 HydrophobicContact CZ3-CG 4.41Å; L633-Q703 HydrophobicContact CD1-CB 3.96Å; L633-Q703 HydrophobicContact CD1-CG 4.08Å; M642-Q703 HydrophobicContact CE-CB 4.26Å; S643-Q703 PolarHBondContact O-NE2 3.36Å; S645-Q703 WeakPolarHBondContact OG-CG 3.4Å; S645-Q703 PolarHBondContact OG-NE2 3.46Å; G699-Q703 WeakPolarHBondContact O-CB 3.29Å; G699-Q703 PolarHBondContact O-N 3.12Å; G700-Q703 PolarHBondContact O-N 2.99Å; Q703-Q705 VanDerWaalsContact C-N 3.32Å; Q703-Q705 PolarHBondContact O-N 3.47Å; Q703-F706 WeakPolarHBondContact O-CB 3.32Å; Q703-F706 PolarHBondContact O-N 3.16Å; Q703-F706 VanDerWaalsContact O-N 3.17Å; Q703-D707 PolarHBondContact NE2-OD1 3.31Å; Q703-D707 VanDerWaalsContact O-CG 3.29Å; Q703-D707 PolarHBondContact O-N 3.35Å
704	L	94.9	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-46.9	173.6	178.3	69.5	0	0	0	110.5	W630 I691 F696 G700 F706 D707 M708 L737	W630-L704 HydrophobicContact CE3-CB 4.44Å; W630-L704 HydrophobicContact CH2-CB 4.13Å; W630-L704 HydrophobicContact CH2-CD1 3.96Å; W630-L704 HydrophobicContact CZ2-CD1 4.39Å; W630-L704 HydrophobicContact CZ3-CB 3.75Å; W630-L704 HydrophobicContact CZ3-CD1 4.42Å; I691-L704 HydrophobicContact CD1-CD2 3.99Å; I691-L704 HydrophobicContact CG1-CD1 4.46Å; I691-L704 HydrophobicContact CG1-CD2 3.88Å; F696-L704 HydrophobicContact CE1-CB 4.31Å; F696-L704 HydrophobicContact CE1-CD2 3.87Å; F696-L704 HydrophobicContact CZ-CD2 4.1Å; G700-L704 WeakPolarHBondContact O-CB 3.18Å; G700-L704 PolarHBondContact O-N 2.9Å; L704-F706 VanDerWaalsContact C-N 3.31Å; L704-F706 PolarHBondContact O-N 3.28Å; L704-D707 PolarHBondContact O-N 2.8Å; L704-M708 HydrophobicContact CD1-CE 3.69Å; L704-M708 HydrophobicContact CD1-CG 4.35Å; L704-M708 VanDerWaalsContact O-CG 3.23Å; L704-M708 WeakPolarHBondContact O-CG 3.29Å; L704-M708 PolarHBondContact O-N 3.44Å; L704-L737 HydrophobicContact CD2-CD1 3.86Å
705	Q	95.3	Very high	94.1	Very high	71 Å²	71	37.5 Å²	37.5	33%	0.332	18%	0.181	S	C	.	.	H	α-helix	trans	-60.9	-40.6	177.1	-174.1	176.9	19.9	0	0	111.8	A701 A702 Q703 T709	A701-Q705 PolarHBondContact O-N 3.5Å; A702-Q705 PolarHBondContact O-N 2.97Å; Q703-Q705 VanDerWaalsContact C-N 3.32Å; Q703-Q705 PolarHBondContact O-N 3.47Å; Q705-T709 HydrophobicContact CG-CG2 4.12Å; Q705-T709 WeakPolarHBondContact O-CB 3.45Å; Q705-T709 WeakPolarHBondContact O-CG2 3.23Å; Q705-T709 PolarHBondContact O-N 2.95Å; Q705-T709 PolarHBondContact O-OG1 3.11Å
706	F	94.6	Very high	94.2	Very high	47 Å²	47	32.9 Å²	32.9	21%	0.206	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-49.1	176.1	-176.4	-87.7	0	0	0	111.8	M642 A702 Q703 L704 M708 R710 N711	M642-F706 HydrophobicContact CB-CD1 4.42Å; M642-F706 HydrophobicContact CB-CD2 3.63Å; M642-F706 HydrophobicContact CB-CE1 4.5Å; M642-F706 HydrophobicContact CB-CE2 3.7Å; M642-F706 HydrophobicContact CB-CG 4.01Å; M642-F706 HydrophobicContact CB-CZ 4.15Å; M642-F706 HydrophobicContact CE-CB 3.67Å; M642-F706 HydrophobicContact CE-CD2 4.49Å; M642-F706 HydrophobicContact CE-CG 4.17Å; M642-F706 HydrophobicContact CG-CD2 4.48Å; M642-F706 VanDerWaalsContact O-CZ 3.29Å; M642-F706 WeakPolarHBondContact O-CZ 3.32Å; M642-F706 HydrophobicContact SD-CB 4.23Å; M642-F706 HydrophobicContact SD-CD2 4.13Å; M642-F706 HydrophobicContact SD-CG 4.4Å; A702-F706 PolarHBondContact O-N 2.98Å; Q703-F706 WeakPolarHBondContact O-CB 3.32Å; Q703-F706 PolarHBondContact O-N 3.16Å; Q703-F706 VanDerWaalsContact O-N 3.17Å; L704-F706 VanDerWaalsContact C-N 3.31Å; L704-F706 PolarHBondContact O-N 3.28Å; F706-M708 VanDerWaalsContact C-N 3.28Å; F706-M708 PolarHBondContact O-N 3.42Å; F706-R710 HydrophobicContact CD2-CB 4.35Å; F706-R710 HydrophobicContact CD2-CG 3.84Å; F706-R710 HydrophobicContact CE1-CB 4.37Å; F706-R710 HydrophobicContact CE2-CB 4.18Å; F706-R710 HydrophobicContact CE2-CG 3.82Å; F706-R710 HydrophobicContact CG-CG 4.38Å; F706-R710 HydrophobicContact CZ-CB 4.19Å; F706-R710 HydrophobicContact CZ-CG 4.33Å; F706-R710 VanDerWaalsContact O-CB 3.3Å; F706-R710 WeakPolarHBondContact O-CB 3.28Å; F706-R710 PolarHBondContact O-N 2.8Å; F706-N711 PolarHBondContact O-ND2 3.25Å
707	D	95.8	Very high	94	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-58.5	-41.1	179.2	-69	-18.6	0	0	0	111.2	Y625 L644 S645 Q703 L704 N711 L712	Y625-D707 PolarHBondContact OH-OD2 3.42Å; L644-D707 HydrophobicContact CD1-CB 4.43Å; S645-D707 WeakPolarHBondContact CB-OD2 3.34Å; S645-D707 PolarHBondContact N-OD1 2.8Å; S645-D707 PolarHBondContact OG-OD1 2.96Å; S645-D707 PolarHBondContact OG-OD2 3.46Å; Q703-D707 PolarHBondContact NE2-OD1 3.31Å; Q703-D707 VanDerWaalsContact O-CG 3.29Å; Q703-D707 PolarHBondContact O-N 3.35Å; L704-D707 PolarHBondContact O-N 2.8Å; D707-N711 VanDerWaalsContact O-CB 3.32Å; D707-N711 WeakPolarHBondContact O-CB 3.35Å; D707-N711 PolarHBondContact O-N 3.43Å; D707-L712 PolarHBondContact O-N 2.96Å
708	M	96.2	Very high	93.8	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.02	21%	0.209	C	C	.	.	I	π-helix	trans	-73.5	-54.1	179	-61.2	-58.2	148.2	0	0	112.6	Y625 I686 L704 F706 L712 F713 I730	Y625-M708 HydrophobicContact CE1-CE 3.94Å; Y625-M708 WeakPolarHBondContact OH-CE 3.47Å; I686-M708 HydrophobicContact CG2-CE 3.85Å; L704-M708 HydrophobicContact CD1-CE 3.69Å; L704-M708 HydrophobicContact CD1-CG 4.35Å; L704-M708 VanDerWaalsContact O-CG 3.23Å; L704-M708 WeakPolarHBondContact O-CG 3.29Å; L704-M708 PolarHBondContact O-N 3.44Å; F706-M708 VanDerWaalsContact C-N 3.28Å; F706-M708 PolarHBondContact O-N 3.42Å; M708-L712 PolarHBondContact O-N 3.27Å; M708-L712 HydrophobicContact SD-CB 4.14Å; M708-L712 HydrophobicContact SD-CD2 3.43Å; M708-L712 WeakPolarHBondContact SD-CD2 3.34Å; M708-L712 HydrophobicContact SD-CG 4.43Å; M708-F713 HydrophobicContact CB-CE1 4.17Å; M708-F713 HydrophobicContact CB-CE2 4.11Å; M708-F713 HydrophobicContact CB-CZ 3.83Å; M708-F713 WeakPolarHBondContact O-CD2 3.4Å; M708-F713 VanDerWaalsContact O-CG 3.26Å; M708-F713 WeakPolarHBondContact O-CG 3.19Å; M708-F713 PolarHBondContact O-N 3.44Å; M708-I730 HydrophobicContact CB-CG2 4.19Å; M708-I730 HydrophobicContact CG-CG2 3.53Å; M708-I730 HydrophobicContact SD-CD1 4.34Å; M708-I730 HydrophobicContact SD-CG2 3.65Å
709	T	94.6	Very high	93.9	Very high	60 Å²	60	38.6 Å²	38.6	37%	0.368	19%	0.191	S	C	.	.	I	π-helix	trans	-77.5	-31.3	-170.5	59.7	0	0	0	0	114	Q705 F713 P714	Q705-T709 HydrophobicContact CG-CG2 4.12Å; Q705-T709 WeakPolarHBondContact O-CB 3.45Å; Q705-T709 WeakPolarHBondContact O-CG2 3.23Å; Q705-T709 PolarHBondContact O-N 2.95Å; Q705-T709 PolarHBondContact O-OG1 3.11Å; T709-F713 HydrophobicContact CG2-CD2 4.36Å; T709-F713 HydrophobicContact CG2-CE2 4.18Å; T709-P714 WeakPolarHBondContact O-CD 3.41Å; T709-P714 WeakPolarHBondContact O-CG 3.43Å
710	R	93.5	Very high	94	Very high	176 Å²	176	39.4 Å²	39.4	66%	0.664	20%	0.195	S	C	*	.	I	π-helix	trans	-99.5	-14	-177.6	-60	-61.8	-171	167.9	0.7	113.6	F706	F706-R710 HydrophobicContact CD2-CB 4.35Å; F706-R710 HydrophobicContact CD2-CG 3.84Å; F706-R710 HydrophobicContact CE1-CB 4.37Å; F706-R710 HydrophobicContact CE2-CB 4.18Å; F706-R710 HydrophobicContact CE2-CG 3.82Å; F706-R710 HydrophobicContact CG-CG 4.38Å; F706-R710 HydrophobicContact CZ-CB 4.19Å; F706-R710 HydrophobicContact CZ-CG 4.33Å; F706-R710 VanDerWaalsContact O-CB 3.3Å; F706-R710 WeakPolarHBondContact O-CB 3.28Å; F706-R710 PolarHBondContact O-N 2.8Å
711	N	94.4	Very high	94	Very high	42 Å²	42	49.6 Å²	49.6	23%	0.225	24%	0.24	C	C	.	.	I	π-helix	trans	-129.5	-62	-176.4	-52.6	-89.7	0	0	0	113.2	L644 L652 F706 D707 P714 L715	L644-N711 HydrophobicContact CD1-CB 3.97Å; L652-N711 HydrophobicContact CD1-CB 3.64Å; F706-N711 PolarHBondContact O-ND2 3.25Å; D707-N711 VanDerWaalsContact O-CB 3.32Å; D707-N711 WeakPolarHBondContact O-CB 3.35Å; D707-N711 PolarHBondContact O-N 3.43Å; N711-P714 WeakPolarHBondContact O-CD 3.2Å; N711-L715 PolarHBondContact O-N 3.5Å
712	L	95.8	Very high	93.9	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.021	27%	0.268	C	S	.	.	I	π-helix	trans	-62.8	-55	-176	-178.9	66.2	0	0	0	113	L652 L655 I686 D707 M708 L715 F727 I730	L652-L712 HydrophobicContact CD2-CB 4.04Å; L652-L712 HydrophobicContact CD2-CD1 3.58Å; L652-L712 HydrophobicContact CD2-CG 4.42Å; L655-L712 HydrophobicContact CD2-CD1 3.7Å; I686-L712 HydrophobicContact CD1-CD2 3.71Å; D707-L712 PolarHBondContact O-N 2.96Å; M708-L712 PolarHBondContact O-N 3.27Å; M708-L712 HydrophobicContact SD-CB 4.14Å; M708-L712 HydrophobicContact SD-CD2 3.43Å; M708-L712 WeakPolarHBondContact SD-CD2 3.34Å; M708-L712 HydrophobicContact SD-CG 4.43Å; L712-L715 WeakPolarHBondContact O-CB 3.36Å; L712-L715 PolarHBondContact O-N 3.21Å; L712-F727 HydrophobicContact CD2-CD1 4.38Å; L712-F727 HydrophobicContact CD2-CE1 3.98Å; L712-F727 HydrophobicContact CD2-CZ 4.29Å; L712-F727 HydrophobicContact CG-CE1 4.44Å; L712-F727 HydrophobicContact CG-CZ 4.25Å; L712-I730 HydrophobicContact CD2-CD1 4.29Å
713	F	96	Very high	94	Very high	10 Å²	10	57.5 Å²	57.5	4%	0.044	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-62.9	-42.4	-177.8	-51.8	-25.8	0	0	0	111.7	M708 T709 L715 F716 P723 E724 F727 I730 K731	M708-F713 HydrophobicContact CB-CE1 4.17Å; M708-F713 HydrophobicContact CB-CE2 4.11Å; M708-F713 HydrophobicContact CB-CZ 3.83Å; M708-F713 WeakPolarHBondContact O-CD2 3.4Å; M708-F713 VanDerWaalsContact O-CG 3.26Å; M708-F713 WeakPolarHBondContact O-CG 3.19Å; M708-F713 PolarHBondContact O-N 3.44Å; T709-F713 HydrophobicContact CG2-CD2 4.36Å; T709-F713 HydrophobicContact CG2-CE2 4.18Å; F713-L715 PolarHBondContact O-N 2.95Å; F713-L715 VanDerWaalsContact O-N 3.13Å; F713-F716 PolarHBondContact O-N 3.32Å; F713-P723 HydrophobicContact CB-CB 4.29Å; F713-P723 HydrophobicContact CB-CG 4.08Å; F713-P723 WeakPolarHBondContact O-CB 3.42Å; F713-P723 WeakPolarHBondContact O-CG 3.48Å; F713-E724 HydrophobicContact CD2-CB 3.53Å; F713-E724 HydrophobicContact CE2-CB 3.81Å; F713-E724 HydrophobicContact CG-CB 4.13Å; F713-F727 HydrophobicContact CD1-CB 4.04Å; F713-F727 AromaticContact CD1-CD2 3.42Å; F713-F727 HydrophobicContact CD1-CD2 3.42Å; F713-F727 VanDerWaalsContact CD1-CD2 3.42Å; F713-F727 AromaticContact CD1-CE2 3.94Å; F713-F727 HydrophobicContact CD1-CE2 3.94Å; F713-F727 AromaticContact CD1-CG 3.8Å; F713-F727 HydrophobicContact CD1-CG 3.8Å; F713-F727 HydrophobicContact CE1-CB 3.34Å; F713-F727 HydrophobicContact CE1-CD1 4.24Å; F713-F727 AromaticContact CE1-CD2 3.65Å; F713-F727 HydrophobicContact CE1-CD2 3.65Å; F713-F727 HydrophobicContact CE1-CE2 4.46Å; F713-F727 AromaticContact CE1-CG 3.5Å; F713-F727 HydrophobicContact CE1-CG 3.5Å; F713-F727 VanDerWaalsContact CE1-CG 3.5Å; F713-F727 HydrophobicContact CG-CD2 4.44Å; F713-F727 HydrophobicContact CZ-CB 3.93Å; F713-I730 HydrophobicContact CE1-CG2 4.32Å; F713-I730 HydrophobicContact CZ-CG2 4.07Å; F713-K731 HydrophobicContact CZ-CB 4.48Å
714	P	95.4	Very high	93.9	Very high	50 Å²	50	59.6 Å²	59.6	33%	0.325	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-54.7	-28.7	176	-33.7	41.1	0	0	0	116	T709 N711 F716 S717	T709-P714 WeakPolarHBondContact O-CD 3.41Å; T709-P714 WeakPolarHBondContact O-CG 3.43Å; N711-P714 WeakPolarHBondContact O-CD 3.2Å; P714-F716 PolarHBondContact O-N 3Å; P714-F716 VanDerWaalsContact O-N 3.07Å; P714-S717 WeakPolarHBondContact CA-OG 3.4Å; P714-S717 VanDerWaalsContact O-CB 3.28Å; P714-S717 WeakPolarHBondContact O-CB 3.36Å; P714-S717 PolarHBondContact O-N 3.49Å; P714-S717 PolarHBondContact O-OG 2.95Å; P714-S717 VanDerWaalsContact O-OG 3.08Å
715	L	94.6	Very high	93.8	Very high	43 Å²	43	62.8 Å²	62.8	23%	0.225	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-55.4	-27.5	175.4	-67.7	179.5	0	0	0	113.2	L652 L655 R656 N711 L712 F713	L652-L715 HydrophobicContact CB-CD1 4.42Å; L652-L715 HydrophobicContact CD2-CD1 3.96Å; L655-L715 HydrophobicContact CD2-CD1 4.05Å; L655-L715 HydrophobicContact CG-CD1 4.38Å; R656-L715 HydrophobicContact CB-CD2 4.26Å; R656-L715 HydrophobicContact CG-CD2 4.44Å; N711-L715 PolarHBondContact O-N 3.5Å; L712-L715 WeakPolarHBondContact O-CB 3.36Å; L712-L715 PolarHBondContact O-N 3.21Å; F713-L715 PolarHBondContact O-N 2.95Å; F713-L715 VanDerWaalsContact O-N 3.13Å
716	F	95.7	Very high	93.7	Very high	1 Å²	1	63.5 Å²	63.5	0%	0.004	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-98.8	3.7	-179	-60.9	-92.3	0	0	0	113.4	L655 L659 W675 V679 F713 P714 H718 Y719 C720 P723 F727	L655-F716 HydrophobicContact CD1-CZ 4.42Å; L655-F716 HydrophobicContact CD2-CE2 4.07Å; L655-F716 HydrophobicContact CD2-CZ 4.04Å; L659-F716 HydrophobicContact CD1-CD1 4.4Å; L659-F716 HydrophobicContact CD1-CE1 3.78Å; L659-F716 HydrophobicContact CD1-CZ 3.85Å; L659-F716 HydrophobicContact CD2-CE1 4.1Å; W675-F716 HydrophobicContact CB-CE1 4.39Å; W675-F716 HydrophobicContact CD2-CD1 4.4Å; W675-F716 AromaticContact CE3-CD1 3.9Å; W675-F716 HydrophobicContact CE3-CD1 3.9Å; W675-F716 HydrophobicContact CE3-CE1 4.34Å; V679-F716 HydrophobicContact CG2-CD1 3.8Å; V679-F716 HydrophobicContact CG2-CE1 3.3Å; V679-F716 HydrophobicContact CG2-CE2 4.12Å; V679-F716 HydrophobicContact CG2-CG 4.38Å; V679-F716 HydrophobicContact CG2-CZ 3.48Å; V679-F716 VanDerWaalsContact CG2-CZ 3.48Å; F713-F716 PolarHBondContact O-N 3.32Å; P714-F716 PolarHBondContact O-N 3Å; P714-F716 VanDerWaalsContact O-N 3.07Å; F716-H718 PolarHBondContact O-N 3.02Å; F716-Y719 HydrophobicContact CB-CD2 4.46Å; F716-Y719 HydrophobicContact CD1-CD2 4.19Å; F716-Y719 PolarHBondContact O-N 3.19Å; F716-C720 PolarHBondContact O-N 3.32Å; F716-C720 VanDerWaalsContact O-N 3.07Å; F716-P723 HydrophobicContact CB-CB 3.71Å; F716-F727 AromaticContact CD2-CE2 3.79Å; F716-F727 HydrophobicContact CD2-CE2 3.79Å; F716-F727 AromaticContact CD2-CZ 3.99Å; F716-F727 HydrophobicContact CD2-CZ 3.99Å; F716-F727 AromaticContact CE2-CE2 3.84Å; F716-F727 HydrophobicContact CE2-CE2 3.84Å; F716-F727 AromaticContact CE2-CZ 3.53Å; F716-F727 HydrophobicContact CE2-CZ 3.53Å; F716-F727 HydrophobicContact CZ-CZ 4.06Å
717	S	91.9	Very high	93.8	Very high	64 Å²	64	61.3 Å²	61.3	45%	0.448	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24.3	-178.3	-60.8	0	0	0	0	113	P714 Y719	P714-S717 WeakPolarHBondContact CA-OG 3.4Å; P714-S717 VanDerWaalsContact O-CB 3.28Å; P714-S717 WeakPolarHBondContact O-CB 3.36Å; P714-S717 PolarHBondContact O-N 3.49Å; P714-S717 PolarHBondContact O-OG 2.95Å; P714-S717 VanDerWaalsContact O-OG 3.08Å; S717-Y719 PolarHBondContact O-N 3.46Å
718	H	87.8	Confident	93.8	Very high	167 Å²	167	66.3 Å²	66.3	77%	0.773	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.9	172.2	-67.9	-74.6	0	0	0	112.3	F716	F716-H718 PolarHBondContact O-N 3.02Å
719	Y	90.6	Very high	93.8	Very high	45 Å²	45	68 Å²	68	18%	0.176	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-20.7	-171.1	-45.8	-45.2	0	0	0	113.2	L659 E663 F671 F716 S717	L659-Y719 HydrophobicContact CD1-CE2 4.46Å; E663-Y719 HydrophobicContact CG-CE1 4.39Å; E663-Y719 WeakPolarHBondContact OE1-CE1 3.19Å; E663-Y719 WeakPolarHBondContact OE2-CE1 3.47Å; E663-Y719 PolarHBondContact OE2-OH 3.32Å; F671-Y719 AromaticContact CE1-CD1 3.57Å; F671-Y719 HydrophobicContact CE1-CD1 3.57Å; F671-Y719 HydrophobicContact CE1-CD2 4.09Å; F671-Y719 AromaticContact CE1-CE1 3.49Å; F671-Y719 HydrophobicContact CE1-CE1 3.49Å; F671-Y719 VanDerWaalsContact CE1-CE1 3.49Å; F671-Y719 HydrophobicContact CE1-CE2 4.02Å; F671-Y719 AromaticContact CE1-CG 3.86Å; F671-Y719 HydrophobicContact CE1-CG 3.86Å; F671-Y719 AromaticContact CE1-CZ 3.71Å; F671-Y719 HydrophobicContact CZ-CD1 4.27Å; F671-Y719 HydrophobicContact CZ-CD2 4.21Å; F671-Y719 AromaticContact CZ-CE1 3.84Å; F671-Y719 HydrophobicContact CZ-CE1 3.84Å; F671-Y719 AromaticContact CZ-CE2 3.77Å; F671-Y719 HydrophobicContact CZ-CE2 3.77Å; F671-Y719 HydrophobicContact CZ-CG 4.44Å; F671-Y719 AromaticContact CZ-CZ 3.55Å; F716-Y719 HydrophobicContact CB-CD2 4.46Å; F716-Y719 HydrophobicContact CD1-CD2 4.19Å; F716-Y719 PolarHBondContact O-N 3.19Å; S717-Y719 PolarHBondContact O-N 3.46Å
720	C	93.1	Very high	93.8	Very high	21 Å²	21	65.1 Å²	65.1	14%	0.142	30%	0.298	C	S	.	.			trans	-154.4	154.9	177	69.9	0	0	0	0	112.2	W675 F716 R722 P723 Y726	W675-C720 HydrophobicContact CH2-CB 4.06Å; W675-C720 HydrophobicContact CZ2-CB 4.28Å; F716-C720 PolarHBondContact O-N 3.32Å; F716-C720 VanDerWaalsContact O-N 3.07Å; C720-R722 PolarHBondContact O-N 3.18Å; C720-P723 WeakPolarHBondContact SG-CA 3.35Å; C720-Y726 HydrophobicContact CB-CE2 4.11Å
721	K	92.4	Very high	94	Very high	214 Å²	214	60 Å²	60	93%	0.93	28%	0.281	S	S	*	.	S	Bend	trans	-72.7	-25.3	-176.7	-66.2	-176.6	178.9	179	0	114.5
722	R	92.8	Very high	94	Very high	166 Å²	166	58.6 Å²	58.6	63%	0.626	27%	0.273	S	S	*	.			trans	-139.7	71.1	-174.1	-70.3	-171.8	179.2	168.2	-2.2	110.5	C720 E724 N725	C720-R722 PolarHBondContact O-N 3.18Å; R722-E724 WeakPolarHBondContact CA-OE2 3.42Å; R722-E724 WeakPolarHBondContact CB-OE1 3.08Å; R722-E724 PolarHBondContact O-N 3.48Å; R722-N725 WeakPolarHBondContact CB-ND2 3.42Å; R722-N725 WeakPolarHBondContact O-CB 3.32Å; R722-N725 PolarHBondContact O-N 2.96Å
723	P	93.4	Very high	94.1	Very high	7 Å²	7	58.4 Å²	58.4	5%	0.045	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.2	-31.3	-175.1	24.8	-35.1	0	0	0	113.7	F713 F716 C720 N725 Y726 F727	F713-P723 HydrophobicContact CB-CB 4.29Å; F713-P723 HydrophobicContact CB-CG 4.08Å; F713-P723 WeakPolarHBondContact O-CB 3.42Å; F713-P723 WeakPolarHBondContact O-CG 3.48Å; F716-P723 HydrophobicContact CB-CB 3.71Å; C720-P723 WeakPolarHBondContact SG-CA 3.35Å; P723-N725 PolarHBondContact O-N 3.41Å; P723-Y726 PolarHBondContact O-N 3.34Å; P723-F727 WeakPolarHBondContact O-CD2 3.1Å
724	E	92.7	Very high	94	Very high	55 Å²	55	58.2 Å²	58.2	26%	0.257	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-58	-23	177.5	70.3	-78.4	-178	0	0	113.5	F713 R722 Y726 F727 K731	F713-E724 HydrophobicContact CD2-CB 3.53Å; F713-E724 HydrophobicContact CE2-CB 3.81Å; F713-E724 HydrophobicContact CG-CB 4.13Å; R722-E724 WeakPolarHBondContact CA-OE2 3.42Å; R722-E724 WeakPolarHBondContact CB-OE1 3.08Å; R722-E724 PolarHBondContact O-N 3.48Å; E724-Y726 VanDerWaalsContact C-N 3.27Å; E724-Y726 PolarHBondContact O-N 3.16Å; E724-F727 PolarHBondContact O-N 3.05Å; E724-K731 HydrophobicContact CB-CD 4.13Å; E724-K731 HydrophobicContact CG-CD 4.14Å; E724-K731 WeakPolarHBondContact O-CD 3.3Å
725	N	92.9	Very high	94	Very high	67 Å²	67	58.1 Å²	58.1	36%	0.358	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-77.2	-13.7	179	-68.8	-19.1	0	0	0	113.8	R722 P723 K728 K731	R722-N725 WeakPolarHBondContact CB-ND2 3.42Å; R722-N725 WeakPolarHBondContact O-CB 3.32Å; R722-N725 PolarHBondContact O-N 2.96Å; P723-N725 PolarHBondContact O-N 3.41Å; N725-K728 WeakPolarHBondContact O-CE 3.34Å; N725-K728 VanDerWaalsContact O-CG 3.26Å; N725-K728 WeakPolarHBondContact O-CG 3.33Å; N725-K731 PolarHBondContact OD1-NZ 3.41Å
726	Y	94.4	Very high	94	Very high	87 Å²	87	56.1 Å²	56.1	34%	0.341	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-20.2	173	-67.5	-91.5	0	0	0	112	W675 Q676 V679 C720 P723 E724	W675-Y726 HydrophobicContact CH2-CD1 4.16Å; W675-Y726 HydrophobicContact CH2-CD2 4.05Å; W675-Y726 AromaticContact CH2-CE1 3.83Å; W675-Y726 HydrophobicContact CH2-CE1 3.83Å; W675-Y726 AromaticContact CH2-CE2 3.71Å; W675-Y726 HydrophobicContact CH2-CE2 3.71Å; W675-Y726 HydrophobicContact CH2-CG 4.26Å; W675-Y726 AromaticContact CH2-CZ 3.59Å; W675-Y726 AromaticContact CZ3-CD1 3.95Å; W675-Y726 HydrophobicContact CZ3-CD1 3.95Å; W675-Y726 HydrophobicContact CZ3-CD2 4.1Å; W675-Y726 HydrophobicContact CZ3-CE1 4.09Å; W675-Y726 HydrophobicContact CZ3-CE2 4.23Å; W675-Y726 AromaticContact CZ3-CG 3.96Å; W675-Y726 HydrophobicContact CZ3-CG 3.96Å; Q676-Y726 HydrophobicContact CG-CD1 4.43Å; Q676-Y726 HydrophobicContact CG-CE1 3.98Å; Q676-Y726 PolarHBondContact NE2-OH 3.49Å; V679-Y726 VanDerWaalsContact CG1-CB 3.48Å; C720-Y726 HydrophobicContact CB-CE2 4.11Å; P723-Y726 PolarHBondContact O-N 3.34Å; E724-Y726 VanDerWaalsContact C-N 3.27Å; E724-Y726 PolarHBondContact O-N 3.16Å
727	F	96.3	Very high	93.9	Very high	1 Å²	1	56.2 Å²	56.2	0%	0.004	26%	0.258	C	S	.	.			trans	-101.7	59.7	176.6	-66	-84.8	0	0	0	111.7	V679 L682 D683 L712 F713 F716 P723 E724 I730 K731	V679-F727 HydrophobicContact CB-CE1 4.38Å; V679-F727 HydrophobicContact CB-CE2 4.45Å; V679-F727 HydrophobicContact CB-CZ 4.12Å; V679-F727 HydrophobicContact CG1-CD1 3.82Å; V679-F727 HydrophobicContact CG1-CD2 3.81Å; V679-F727 HydrophobicContact CG1-CE1 3.64Å; V679-F727 HydrophobicContact CG1-CE2 3.6Å; V679-F727 HydrophobicContact CG1-CG 3.93Å; V679-F727 HydrophobicContact CG1-CZ 3.53Å; V679-F727 HydrophobicContact CG2-CE1 4.36Å; V679-F727 HydrophobicContact CG2-CE2 3.97Å; V679-F727 HydrophobicContact CG2-CZ 3.66Å; L682-F727 HydrophobicContact CB-CE1 4.08Å; D683-F727 HydrophobicContact CB-CD1 4.03Å; D683-F727 VanDerWaalsContact CG-C 3.49Å; D683-F727 VanDerWaalsContact OD1-CA 3.23Å; D683-F727 WeakPolarHBondContact OD1-CA 3.37Å; L712-F727 HydrophobicContact CD2-CD1 4.38Å; L712-F727 HydrophobicContact CD2-CE1 3.98Å; L712-F727 HydrophobicContact CD2-CZ 4.29Å; L712-F727 HydrophobicContact CG-CE1 4.44Å; L712-F727 HydrophobicContact CG-CZ 4.25Å; F713-F727 HydrophobicContact CD1-CB 4.04Å; F713-F727 AromaticContact CD1-CD2 3.42Å; F713-F727 HydrophobicContact CD1-CD2 3.42Å; F713-F727 VanDerWaalsContact CD1-CD2 3.42Å; F713-F727 AromaticContact CD1-CE2 3.94Å; F713-F727 HydrophobicContact CD1-CE2 3.94Å; F713-F727 AromaticContact CD1-CG 3.8Å; F713-F727 HydrophobicContact CD1-CG 3.8Å; F713-F727 HydrophobicContact CE1-CB 3.34Å; F713-F727 HydrophobicContact CE1-CD1 4.24Å; F713-F727 AromaticContact CE1-CD2 3.65Å; F713-F727 HydrophobicContact CE1-CD2 3.65Å; F713-F727 HydrophobicContact CE1-CE2 4.46Å; F713-F727 AromaticContact CE1-CG 3.5Å; F713-F727 HydrophobicContact CE1-CG 3.5Å; F713-F727 VanDerWaalsContact CE1-CG 3.5Å; F713-F727 HydrophobicContact CG-CD2 4.44Å; F713-F727 HydrophobicContact CZ-CB 3.93Å; F716-F727 AromaticContact CD2-CE2 3.79Å; F716-F727 HydrophobicContact CD2-CE2 3.79Å; F716-F727 AromaticContact CD2-CZ 3.99Å; F716-F727 HydrophobicContact CD2-CZ 3.99Å; F716-F727 AromaticContact CE2-CE2 3.84Å; F716-F727 HydrophobicContact CE2-CE2 3.84Å; F716-F727 AromaticContact CE2-CZ 3.53Å; F716-F727 HydrophobicContact CE2-CZ 3.53Å; F716-F727 HydrophobicContact CZ-CZ 4.06Å; P723-F727 WeakPolarHBondContact O-CD2 3.1Å; E724-F727 PolarHBondContact O-N 3.05Å; F727-I730 HydrophobicContact CB-CB 4.4Å; F727-I730 HydrophobicContact CB-CD1 4.42Å; F727-I730 HydrophobicContact CD1-CD1 3.74Å; F727-I730 HydrophobicContact CE1-CD1 4.48Å; F727-I730 HydrophobicContact CG-CD1 4.49Å; F727-K731 WeakPolarHBondContact O-CB 3.24Å; F727-K731 PolarHBondContact O-N 2.85Å
728	K	94.8	Very high	94	Very high	109 Å²	109	55.6 Å²	55.6	47%	0.474	25%	0.25	S	C	.	.	H	α-helix	trans	-65.1	-44.4	-169	-64	-177.5	-178.2	174.9	0	112.5	D683 N725 K731 E732 K771	D683-K728 PolarHBondContact OD1-N 3.15Å; D683-K728 PolarHBondContact OD2-N 3.48Å; D683-K728 VanDerWaalsContact OD2-N 3.15Å; N725-K728 WeakPolarHBondContact O-CE 3.34Å; N725-K728 VanDerWaalsContact O-CG 3.26Å; N725-K728 WeakPolarHBondContact O-CG 3.33Å; K728-K731 PolarHBondContact O-N 3.37Å; K728-E732 WeakPolarHBondContact O-CB 3.35Å; K728-E732 WeakPolarHBondContact O-CG 3.45Å; K728-E732 PolarHBondContact O-N 2.86Å; K728-K771 HydrophobicContact CB-CB 4.03Å; K728-K771 HydrophobicContact CB-CG 3.88Å; K728-K771 HydrophobicContact CD-CB 4.46Å; K728-K771 HydrophobicContact CD-CD 4.48Å; K728-K771 HydrophobicContact CD-CG 4.35Å
729	H	96.1	Very high	94.3	Very high	39 Å²	39	49 Å²	49	18%	0.181	22%	0.22	C	C	.	.	H	α-helix	trans	-67.6	-45.4	-177.8	-58.5	88	0	0	0	110.9	D683 Y687 A733 L772	D683-H729 PolarHBondContact OD1-N 3.4Å; D683-H729 VanDerWaalsContact OD1-N 3.11Å; D683-H729 IonicContact OD2-CE1 2.68Å; D683-H729 IonicContact OD2-CG 2.73Å; D683-H729 PolarHBondContact OD2-N 2.74Å; D683-H729 IonicContact OD2-ND1 3.87Å; D683-H729 PolarHBondContact OD2-ND1 2.93Å; Y687-H729 HydrophobicContact CD1-CB 4.04Å; Y687-H729 HydrophobicContact CD2-CB 3.99Å; Y687-H729 HydrophobicContact CG-CB 3.67Å; H729-A733 WeakPolarHBondContact O-CB 3.3Å; H729-A733 PolarHBondContact O-N 3.39Å; H729-L772 HydrophobicContact CB-CD2 4.36Å
730	I	96.4	Very high	94.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-46.8	177	-62.2	172.7	0	0	0	110.7	D683 I686 I691 M708 L712 F713 F727 A733 C734	D683-I730 WeakPolarHBondContact OD1-CG1 3.48Å; D683-I730 PolarHBondContact OD1-N 2.89Å; I686-I730 HydrophobicContact CB-CD1 3.6Å; I686-I730 HydrophobicContact CB-CG1 4.01Å; I686-I730 HydrophobicContact CD1-CD1 3.74Å; I686-I730 HydrophobicContact CG1-CD1 4.2Å; I686-I730 HydrophobicContact CG2-CD1 3.74Å; I686-I730 HydrophobicContact CG2-CG1 3.95Å; I691-I730 HydrophobicContact CD1-CG2 4.38Å; M708-I730 HydrophobicContact CB-CG2 4.19Å; M708-I730 HydrophobicContact CG-CG2 3.53Å; M708-I730 HydrophobicContact SD-CD1 4.34Å; M708-I730 HydrophobicContact SD-CG2 3.65Å; L712-I730 HydrophobicContact CD2-CD1 4.29Å; F713-I730 HydrophobicContact CE1-CG2 4.32Å; F713-I730 HydrophobicContact CZ-CG2 4.07Å; F727-I730 HydrophobicContact CB-CB 4.4Å; F727-I730 HydrophobicContact CB-CD1 4.42Å; F727-I730 HydrophobicContact CD1-CD1 3.74Å; F727-I730 HydrophobicContact CE1-CD1 4.48Å; F727-I730 HydrophobicContact CG-CD1 4.49Å; I730-A733 PolarHBondContact O-N 2.96Å; I730-C734 WeakPolarHBondContact O-CB 3.33Å; I730-C734 PolarHBondContact O-N 2.87Å; I730-C734 PolarHBondContact O-SG 2.9Å
731	K	95.8	Very high	93.9	Very high	69 Å²	69	53 Å²	53	30%	0.3	25%	0.245	S	C	.	.	H	α-helix	trans	-59.6	-49.9	-178	-179	-176.7	-179.7	-178.3	0	111	F713 E724 N725 F727 K728 C734 I735	F713-K731 HydrophobicContact CZ-CB 4.48Å; E724-K731 HydrophobicContact CB-CD 4.13Å; E724-K731 HydrophobicContact CG-CD 4.14Å; E724-K731 WeakPolarHBondContact O-CD 3.3Å; N725-K731 PolarHBondContact OD1-NZ 3.41Å; F727-K731 WeakPolarHBondContact O-CB 3.24Å; F727-K731 PolarHBondContact O-N 2.85Å; K728-K731 PolarHBondContact O-N 3.37Å; K731-C734 PolarHBondContact O-N 3.31Å; K731-I735 WeakPolarHBondContact O-CG1 3.26Å; K731-I735 PolarHBondContact O-N 3.08Å; K731-I735 VanDerWaalsContact O-N 3.13Å
732	E	96	Very high	93.6	Very high	11 Å²	11	44.7 Å²	44.7	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-69.6	-36	-179.7	-68	-178.4	-173.9	0	0	112.2	K728 C734 I735 V736 I769 Y770 K771 L772	K728-E732 WeakPolarHBondContact O-CB 3.35Å; K728-E732 WeakPolarHBondContact O-CG 3.45Å; K728-E732 PolarHBondContact O-N 2.86Å; E732-C734 VanDerWaalsContact C-N 3.34Å; E732-C734 PolarHBondContact O-N 2.57Å; E732-I735 WeakPolarHBondContact O-CB 3.39Å; E732-I735 PolarHBondContact O-N 2.93Å; E732-I735 VanDerWaalsContact O-N 3.16Å; E732-V736 WeakPolarHBondContact O-CG2 3.31Å; E732-V736 PolarHBondContact O-N 3.25Å; E732-I769 HydrophobicContact CB-CG2 4.45Å; E732-I769 WeakPolarHBondContact OE2-CG2 3.39Å; E732-Y770 VanDerWaalsContact CD-N 3.28Å; E732-Y770 PolarHBondContact OE1-N 3.09Å; E732-Y770 PolarHBondContact OE2-N 3.02Å; E732-K771 VanDerWaalsContact CD-N 3.27Å; E732-K771 WeakPolarHBondContact OE1-CB 3.36Å; E732-K771 PolarHBondContact OE1-N 3.37Å; E732-K771 WeakPolarHBondContact OE2-CA 3.43Å; E732-K771 WeakPolarHBondContact OE2-CB 3.42Å; E732-K771 PolarHBondContact OE2-N 2.9Å; E732-L772 HydrophobicContact CB-CD1 3.56Å; E732-L772 HydrophobicContact CB-CG 3.88Å; E732-L772 WeakPolarHBondContact OE2-CG 3.47Å; E732-L772 PolarHBondContact OE2-N 2.93Å
733	A	96.2	Very high	93.4	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-40.4	173.1	0	0	0	0	0	112.3	Y687 I691 H729 I730 I735 V736 L737 L780	Y687-A733 HydrophobicContact CD2-CB 4Å; Y687-A733 HydrophobicContact CE2-CB 4.04Å; I691-A733 HydrophobicContact CD1-CB 3.92Å; I691-A733 HydrophobicContact CG2-CB 4.14Å; H729-A733 WeakPolarHBondContact O-CB 3.3Å; H729-A733 PolarHBondContact O-N 3.39Å; I730-A733 PolarHBondContact O-N 2.96Å; A733-I735 VanDerWaalsContact C-N 3.29Å; A733-I735 PolarHBondContact O-N 3.06Å; A733-V736 PolarHBondContact O-N 3.39Å; A733-L737 WeakPolarHBondContact O-CB 3.49Å; A733-L737 VanDerWaalsContact O-CG 3.3Å; A733-L737 WeakPolarHBondContact O-CG 3.29Å; A733-L737 PolarHBondContact O-N 2.99Å; A733-L780 HydrophobicContact CB-CD1 3.93Å; A733-L780 HydrophobicContact CB-CD2 3.91Å
734	C	95.9	Very high	93.2	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-37.1	173.8	-69.5	0	0	0	0	111.9	I730 K731 E732 N738	I730-C734 WeakPolarHBondContact O-CB 3.33Å; I730-C734 PolarHBondContact O-N 2.87Å; I730-C734 PolarHBondContact O-SG 2.9Å; K731-C734 PolarHBondContact O-N 3.31Å; E732-C734 VanDerWaalsContact C-N 3.34Å; E732-C734 PolarHBondContact O-N 2.57Å; C734-N738 WeakPolarHBondContact O-CB 3.48Å; C734-N738 PolarHBondContact O-N 2.73Å; C734-N738 PolarHBondContact O-ND2 3.48Å
735	I	95.3	Very high	92.9	Very high	49 Å²	49	38.8 Å²	38.8	25%	0.251	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-53.1	174.5	-67.2	168.8	0	0	0	109.8	K731 E732 A733 L737 N738 L739 V767	K731-I735 WeakPolarHBondContact O-CG1 3.26Å; K731-I735 PolarHBondContact O-N 3.08Å; K731-I735 VanDerWaalsContact O-N 3.13Å; E732-I735 WeakPolarHBondContact O-CB 3.39Å; E732-I735 PolarHBondContact O-N 2.93Å; E732-I735 VanDerWaalsContact O-N 3.16Å; A733-I735 VanDerWaalsContact C-N 3.29Å; A733-I735 PolarHBondContact O-N 3.06Å; I735-L737 PolarHBondContact O-N 2.87Å; I735-N738 PolarHBondContact O-N 3.32Å; I735-L739 WeakPolarHBondContact O-CG 3.43Å; I735-L739 PolarHBondContact O-N 2.98Å; I735-L739 VanDerWaalsContact O-N 3.17Å; I735-V767 HydrophobicContact CG2-CG1 3.87Å; I735-V767 WeakPolarHBondContact CG2-O 3.43Å
736	V	94.5	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-46.2	-177.4	177.4	0	0	0	0	112.3	E732 A733 N738 L739 I769 V777 L780 L781 R784	E732-V736 WeakPolarHBondContact O-CG2 3.31Å; E732-V736 PolarHBondContact O-N 3.25Å; A733-V736 PolarHBondContact O-N 3.39Å; V736-N738 VanDerWaalsContact C-N 3.28Å; V736-N738 PolarHBondContact O-N 3.1Å; V736-L739 PolarHBondContact O-N 3.42Å; V736-I769 HydrophobicContact CG2-CD1 3.38Å; V736-I769 HydrophobicContact CG2-CG1 4.2Å; V736-V777 HydrophobicContact CG1-CG1 4.23Å; V736-V777 HydrophobicContact CG2-CG1 4Å; V736-V777 HydrophobicContact CG2-CG2 4.48Å; V736-L780 HydrophobicContact CB-CB 4.34Å; V736-L780 HydrophobicContact CB-CD1 4.34Å; V736-L780 HydrophobicContact CG1-CB 3.75Å; V736-L780 HydrophobicContact CG2-CD1 4.35Å; V736-L781 HydrophobicContact CG1-CD2 3.83Å; V736-L781 HydrophobicContact CG1-CG 3.91Å; V736-R784 PolarHBondContact O-NH1 3.24Å
737	L	93.6	Very high	92.4	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-31	-178.3	-70	173.2	0	0	0	112.6	I691 F696 A701 L704 A733 I735 R784	I691-L737 HydrophobicContact CG2-CD1 3.93Å; F696-L737 HydrophobicContact CB-CD2 4.48Å; F696-L737 HydrophobicContact CD2-CD1 4Å; F696-L737 HydrophobicContact CD2-CD2 4.1Å; F696-L737 HydrophobicContact CE2-CD1 4.14Å; F696-L737 HydrophobicContact CG-CD1 4.26Å; F696-L737 HydrophobicContact CG-CD2 4.47Å; F696-L737 HydrophobicContact CZ-CD1 4.5Å; A701-L737 HydrophobicContact CB-CB 4Å; L704-L737 HydrophobicContact CD2-CD1 3.86Å; A733-L737 WeakPolarHBondContact O-CB 3.49Å; A733-L737 VanDerWaalsContact O-CG 3.3Å; A733-L737 WeakPolarHBondContact O-CG 3.29Å; A733-L737 PolarHBondContact O-N 2.99Å; I735-L737 PolarHBondContact O-N 2.87Å; L737-R784 HydrophobicContact CD2-CG 3.96Å
738	N	93.3	Very high	91.9	Very high	51 Å²	51	40.6 Å²	40.6	27%	0.273	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	8.1	-178.7	-69.7	-80.5	0	0	0	114	A701 A702 C734 I735 V736 N740	A701-N738 PolarHBondContact O-ND2 3.42Å; A701-N738 PolarHBondContact O-OD1 2.83Å; A702-N738 WeakPolarHBondContact CA-OD1 3.37Å; A702-N738 PolarHBondContact N-OD1 3.45Å; C734-N738 WeakPolarHBondContact O-CB 3.48Å; C734-N738 PolarHBondContact O-N 2.73Å; C734-N738 PolarHBondContact O-ND2 3.48Å; I735-N738 PolarHBondContact O-N 3.32Å; V736-N738 VanDerWaalsContact C-N 3.28Å; V736-N738 PolarHBondContact O-N 3.1Å; N738-N740 PolarHBondContact O-N 3.3Å
739	L	92.9	Very high	91.4	Very high	28 Å²	28	40 Å²	40	15%	0.147	22%	0.217	C	C	.	.	S	Bend	trans	-59.5	141.3	171.8	-69.5	173.1	0	0	0	110.6	I735 V736 A744 L747 V767 R784	I735-L739 WeakPolarHBondContact O-CG 3.43Å; I735-L739 PolarHBondContact O-N 2.98Å; I735-L739 VanDerWaalsContact O-N 3.17Å; V736-L739 PolarHBondContact O-N 3.42Å; L739-A744 HydrophobicContact CB-CB 4.11Å; L739-L747 HydrophobicContact CD1-CD2 3.71Å; L739-V767 HydrophobicContact CD1-CG1 4.08Å; L739-V767 HydrophobicContact CD2-CG1 3.59Å; L739-V767 HydrophobicContact CG-CG1 4.35Å; L739-R784 VanDerWaalsContact O-CZ 3.24Å; L739-R784 PolarHBondContact O-NH1 3.24Å; L739-R784 PolarHBondContact O-NH2 3.43Å
740	N	89.8	Confident	90.9	Very high	100 Å²	100	40.7 Å²	40.7	54%	0.535	22%	0.224	S	C	.	.			trans	-58.9	151.8	169.1	73.2	55.1	0	0	0	109.8	N738 G742 S743 A744	N738-N740 PolarHBondContact O-N 3.3Å; N740-G742 VanDerWaalsContact C-N 3.25Å; N740-G742 PolarHBondContact O-N 3.37Å; N740-G742 PolarHBondContact OD1-N 3.47Å; N740-S743 VanDerWaalsContact CG-OG 3.28Å; N740-S743 PolarHBondContact ND2-OG 3.01Å; N740-S743 PolarHBondContact O-N 3.36Å; N740-S743 VanDerWaalsContact OD1-CB 3.28Å; N740-S743 WeakPolarHBondContact OD1-CB 3.38Å; N740-S743 PolarHBondContact OD1-N 2.86Å; N740-S743 PolarHBondContact OD1-OG 3.47Å; N740-A744 WeakPolarHBondContact O-CB 3.42Å; N740-A744 PolarHBondContact O-N 2.98Å
741	V	86.6	Confident	90.3	Very high	51 Å²	51	41 Å²	41	31%	0.309	23%	0.226	S	C	.	.	H	α-helix	trans	-56.6	-38.8	-172.8	176.7	0	0	0	0	112.3	A744 L745 P788	V741-A744 PolarHBondContact O-N 3.48Å; V741-L745 HydrophobicContact CG1-CD1 4.2Å; V741-L745 WeakPolarHBondContact O-CG 3.24Å; V741-L745 PolarHBondContact O-N 2.87Å; V741-P788 HydrophobicContact CG1-CG 4.23Å
742	G	86.1	Confident	89.5	Confident	39 Å²	39	42.8 Å²	42.8	40%	0.402	24%	0.235	S	C	.	.	H	α-helix	trans	-66.2	-47.3	178.9	0	0	0	0	0	112.9	N740 A744 L745 L746	N740-G742 VanDerWaalsContact C-N 3.25Å; N740-G742 PolarHBondContact O-N 3.37Å; N740-G742 PolarHBondContact OD1-N 3.47Å; G742-A744 VanDerWaalsContact C-N 3.31Å; G742-A744 PolarHBondContact O-N 3.11Å; G742-L745 PolarHBondContact O-N 2.98Å; G742-L746 WeakPolarHBondContact O-CG 3.5Å; G742-L746 PolarHBondContact O-N 3.01Å
743	S	88.9	Confident	88.5	Confident	47 Å²	47	44.6 Å²	44.6	33%	0.329	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-35.4	176.8	-59.1	0	0	0	0	111.8	N740 L747	N740-S743 VanDerWaalsContact CG-OG 3.28Å; N740-S743 PolarHBondContact ND2-OG 3.01Å; N740-S743 PolarHBondContact O-N 3.36Å; N740-S743 VanDerWaalsContact OD1-CB 3.28Å; N740-S743 WeakPolarHBondContact OD1-CB 3.38Å; N740-S743 PolarHBondContact OD1-N 2.86Å; N740-S743 PolarHBondContact OD1-OG 3.47Å; S743-L747 VanDerWaalsContact O-CB 3.28Å; S743-L747 WeakPolarHBondContact O-CB 3.46Å; S743-L747 PolarHBondContact O-N 2.89Å
744	A	88.5	Confident	86.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-39.9	174.8	0	0	0	0	0	112.7	L739 N740 V741 G742 R748 L781 R784 W787	L739-A744 HydrophobicContact CB-CB 4.11Å; N740-A744 WeakPolarHBondContact O-CB 3.42Å; N740-A744 PolarHBondContact O-N 2.98Å; V741-A744 PolarHBondContact O-N 3.48Å; G742-A744 VanDerWaalsContact C-N 3.31Å; G742-A744 PolarHBondContact O-N 3.11Å; A744-R748 VanDerWaalsContact O-CB 3.31Å; A744-R748 WeakPolarHBondContact O-CB 3.42Å; A744-R748 PolarHBondContact O-N 2.94Å; A744-L781 HydrophobicContact CB-CD2 4Å; A744-R784 VanDerWaalsContact CB-NH1 3.27Å; A744-W787 HydrophobicContact CB-CH2 4.29Å; A744-W787 HydrophobicContact CB-CZ3 4.36Å
745	L	86.9	Confident	84.6	Confident	57 Å²	57	55.4 Å²	55.4	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-46.8	174.1	-75.8	169.6	0	0	0	111.6	V741 G742 L747 R748 D749 W787 P788	V741-L745 HydrophobicContact CG1-CD1 4.2Å; V741-L745 WeakPolarHBondContact O-CG 3.24Å; V741-L745 PolarHBondContact O-N 2.87Å; G742-L745 PolarHBondContact O-N 2.98Å; L745-L747 VanDerWaalsContact C-N 3.33Å; L745-L747 PolarHBondContact O-N 3.4Å; L745-R748 WeakPolarHBondContact O-CB 3.34Å; L745-R748 PolarHBondContact O-N 2.8Å; L745-D749 VanDerWaalsContact O-CG 3.32Å; L745-D749 PolarHBondContact O-N 2.91Å; L745-W787 HydrophobicContact CD2-CE3 3.73Å; L745-W787 HydrophobicContact CD2-CZ3 3.5Å; L745-W787 VanDerWaalsContact CD2-CZ3 3.5Å; L745-W787 HydrophobicContact CG-CE3 4.24Å; L745-W787 HydrophobicContact CG-CZ3 3.84Å; L745-P788 HydrophobicContact CD1-CG 4.12Å
746	L	87.9	Confident	82.8	Confident	118 Å²	118	55.6 Å²	55.6	62%	0.618	33%	0.332	S	S	*	.	H	α-helix	trans	-59.5	-45.3	176.4	-71.4	172.7	0	0	0	111.5	G742 R748 D749 V750	G742-L746 WeakPolarHBondContact O-CG 3.5Å; G742-L746 PolarHBondContact O-N 3.01Å; L746-R748 VanDerWaalsContact C-N 3.35Å; L746-R748 PolarHBondContact O-N 3.15Å; L746-D749 PolarHBondContact O-N 3.12Å; L746-V750 WeakPolarHBondContact O-CB 3.45Å; L746-V750 VanDerWaalsContact O-CG2 3.25Å; L746-V750 WeakPolarHBondContact O-CG2 3.4Å; L746-V750 PolarHBondContact O-N 2.98Å
747	L	87.9	Confident	81.1	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.037	37%	0.368	C	S	.	.	H	α-helix	trans	-62	-44.6	176.8	-173.5	61.3	0	0	0	110.7	L739 S743 L745 D749 V750 L751 A763 L764 I769 V777 L781	L739-L747 HydrophobicContact CD1-CD2 3.71Å; S743-L747 VanDerWaalsContact O-CB 3.28Å; S743-L747 WeakPolarHBondContact O-CB 3.46Å; S743-L747 PolarHBondContact O-N 2.89Å; L745-L747 VanDerWaalsContact C-N 3.33Å; L745-L747 PolarHBondContact O-N 3.4Å; L747-D749 PolarHBondContact O-N 3.24Å; L747-V750 PolarHBondContact O-N 3.11Å; L747-L751 HydrophobicContact CD1-CD1 4.44Å; L747-L751 HydrophobicContact CD1-CG 4.41Å; L747-L751 HydrophobicContact CG-CD1 4.16Å; L747-L751 HydrophobicContact CG-CG 4.5Å; L747-L751 WeakPolarHBondContact O-CB 3.49Å; L747-L751 WeakPolarHBondContact O-CG 3.48Å; L747-L751 PolarHBondContact O-N 3.07Å; L747-A763 HydrophobicContact CD1-CB 4.2Å; L747-L764 HydrophobicContact CD1-CD2 4.3Å; L747-I769 HydrophobicContact CD2-CD1 4.43Å; L747-V777 HydrophobicContact CD2-CG1 4.1Å; L747-L781 HydrophobicContact CG-CD1 4.49Å
748	R	86.1	Confident	79.6	Confident	68 Å²	68	70.2 Å²	70.2	26%	0.257	41%	0.405	S	S	.	.	H	α-helix	trans	-59.1	-45.5	176.3	-173	178.4	174.2	166.6	2	112.4	A744 L745 L746 L751 Q752 L781	A744-R748 VanDerWaalsContact O-CB 3.31Å; A744-R748 WeakPolarHBondContact O-CB 3.42Å; A744-R748 PolarHBondContact O-N 2.94Å; L745-R748 WeakPolarHBondContact O-CB 3.34Å; L745-R748 PolarHBondContact O-N 2.8Å; L746-R748 VanDerWaalsContact C-N 3.35Å; L746-R748 PolarHBondContact O-N 3.15Å; R748-L751 PolarHBondContact O-N 2.83Å; R748-Q752 WeakPolarHBondContact O-CB 3.38Å; R748-Q752 VanDerWaalsContact O-CG 3.27Å; R748-Q752 WeakPolarHBondContact O-CG 3.46Å; R748-Q752 PolarHBondContact O-N 3.36Å; R748-L781 HydrophobicContact CB-CD1 4.05Å
749	D	85.1	Confident	78.6	Confident	97 Å²	97	70.7 Å²	70.7	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-66.1	-40.6	-179.3	-71.1	-16.5	0	0	0	111.6	L745 L746 L747 Q752 S753	L745-D749 VanDerWaalsContact O-CG 3.32Å; L745-D749 PolarHBondContact O-N 2.91Å; L746-D749 PolarHBondContact O-N 3.12Å; L747-D749 PolarHBondContact O-N 3.24Å; D749-Q752 PolarHBondContact O-N 3.17Å; D749-S753 WeakPolarHBondContact O-CB 3.46Å; D749-S753 PolarHBondContact O-N 3.26Å
750	V	85.9	Confident	77.9	Confident	54 Å²	54	69.5 Å²	69.5	33%	0.327	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-43.1	175.4	171.5	0	0	0	0	110.9	L746 L747 S753 A763	L746-V750 WeakPolarHBondContact O-CB 3.45Å; L746-V750 VanDerWaalsContact O-CG2 3.25Å; L746-V750 WeakPolarHBondContact O-CG2 3.4Å; L746-V750 PolarHBondContact O-N 2.98Å; L747-V750 PolarHBondContact O-N 3.11Å; V750-S753 PolarHBondContact O-N 2.88Å; V750-S753 PolarHBondContact O-OG 3.42Å; V750-A763 HydrophobicContact CG1-CB 3.78Å
751	L	84	Confident	77.5	Confident	6 Å²	6	68 Å²	68	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-67.9	-34.3	178.3	-66.6	179.7	0	0	0	112.6	L747 R748 A760 L764 Q774 V777 E778 L781	L747-L751 HydrophobicContact CD1-CD1 4.44Å; L747-L751 HydrophobicContact CD1-CG 4.41Å; L747-L751 HydrophobicContact CG-CD1 4.16Å; L747-L751 HydrophobicContact CG-CG 4.5Å; L747-L751 WeakPolarHBondContact O-CB 3.49Å; L747-L751 WeakPolarHBondContact O-CG 3.48Å; L747-L751 PolarHBondContact O-N 3.07Å; R748-L751 PolarHBondContact O-N 2.83Å; L751-A760 HydrophobicContact CD2-CB 3.79Å; L751-L764 HydrophobicContact CD1-CD2 4.47Å; L751-L764 HydrophobicContact CD2-CD1 4.47Å; L751-L764 HydrophobicContact CD2-CD2 4.34Å; L751-L764 HydrophobicContact CD2-CG 4.28Å; L751-Q774 HydrophobicContact CD2-CG 3.87Å; L751-Q774 PolarHBondContact O-NE2 3.33Å; L751-V777 HydrophobicContact CD1-CB 4.2Å; L751-V777 HydrophobicContact CD1-CG1 3.79Å; L751-E778 HydrophobicContact CB-CG 4.13Å; L751-E778 HydrophobicContact CD1-CG 4.05Å; L751-L781 HydrophobicContact CD1-CD1 4.26Å
752	Q	79.1	Confident	77.4	Confident	107 Å²	107	67.9 Å²	67.9	50%	0.5	40%	0.403	S	S	.	.	H	α-helix	trans	-83.1	-9.8	178.1	-68	-176	-5.6	0	0	114	R748 D749	R748-Q752 WeakPolarHBondContact O-CB 3.38Å; R748-Q752 VanDerWaalsContact O-CG 3.27Å; R748-Q752 WeakPolarHBondContact O-CG 3.46Å; R748-Q752 PolarHBondContact O-N 3.36Å; D749-Q752 PolarHBondContact O-N 3.17Å
753	S	74.1	Confident	77.4	Confident	49 Å²	49	66.7 Å²	66.7	34%	0.343	39%	0.39	S	S	.	.			trans	-68.4	133.7	179	74.6	0	0	0	0	111.5	D749 V750 S755	D749-S753 WeakPolarHBondContact O-CB 3.46Å; D749-S753 PolarHBondContact O-N 3.26Å; V750-S753 PolarHBondContact O-N 2.88Å; V750-S753 PolarHBondContact O-OG 3.42Å; S753-S755 PolarHBondContact O-N 3.42Å
754	T	55.8	Low	77.4	Confident	153 Å²	153	65 Å²	65	94%	0.939	38%	0.377	S	S	*	.	S	Bend	trans	-74.2	3.8	-172.8	-19	0	0	0	0	113.5	G756	T754-G756 PolarHBondContact O-N 2.95Å
755	S	54.6	Low	77.5	Confident	79 Å²	79	68.5 Å²	68.5	55%	0.552	40%	0.396	S	S	*	.	S	Bend	trans	-96.7	61.9	-171.8	50.8	0	0	0	0	113.4	S753 P759	S753-S755 PolarHBondContact O-N 3.42Å; S755-P759 WeakPolarHBondContact O-CG 3.21Å
756	G	57.4	Low	77.5	Confident	53 Å²	53	74 Å²	74	55%	0.546	42%	0.42	S	S	.	.			trans	78.2	162.6	161.2	0	0	0	0	0	118.1	T754 P759	T754-G756 PolarHBondContact O-N 2.95Å; G756-P759 WeakPolarHBondContact O-CD 3.46Å
757	Q	59.1	Low	77.6	Confident	162 Å²	162	70.5 Å²	70.5	76%	0.757	40%	0.403	S	S	*	.	H	α-helix	trans	-76.9	-22	-176.4	-74.9	176.9	-32.2	0	0	115	T761	Q757-T761 WeakPolarHBondContact O-CG2 3.45Å; Q757-T761 PolarHBondContact O-N 3.48Å; Q757-T761 PolarHBondContact O-OG1 3.15Å
758	L	61.1	Low	77.6	Confident	149 Å²	149	71.1 Å²	71.1	78%	0.78	41%	0.412	S	S	*	.	H	α-helix	trans	-69.3	-41.3	-176.8	-84.9	144.2	0	0	0	114.2	T761 A762	L758-T761 PolarHBondContact O-OG1 3.44Å; L758-A762 PolarHBondContact O-N 2.93Å
759	P	73.3	Confident	77.9	Confident	60 Å²	60	68 Å²	68	39%	0.39	40%	0.4	S	S	.	.	H	α-helix	trans	-67.8	-37.8	174.4	-22.9	35.1	0	0	0	113.4	S755 G756 A762 A763	S755-P759 WeakPolarHBondContact O-CG 3.21Å; G756-P759 WeakPolarHBondContact O-CD 3.46Å; P759-A762 PolarHBondContact O-N 2.48Å; P759-A763 WeakPolarHBondContact O-CB 3.4Å; P759-A763 PolarHBondContact O-N 3.23Å
760	A	76.9	Confident	78.1	Confident	3 Å²	3	71.4 Å²	71.4	3%	0.025	41%	0.407	C	S	.	.	H	α-helix	trans	-63.8	-45.8	178.8	0	0	0	0	0	111.6	L751 A763 L764	L751-A760 HydrophobicContact CD2-CB 3.79Å; A760-A763 PolarHBondContact O-N 3.45Å; A760-L764 VanDerWaalsContact O-CG 3.25Å; A760-L764 WeakPolarHBondContact O-CG 3.14Å; A760-L764 PolarHBondContact O-N 3.01Å
761	T	82.3	Confident	78.3	Confident	70 Å²	70	74.2 Å²	74.2	43%	0.429	42%	0.415	S	S	.	.	H	α-helix	trans	-65.2	-38.6	177.8	45.6	0	0	0	0	113.1	Q757 L758 L764 N765	Q757-T761 WeakPolarHBondContact O-CG2 3.45Å; Q757-T761 PolarHBondContact O-N 3.48Å; Q757-T761 PolarHBondContact O-OG1 3.15Å; L758-T761 PolarHBondContact O-OG1 3.44Å; T761-L764 PolarHBondContact O-N 2.99Å; T761-N765 PolarHBondContact O-N 3.37Å; T761-N765 VanDerWaalsContact O-N 3.07Å; T761-N765 PolarHBondContact O-ND2 3.46Å
762	A	84.6	Confident	78.7	Confident	47 Å²	47	74.3 Å²	74.3	39%	0.388	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-46	174	0	0	0	0	0	112	L758 P759 L764 N765 E766	L758-A762 PolarHBondContact O-N 2.93Å; P759-A762 PolarHBondContact O-N 2.48Å; A762-L764 PolarHBondContact O-N 3.08Å; A762-N765 PolarHBondContact O-N 3.46Å; A762-E766 WeakPolarHBondContact O-CG 3.45Å; A762-E766 PolarHBondContact O-N 2.8Å
763	A	85.4	Confident	79.2	Confident	15 Å²	15	71.7 Å²	71.7	12%	0.124	41%	0.412	C	S	.	.	H	α-helix	trans	-63.7	-38.2	178.1	0	0	0	0	0	112.8	L747 V750 P759 A760 E766 V767	L747-A763 HydrophobicContact CD1-CB 4.2Å; V750-A763 HydrophobicContact CG1-CB 3.78Å; P759-A763 WeakPolarHBondContact O-CB 3.4Å; P759-A763 PolarHBondContact O-N 3.23Å; A760-A763 PolarHBondContact O-N 3.45Å; A763-E766 PolarHBondContact O-N 3.08Å; A763-V767 WeakPolarHBondContact O-CG2 3.35Å; A763-V767 PolarHBondContact O-N 2.88Å
764	L	89.6	Confident	79.9	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.058	41%	0.409	C	S	.	.	H	α-helix	trans	-62.3	-45.8	173.3	-70.7	175.5	0	0	0	111.6	L747 L751 A760 T761 A762 E766 V767 G768 I769 Q774 V777	L747-L764 HydrophobicContact CD1-CD2 4.3Å; L751-L764 HydrophobicContact CD1-CD2 4.47Å; L751-L764 HydrophobicContact CD2-CD1 4.47Å; L751-L764 HydrophobicContact CD2-CD2 4.34Å; L751-L764 HydrophobicContact CD2-CG 4.28Å; A760-L764 VanDerWaalsContact O-CG 3.25Å; A760-L764 WeakPolarHBondContact O-CG 3.14Å; A760-L764 PolarHBondContact O-N 3.01Å; T761-L764 PolarHBondContact O-N 2.99Å; A762-L764 PolarHBondContact O-N 3.08Å; L764-E766 VanDerWaalsContact C-N 3.35Å; L764-E766 PolarHBondContact O-N 3.46Å; L764-V767 PolarHBondContact O-N 3.32Å; L764-G768 PolarHBondContact O-N 3.34Å; L764-I769 CarbonylContact C-O 3.56Å; L764-I769 HydrophobicContact CB-CB 4.22Å; L764-I769 HydrophobicContact CD2-CB 4.35Å; L764-I769 HydrophobicContact CD2-CD1 3.86Å; L764-I769 HydrophobicContact CD2-CG2 4.27Å; L764-I769 WeakPolarHBondContact O-CB 3.47Å; L764-I769 PolarHBondContact O-N 2.93Å; L764-Q774 HydrophobicContact CD1-CB 4.45Å; L764-V777 HydrophobicContact CD2-CB 4.09Å; L764-V777 HydrophobicContact CD2-CG1 3.86Å; L764-V777 HydrophobicContact CD2-CG2 3.77Å
765	N	89.9	Confident	81.4	Confident	74 Å²	74	72.1 Å²	72.1	40%	0.396	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-36.8	178.7	-71.2	-22.5	0	0	0	112.8	T761 A762 V767 G768 I769 Y770	T761-N765 PolarHBondContact O-N 3.37Å; T761-N765 VanDerWaalsContact O-N 3.07Å; T761-N765 PolarHBondContact O-ND2 3.46Å; A762-N765 PolarHBondContact O-N 3.46Å; N765-V767 VanDerWaalsContact C-N 3.25Å; N765-V767 PolarHBondContact O-N 3.25Å; N765-G768 PolarHBondContact O-N 2.86Å; N765-G768 VanDerWaalsContact O-N 3.1Å; N765-I769 PolarHBondContact OD1-O 2.94Å; N765-Y770 HydrophobicContact CB-CD1 4.43Å; N765-Y770 HydrophobicContact CB-CE1 3.97Å; N765-Y770 PolarHBondContact O-OH 2.98Å; N765-Y770 VanDerWaalsContact OD1-CD1 3.24Å; N765-Y770 WeakPolarHBondContact OD1-CD1 3.35Å
766	E	88.4	Confident	83.2	Confident	171 Å²	171	70.6 Å²	70.6	80%	0.799	38%	0.383	S	S	*	.	H	α-helix	trans	-63.1	-32.5	176.6	-77.9	-178.5	178.5	0	0	112.5	A762 A763 L764 G768	A762-E766 WeakPolarHBondContact O-CG 3.45Å; A762-E766 PolarHBondContact O-N 2.8Å; A763-E766 PolarHBondContact O-N 3.08Å; L764-E766 VanDerWaalsContact C-N 3.35Å; L764-E766 PolarHBondContact O-N 3.46Å; E766-G768 VanDerWaalsContact C-N 3.29Å
767	V	88.1	Confident	84.8	Confident	45 Å²	45	68.1 Å²	68.1	27%	0.273	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.9	177.4	-177.4	0	0	0	0	111.9	I735 L739 A763 L764 N765 I769	I735-V767 HydrophobicContact CG2-CG1 3.87Å; I735-V767 WeakPolarHBondContact CG2-O 3.43Å; L739-V767 HydrophobicContact CD1-CG1 4.08Å; L739-V767 HydrophobicContact CD2-CG1 3.59Å; L739-V767 HydrophobicContact CG-CG1 4.35Å; A763-V767 WeakPolarHBondContact O-CG2 3.35Å; A763-V767 PolarHBondContact O-N 2.88Å; L764-V767 PolarHBondContact O-N 3.32Å; N765-V767 VanDerWaalsContact C-N 3.25Å; N765-V767 PolarHBondContact O-N 3.25Å; V767-I769 HydrophobicContact CB-CD1 4.38Å; V767-I769 HydrophobicContact CG1-CD1 4.18Å
768	G	89.2	Confident	86.3	Confident	21 Å²	21	63 Å²	63	22%	0.216	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	24.8	178.3	0	0	0	0	0	114.3	L764 N765 E766	L764-G768 PolarHBondContact O-N 3.34Å; N765-G768 PolarHBondContact O-N 2.86Å; N765-G768 VanDerWaalsContact O-N 3.1Å; E766-G768 VanDerWaalsContact C-N 3.29Å
769	I	91.6	Very high	87.8	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.316	C	S	.	.			trans	-103.5	114.8	177.7	-56.5	165.6	0	0	0	108.2	E732 V736 L747 L764 N765 V767 L772 V777	E732-I769 HydrophobicContact CB-CG2 4.45Å; E732-I769 WeakPolarHBondContact OE2-CG2 3.39Å; V736-I769 HydrophobicContact CG2-CD1 3.38Å; V736-I769 HydrophobicContact CG2-CG1 4.2Å; L747-I769 HydrophobicContact CD2-CD1 4.43Å; L764-I769 CarbonylContact C-O 3.56Å; L764-I769 HydrophobicContact CB-CB 4.22Å; L764-I769 HydrophobicContact CD2-CB 4.35Å; L764-I769 HydrophobicContact CD2-CD1 3.86Å; L764-I769 HydrophobicContact CD2-CG2 4.27Å; L764-I769 WeakPolarHBondContact O-CB 3.47Å; L764-I769 PolarHBondContact O-N 2.93Å; N765-I769 PolarHBondContact OD1-O 2.94Å; V767-I769 HydrophobicContact CB-CD1 4.38Å; V767-I769 HydrophobicContact CG1-CD1 4.18Å; I769-L772 HydrophobicContact CG2-CB 3.87Å; I769-L772 HydrophobicContact CG2-CD1 4.5Å; I769-V777 HydrophobicContact CD1-CG1 4.3Å; I769-V777 HydrophobicContact CD1-CG2 4.26Å; I769-V777 HydrophobicContact CG2-CG2 4.03Å
770	Y	90.5	Very high	88.7	Confident	169 Å²	169	56.9 Å²	56.9	66%	0.663	30%	0.297	S	S	*	.			trans	-124.4	-19.6	-175.6	-55.3	-76.2	0	0	0	113.2	E732 N765	E732-Y770 VanDerWaalsContact CD-N 3.28Å; E732-Y770 PolarHBondContact OE1-N 3.09Å; E732-Y770 PolarHBondContact OE2-N 3.02Å; N765-Y770 HydrophobicContact CB-CD1 4.43Å; N765-Y770 HydrophobicContact CB-CE1 3.97Å; N765-Y770 PolarHBondContact O-OH 2.98Å; N765-Y770 VanDerWaalsContact OD1-CD1 3.24Å; N765-Y770 WeakPolarHBondContact OD1-CD1 3.35Å
771	K	89.8	Confident	89.4	Confident	113 Å²	113	56.8 Å²	56.8	49%	0.491	30%	0.296	S	S	.	.	S	Bend	trans	-106.1	-40.3	-174.1	-179.1	60.2	178.2	173.4	0	112.9	K728 E732	K728-K771 HydrophobicContact CB-CB 4.03Å; K728-K771 HydrophobicContact CB-CG 3.88Å; K728-K771 HydrophobicContact CD-CB 4.46Å; K728-K771 HydrophobicContact CD-CD 4.48Å; K728-K771 HydrophobicContact CD-CG 4.35Å; E732-K771 VanDerWaalsContact CD-N 3.27Å; E732-K771 WeakPolarHBondContact OE1-CB 3.36Å; E732-K771 PolarHBondContact OE1-N 3.37Å; E732-K771 WeakPolarHBondContact OE2-CA 3.43Å; E732-K771 WeakPolarHBondContact OE2-CB 3.42Å; E732-K771 PolarHBondContact OE2-N 2.9Å
772	L	91.7	Very high	89.9	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	30%	0.297	C	S	.	.	S	Bend	trans	-69.9	138.7	-178.5	-65.4	176.4	0	0	0	111.6	Y687 H729 E732 I769 D776 V777 L780	Y687-L772 HydrophobicContact CE1-CD2 4.32Å; Y687-L772 HydrophobicContact CE2-CD2 3.89Å; H729-L772 HydrophobicContact CB-CD2 4.36Å; E732-L772 HydrophobicContact CB-CD1 3.56Å; E732-L772 HydrophobicContact CB-CG 3.88Å; E732-L772 WeakPolarHBondContact OE2-CG 3.47Å; E732-L772 PolarHBondContact OE2-N 2.93Å; I769-L772 HydrophobicContact CG2-CB 3.87Å; I769-L772 HydrophobicContact CG2-CD1 4.5Å; L772-D776 HydrophobicContact CB-CB 4.3Å; L772-D776 HydrophobicContact CD2-CB 4.35Å; L772-V777 HydrophobicContact CB-CG2 3.9Å; L772-V777 HydrophobicContact CD1-CG2 4.36Å; L772-L780 HydrophobicContact CD1-CD1 3.54Å
773	A	90.6	Very high	90.2	Very high	51 Å²	51	55.8 Å²	55.8	42%	0.421	28%	0.282	S	S	.	.			trans	-72.7	158	173.4	0	0	0	0	0	110.5	Q775 D776 V777	A773-Q775 PolarHBondContact O-N 3.31Å; A773-D776 WeakPolarHBondContact CB-OD2 3.41Å; A773-D776 PolarHBondContact N-OD2 3.11Å; A773-D776 WeakPolarHBondContact O-CB 3.4Å; A773-D776 PolarHBondContact O-N 3.21Å; A773-V777 PolarHBondContact O-N 3.48Å; A773-V777 VanDerWaalsContact O-N 3.15Å
774	Q	87.9	Confident	90.5	Very high	60 Å²	60	55.4 Å²	55.4	28%	0.28	28%	0.277	S	S	.	.	H	α-helix	trans	-50.8	-45.2	176.3	167.2	171.6	-1.6	0	0	112.6	L751 L764 D776 V777 E778	L751-Q774 HydrophobicContact CD2-CG 3.87Å; L751-Q774 PolarHBondContact O-NE2 3.33Å; L764-Q774 HydrophobicContact CD1-CB 4.45Å; Q774-D776 VanDerWaalsContact C-N 3.31Å; Q774-D776 PolarHBondContact O-N 3.17Å; Q774-V777 PolarHBondContact O-N 3.26Å; Q774-E778 PolarHBondContact NE2-OE1 2.93Å; Q774-E778 PolarHBondContact O-N 3.1Å
775	Q	88.1	Confident	90.4	Very high	151 Å²	151	58.2 Å²	58.2	71%	0.706	30%	0.295	S	S	*	.	H	α-helix	trans	-62.8	-38	-179.5	-65.9	175.8	0.9	0	0	112	A773 V777 E778 I779	A773-Q775 PolarHBondContact O-N 3.31Å; Q775-V777 VanDerWaalsContact C-N 3.33Å; Q775-V777 PolarHBondContact O-N 2.87Å; Q775-E778 PolarHBondContact O-N 3.33Å; Q775-I779 VanDerWaalsContact O-CG1 3.29Å; Q775-I779 WeakPolarHBondContact O-CG1 3.37Å; Q775-I779 PolarHBondContact O-N 2.91Å
776	D	90.8	Very high	89.8	Confident	48 Å²	48	56.6 Å²	56.6	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.4	-70.4	-47.9	0	0	0	111.5	Y687 L772 A773 Q774 I779 L780	Y687-D776 VanDerWaalsContact OH-CB 3.32Å; Y687-D776 WeakPolarHBondContact OH-CB 3.38Å; Y687-D776 PolarHBondContact OH-OD1 2.99Å; L772-D776 HydrophobicContact CB-CB 4.3Å; L772-D776 HydrophobicContact CD2-CB 4.35Å; A773-D776 WeakPolarHBondContact CB-OD2 3.41Å; A773-D776 PolarHBondContact N-OD2 3.11Å; A773-D776 WeakPolarHBondContact O-CB 3.4Å; A773-D776 PolarHBondContact O-N 3.21Å; Q774-D776 VanDerWaalsContact C-N 3.31Å; Q774-D776 PolarHBondContact O-N 3.17Å; D776-I779 PolarHBondContact O-N 2.93Å; D776-L780 VanDerWaalsContact O-CG 3.3Å; D776-L780 WeakPolarHBondContact O-CG 3.44Å; D776-L780 PolarHBondContact O-N 3.42Å
777	V	92.1	Very high	89.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-39.5	178.1	179.4	0	0	0	0	111.2	V736 L747 L751 L764 I769 L772 A773 Q774 Q775 I779 L780 L781	V736-V777 HydrophobicContact CG1-CG1 4.23Å; V736-V777 HydrophobicContact CG2-CG1 4Å; V736-V777 HydrophobicContact CG2-CG2 4.48Å; L747-V777 HydrophobicContact CD2-CG1 4.1Å; L751-V777 HydrophobicContact CD1-CB 4.2Å; L751-V777 HydrophobicContact CD1-CG1 3.79Å; L764-V777 HydrophobicContact CD2-CB 4.09Å; L764-V777 HydrophobicContact CD2-CG1 3.86Å; L764-V777 HydrophobicContact CD2-CG2 3.77Å; I769-V777 HydrophobicContact CD1-CG1 4.3Å; I769-V777 HydrophobicContact CD1-CG2 4.26Å; I769-V777 HydrophobicContact CG2-CG2 4.03Å; L772-V777 HydrophobicContact CB-CG2 3.9Å; L772-V777 HydrophobicContact CD1-CG2 4.36Å; A773-V777 PolarHBondContact O-N 3.48Å; A773-V777 VanDerWaalsContact O-N 3.15Å; Q774-V777 PolarHBondContact O-N 3.26Å; Q775-V777 VanDerWaalsContact C-N 3.33Å; Q775-V777 PolarHBondContact O-N 2.87Å; V777-I779 VanDerWaalsContact C-N 3.34Å; V777-I779 PolarHBondContact O-N 3.5Å; V777-L780 PolarHBondContact O-N 3.28Å; V777-L781 HydrophobicContact CG1-CD1 4.25Å; V777-L781 HydrophobicContact CG1-CG 4.5Å; V777-L781 VanDerWaalsContact O-CG 3.29Å; V777-L781 WeakPolarHBondContact O-CG 3.19Å; V777-L781 PolarHBondContact O-N 2.85Å
778	E	90.1	Very high	88.5	Confident	55 Å²	55	52.3 Å²	52.3	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-42.2	172.8	-72	175.1	-162.4	0	0	112	L751 Q774 Q775 L781 N782	L751-E778 HydrophobicContact CB-CG 4.13Å; L751-E778 HydrophobicContact CD1-CG 4.05Å; Q774-E778 PolarHBondContact NE2-OE1 2.93Å; Q774-E778 PolarHBondContact O-N 3.1Å; Q775-E778 PolarHBondContact O-N 3.33Å; E778-L781 PolarHBondContact O-N 3.28Å; E778-N782 PolarHBondContact O-N 3.3Å; E778-N782 VanDerWaalsContact O-N 3.12Å; E778-N782 PolarHBondContact O-ND2 3.48Å; E778-N782 VanDerWaalsContact O-ND2 3.07Å
779	I	92.1	Very high	86.9	Confident	80 Å²	80	59.3 Å²	59.3	41%	0.41	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-51.9	174.1	-67.3	163.9	0	0	0	109.8	L692 Q775 D776 V777 L781 N782 L783	L692-I779 HydrophobicContact CD2-CG2 3.9Å; Q775-I779 VanDerWaalsContact O-CG1 3.29Å; Q775-I779 WeakPolarHBondContact O-CG1 3.37Å; Q775-I779 PolarHBondContact O-N 2.91Å; D776-I779 PolarHBondContact O-N 2.93Å; V777-I779 VanDerWaalsContact C-N 3.34Å; V777-I779 PolarHBondContact O-N 3.5Å; I779-L781 VanDerWaalsContact C-N 3.3Å; I779-L781 PolarHBondContact O-N 3.16Å; I779-N782 WeakPolarHBondContact O-CA 3.49Å; I779-N782 WeakPolarHBondContact O-CB 3.19Å; I779-N782 PolarHBondContact O-N 3.08Å; I779-L783 HydrophobicContact CG2-CD1 4.45Å; I779-L783 WeakPolarHBondContact O-CG 3.38Å; I779-L783 PolarHBondContact O-N 3.17Å; I779-L783 VanDerWaalsContact O-N 3.09Å
780	L	93.8	Very high	84.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.3	-39.2	-179.9	-74.2	167.6	0	0	0	113.1	Y687 I691 L692 A733 V736 L772 D776 V777 N782 L783	Y687-L780 HydrophobicContact CE2-CD1 4.18Å; Y687-L780 HydrophobicContact CE2-CD2 4.18Å; Y687-L780 HydrophobicContact CE2-CG 4.48Å; I691-L780 HydrophobicContact CG2-CD2 3.61Å; L692-L780 HydrophobicContact CD2-CD2 3.84Å; L692-L780 HydrophobicContact CD2-CG 4.21Å; A733-L780 HydrophobicContact CB-CD1 3.93Å; A733-L780 HydrophobicContact CB-CD2 3.91Å; V736-L780 HydrophobicContact CB-CB 4.34Å; V736-L780 HydrophobicContact CB-CD1 4.34Å; V736-L780 HydrophobicContact CG1-CB 3.75Å; V736-L780 HydrophobicContact CG2-CD1 4.35Å; L772-L780 HydrophobicContact CD1-CD1 3.54Å; D776-L780 VanDerWaalsContact O-CG 3.3Å; D776-L780 WeakPolarHBondContact O-CG 3.44Å; D776-L780 PolarHBondContact O-N 3.42Å; V777-L780 PolarHBondContact O-N 3.28Å; L780-N782 VanDerWaalsContact C-N 3.34Å; L780-L783 HydrophobicContact CD2-CD1 4.31Å; L780-L783 PolarHBondContact O-N 3.04Å
781	L	91.7	Very high	82.7	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-44.7	173.7	-72.4	168.8	0	0	0	110.5	V736 A744 L747 R748 L751 V777 E778 I779 L783 R784 W787	V736-L781 HydrophobicContact CG1-CD2 3.83Å; V736-L781 HydrophobicContact CG1-CG 3.91Å; A744-L781 HydrophobicContact CB-CD2 4Å; L747-L781 HydrophobicContact CG-CD1 4.49Å; R748-L781 HydrophobicContact CB-CD1 4.05Å; L751-L781 HydrophobicContact CD1-CD1 4.26Å; V777-L781 HydrophobicContact CG1-CD1 4.25Å; V777-L781 HydrophobicContact CG1-CG 4.5Å; V777-L781 VanDerWaalsContact O-CG 3.29Å; V777-L781 WeakPolarHBondContact O-CG 3.19Å; V777-L781 PolarHBondContact O-N 2.85Å; E778-L781 PolarHBondContact O-N 3.28Å; I779-L781 VanDerWaalsContact C-N 3.3Å; I779-L781 PolarHBondContact O-N 3.16Å; L781-L783 PolarHBondContact O-N 2.71Å; L781-R784 VanDerWaalsContact O-CB 3.31Å; L781-R784 WeakPolarHBondContact O-CB 3.44Å; L781-R784 PolarHBondContact O-N 3.42Å; L781-R784 VanDerWaalsContact O-N 3.11Å; L781-W787 HydrophobicContact CB-CH2 4.46Å; L781-W787 HydrophobicContact CB-CZ2 4.22Å; L781-W787 HydrophobicContact CD2-CH2 4.42Å; L781-W787 WeakPolarHBondContact O-CZ2 3.08Å
782	N	91.1	Very high	80	Confident	82 Å²	82	68.1 Å²	68.1	44%	0.439	38%	0.375	S	S	.	.	H	α-helix	trans	-66.4	-20.8	178.5	-69	-37.4	0	0	0	114	E778 I779 L780 R784	E778-N782 PolarHBondContact O-N 3.3Å; E778-N782 VanDerWaalsContact O-N 3.12Å; E778-N782 PolarHBondContact O-ND2 3.48Å; E778-N782 VanDerWaalsContact O-ND2 3.07Å; I779-N782 WeakPolarHBondContact O-CA 3.49Å; I779-N782 WeakPolarHBondContact O-CB 3.19Å; I779-N782 PolarHBondContact O-N 3.08Å; L780-N782 VanDerWaalsContact C-N 3.34Å; N782-R784 PolarHBondContact O-N 3.41Å
783	L	91.9	Very high	79.4	Confident	15 Å²	15	71.1 Å²	71.1	8%	0.079	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.9	174.4	-62.2	176.9	0	0	0	113.2	L692 H695 F696 I779 L780 L781	L692-L783 HydrophobicContact CD2-CD1 3.98Å; H695-L783 CarbonylContact C-O 3.55Å; H695-L783 VanDerWaalsContact CA-O 3.26Å; H695-L783 WeakPolarHBondContact CA-O 3.17Å; H695-L783 WeakPolarHBondContact CB-O 3.49Å; F696-L783 PolarHBondContact N-O 2.8Å; I779-L783 HydrophobicContact CG2-CD1 4.45Å; I779-L783 WeakPolarHBondContact O-CG 3.38Å; I779-L783 PolarHBondContact O-N 3.17Å; I779-L783 VanDerWaalsContact O-N 3.09Å; L780-L783 HydrophobicContact CD2-CD1 4.31Å; L780-L783 PolarHBondContact O-N 3.04Å; L781-L783 PolarHBondContact O-N 2.71Å
784	R	92.1	Very high	78.8	Confident	6 Å²	6	72.2 Å²	72.2	2%	0.023	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-78.1	141.2	175.9	-61.7	173.5	57.1	149.1	-0.4	111.1	V736 L737 L739 A744 L781 N782 N786 W787	V736-R784 PolarHBondContact O-NH1 3.24Å; L737-R784 HydrophobicContact CD2-CG 3.96Å; L739-R784 VanDerWaalsContact O-CZ 3.24Å; L739-R784 PolarHBondContact O-NH1 3.24Å; L739-R784 PolarHBondContact O-NH2 3.43Å; A744-R784 VanDerWaalsContact CB-NH1 3.27Å; L781-R784 VanDerWaalsContact O-CB 3.31Å; L781-R784 WeakPolarHBondContact O-CB 3.44Å; L781-R784 PolarHBondContact O-N 3.42Å; L781-R784 VanDerWaalsContact O-N 3.11Å; N782-R784 PolarHBondContact O-N 3.41Å; R784-N786 PolarHBondContact NE-OD1 3.42Å; R784-N786 PolarHBondContact NH2-ND2 3.2Å; R784-N786 VanDerWaalsContact NH2-ND2 3.17Å; R784-N786 PolarHBondContact NH2-OD1 3.47Å; R784-N786 VanDerWaalsContact NH2-OD1 3.16Å; R784-W787 PolarHBondContact O-NE1 3.34Å
785	T	86.3	Confident	78.3	Confident	70 Å²	70	72.8 Å²	72.8	43%	0.429	40%	0.396	S	S	.	.			trans	-105	-6.6	176.7	57.5	0	0	0	0	114.5	L631 H695 F696 N697 W787	L631-T785 HydrophobicContact CD2-CG2 3.37Å; H695-T785 HydrophobicContact CB-CG2 4.21Å; F696-T785 PolarHBondContact O-N 3.15Å; F696-T785 PolarHBondContact O-OG1 3.23Å; F696-T785 VanDerWaalsContact O-OG1 3.12Å; N697-T785 WeakPolarHBondContact CA-OG1 3.3Å; T785-W787 PolarHBondContact O-N 2.62Å; T785-W787 VanDerWaalsContact O-N 3.1Å
786	N	77.8	Confident	77.8	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.219	38%	0.377	C	S	.	.			trans	-85.2	36.2	-177.6	63	-11.9	0	0	0	113.9	R784	R784-N786 PolarHBondContact NE-OD1 3.42Å; R784-N786 PolarHBondContact NH2-ND2 3.2Å; R784-N786 VanDerWaalsContact NH2-ND2 3.17Å; R784-N786 PolarHBondContact NH2-OD1 3.47Å; R784-N786 VanDerWaalsContact NH2-OD1 3.16Å
787	W	80.4	Confident	76.9	Confident	59 Å²	59	69.5 Å²	69.5	22%	0.223	39%	0.385	C	S	.	.			trans	-75.4	134.7	174.1	-63.7	110.4	0	0	0	109.9	A744 L745 L781 R784 T785 N789	A744-W787 HydrophobicContact CB-CH2 4.29Å; A744-W787 HydrophobicContact CB-CZ3 4.36Å; L745-W787 HydrophobicContact CD2-CE3 3.73Å; L745-W787 HydrophobicContact CD2-CZ3 3.5Å; L745-W787 VanDerWaalsContact CD2-CZ3 3.5Å; L745-W787 HydrophobicContact CG-CE3 4.24Å; L745-W787 HydrophobicContact CG-CZ3 3.84Å; L781-W787 HydrophobicContact CB-CH2 4.46Å; L781-W787 HydrophobicContact CB-CZ2 4.22Å; L781-W787 HydrophobicContact CD2-CH2 4.42Å; L781-W787 WeakPolarHBondContact O-CZ2 3.08Å; R784-W787 PolarHBondContact O-NE1 3.34Å; T785-W787 PolarHBondContact O-N 2.62Å; T785-W787 VanDerWaalsContact O-N 3.1Å; W787-N789 PolarHBondContact O-N 3.01Å
788	P	69.8	Low	75.9	Confident	66 Å²	66	74.1 Å²	74.1	43%	0.429	41%	0.411	S	S	.	.			trans	-58.6	135.7	172.1	23.8	-28.5	0	0	0	107.7	V741 L745 T790	V741-P788 HydrophobicContact CG1-CG 4.23Å; L745-P788 HydrophobicContact CD1-CG 4.12Å; P788-T790 VanDerWaalsContact C-N 3.31Å; P788-T790 PolarHBondContact O-N 3.36Å
789	N	54.9	Low	74.9	Confident	168 Å²	168	75.5 Å²	75.5	90%	0.898	42%	0.421	S	S	*	.			trans	-52	100.1	175	-88.6	-19	0	0	0	108.2	W787 G791	W787-N789 PolarHBondContact O-N 3.01Å; N789-G791 PolarHBondContact O-N 3.39Å
790	T	49	Very low	73.6	Confident	119 Å²	119	75.2 Å²	75.2	73%	0.73	42%	0.422	S	S	*	.			trans	-71	91.1	168.1	50.6	0	0	0	0	104.4	P788 K792	P788-T790 VanDerWaalsContact C-N 3.31Å; P788-T790 PolarHBondContact O-N 3.36Å; T790-K792 VanDerWaalsContact C-N 3.28Å; T790-K792 PolarHBondContact O-N 2.67Å
791	G	44.3	Very low	71.9	Confident	83 Å²	83	81.4 Å²	81.4	86%	0.856	46%	0.458	S	S	*	.			trans	-54.1	98.6	170	0	0	0	0	0	108.2	N789	N789-G791 PolarHBondContact O-N 3.39Å
792	K	33.7	Very low	70.1	Confident	267 Å²	267	88.7 Å²	88.7	100%	1.161	50%	0.499	S	S	*	.			trans	-123.1	0	162.7	-84.7	-167.3	176.7	-179.5	0	107	T790	T790-K792 VanDerWaalsContact C-N 3.28Å; T790-K792 PolarHBondContact O-N 2.67Å

Retrieved 792 of 792 residues in 1978.6 ms (Link to these results)

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